Ticket #7561: pdb_00017xsv-extended_PDB_CCD_codes-model.cif

File pdb_00017xsv-extended_PDB_CCD_codes-model.cif, 453.5 KB (added by Eric Pettersen, 3 years ago)
Line 
1data_PDB_00017XSV
2#
3_entry.id PDB_00017XSV
4#
5_audit_conform.dict_name mmcif_pdbx.dic
6_audit_conform.dict_version 5.359
7_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic
8#
9loop_
10_database_2.database_id
11_database_2.database_code
12_database_2.pdbx_database_accession
13_database_2.pdbx_DOI
14PDB PDB_00017XSV pdb_00017xsv 10.2210/pdb_00017xsv/pdb
15WWPDB D_1300028350 ? ?
16#
17_pdbx_database_status.status_code REL
18_pdbx_database_status.status_code_sf REL
19_pdbx_database_status.status_code_mr ?
20_pdbx_database_status.entry_id PDB_00017XSV
21_pdbx_database_status.recvd_initial_deposition_date 2022-05-15
22_pdbx_database_status.SG_entry N
23_pdbx_database_status.deposit_site PDBJ
24_pdbx_database_status.process_site PDBJ
25_pdbx_database_status.status_code_cs ?
26_pdbx_database_status.status_code_nmr_data ?
27_pdbx_database_status.methods_development_category ?
28_pdbx_database_status.pdb_format_compatible Y
29#
30loop_
31_audit_author.name
32_audit_author.pdbx_ordinal
33_audit_author.identifier_ORCID
34'Shen, C.' 1 ?
35'Xie, Y.' 2 ?
36'Ren, X.' 3 ?
37'Zhou, Y.' 4 ?
38'Niu, H.' 5 ?
39#
40_citation.abstract ?
41_citation.abstract_id_CAS ?
42_citation.book_id_ISBN ?
43_citation.book_publisher ?
44_citation.book_publisher_city ?
45_citation.book_title ?
46_citation.coordinate_linkage ?
47_citation.country UK
48_citation.database_id_Medline ?
49_citation.details ?
50_citation.id primary
51_citation.journal_abbrev Bioorg.Med.Chem.Lett.
52_citation.journal_id_ASTM BMCLE8
53_citation.journal_id_CSD 1127
54_citation.journal_id_ISSN 1464-3405
55_citation.journal_full ?
56_citation.journal_issue ?
57_citation.journal_volume 72
58_citation.language ?
59_citation.page_first 128874
60_citation.page_last 128874
61_citation.title
62;Design, synthesis, and bioactivity evaluation of macrocyclic benzo[b]pyrido[4,3-e][1,4]oxazine derivatives as novel Pim-1 kinase inhibitors.
63;
64_citation.year 2022
65_citation.database_id_CSD ?
66_citation.pdbx_database_id_DOI 10.1016/j.bmcl.2022.128874
67_citation.pdbx_database_id_PubMed 35779826
68_citation.pdbx_database_id_patent ?
69_citation.unpublished_flag ?
70#
71loop_
72_citation_author.citation_id
73_citation_author.name
74_citation_author.ordinal
75_citation_author.identifier_ORCID
76primary 'Xu, J.' 1 ?
77primary 'Shen, C.' 2 ?
78primary 'Xie, Y.' 3 ?
79primary 'Qiu, B.' 4 ?
80primary 'Ren, X.' 5 ?
81primary 'Zhou, Y.' 6 ?
82primary 'Li, G.' 7 ?
83primary 'Zheng, G.' 8 ?
84primary 'Huang, N.' 9 ?
85#
86_cell.angle_alpha 90.000
87_cell.angle_alpha_esd ?
88_cell.angle_beta 90.000
89_cell.angle_beta_esd ?
90_cell.angle_gamma 120.000
91_cell.angle_gamma_esd ?
92_cell.entry_id PDB_00017XSV
93_cell.details ?
94_cell.formula_units_Z ?
95_cell.length_a 97.111
96_cell.length_a_esd ?
97_cell.length_b 97.111
98_cell.length_b_esd ?
99_cell.length_c 78.955
100_cell.length_c_esd ?
101_cell.volume ?
102_cell.volume_esd ?
103_cell.Z_PDB 6
104_cell.reciprocal_angle_alpha ?
105_cell.reciprocal_angle_beta ?
106_cell.reciprocal_angle_gamma ?
107_cell.reciprocal_angle_alpha_esd ?
108_cell.reciprocal_angle_beta_esd ?
109_cell.reciprocal_angle_gamma_esd ?
110_cell.reciprocal_length_a ?
111_cell.reciprocal_length_b ?
112_cell.reciprocal_length_c ?
113_cell.reciprocal_length_a_esd ?
114_cell.reciprocal_length_b_esd ?
115_cell.reciprocal_length_c_esd ?
116_cell.pdbx_unique_axis ?
117_cell.pdbx_esd_method ?
118#
119_symmetry.entry_id PDB_00017XSV
120_symmetry.cell_setting ?
121_symmetry.Int_Tables_number 170
122_symmetry.space_group_name_Hall ?
123_symmetry.space_group_name_H-M 'P 65'
124_symmetry.pdbx_full_space_group_name_H-M ?
125#
126loop_
127_entity.id
128_entity.type
129_entity.src_method
130_entity.pdbx_description
131_entity.formula_weight
132_entity.pdbx_number_of_molecules
133_entity.pdbx_ec
134_entity.pdbx_mutation
135_entity.pdbx_fragment
136_entity.details
1371 polymer man 'Serine/threonine-protein kinase pim-1' 33292.719 1 2.7.11.1 ? ? ?
1382 non-polymer syn
139'8-Methyl-2,5,20-trioxa-8,13,17-triazatetracyclo[11.10.2.014,19.021,25]pentacosa-1(24),14(19),15,17,21(25),22-hexaene' 355.431 1
140? ? ? ?
1413 water nat water 18.015 16 ? ? ? ?
142#
143_entity_poly.entity_id 1
144_entity_poly.type 'polypeptide(L)'
145_entity_poly.nstd_linkage no
146_entity_poly.nstd_monomer yes
147_entity_poly.pdbx_seq_one_letter_code
148;GPHMKEKEPLESQYQVGPLLGSGGFGSVYSGIRVSDNLPVAIKHVEKDRISDWGELPNGTRVPMEVVLLKKVSSGFSGVI
149RLLDWFERPDSFVLILERPEPVQDLFDFITERGALQEELARSFFWQVLEAVRHCHNCGVLHRDIKDENILIDLNRGELKL
150IDFGSGALLKDTVYTDFDGTRVYSPPEWIRYHRYHGRSAAVWSLGILLYDMVCGDIPFEHDEEIIRGQVFFRQRVS
151(SEP01)ECQHLIRWCLALRPSDRPTFEEIQNHPWMQDVLLPQETAEIHLHSLSPGPSK
152;
153_entity_poly.pdbx_seq_one_letter_code_can
154;GPHMKEKEPLESQYQVGPLLGSGGFGSVYSGIRVSDNLPVAIKHVEKDRISDWGELPNGTRVPMEVVLLKKVSSGFSGVI
155RLLDWFERPDSFVLILERPEPVQDLFDFITERGALQEELARSFFWQVLEAVRHCHNCGVLHRDIKDENILIDLNRGELKL
156IDFGSGALLKDTVYTDFDGTRVYSPPEWIRYHRYHGRSAAVWSLGILLYDMVCGDIPFEHDEEIIRGQVFFRQRVSSECQ
157HLIRWCLALRPSDRPTFEEIQNHPWMQDVLLPQETAEIHLHSLSPGPSK
158;
159_entity_poly.pdbx_strand_id A
160_entity_poly.pdbx_target_identifier ?
161#
162loop_
163_entity_poly_seq.entity_id
164_entity_poly_seq.num
165_entity_poly_seq.mon_id
166_entity_poly_seq.hetero
1671 1 GLY n
1681 2 PRO n
1691 3 HIS n
1701 4 MET n
1711 5 LYS n
1721 6 GLU n
1731 7 LYS n
1741 8 GLU n
1751 9 PRO n
1761 10 LEU n
1771 11 GLU n
1781 12 SER n
1791 13 GLN n
1801 14 TYR n
1811 15 GLN n
1821 16 VAL n
1831 17 GLY n
1841 18 PRO n
1851 19 LEU n
1861 20 LEU n
1871 21 GLY n
1881 22 SER n
1891 23 GLY n
1901 24 GLY n
1911 25 PHE n
1921 26 GLY n
1931 27 SER n
1941 28 VAL n
1951 29 TYR n
1961 30 SER n
1971 31 GLY n
1981 32 ILE n
1991 33 ARG n
2001 34 VAL n
2011 35 SER n
2021 36 ASP n
2031 37 ASN n
2041 38 LEU n
2051 39 PRO n
2061 40 VAL n
2071 41 ALA n
2081 42 ILE n
2091 43 LYS n
2101 44 HIS n
2111 45 VAL n
2121 46 GLU n
2131 47 LYS n
2141 48 ASP n
2151 49 ARG n
2161 50 ILE n
2171 51 SER n
2181 52 ASP n
2191 53 TRP n
2201 54 GLY n
2211 55 GLU n
2221 56 LEU n
2231 57 PRO n
2241 58 ASN n
2251 59 GLY n
2261 60 THR n
2271 61 ARG n
2281 62 VAL n
2291 63 PRO n
2301 64 MET n
2311 65 GLU n
2321 66 VAL n
2331 67 VAL n
2341 68 LEU n
2351 69 LEU n
2361 70 LYS n
2371 71 LYS n
2381 72 VAL n
2391 73 SER n
2401 74 SER n
2411 75 GLY n
2421 76 PHE n
2431 77 SER n
2441 78 GLY n
2451 79 VAL n
2461 80 ILE n
2471 81 ARG n
2481 82 LEU n
2491 83 LEU n
2501 84 ASP n
2511 85 TRP n
2521 86 PHE n
2531 87 GLU n
2541 88 ARG n
2551 89 PRO n
2561 90 ASP n
2571 91 SER n
2581 92 PHE n
2591 93 VAL n
2601 94 LEU n
2611 95 ILE n
2621 96 LEU n
2631 97 GLU n
2641 98 ARG n
2651 99 PRO n
2661 100 GLU n
2671 101 PRO n
2681 102 VAL n
2691 103 GLN n
2701 104 ASP n
2711 105 LEU n
2721 106 PHE n
2731 107 ASP n
2741 108 PHE n
2751 109 ILE n
2761 110 THR n
2771 111 GLU n
2781 112 ARG n
2791 113 GLY n
2801 114 ALA n
2811 115 LEU n
2821 116 GLN n
2831 117 GLU n
2841 118 GLU n
2851 119 LEU n
2861 120 ALA n
2871 121 ARG n
2881 122 SER n
2891 123 PHE n
2901 124 PHE n
2911 125 TRP n
2921 126 GLN n
2931 127 VAL n
2941 128 LEU n
2951 129 GLU n
2961 130 ALA n
2971 131 VAL n
2981 132 ARG n
2991 133 HIS n
3001 134 CYS n
3011 135 HIS n
3021 136 ASN n
3031 137 CYS n
3041 138 GLY n
3051 139 VAL n
3061 140 LEU n
3071 141 HIS n
3081 142 ARG n
3091 143 ASP n
3101 144 ILE n
3111 145 LYS n
3121 146 ASP n
3131 147 GLU n
3141 148 ASN n
3151 149 ILE n
3161 150 LEU n
3171 151 ILE n
3181 152 ASP n
3191 153 LEU n
3201 154 ASN n
3211 155 ARG n
3221 156 GLY n
3231 157 GLU n
3241 158 LEU n
3251 159 LYS n
3261 160 LEU n
3271 161 ILE n
3281 162 ASP n
3291 163 PHE n
3301 164 GLY n
3311 165 SER n
3321 166 GLY n
3331 167 ALA n
3341 168 LEU n
3351 169 LEU n
3361 170 LYS n
3371 171 ASP n
3381 172 THR n
3391 173 VAL n
3401 174 TYR n
3411 175 THR n
3421 176 ASP n
3431 177 PHE n
3441 178 ASP n
3451 179 GLY n
3461 180 THR n
3471 181 ARG n
3481 182 VAL n
3491 183 TYR n
3501 184 SER n
3511 185 PRO n
3521 186 PRO n
3531 187 GLU n
3541 188 TRP n
3551 189 ILE n
3561 190 ARG n
3571 191 TYR n
3581 192 HIS n
3591 193 ARG n
3601 194 TYR n
3611 195 HIS n
3621 196 GLY n
3631 197 ARG n
3641 198 SER n
3651 199 ALA n
3661 200 ALA n
3671 201 VAL n
3681 202 TRP n
3691 203 SER n
3701 204 LEU n
3711 205 GLY n
3721 206 ILE n
3731 207 LEU n
3741 208 LEU n
3751 209 TYR n
3761 210 ASP n
3771 211 MET n
3781 212 VAL n
3791 213 CYS n
3801 214 GLY n
3811 215 ASP n
3821 216 ILE n
3831 217 PRO n
3841 218 PHE n
3851 219 GLU n
3861 220 HIS n
3871 221 ASP n
3881 222 GLU n
3891 223 GLU n
3901 224 ILE n
3911 225 ILE n
3921 226 ARG n
3931 227 GLY n
3941 228 GLN n
3951 229 VAL n
3961 230 PHE n
3971 231 PHE n
3981 232 ARG n
3991 233 GLN n
4001 234 ARG n
4011 235 VAL n
4021 236 SER n
4031 237 SEP01 n
4041 238 GLU n
4051 239 CYS n
4061 240 GLN n
4071 241 HIS n
4081 242 LEU n
4091 243 ILE n
4101 244 ARG n
4111 245 TRP n
4121 246 CYS n
4131 247 LEU n
4141 248 ALA n
4151 249 LEU n
4161 250 ARG n
4171 251 PRO n
4181 252 SER n
4191 253 ASP n
4201 254 ARG n
4211 255 PRO n
4221 256 THR n
4231 257 PHE n
4241 258 GLU n
4251 259 GLU n
4261 260 ILE n
4271 261 GLN n
4281 262 ASN n
4291 263 HIS n
4301 264 PRO n
4311 265 TRP n
4321 266 MET n
4331 267 GLN n
4341 268 ASP n
4351 269 VAL n
4361 270 LEU n
4371 271 LEU n
4381 272 PRO n
4391 273 GLN n
4401 274 GLU n
4411 275 THR n
4421 276 ALA n
4431 277 GLU n
4441 278 ILE n
4451 279 HIS n
4461 280 LEU n
4471 281 HIS n
4481 282 SER n
4491 283 LEU n
4501 284 SER n
4511 285 PRO n
4521 286 GLY n
4531 287 PRO n
4541 288 SER n
4551 289 LYS n
456#
457_entity_src_gen.entity_id 1
458_entity_src_gen.pdbx_src_id 1
459_entity_src_gen.pdbx_alt_source_flag sample
460_entity_src_gen.pdbx_seq_type 'Biological sequence'
461_entity_src_gen.pdbx_beg_seq_num 1
462_entity_src_gen.pdbx_end_seq_num 289
463_entity_src_gen.gene_src_common_name human
464_entity_src_gen.gene_src_genus ?
465_entity_src_gen.pdbx_gene_src_gene PIM1
466_entity_src_gen.gene_src_species ?
467_entity_src_gen.gene_src_strain ?
468_entity_src_gen.gene_src_tissue ?
469_entity_src_gen.gene_src_tissue_fraction ?
470_entity_src_gen.gene_src_details ?
471_entity_src_gen.pdbx_gene_src_fragment ?
472_entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens'
473_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606
474_entity_src_gen.pdbx_gene_src_variant ?
475_entity_src_gen.pdbx_gene_src_cell_line ?
476_entity_src_gen.pdbx_gene_src_atcc ?
477_entity_src_gen.pdbx_gene_src_organ ?
478_entity_src_gen.pdbx_gene_src_organelle ?
479_entity_src_gen.pdbx_gene_src_cell ?
480_entity_src_gen.pdbx_gene_src_cellular_location ?
481_entity_src_gen.host_org_common_name ?
482_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli'
483_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562
484_entity_src_gen.host_org_genus ?
485_entity_src_gen.pdbx_host_org_gene ?
486_entity_src_gen.pdbx_host_org_organ ?
487_entity_src_gen.host_org_species ?
488_entity_src_gen.pdbx_host_org_tissue ?
489_entity_src_gen.pdbx_host_org_tissue_fraction ?
490_entity_src_gen.pdbx_host_org_strain 'BL21(DE3'
491_entity_src_gen.pdbx_host_org_variant ?
492_entity_src_gen.pdbx_host_org_cell_line ?
493_entity_src_gen.pdbx_host_org_atcc ?
494_entity_src_gen.pdbx_host_org_culture_collection ?
495_entity_src_gen.pdbx_host_org_cell ?
496_entity_src_gen.pdbx_host_org_organelle ?
497_entity_src_gen.pdbx_host_org_cellular_location ?
498_entity_src_gen.pdbx_host_org_vector_type plasmid
499_entity_src_gen.pdbx_host_org_vector ?
500_entity_src_gen.host_org_details ?
501_entity_src_gen.expression_system_id ?
502_entity_src_gen.plasmid_name pET28
503_entity_src_gen.plasmid_details ?
504_entity_src_gen.pdbx_description ?
505#
506_struct_ref.id 1
507_struct_ref.db_name UNP
508_struct_ref.db_code PIM1_HUMAN
509_struct_ref.pdbx_db_accession P11309
510_struct_ref.pdbx_db_isoform ?
511_struct_ref.entity_id 1
512_struct_ref.pdbx_seq_one_letter_code
513;KEKEPLESQYQVGPLLGSGGFGSVYSGIRVSDNLPVAIKHVEKDRISDWGELPNGTRVPMEVVLLKKVSSGFSGVIRLLD
514WFERPDSFVLILERPEPVQDLFDFITERGALQEELARSFFWQVLEAVRHCHNCGVLHRDIKDENILIDLNRGELKLIDFG
515SGALLKDTVYTDFDGTRVYSPPEWIRYHRYHGRSAAVWSLGILLYDMVCGDIPFEHDEEIIRGQVFFRQRVSSECQHLIR
516WCLALRPSDRPTFEEIQNHPWMQDVLLPQETAEIHLHSLSPGPSK
517;
518_struct_ref.pdbx_align_begin 29
519#
520_struct_ref_seq.align_id 1
521_struct_ref_seq.ref_id 1
522_struct_ref_seq.pdbx_PDB_id_code PDB_00017XSV
523_struct_ref_seq.pdbx_strand_id A
524_struct_ref_seq.seq_align_beg 5
525_struct_ref_seq.pdbx_seq_align_beg_ins_code ?
526_struct_ref_seq.seq_align_end 289
527_struct_ref_seq.pdbx_seq_align_end_ins_code ?
528_struct_ref_seq.pdbx_db_accession P11309
529_struct_ref_seq.db_align_beg 29
530_struct_ref_seq.pdbx_db_align_beg_ins_code ?
531_struct_ref_seq.db_align_end 313
532_struct_ref_seq.pdbx_db_align_end_ins_code ?
533_struct_ref_seq.pdbx_auth_seq_align_beg 29
534_struct_ref_seq.pdbx_auth_seq_align_end 313
535#
536loop_
537_struct_ref_seq_dif.align_id
538_struct_ref_seq_dif.pdbx_pdb_id_code
539_struct_ref_seq_dif.mon_id
540_struct_ref_seq_dif.pdbx_pdb_strand_id
541_struct_ref_seq_dif.seq_num
542_struct_ref_seq_dif.pdbx_pdb_ins_code
543_struct_ref_seq_dif.pdbx_seq_db_name
544_struct_ref_seq_dif.pdbx_seq_db_accession_code
545_struct_ref_seq_dif.db_mon_id
546_struct_ref_seq_dif.pdbx_seq_db_seq_num
547_struct_ref_seq_dif.details
548_struct_ref_seq_dif.pdbx_auth_seq_num
549_struct_ref_seq_dif.pdbx_ordinal
5501 PDB_00017XSV GLY A 1 ? UNP P11309 ? ? 'expression tag' 25 1
5511 PDB_00017XSV PRO A 2 ? UNP P11309 ? ? 'expression tag' 26 2
5521 PDB_00017XSV HIS A 3 ? UNP P11309 ? ? 'expression tag' 27 3
5531 PDB_00017XSV MET A 4 ? UNP P11309 ? ? 'expression tag' 28 4
554#
555loop_
556_chem_comp.id
557_chem_comp.type
558_chem_comp.mon_nstd_flag
559_chem_comp.name
560_chem_comp.pdbx_synonyms
561_chem_comp.formula
562_chem_comp.formula_weight
563ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093
564ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209
565ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118
566ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103
567CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158
568GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144
569GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129
570GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067
571HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162
572HOH non-polymer . WATER ? 'H2 O' 18.015
573I4M non-polymer .
574'8-Methyl-2,5,20-trioxa-8,13,17-triazatetracyclo[11.10.2.014,19.021,25]pentacosa-1(24),14(19),15,17,21(25),22-hexaene' ?
575'C20 H25 N3 O3' 355.431
576ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173
577LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173
578LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195
579MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211
580PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189
581PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130
582SEP01 'L-peptide linking' n PHOSPHOSERINE PHOSPHONOSERINE 'C3 H8 N O6 P' 185.072
583SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093
584THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119
585TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225
586TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189
587VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146
588#
589_exptl.absorpt_coefficient_mu ?
590_exptl.absorpt_correction_T_max ?
591_exptl.absorpt_correction_T_min ?
592_exptl.absorpt_correction_type ?
593_exptl.absorpt_process_details ?
594_exptl.entry_id PDB_00017XSV
595_exptl.crystals_number 1
596_exptl.details ?
597_exptl.method 'X-RAY DIFFRACTION'
598_exptl.method_details ?
599#
600_exptl_crystal.colour ?
601_exptl_crystal.density_diffrn ?
602_exptl_crystal.density_Matthews 3.24
603_exptl_crystal.density_method ?
604_exptl_crystal.density_percent_sol 61.99
605_exptl_crystal.description ?
606_exptl_crystal.F_000 ?
607_exptl_crystal.id 1
608_exptl_crystal.preparation ?
609_exptl_crystal.size_max ?
610_exptl_crystal.size_mid ?
611_exptl_crystal.size_min ?
612_exptl_crystal.size_rad ?
613_exptl_crystal.colour_lustre ?
614_exptl_crystal.colour_modifier ?
615_exptl_crystal.colour_primary ?
616_exptl_crystal.density_meas ?
617_exptl_crystal.density_meas_esd ?
618_exptl_crystal.density_meas_gt ?
619_exptl_crystal.density_meas_lt ?
620_exptl_crystal.density_meas_temp ?
621_exptl_crystal.density_meas_temp_esd ?
622_exptl_crystal.density_meas_temp_gt ?
623_exptl_crystal.density_meas_temp_lt ?
624_exptl_crystal.pdbx_crystal_image_url ?
625_exptl_crystal.pdbx_crystal_image_format ?
626_exptl_crystal.pdbx_mosaicity 0.340
627_exptl_crystal.pdbx_mosaicity_esd ?
628_exptl_crystal.pdbx_mosaic_method ?
629_exptl_crystal.pdbx_mosaic_block_size ?
630_exptl_crystal.pdbx_mosaic_block_size_esd ?
631#
632_exptl_crystal_grow.apparatus ?
633_exptl_crystal_grow.atmosphere ?
634_exptl_crystal_grow.crystal_id 1
635_exptl_crystal_grow.details ?
636_exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP'
637_exptl_crystal_grow.method_ref ?
638_exptl_crystal_grow.pH 8.0
639_exptl_crystal_grow.pressure ?
640_exptl_crystal_grow.pressure_esd ?
641_exptl_crystal_grow.seeding ?
642_exptl_crystal_grow.seeding_ref ?
643_exptl_crystal_grow.temp 291
644_exptl_crystal_grow.temp_details ?
645_exptl_crystal_grow.temp_esd ?
646_exptl_crystal_grow.time ?
647_exptl_crystal_grow.pdbx_details '0.4M POTASSIUM SODIUM TARTRATE'
648_exptl_crystal_grow.pdbx_pH_range ?
649#
650_diffrn.ambient_environment ?
651_diffrn.ambient_temp 291
652_diffrn.ambient_temp_details ?
653_diffrn.ambient_temp_esd ?
654_diffrn.crystal_id 1
655_diffrn.crystal_support ?
656_diffrn.crystal_treatment ?
657_diffrn.details ?
658_diffrn.id 1
659_diffrn.ambient_pressure ?
660_diffrn.ambient_pressure_esd ?
661_diffrn.ambient_pressure_gt ?
662_diffrn.ambient_pressure_lt ?
663_diffrn.ambient_temp_gt ?
664_diffrn.ambient_temp_lt ?
665_diffrn.pdbx_serial_crystal_experiment N
666#
667_diffrn_detector.details ?
668_diffrn_detector.detector PIXEL
669_diffrn_detector.diffrn_id 1
670_diffrn_detector.type 'DECTRIS EIGER X 16M'
671_diffrn_detector.area_resol_mean ?
672_diffrn_detector.dtime ?
673_diffrn_detector.pdbx_frames_total ?
674_diffrn_detector.pdbx_collection_time_total ?
675_diffrn_detector.pdbx_collection_date 2022-01-24
676_diffrn_detector.pdbx_frequency ?
677#
678_diffrn_radiation.collimation ?
679_diffrn_radiation.diffrn_id 1
680_diffrn_radiation.filter_edge ?
681_diffrn_radiation.inhomogeneity ?
682_diffrn_radiation.monochromator ?
683_diffrn_radiation.polarisn_norm ?
684_diffrn_radiation.polarisn_ratio ?
685_diffrn_radiation.probe ?
686_diffrn_radiation.type ?
687_diffrn_radiation.xray_symbol ?
688_diffrn_radiation.wavelength_id 1
689_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M
690_diffrn_radiation.pdbx_wavelength_list ?
691_diffrn_radiation.pdbx_wavelength ?
692_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH'
693_diffrn_radiation.pdbx_analyzer ?
694_diffrn_radiation.pdbx_scattering_type x-ray
695#
696_diffrn_radiation_wavelength.id 1
697_diffrn_radiation_wavelength.wavelength 0.9792
698_diffrn_radiation_wavelength.wt 1.0
699#
700_diffrn_source.current ?
701_diffrn_source.details ?
702_diffrn_source.diffrn_id 1
703_diffrn_source.power ?
704_diffrn_source.size ?
705_diffrn_source.source SYNCHROTRON
706_diffrn_source.target ?
707_diffrn_source.type 'SSRF BEAMLINE BL10U2'
708_diffrn_source.voltage ?
709_diffrn_source.take-off_angle ?
710_diffrn_source.pdbx_wavelength_list 0.9792
711_diffrn_source.pdbx_wavelength ?
712_diffrn_source.pdbx_synchrotron_beamline BL10U2
713_diffrn_source.pdbx_synchrotron_site SSRF
714#
715_reflns.B_iso_Wilson_estimate 62.510
716_reflns.entry_id PDB_00017XSV
717_reflns.data_reduction_details ?
718_reflns.data_reduction_method ?
719_reflns.d_resolution_high 2.660
720_reflns.d_resolution_low 41.360
721_reflns.details ?
722_reflns.limit_h_max ?
723_reflns.limit_h_min ?
724_reflns.limit_k_max ?
725_reflns.limit_k_min ?
726_reflns.limit_l_max ?
727_reflns.limit_l_min ?
728_reflns.number_all ?
729_reflns.number_obs 11558
730_reflns.observed_criterion ?
731_reflns.observed_criterion_F_max ?
732_reflns.observed_criterion_F_min ?
733_reflns.observed_criterion_I_max ?
734_reflns.observed_criterion_I_min ?
735_reflns.observed_criterion_sigma_F ?
736_reflns.observed_criterion_sigma_I ?
737_reflns.percent_possible_obs 93.700
738_reflns.R_free_details ?
739_reflns.Rmerge_F_all ?
740_reflns.Rmerge_F_obs ?
741_reflns.Friedel_coverage ?
742_reflns.number_gt ?
743_reflns.threshold_expression ?
744_reflns.pdbx_redundancy 19.300
745_reflns.pdbx_Rmerge_I_obs 0.152
746_reflns.pdbx_Rmerge_I_all ?
747_reflns.pdbx_Rsym_value ?
748_reflns.pdbx_netI_over_av_sigmaI ?
749_reflns.pdbx_netI_over_sigmaI 16.000
750_reflns.pdbx_res_netI_over_av_sigmaI_2 ?
751_reflns.pdbx_res_netI_over_sigmaI_2 ?
752_reflns.pdbx_chi_squared ?
753_reflns.pdbx_scaling_rejects 36
754_reflns.pdbx_d_res_high_opt ?
755_reflns.pdbx_d_res_low_opt ?
756_reflns.pdbx_d_res_opt_method ?
757_reflns.phase_calculation_details ?
758_reflns.pdbx_Rrim_I_all 0.156
759_reflns.pdbx_Rpim_I_all 0.035
760_reflns.pdbx_d_opt ?
761_reflns.pdbx_number_measured_all 223541
762_reflns.pdbx_diffrn_id 1
763_reflns.pdbx_ordinal 1
764_reflns.pdbx_CC_half 0.999
765_reflns.pdbx_CC_star ?
766_reflns.pdbx_R_split ?
767_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1] ?
768_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2] ?
769_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3] ?
770_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1] ?
771_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2] ?
772_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3] ?
773_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1] ?
774_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2] ?
775_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3] ?
776_reflns.pdbx_aniso_diffraction_limit_1 ?
777_reflns.pdbx_aniso_diffraction_limit_2 ?
778_reflns.pdbx_aniso_diffraction_limit_3 ?
779_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1] ?
780_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2] ?
781_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3] ?
782_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1] ?
783_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2] ?
784_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3] ?
785_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1] ?
786_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2] ?
787_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3] ?
788_reflns.pdbx_aniso_B_tensor_eigenvalue_1 ?
789_reflns.pdbx_aniso_B_tensor_eigenvalue_2 ?
790_reflns.pdbx_aniso_B_tensor_eigenvalue_3 ?
791_reflns.pdbx_orthogonalization_convention ?
792_reflns.pdbx_percent_possible_ellipsoidal ?
793_reflns.pdbx_percent_possible_spherical ?
794_reflns.pdbx_percent_possible_ellipsoidal_anomalous ?
795_reflns.pdbx_percent_possible_spherical_anomalous ?
796_reflns.pdbx_redundancy_anomalous ?
797_reflns.pdbx_CC_half_anomalous ?
798_reflns.pdbx_absDiff_over_sigma_anomalous ?
799_reflns.pdbx_percent_possible_anomalous ?
800_reflns.pdbx_observed_signal_threshold ?
801_reflns.pdbx_signal_type ?
802_reflns.pdbx_signal_details ?
803_reflns.pdbx_signal_software_id ?
804_reflns.pdbx_CC_split_method ?
805#
806loop_
807_reflns_shell.d_res_high
808_reflns_shell.d_res_low
809_reflns_shell.meanI_over_sigI_all
810_reflns_shell.meanI_over_sigI_obs
811_reflns_shell.number_measured_all
812_reflns_shell.number_measured_obs
813_reflns_shell.number_possible
814_reflns_shell.number_unique_all
815_reflns_shell.number_unique_obs
816_reflns_shell.percent_possible_all
817_reflns_shell.percent_possible_obs
818_reflns_shell.Rmerge_F_all
819_reflns_shell.Rmerge_F_obs
820_reflns_shell.Rmerge_I_all
821_reflns_shell.Rmerge_I_obs
822_reflns_shell.meanI_over_sigI_gt
823_reflns_shell.meanI_over_uI_all
824_reflns_shell.meanI_over_uI_gt
825_reflns_shell.number_measured_gt
826_reflns_shell.number_unique_gt
827_reflns_shell.percent_possible_gt
828_reflns_shell.Rmerge_F_gt
829_reflns_shell.Rmerge_I_gt
830_reflns_shell.pdbx_redundancy
831_reflns_shell.pdbx_Rsym_value
832_reflns_shell.pdbx_chi_squared
833_reflns_shell.pdbx_netI_over_sigmaI_all
834_reflns_shell.pdbx_netI_over_sigmaI_obs
835_reflns_shell.pdbx_Rrim_I_all
836_reflns_shell.pdbx_Rpim_I_all
837_reflns_shell.pdbx_rejects
838_reflns_shell.pdbx_ordinal
839_reflns_shell.pdbx_diffrn_id
840_reflns_shell.pdbx_CC_half
841_reflns_shell.pdbx_CC_star
842_reflns_shell.pdbx_R_split
843_reflns_shell.pdbx_percent_possible_ellipsoidal
844_reflns_shell.pdbx_percent_possible_spherical
845_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous
846_reflns_shell.pdbx_percent_possible_spherical_anomalous
847_reflns_shell.pdbx_redundancy_anomalous
848_reflns_shell.pdbx_CC_half_anomalous
849_reflns_shell.pdbx_absDiff_over_sigma_anomalous
850_reflns_shell.pdbx_percent_possible_anomalous
8512.660 2.790 ? ? 31485 ? ? ? 1580 96.800 ? ? ? ? 1.626 ? ? ? ? ? ? ? ? 19.900 ? ? ? 2.400 1.669 0.372 ? 1 1 0.681 ? ? ? ? ? ? ? ?
852? ?
8538.810 41.360 ? ? 5201 ? ? ? 351 98.900 ? ? ? ? 0.056 ? ? ? ? ? ? ? ? 14.800 ? ? ? 40.100 0.058 0.014 ? 2 1 0.998 ? ? ? ? ? ? ? ?
854? ?
855#
856_refine.aniso_B[1][1] ?
857_refine.aniso_B[1][2] ?
858_refine.aniso_B[1][3] ?
859_refine.aniso_B[2][2] ?
860_refine.aniso_B[2][3] ?
861_refine.aniso_B[3][3] ?
862_refine.B_iso_max 142.540
863_refine.B_iso_mean 69.2310
864_refine.B_iso_min 30.000
865_refine.correlation_coeff_Fo_to_Fc ?
866_refine.correlation_coeff_Fo_to_Fc_free ?
867_refine.details ?
868_refine.diff_density_max ?
869_refine.diff_density_max_esd ?
870_refine.diff_density_min ?
871_refine.diff_density_min_esd ?
872_refine.diff_density_rms ?
873_refine.diff_density_rms_esd ?
874_refine.entry_id PDB_00017XSV
875_refine.pdbx_refine_id 'X-RAY DIFFRACTION'
876_refine.ls_abs_structure_details ?
877_refine.ls_abs_structure_Flack ?
878_refine.ls_abs_structure_Flack_esd ?
879_refine.ls_abs_structure_Rogers ?
880_refine.ls_abs_structure_Rogers_esd ?
881_refine.ls_d_res_high 2.6600
882_refine.ls_d_res_low 31.7900
883_refine.ls_extinction_coef ?
884_refine.ls_extinction_coef_esd ?
885_refine.ls_extinction_expression ?
886_refine.ls_extinction_method ?
887_refine.ls_goodness_of_fit_all ?
888_refine.ls_goodness_of_fit_all_esd ?
889_refine.ls_goodness_of_fit_obs ?
890_refine.ls_goodness_of_fit_obs_esd ?
891_refine.ls_hydrogen_treatment ?
892_refine.ls_matrix_type ?
893_refine.ls_number_constraints ?
894_refine.ls_number_parameters ?
895_refine.ls_number_reflns_all ?
896_refine.ls_number_reflns_obs 11529
897_refine.ls_number_reflns_R_free 1138
898_refine.ls_number_reflns_R_work 10391
899_refine.ls_number_restraints ?
900_refine.ls_percent_reflns_obs 94.0400
901_refine.ls_percent_reflns_R_free 9.8700
902_refine.ls_R_factor_all ?
903_refine.ls_R_factor_obs 0.1969
904_refine.ls_R_factor_R_free 0.2332
905_refine.ls_R_factor_R_free_error ?
906_refine.ls_R_factor_R_free_error_details ?
907_refine.ls_R_factor_R_work 0.1927
908_refine.ls_R_Fsqd_factor_obs ?
909_refine.ls_R_I_factor_obs ?
910_refine.ls_redundancy_reflns_all ?
911_refine.ls_redundancy_reflns_obs ?
912_refine.ls_restrained_S_all ?
913_refine.ls_restrained_S_obs ?
914_refine.ls_shift_over_esd_max ?
915_refine.ls_shift_over_esd_mean ?
916_refine.ls_structure_factor_coef ?
917_refine.ls_weighting_details ?
918_refine.ls_weighting_scheme ?
919_refine.ls_wR_factor_all ?
920_refine.ls_wR_factor_obs ?
921_refine.ls_wR_factor_R_free ?
922_refine.ls_wR_factor_R_work ?
923_refine.occupancy_max ?
924_refine.occupancy_min ?
925_refine.solvent_model_details 'FLAT BULK SOLVENT MODEL'
926_refine.solvent_model_param_bsol ?
927_refine.solvent_model_param_ksol ?
928_refine.pdbx_R_complete ?
929_refine.ls_R_factor_gt ?
930_refine.ls_goodness_of_fit_gt ?
931_refine.ls_goodness_of_fit_ref ?
932_refine.ls_shift_over_su_max ?
933_refine.ls_shift_over_su_max_lt ?
934_refine.ls_shift_over_su_mean ?
935_refine.ls_shift_over_su_mean_lt ?
936_refine.pdbx_ls_sigma_I ?
937_refine.pdbx_ls_sigma_F 1.360
938_refine.pdbx_ls_sigma_Fsqd ?
939_refine.pdbx_data_cutoff_high_absF ?
940_refine.pdbx_data_cutoff_high_rms_absF ?
941_refine.pdbx_data_cutoff_low_absF ?
942_refine.pdbx_isotropic_thermal_model ?
943_refine.pdbx_ls_cross_valid_method THROUGHOUT
944_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT'
945_refine.pdbx_starting_model 6KZI
946_refine.pdbx_stereochemistry_target_values ML
947_refine.pdbx_R_Free_selection_details ?
948_refine.pdbx_stereochem_target_val_spec_case ?
949_refine.pdbx_overall_ESU_R ?
950_refine.pdbx_overall_ESU_R_Free ?
951_refine.pdbx_solvent_vdw_probe_radii 1.1100
952_refine.pdbx_solvent_ion_probe_radii ?
953_refine.pdbx_solvent_shrinkage_radii 0.9000
954_refine.pdbx_real_space_R ?
955_refine.pdbx_density_correlation ?
956_refine.pdbx_pd_number_of_powder_patterns ?
957_refine.pdbx_pd_number_of_points ?
958_refine.pdbx_pd_meas_number_of_points ?
959_refine.pdbx_pd_proc_ls_prof_R_factor ?
960_refine.pdbx_pd_proc_ls_prof_wR_factor ?
961_refine.pdbx_pd_Marquardt_correlation_coeff ?
962_refine.pdbx_pd_Fsqrd_R_factor ?
963_refine.pdbx_pd_ls_matrix_band_width ?
964_refine.pdbx_overall_phase_error 27.2700
965_refine.pdbx_overall_SU_R_free_Cruickshank_DPI ?
966_refine.pdbx_overall_SU_R_free_Blow_DPI ?
967_refine.pdbx_overall_SU_R_Blow_DPI ?
968_refine.pdbx_TLS_residual_ADP_flag ?
969_refine.pdbx_diffrn_id 1
970_refine.overall_SU_B ?
971_refine.overall_SU_ML 0.4000
972_refine.overall_SU_R_Cruickshank_DPI ?
973_refine.overall_SU_R_free ?
974_refine.overall_FOM_free_R_set ?
975_refine.overall_FOM_work_R_set ?
976_refine.pdbx_average_fsc_overall ?
977_refine.pdbx_average_fsc_work ?
978_refine.pdbx_average_fsc_free ?
979#
980_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION'
981_refine_hist.cycle_id final
982_refine_hist.details ?
983_refine_hist.d_res_high 2.6600
984_refine_hist.d_res_low 31.7900
985_refine_hist.number_atoms_solvent 16
986_refine_hist.number_atoms_total 2269
987_refine_hist.number_reflns_all ?
988_refine_hist.number_reflns_obs ?
989_refine_hist.number_reflns_R_free ?
990_refine_hist.number_reflns_R_work ?
991_refine_hist.R_factor_all ?
992_refine_hist.R_factor_obs ?
993_refine_hist.R_factor_R_free ?
994_refine_hist.R_factor_R_work ?
995_refine_hist.pdbx_number_residues_total 274
996_refine_hist.pdbx_B_iso_mean_ligand 57.33
997_refine_hist.pdbx_B_iso_mean_solvent 59.99
998_refine_hist.pdbx_number_atoms_protein 2227
999_refine_hist.pdbx_number_atoms_nucleic_acid 0
1000_refine_hist.pdbx_number_atoms_ligand 26
1001_refine_hist.pdbx_number_atoms_lipid ?
1002_refine_hist.pdbx_number_atoms_carb ?
1003_refine_hist.pdbx_pseudo_atom_details ?
1004#
1005loop_
1006_refine_ls_shell.pdbx_refine_id
1007_refine_ls_shell.d_res_high
1008_refine_ls_shell.d_res_low
1009_refine_ls_shell.number_reflns_all
1010_refine_ls_shell.number_reflns_obs
1011_refine_ls_shell.number_reflns_R_free
1012_refine_ls_shell.number_reflns_R_work
1013_refine_ls_shell.percent_reflns_obs
1014_refine_ls_shell.percent_reflns_R_free
1015_refine_ls_shell.R_factor_all
1016_refine_ls_shell.R_factor_obs
1017_refine_ls_shell.R_factor_R_free
1018_refine_ls_shell.R_factor_R_free_error
1019_refine_ls_shell.R_factor_R_work
1020_refine_ls_shell.redundancy_reflns_all
1021_refine_ls_shell.redundancy_reflns_obs
1022_refine_ls_shell.wR_factor_all
1023_refine_ls_shell.wR_factor_obs
1024_refine_ls_shell.wR_factor_R_free
1025_refine_ls_shell.wR_factor_R_work
1026_refine_ls_shell.pdbx_R_complete
1027_refine_ls_shell.pdbx_total_number_of_bins_used
1028_refine_ls_shell.pdbx_phase_error
1029_refine_ls_shell.pdbx_fsc_work
1030_refine_ls_shell.pdbx_fsc_free
1031'X-RAY DIFFRACTION' 2.6600 2.7800 1528 . 154 1374 100.0000 . . . 0.3242 0.0000 0.2837 . . . . . . . 8 . . .
1032'X-RAY DIFFRACTION' 2.7800 2.9300 1511 . 147 1364 100.0000 . . . 0.3508 0.0000 0.2705 . . . . . . . 8 . . .
1033'X-RAY DIFFRACTION' 2.9300 3.1100 1525 . 150 1375 100.0000 . . . 0.3267 0.0000 0.2458 . . . . . . . 8 . . .
1034'X-RAY DIFFRACTION' 3.1100 3.3300 1390 . 142 1248 99.0000 . . . 0.2846 0.0000 0.2269 . . . . . . . 8 . . .
1035'X-RAY DIFFRACTION' 3.3800 3.6900 1115 . 111 1004 82.0000 . . . 0.2567 0.0000 0.2092 . . . . . . . 8 . . .
1036'X-RAY DIFFRACTION' 3.6900 4.2200 1363 . 134 1229 89.0000 . . . 0.2364 0.0000 0.1717 . . . . . . . 8 . . .
1037'X-RAY DIFFRACTION' 4.2200 5.3100 1531 . 151 1380 100.0000 . . . 0.1698 0.0000 0.1553 . . . . . . . 8 . . .
1038'X-RAY DIFFRACTION' 5.3100 31.7900 1566 . 149 1417 100.0000 . . . 0.2017 0.0000 0.1765 . . . . . . . 8 . . .
1039#
1040_struct.entry_id PDB_00017XSV
1041_struct.title 'Crystal Structures of PIM1 in Complex with Macrocyclic Compound H3'
1042_struct.pdbx_structure_determination_methodology ?
1043_struct.pdbx_model_details ?
1044_struct.pdbx_formula_weight ?
1045_struct.pdbx_formula_weight_method ?
1046_struct.pdbx_model_type_details ?
1047_struct.pdbx_CASP_flag N
1048#
1049_struct_keywords.entry_id PDB_00017XSV
1050_struct_keywords.text 'Pim-1 kinase, Compound H3, TRANSFERASE-INHIBITOR complex, TRANSFERASE'
1051_struct_keywords.pdbx_keywords TRANSFERASE
1052#
1053loop_
1054_struct_asym.id
1055_struct_asym.pdbx_blank_PDB_chainid_flag
1056_struct_asym.pdbx_modified
1057_struct_asym.entity_id
1058_struct_asym.details
1059A N N 1 ?
1060B N N 2 ?
1061C N N 3 ?
1062#
1063loop_
1064_struct_conf.conf_type_id
1065_struct_conf.id
1066_struct_conf.pdbx_PDB_helix_id
1067_struct_conf.beg_label_comp_id
1068_struct_conf.beg_label_asym_id
1069_struct_conf.beg_label_seq_id
1070_struct_conf.pdbx_beg_PDB_ins_code
1071_struct_conf.end_label_comp_id
1072_struct_conf.end_label_asym_id
1073_struct_conf.end_label_seq_id
1074_struct_conf.pdbx_end_PDB_ins_code
1075_struct_conf.beg_auth_comp_id
1076_struct_conf.beg_auth_asym_id
1077_struct_conf.beg_auth_seq_id
1078_struct_conf.end_auth_comp_id
1079_struct_conf.end_auth_asym_id
1080_struct_conf.end_auth_seq_id
1081_struct_conf.pdbx_PDB_helix_class
1082_struct_conf.details
1083_struct_conf.pdbx_PDB_helix_length
1084HELX_P HELX_P1 AA1 PRO A 9 ? GLN A 13 ? PRO A 33 GLN A 37 1 ? 5
1085HELX_P HELX_P2 AA2 MET A 64 ? SER A 73 ? MET A 88 SER A 97 1 ? 10
1086HELX_P HELX_P3 AA3 LEU A 105 ? GLY A 113 ? LEU A 129 GLY A 137 1 ? 9
1087HELX_P HELX_P4 AA4 GLN A 116 ? CYS A 137 ? GLN A 140 CYS A 161 1 ? 22
1088HELX_P HELX_P5 AA5 LYS A 145 ? GLU A 147 ? LYS A 169 GLU A 171 5 ? 3
1089HELX_P HELX_P6 AA6 PRO A 185 ? HIS A 192 ? PRO A 209 HIS A 216 1 ? 8
1090HELX_P HELX_P7 AA7 HIS A 195 ? GLY A 214 ? HIS A 219 GLY A 238 1 ? 20
1091HELX_P HELX_P8 AA8 HIS A 220 ? GLY A 227 ? HIS A 244 GLY A 251 1 ? 8
1092HELX_P HELX_P9 AA9 SER A 236 ? LEU A 247 ? SER A 260 LEU A 271 1 ? 12
1093HELX_P HELX_P10 AB1 ARG A 250 ? ARG A 254 ? ARG A 274 ARG A 278 5 ? 5
1094HELX_P HELX_P11 AB2 THR A 256 ? ASN A 262 ? THR A 280 ASN A 286 1 ? 7
1095HELX_P HELX_P12 AB3 HIS A 263 ? GLN A 267 ? HIS A 287 GLN A 291 5 ? 5
1096HELX_P HELX_P13 AB4 LEU A 271 ? HIS A 279 ? LEU A 295 HIS A 303 1 ? 9
1097#
1098_struct_conf_type.id HELX_P
1099_struct_conf_type.criteria ?
1100_struct_conf_type.reference ?
1101#
1102loop_
1103_struct_conn.id
1104_struct_conn.conn_type_id
1105_struct_conn.pdbx_leaving_atom_flag
1106_struct_conn.pdbx_PDB_id
1107_struct_conn.ptnr1_label_asym_id
1108_struct_conn.ptnr1_label_comp_id
1109_struct_conn.ptnr1_label_seq_id
1110_struct_conn.ptnr1_label_atom_id
1111_struct_conn.pdbx_ptnr1_label_alt_id
1112_struct_conn.pdbx_ptnr1_PDB_ins_code
1113_struct_conn.pdbx_ptnr1_standard_comp_id
1114_struct_conn.ptnr1_symmetry
1115_struct_conn.ptnr2_label_asym_id
1116_struct_conn.ptnr2_label_comp_id
1117_struct_conn.ptnr2_label_seq_id
1118_struct_conn.ptnr2_label_atom_id
1119_struct_conn.pdbx_ptnr2_label_alt_id
1120_struct_conn.pdbx_ptnr2_PDB_ins_code
1121_struct_conn.ptnr1_auth_asym_id
1122_struct_conn.ptnr1_auth_comp_id
1123_struct_conn.ptnr1_auth_seq_id
1124_struct_conn.ptnr2_auth_asym_id
1125_struct_conn.ptnr2_auth_comp_id
1126_struct_conn.ptnr2_auth_seq_id
1127_struct_conn.ptnr2_symmetry
1128_struct_conn.pdbx_ptnr3_label_atom_id
1129_struct_conn.pdbx_ptnr3_label_seq_id
1130_struct_conn.pdbx_ptnr3_label_comp_id
1131_struct_conn.pdbx_ptnr3_label_asym_id
1132_struct_conn.pdbx_ptnr3_label_alt_id
1133_struct_conn.pdbx_ptnr3_PDB_ins_code
1134_struct_conn.details
1135_struct_conn.pdbx_dist_value
1136_struct_conn.pdbx_value_order
1137_struct_conn.pdbx_role
1138covale1 covale both ? A SER 236 C ? ? ? 1_555 A SEP01 237 N ? ? A SER 260 A SEP01 261 1_555 ? ? ? ? ? ? ? 1.328 ? ?
1139covale2 covale both ? A SEP01 237 C ? ? ? 1_555 A GLU 238 N ? ? A SEP01 261 A GLU 262 1_555 ? ? ? ? ? ? ? 1.330 ? ?
1140#
1141_struct_conn_type.id covale
1142_struct_conn_type.criteria ?
1143_struct_conn_type.reference ?
1144#
1145_struct_mon_prot_cis.pdbx_id 1
1146_struct_mon_prot_cis.label_comp_id GLU
1147_struct_mon_prot_cis.label_seq_id 100
1148_struct_mon_prot_cis.label_asym_id A
1149_struct_mon_prot_cis.label_alt_id .
1150_struct_mon_prot_cis.pdbx_PDB_ins_code ?
1151_struct_mon_prot_cis.auth_comp_id GLU
1152_struct_mon_prot_cis.auth_seq_id 124
1153_struct_mon_prot_cis.auth_asym_id A
1154_struct_mon_prot_cis.pdbx_label_comp_id_2 PRO
1155_struct_mon_prot_cis.pdbx_label_seq_id_2 101
1156_struct_mon_prot_cis.pdbx_label_asym_id_2 A
1157_struct_mon_prot_cis.pdbx_PDB_ins_code_2 ?
1158_struct_mon_prot_cis.pdbx_auth_comp_id_2 PRO
1159_struct_mon_prot_cis.pdbx_auth_seq_id_2 125
1160_struct_mon_prot_cis.pdbx_auth_asym_id_2 A
1161_struct_mon_prot_cis.pdbx_PDB_model_num 1
1162_struct_mon_prot_cis.pdbx_omega_angle -4.66
1163#
1164loop_
1165_struct_sheet.id
1166_struct_sheet.type
1167_struct_sheet.number_strands
1168_struct_sheet.details
1169AA1 ? 5 ?
1170AA2 ? 2 ?
1171AA3 ? 3 ?
1172AA4 ? 2 ?
1173#
1174loop_
1175_struct_sheet_order.sheet_id
1176_struct_sheet_order.range_id_1
1177_struct_sheet_order.range_id_2
1178_struct_sheet_order.offset
1179_struct_sheet_order.sense
1180AA1 1 2 ? anti-parallel
1181AA1 2 3 ? anti-parallel
1182AA1 3 4 ? anti-parallel
1183AA1 4 5 ? anti-parallel
1184AA2 1 2 ? anti-parallel
1185AA3 1 2 ? anti-parallel
1186AA3 2 3 ? anti-parallel
1187AA4 1 2 ? anti-parallel
1188#
1189loop_
1190_struct_sheet_range.sheet_id
1191_struct_sheet_range.id
1192_struct_sheet_range.beg_label_comp_id
1193_struct_sheet_range.beg_label_asym_id
1194_struct_sheet_range.beg_label_seq_id
1195_struct_sheet_range.pdbx_beg_PDB_ins_code
1196_struct_sheet_range.end_label_comp_id
1197_struct_sheet_range.end_label_asym_id
1198_struct_sheet_range.end_label_seq_id
1199_struct_sheet_range.pdbx_end_PDB_ins_code
1200_struct_sheet_range.beg_auth_comp_id
1201_struct_sheet_range.beg_auth_asym_id
1202_struct_sheet_range.beg_auth_seq_id
1203_struct_sheet_range.end_auth_comp_id
1204_struct_sheet_range.end_auth_asym_id
1205_struct_sheet_range.end_auth_seq_id
1206AA1 1 TYR A 14 ? GLY A 23 ? TYR A 38 GLY A 47
1207AA1 2 GLY A 26 ? ARG A 33 ? GLY A 50 ARG A 57
1208AA1 3 LEU A 38 ? GLU A 46 ? LEU A 62 GLU A 70
1209AA1 4 SER A 91 ? GLU A 97 ? SER A 115 GLU A 121
1210AA1 5 LEU A 82 ? GLU A 87 ? LEU A 106 GLU A 111
1211AA2 1 TRP A 53 ? LEU A 56 ? TRP A 77 LEU A 80
1212AA2 2 THR A 60 ? PRO A 63 ? THR A 84 PRO A 87
1213AA3 1 VAL A 102 ? ASP A 104 ? VAL A 126 ASP A 128
1214AA3 2 ILE A 149 ? ASP A 152 ? ILE A 173 ASP A 176
1215AA3 3 GLU A 157 ? LEU A 160 ? GLU A 181 LEU A 184
1216AA4 1 VAL A 139 ? LEU A 140 ? VAL A 163 LEU A 164
1217AA4 2 ALA A 167 ? LEU A 168 ? ALA A 191 LEU A 192
1218#
1219loop_
1220_pdbx_struct_sheet_hbond.sheet_id
1221_pdbx_struct_sheet_hbond.range_id_1
1222_pdbx_struct_sheet_hbond.range_id_2
1223_pdbx_struct_sheet_hbond.range_1_label_atom_id
1224_pdbx_struct_sheet_hbond.range_1_label_comp_id
1225_pdbx_struct_sheet_hbond.range_1_label_asym_id
1226_pdbx_struct_sheet_hbond.range_1_label_seq_id
1227_pdbx_struct_sheet_hbond.range_1_PDB_ins_code
1228_pdbx_struct_sheet_hbond.range_1_auth_atom_id
1229_pdbx_struct_sheet_hbond.range_1_auth_comp_id
1230_pdbx_struct_sheet_hbond.range_1_auth_asym_id
1231_pdbx_struct_sheet_hbond.range_1_auth_seq_id
1232_pdbx_struct_sheet_hbond.range_2_label_atom_id
1233_pdbx_struct_sheet_hbond.range_2_label_comp_id
1234_pdbx_struct_sheet_hbond.range_2_label_asym_id
1235_pdbx_struct_sheet_hbond.range_2_label_seq_id
1236_pdbx_struct_sheet_hbond.range_2_PDB_ins_code
1237_pdbx_struct_sheet_hbond.range_2_auth_atom_id
1238_pdbx_struct_sheet_hbond.range_2_auth_comp_id
1239_pdbx_struct_sheet_hbond.range_2_auth_asym_id
1240_pdbx_struct_sheet_hbond.range_2_auth_seq_id
1241AA1 1 2 N PRO A 18 ? N PRO A 42 O SER A 30 ? O SER A 54
1242AA1 2 3 N SER A 27 ? N SER A 51 O HIS A 44 ? O HIS A 68
1243AA1 3 4 N LYS A 43 ? N LYS A 67 O LEU A 94 ? O LEU A 118
1244AA1 4 5 O ILE A 95 ? O ILE A 119 N ASP A 84 ? N ASP A 108
1245AA2 1 2 N GLY A 54 ? N GLY A 78 O VAL A 62 ? O VAL A 86
1246AA3 1 2 N GLN A 103 ? N GLN A 127 O ILE A 151 ? O ILE A 175
1247AA3 2 3 N ASP A 152 ? N ASP A 176 O GLU A 157 ? O GLU A 181
1248AA4 1 2 N LEU A 140 ? N LEU A 164 O ALA A 167 ? O ALA A 191
1249#
1250_atom_sites.entry_id PDB_00017XSV
1251_atom_sites.Cartn_transf_matrix[1][1] ?
1252_atom_sites.Cartn_transf_matrix[1][2] ?
1253_atom_sites.Cartn_transf_matrix[1][3] ?
1254_atom_sites.Cartn_transf_matrix[2][1] ?
1255_atom_sites.Cartn_transf_matrix[2][2] ?
1256_atom_sites.Cartn_transf_matrix[2][3] ?
1257_atom_sites.Cartn_transf_matrix[3][1] ?
1258_atom_sites.Cartn_transf_matrix[3][2] ?
1259_atom_sites.Cartn_transf_matrix[3][3] ?
1260_atom_sites.Cartn_transf_vector[1] ?
1261_atom_sites.Cartn_transf_vector[2] ?
1262_atom_sites.Cartn_transf_vector[3] ?
1263_atom_sites.fract_transf_matrix[1][1] 0.010297
1264_atom_sites.fract_transf_matrix[1][2] 0.005945
1265_atom_sites.fract_transf_matrix[1][3] 0.000000
1266_atom_sites.fract_transf_matrix[2][1] 0.000000
1267_atom_sites.fract_transf_matrix[2][2] 0.011891
1268_atom_sites.fract_transf_matrix[2][3] 0.000000
1269_atom_sites.fract_transf_matrix[3][1] 0.000000
1270_atom_sites.fract_transf_matrix[3][2] 0.000000
1271_atom_sites.fract_transf_matrix[3][3] 0.012665
1272_atom_sites.fract_transf_vector[1] 0.000000
1273_atom_sites.fract_transf_vector[2] 0.000000
1274_atom_sites.fract_transf_vector[3] 0.000000
1275_atom_sites.solution_primary ?
1276_atom_sites.solution_secondary ?
1277_atom_sites.solution_hydrogens ?
1278_atom_sites.special_details ?
1279#
1280loop_
1281_atom_type.symbol
1282C
1283N
1284O
1285P
1286S
1287#
1288loop_
1289_atom_site.group_PDB
1290_atom_site.id
1291_atom_site.type_symbol
1292_atom_site.label_atom_id
1293_atom_site.label_alt_id
1294_atom_site.label_comp_id
1295_atom_site.label_asym_id
1296_atom_site.label_entity_id
1297_atom_site.label_seq_id
1298_atom_site.pdbx_PDB_ins_code
1299_atom_site.Cartn_x
1300_atom_site.Cartn_y
1301_atom_site.Cartn_z
1302_atom_site.occupancy
1303_atom_site.B_iso_or_equiv
1304_atom_site.pdbx_formal_charge
1305_atom_site.auth_seq_id
1306_atom_site.auth_comp_id
1307_atom_site.auth_asym_id
1308_atom_site.auth_atom_id
1309_atom_site.pdbx_PDB_model_num
1310ATOM 1 N N . GLU A 1 8 ? 92.296 38.333 -11.678 1.00 124.41 ? 32 GLU A N 1
1311ATOM 2 C CA . GLU A 1 8 ? 92.513 39.621 -12.335 1.00 130.39 ? 32 GLU A CA 1
1312ATOM 3 C C . GLU A 1 8 ? 91.264 40.522 -12.332 1.00 126.20 ? 32 GLU A C 1
1313ATOM 4 O O . GLU A 1 8 ? 91.362 41.689 -11.951 1.00 107.01 ? 32 GLU A O 1
1314ATOM 5 C CB . GLU A 1 8 ? 93.016 39.414 -13.772 1.00 121.37 ? 32 GLU A CB 1
1315ATOM 6 N N . PRO A 1 9 ? 90.096 40.014 -12.747 1.00 129.25 ? 33 PRO A N 1
1316ATOM 7 C CA . PRO A 1 9 ? 88.895 40.855 -12.712 1.00 120.46 ? 33 PRO A CA 1
1317ATOM 8 C C . PRO A 1 9 ? 88.141 40.836 -11.392 1.00 118.71 ? 33 PRO A C 1
1318ATOM 9 O O . PRO A 1 9 ? 87.237 41.662 -11.218 1.00 120.65 ? 33 PRO A O 1
1319ATOM 10 C CB . PRO A 1 9 ? 88.019 40.261 -13.841 1.00 115.56 ? 33 PRO A CB 1
1320ATOM 11 C CG . PRO A 1 9 ? 88.779 39.072 -14.388 1.00 113.03 ? 33 PRO A CG 1
1321ATOM 12 C CD . PRO A 1 9 ? 89.778 38.707 -13.346 1.00 120.84 ? 33 PRO A CD 1
1322ATOM 13 N N . LEU A 1 10 ? 88.481 39.946 -10.456 1.00 105.57 ? 34 LEU A N 1
1323ATOM 14 C CA . LEU A 1 10 ? 87.674 39.816 -9.245 1.00 96.19 ? 34 LEU A CA 1
1324ATOM 15 C C . LEU A 1 10 ? 87.877 40.999 -8.302 1.00 89.62 ? 34 LEU A C 1
1325ATOM 16 O O . LEU A 1 10 ? 86.907 41.639 -7.879 1.00 93.74 ? 34 LEU A O 1
1326ATOM 17 C CB . LEU A 1 10 ? 87.994 38.502 -8.533 1.00 95.92 ? 34 LEU A CB 1
1327ATOM 18 C CG . LEU A 1 10 ? 87.603 38.446 -7.051 1.00 92.40 ? 34 LEU A CG 1
1328ATOM 19 C CD1 . LEU A 1 10 ? 86.094 38.540 -6.861 1.00 63.79 ? 34 LEU A CD1 1
1329ATOM 20 C CD2 . LEU A 1 10 ? 88.128 37.175 -6.422 1.00 89.32 ? 34 LEU A CD2 1
1330ATOM 21 N N . GLU A 1 11 ? 89.126 41.300 -7.950 1.00 87.01 ? 35 GLU A N 1
1331ATOM 22 C CA . GLU A 1 11 ? 89.376 42.302 -6.920 1.00 98.79 ? 35 GLU A CA 1
1332ATOM 23 C C . GLU A 1 11 ? 89.146 43.729 -7.402 1.00 94.12 ? 35 GLU A C 1
1333ATOM 24 O O . GLU A 1 11 ? 89.040 44.638 -6.571 1.00 94.98 ? 35 GLU A O 1
1334ATOM 25 C CB . GLU A 1 11 ? 90.799 42.154 -6.380 1.00 95.94 ? 35 GLU A CB 1
1335ATOM 26 C CG . GLU A 1 11 ? 91.203 40.711 -6.113 1.00 104.75 ? 35 GLU A CG 1
1336ATOM 27 C CD . GLU A 1 11 ? 91.281 40.395 -4.628 1.00 117.51 ? 35 GLU A CD 1
1337ATOM 28 O OE1 . GLU A 1 11 ? 91.916 39.383 -4.263 1.00 114.15 ? 35 GLU A OE1 1
1338ATOM 29 O OE2 . GLU A 1 11 ? 90.693 41.151 -3.825 1.00 113.26 ? 35 GLU A OE2 1
1339ATOM 30 N N . SER A 1 12 ? 89.062 43.946 -8.713 1.00 95.18 ? 36 SER A N 1
1340ATOM 31 C CA . SER A 1 12 ? 88.778 45.270 -9.252 1.00 88.28 ? 36 SER A CA 1
1341ATOM 32 C C . SER A 1 12 ? 87.286 45.475 -9.495 1.00 92.71 ? 36 SER A C 1
1342ATOM 33 O O . SER A 1 12 ? 86.739 46.531 -9.160 1.00 84.11 ? 36 SER A O 1
1343ATOM 34 C CB . SER A 1 12 ? 89.559 45.485 -10.551 1.00 84.46 ? 36 SER A CB 1
1344ATOM 35 O OG . SER A 1 12 ? 89.452 44.351 -11.396 1.00 105.30 ? 36 SER A OG 1
1345ATOM 36 N N . GLN A 1 13 ? 86.621 44.470 -10.078 1.00 91.53 ? 37 GLN A N 1
1346ATOM 37 C CA . GLN A 1 13 ? 85.190 44.570 -10.355 1.00 83.29 ? 37 GLN A CA 1
1347ATOM 38 C C . GLN A 1 13 ? 84.370 44.737 -9.086 1.00 79.50 ? 37 GLN A C 1
1348ATOM 39 O O . GLN A 1 13 ? 83.318 45.387 -9.106 1.00 78.87 ? 37 GLN A O 1
1349ATOM 40 C CB . GLN A 1 13 ? 84.708 43.329 -11.098 1.00 78.85 ? 37 GLN A CB 1
1350ATOM 41 C CG . GLN A 1 13 ? 84.681 43.436 -12.601 1.00 87.69 ? 37 GLN A CG 1
1351ATOM 42 C CD . GLN A 1 13 ? 83.399 42.866 -13.174 1.00 95.93 ? 37 GLN A CD 1
1352ATOM 43 O OE1 . GLN A 1 13 ? 82.303 43.174 -12.700 1.00 74.85 ? 37 GLN A OE1 1
1353ATOM 44 N NE2 . GLN A 1 13 ? 83.528 42.017 -14.187 1.00 99.98 ? 37 GLN A NE2 1
1354ATOM 45 N N . TYR A 1 14 ? 84.814 44.144 -7.987 1.00 77.59 ? 38 TYR A N 1
1355ATOM 46 C CA . TYR A 1 14 ? 84.046 44.105 -6.755 1.00 69.05 ? 38 TYR A CA 1
1356ATOM 47 C C . TYR A 1 14 ? 84.869 44.673 -5.610 1.00 73.88 ? 38 TYR A C 1
1357ATOM 48 O O . TYR A 1 14 ? 86.065 44.388 -5.484 1.00 78.57 ? 38 TYR A O 1
1358ATOM 49 C CB . TYR A 1 14 ? 83.610 42.672 -6.448 1.00 56.54 ? 38 TYR A CB 1
1359ATOM 50 C CG . TYR A 1 14 ? 82.771 42.062 -7.548 1.00 65.14 ? 38 TYR A CG 1
1360ATOM 51 C CD1 . TYR A 1 14 ? 81.445 42.434 -7.724 1.00 58.98 ? 38 TYR A CD1 1
1361ATOM 52 C CD2 . TYR A 1 14 ? 83.318 41.155 -8.440 1.00 65.05 ? 38 TYR A CD2 1
1362ATOM 53 C CE1 . TYR A 1 14 ? 80.681 41.893 -8.731 1.00 58.75 ? 38 TYR A CE1 1
1363ATOM 54 C CE2 . TYR A 1 14 ? 82.559 40.609 -9.460 1.00 74.46 ? 38 TYR A CE2 1
1364ATOM 55 C CZ . TYR A 1 14 ? 81.241 40.981 -9.600 1.00 72.61 ? 38 TYR A CZ 1
1365ATOM 56 O OH . TYR A 1 14 ? 80.477 40.443 -10.614 1.00 78.82 ? 38 TYR A OH 1
1366ATOM 57 N N . GLN A 1 15 ? 84.225 45.504 -4.800 1.00 67.61 ? 39 GLN A N 1
1367ATOM 58 C CA . GLN A 1 15 ? 84.804 46.003 -3.566 1.00 67.83 ? 39 GLN A CA 1
1368ATOM 59 C C . GLN A 1 15 ? 84.354 45.090 -2.433 1.00 69.02 ? 39 GLN A C 1
1369ATOM 60 O O . GLN A 1 15 ? 83.151 44.940 -2.193 1.00 74.65 ? 39 GLN A O 1
1370ATOM 61 C CB . GLN A 1 15 ? 84.369 47.447 -3.323 1.00 73.12 ? 39 GLN A CB 1
1371ATOM 62 C CG . GLN A 1 15 ? 85.377 48.287 -2.560 1.00 94.13 ? 39 GLN A CG 1
1372ATOM 63 C CD . GLN A 1 15 ? 84.740 49.505 -1.918 1.00 117.37 ? 39 GLN A CD 1
1373ATOM 64 O OE1 . GLN A 1 15 ? 85.118 49.913 -0.818 1.00 112.75 ? 39 GLN A OE1 1
1374ATOM 65 N NE2 . GLN A 1 15 ? 83.764 50.092 -2.605 1.00 107.30 ? 39 GLN A NE2 1
1375ATOM 66 N N . VAL A 1 16 ? 85.314 44.474 -1.755 1.00 67.64 ? 40 VAL A N 1
1376ATOM 67 C CA . VAL A 1 16 ? 85.043 43.492 -0.712 1.00 67.52 ? 40 VAL A CA 1
1377ATOM 68 C C . VAL A 1 16 ? 84.817 44.215 0.609 1.00 63.09 ? 40 VAL A C 1
1378ATOM 69 O O . VAL A 1 16 ? 85.493 45.203 0.918 1.00 67.09 ? 40 VAL A O 1
1379ATOM 70 C CB . VAL A 1 16 ? 86.204 42.481 -0.613 1.00 62.70 ? 40 VAL A CB 1
1380ATOM 71 C CG1 . VAL A 1 16 ? 86.071 41.608 0.624 1.00 70.90 ? 40 VAL A CG1 1
1381ATOM 72 C CG2 . VAL A 1 16 ? 86.275 41.628 -1.865 1.00 78.95 ? 40 VAL A CG2 1
1382ATOM 73 N N . GLY A 1 17 ? 83.862 43.725 1.394 1.00 68.33 ? 41 GLY A N 1
1383ATOM 74 C CA . GLY A 1 17 ? 83.551 44.321 2.668 1.00 53.26 ? 41 GLY A CA 1
1384ATOM 75 C C . GLY A 1 17 ? 83.576 43.329 3.813 1.00 66.63 ? 41 GLY A C 1
1385ATOM 76 O O . GLY A 1 17 ? 84.366 42.377 3.840 1.00 57.18 ? 41 GLY A O 1
1386ATOM 77 N N . PRO A 1 18 ? 82.700 43.540 4.792 1.00 58.74 ? 42 PRO A N 1
1387ATOM 78 C CA . PRO A 1 18 ? 82.704 42.682 5.978 1.00 53.12 ? 42 PRO A CA 1
1388ATOM 79 C C . PRO A 1 18 ? 82.286 41.261 5.638 1.00 55.35 ? 42 PRO A C 1
1389ATOM 80 O O . PRO A 1 18 ? 81.542 41.019 4.687 1.00 46.38 ? 42 PRO A O 1
1390ATOM 81 C CB . PRO A 1 18 ? 81.682 43.355 6.905 1.00 66.86 ? 42 PRO A CB 1
1391ATOM 82 C CG . PRO A 1 18 ? 81.501 44.741 6.346 1.00 59.61 ? 42 PRO A CG 1
1392ATOM 83 C CD . PRO A 1 18 ? 81.663 44.579 4.876 1.00 63.00 ? 42 PRO A CD 1
1393ATOM 84 N N . LEU A 1 19 ? 82.773 40.316 6.435 1.00 60.60 ? 43 LEU A N 1
1394ATOM 85 C CA . LEU A 1 19 ? 82.337 38.934 6.301 1.00 49.27 ? 43 LEU A CA 1
1395ATOM 86 C C . LEU A 1 19 ? 80.898 38.802 6.782 1.00 56.67 ? 43 LEU A C 1
1396ATOM 87 O O . LEU A 1 19 ? 80.599 39.045 7.957 1.00 79.95 ? 43 LEU A O 1
1397ATOM 88 C CB . LEU A 1 19 ? 83.256 38.001 7.084 1.00 53.75 ? 43 LEU A CB 1
1398ATOM 89 C CG . LEU A 1 19 ? 82.961 36.517 6.848 1.00 63.27 ? 43 LEU A CG 1
1399ATOM 90 C CD1 . LEU A 1 19 ? 83.878 35.938 5.792 1.00 60.62 ? 43 LEU A CD1 1
1400ATOM 91 C CD2 . LEU A 1 19 ? 83.092 35.735 8.145 1.00 64.63 ? 43 LEU A CD2 1
1401ATOM 92 N N . LEU A 1 20 ? 80.007 38.421 5.867 1.00 47.56 ? 44 LEU A N 1
1402ATOM 93 C CA . LEU A 1 20 ? 78.619 38.176 6.231 1.00 53.81 ? 44 LEU A CA 1
1403ATOM 94 C C . LEU A 1 20 ? 78.497 36.894 7.039 1.00 61.99 ? 44 LEU A C 1
1404ATOM 95 O O . LEU A 1 20 ? 77.925 36.890 8.135 1.00 72.03 ? 44 LEU A O 1
1405ATOM 96 C CB . LEU A 1 20 ? 77.758 38.101 4.973 1.00 52.18 ? 44 LEU A CB 1
1406ATOM 97 C CG . LEU A 1 20 ? 77.504 39.421 4.248 1.00 61.51 ? 44 LEU A CG 1
1407ATOM 98 C CD1 . LEU A 1 20 ? 77.062 39.152 2.823 1.00 60.72 ? 44 LEU A CD1 1
1408ATOM 99 C CD2 . LEU A 1 20 ? 76.465 40.247 4.986 1.00 63.19 ? 44 LEU A CD2 1
1409ATOM 100 N N . GLY A 1 21 ? 79.038 35.797 6.519 1.00 54.58 ? 45 GLY A N 1
1410ATOM 101 C CA . GLY A 1 21 ? 79.014 34.543 7.247 1.00 62.00 ? 45 GLY A CA 1
1411ATOM 102 C C . GLY A 1 21 ? 80.087 33.595 6.771 1.00 50.36 ? 45 GLY A C 1
1412ATOM 103 O O . GLY A 1 21 ? 80.643 33.747 5.679 1.00 64.83 ? 45 GLY A O 1
1413ATOM 104 N N . SER A 1 22 ? 80.382 32.610 7.616 1.00 60.36 ? 46 SER A N 1
1414ATOM 105 C CA . SER A 1 22 ? 81.325 31.554 7.288 1.00 62.87 ? 46 SER A CA 1
1415ATOM 106 C C . SER A 1 22 ? 80.834 30.246 7.889 1.00 72.75 ? 46 SER A C 1
1416ATOM 107 O O . SER A 1 22 ? 80.210 30.228 8.954 1.00 71.59 ? 46 SER A O 1
1417ATOM 108 C CB . SER A 1 22 ? 82.738 31.849 7.804 1.00 55.67 ? 46 SER A CB 1
1418ATOM 109 O OG . SER A 1 22 ? 82.725 32.110 9.196 1.00 68.63 ? 46 SER A OG 1
1419ATOM 110 N N . GLY A 1 23 ? 81.127 29.151 7.195 1.00 74.15 ? 47 GLY A N 1
1420ATOM 111 C CA . GLY A 1 23 ? 80.758 27.835 7.673 1.00 79.19 ? 47 GLY A CA 1
1421ATOM 112 C C . GLY A 1 23 ? 81.021 26.752 6.650 1.00 75.65 ? 47 GLY A C 1
1422ATOM 113 O O . GLY A 1 23 ? 81.994 26.830 5.892 1.00 80.25 ? 47 GLY A O 1
1423ATOM 114 N N . GLY A 1 24 ? 80.158 25.733 6.619 1.00 60.00 ? 48 GLY A N 1
1424ATOM 115 C CA . GLY A 1 24 ? 80.295 24.672 5.636 1.00 68.83 ? 48 GLY A CA 1
1425ATOM 116 C C . GLY A 1 24 ? 80.109 25.138 4.207 1.00 55.45 ? 48 GLY A C 1
1426ATOM 117 O O . GLY A 1 24 ? 80.556 24.459 3.277 1.00 67.93 ? 48 GLY A O 1
1427ATOM 118 N N . PHE A 1 25 ? 79.450 26.278 4.009 1.00 55.77 ? 49 PHE A N 1
1428ATOM 119 C CA . PHE A 1 25 ? 79.342 26.870 2.686 1.00 46.04 ? 49 PHE A CA 1
1429ATOM 120 C C . PHE A 1 25 ? 80.616 27.588 2.266 1.00 61.50 ? 49 PHE A C 1
1430ATOM 121 O O . PHE A 1 25 ? 80.734 27.982 1.101 1.00 60.20 ? 49 PHE A O 1
1431ATOM 122 C CB . PHE A 1 25 ? 78.166 27.849 2.640 1.00 43.68 ? 49 PHE A CB 1
1432ATOM 123 C CG . PHE A 1 25 ? 78.173 28.864 3.756 1.00 60.12 ? 49 PHE A CG 1
1433ATOM 124 C CD1 . PHE A 1 25 ? 78.891 30.047 3.632 1.00 48.31 ? 49 PHE A CD1 1
1434ATOM 125 C CD2 . PHE A 1 25 ? 77.456 28.639 4.923 1.00 44.37 ? 49 PHE A CD2 1
1435ATOM 126 C CE1 . PHE A 1 25 ? 78.902 30.975 4.650 1.00 61.00 ? 49 PHE A CE1 1
1436ATOM 127 C CE2 . PHE A 1 25 ? 77.463 29.562 5.943 1.00 56.63 ? 49 PHE A CE2 1
1437ATOM 128 C CZ . PHE A 1 25 ? 78.186 30.735 5.810 1.00 65.52 ? 49 PHE A CZ 1
1438ATOM 129 N N . GLY A 1 26 ? 81.569 27.763 3.176 1.00 50.70 ? 50 GLY A N 1
1439ATOM 130 C CA . GLY A 1 26 ? 82.743 28.553 2.879 1.00 59.00 ? 50 GLY A CA 1
1440ATOM 131 C C . GLY A 1 26 ? 82.688 29.881 3.601 1.00 63.12 ? 50 GLY A C 1
1441ATOM 132 O O . GLY A 1 26 ? 82.228 29.941 4.746 1.00 55.17 ? 50 GLY A O 1
1442ATOM 133 N N . SER A 1 27 ? 83.126 30.958 2.953 1.00 52.28 ? 51 SER A N 1
1443ATOM 134 C CA . SER A 1 27 ? 83.141 32.271 3.585 1.00 42.65 ? 51 SER A CA 1
1444ATOM 135 C C . SER A 1 27 ? 82.485 33.282 2.659 1.00 48.11 ? 51 SER A C 1
1445ATOM 136 O O . SER A 1 27 ? 82.963 33.512 1.546 1.00 42.34 ? 51 SER A O 1
1446ATOM 137 C CB . SER A 1 27 ? 84.570 32.685 3.927 1.00 46.77 ? 51 SER A CB 1
1447ATOM 138 O OG . SER A 1 27 ? 85.080 31.849 4.955 1.00 56.32 ? 51 SER A OG 1
1448ATOM 139 N N . VAL A 1 28 ? 81.393 33.881 3.114 1.00 49.03 ? 52 VAL A N 1
1449ATOM 140 C CA . VAL A 1 28 ? 80.653 34.856 2.325 1.00 50.07 ? 52 VAL A CA 1
1450ATOM 141 C C . VAL A 1 28 ? 80.989 36.245 2.843 1.00 42.96 ? 52 VAL A C 1
1451ATOM 142 O O . VAL A 1 28 ? 81.011 36.472 4.056 1.00 61.43 ? 52 VAL A O 1
1452ATOM 143 C CB . VAL A 1 28 ? 79.142 34.583 2.392 1.00 48.97 ? 52 VAL A CB 1
1453ATOM 144 C CG1 . VAL A 1 28 ? 78.370 35.643 1.631 1.00 41.93 ? 52 VAL A CG1 1
1454ATOM 145 C CG2 . VAL A 1 28 ? 78.840 33.193 1.853 1.00 48.86 ? 52 VAL A CG2 1
1455ATOM 146 N N . TYR A 1 29 ? 81.270 37.166 1.930 1.00 46.18 ? 53 TYR A N 1
1456ATOM 147 C CA . TYR A 1 29 ? 81.593 38.547 2.250 1.00 43.52 ? 53 TYR A CA 1
1457ATOM 148 C C . TYR A 1 29 ? 80.569 39.478 1.624 1.00 48.78 ? 53 TYR A C 1
1458ATOM 149 O O . TYR A 1 29 ? 80.051 39.214 0.537 1.00 45.22 ? 53 TYR A O 1
1459ATOM 150 C CB . TYR A 1 29 ? 82.979 38.943 1.743 1.00 42.98 ? 53 TYR A CB 1
1460ATOM 151 C CG . TYR A 1 29 ? 84.124 38.413 2.560 1.00 56.21 ? 53 TYR A CG 1
1461ATOM 152 C CD1 . TYR A 1 29 ? 84.494 37.077 2.488 1.00 49.34 ? 53 TYR A CD1 1
1462ATOM 153 C CD2 . TYR A 1 29 ? 84.845 39.254 3.403 1.00 52.68 ? 53 TYR A CD2 1
1463ATOM 154 C CE1 . TYR A 1 29 ? 85.551 36.590 3.234 1.00 54.62 ? 53 TYR A CE1 1
1464ATOM 155 C CE2 . TYR A 1 29 ? 85.904 38.774 4.152 1.00 62.44 ? 53 TYR A CE2 1
1465ATOM 156 C CZ . TYR A 1 29 ? 86.252 37.440 4.061 1.00 54.64 ? 53 TYR A CZ 1
1466ATOM 157 O OH . TYR A 1 29 ? 87.305 36.948 4.804 1.00 70.40 ? 53 TYR A OH 1
1467ATOM 158 N N . SER A 1 30 ? 80.274 40.567 2.326 1.00 59.72 ? 54 SER A N 1
1468ATOM 159 C CA . SER A 1 30 ? 79.531 41.656 1.714 1.00 51.56 ? 54 SER A CA 1
1469ATOM 160 C C . SER A 1 30 ? 80.413 42.313 0.666 1.00 48.44 ? 54 SER A C 1
1470ATOM 161 O O . SER A 1 30 ? 81.596 42.564 0.911 1.00 56.07 ? 54 SER A O 1
1471ATOM 162 C CB . SER A 1 30 ? 79.094 42.673 2.768 1.00 65.00 ? 54 SER A CB 1
1472ATOM 163 O OG . SER A 1 30 ? 78.681 43.891 2.168 1.00 66.32 ? 54 SER A OG 1
1473ATOM 164 N N . GLY A 1 31 ? 79.846 42.583 -0.507 1.00 59.93 ? 55 GLY A N 1
1474ATOM 165 C CA . GLY A 1 31 ? 80.595 43.206 -1.573 1.00 63.84 ? 55 GLY A CA 1
1475ATOM 166 C C . GLY A 1 31 ? 79.722 44.187 -2.326 1.00 58.32 ? 55 GLY A C 1
1476ATOM 167 O O . GLY A 1 31 ? 78.493 44.172 -2.233 1.00 58.76 ? 55 GLY A O 1
1477ATOM 168 N N . ILE A 1 32 ? 80.390 45.062 -3.073 1.00 63.18 ? 56 ILE A N 1
1478ATOM 169 C CA . ILE A 1 32 ? 79.676 46.070 -3.897 1.00 70.63 ? 56 ILE A CA 1
1479ATOM 170 C C . ILE A 1 32 ? 80.283 45.996 -5.295 1.00 63.50 ? 56 ILE A C 1
1480ATOM 171 O O . ILE A 1 32 ? 81.510 46.129 -5.411 1.00 70.83 ? 56 ILE A O 1
1481ATOM 172 C CB . ILE A 1 32 ? 79.808 47.470 -3.268 1.00 73.47 ? 56 ILE A CB 1
1482ATOM 173 C CG1 . ILE A 1 32 ? 78.847 47.663 -2.093 1.00 82.40 ? 56 ILE A CG1 1
1483ATOM 174 C CG2 . ILE A 1 32 ? 79.640 48.572 -4.301 1.00 77.12 ? 56 ILE A CG2 1
1484ATOM 175 C CD1 . ILE A 1 32 ? 77.416 47.905 -2.505 1.00 93.36 ? 56 ILE A CD1 1
1485ATOM 176 N N . ARG A 1 33 ? 79.461 45.733 -6.306 1.00 66.65 ? 57 ARG A N 1
1486ATOM 177 C CA . ARG A 1 33 ? 79.968 45.750 -7.695 1.00 75.13 ? 57 ARG A CA 1
1487ATOM 178 C C . ARG A 1 33 ? 80.227 47.202 -8.054 1.00 73.00 ? 57 ARG A C 1
1488ATOM 179 O O . ARG A 1 33 ? 79.264 47.941 -8.124 1.00 85.06 ? 57 ARG A O 1
1489ATOM 180 C CB . ARG A 1 33 ? 78.932 45.168 -8.655 1.00 69.92 ? 57 ARG A CB 1
1490ATOM 181 C CG . ARG A 1 33 ? 79.435 44.962 -10.075 1.00 67.25 ? 57 ARG A CG 1
1491ATOM 182 C CD . ARG A 1 33 ? 78.565 43.991 -10.844 1.00 58.47 ? 57 ARG A CD 1
1492ATOM 183 N NE . ARG A 1 33 ? 77.228 44.515 -11.077 1.00 75.83 ? 57 ARG A NE 1
1493ATOM 184 C CZ . ARG A 1 33 ? 76.199 43.796 -11.507 1.00 67.92 ? 57 ARG A CZ 1
1494ATOM 185 N NH1 . ARG A 1 33 ? 76.344 42.506 -11.753 1.00 68.02 ? 57 ARG A NH1 1
1495ATOM 186 N NH2 . ARG A 1 33 ? 75.027 44.371 -11.692 1.00 56.77 ? 57 ARG A NH2 1
1496ATOM 187 N N . VAL A 1 34 ? 81.483 47.578 -8.273 1.00 75.22 ? 58 VAL A N 1
1497ATOM 188 C CA . VAL A 1 34 ? 81.824 49.001 -8.566 1.00 82.64 ? 58 VAL A CA 1
1498ATOM 189 C C . VAL A 1 34 ? 81.061 49.432 -9.820 1.00 82.32 ? 58 VAL A C 1
1499ATOM 190 O O . VAL A 1 34 ? 80.632 50.596 -9.873 1.00 86.47 ? 58 VAL A O 1
1500ATOM 191 C CB . VAL A 1 34 ? 83.344 49.171 -8.712 1.00 79.51 ? 58 VAL A CB 1
1501ATOM 192 C CG1 . VAL A 1 34 ? 83.753 50.635 -8.709 1.00 84.86 ? 58 VAL A CG1 1
1502ATOM 193 C CG2 . VAL A 1 34 ? 84.095 48.412 -7.629 1.00 68.90 ? 58 VAL A CG2 1
1503ATOM 194 N N . SER A 1 35 ? 80.860 48.513 -10.762 1.00 85.05 ? 59 SER A N 1
1504ATOM 195 C CA . SER A 1 35 ? 80.110 48.793 -12.012 1.00 86.42 ? 59 SER A CA 1
1505ATOM 196 C C . SER A 1 35 ? 78.774 49.484 -11.733 1.00 93.08 ? 59 SER A C 1
1506ATOM 197 O O . SER A 1 35 ? 78.533 50.539 -12.337 1.00 100.12 ? 59 SER A O 1
1507ATOM 198 C CB . SER A 1 35 ? 79.885 47.513 -12.764 1.00 85.39 ? 59 SER A CB 1
1508ATOM 199 O OG . SER A 1 35 ? 81.028 46.671 -12.713 1.00 80.91 ? 59 SER A OG 1
1509ATOM 200 N N . ASP A 1 36 ? 77.930 48.906 -10.879 1.00 95.71 ? 60 ASP A N 1
1510ATOM 201 C CA . ASP A 1 36 ? 76.574 49.464 -10.657 1.00 84.02 ? 60 ASP A CA 1
1511ATOM 202 C C . ASP A 1 36 ? 76.361 49.813 -9.190 1.00 96.66 ? 60 ASP A C 1
1512ATOM 203 O O . ASP A 1 36 ? 75.198 50.094 -8.840 1.00 95.40 ? 60 ASP A O 1
1513ATOM 204 C CB . ASP A 1 36 ? 75.520 48.434 -11.051 1.00 82.54 ? 60 ASP A CB 1
1514ATOM 205 C CG . ASP A 1 36 ? 75.680 47.896 -12.459 1.00 115.16 ? 60 ASP A CG 1
1515ATOM 206 O OD1 . ASP A 1 36 ? 76.386 46.888 -12.619 1.00 105.97 ? 60 ASP A OD1 1
1516ATOM 207 O OD2 . ASP A 1 36 ? 75.096 48.492 -13.384 1.00 129.24 ? 60 ASP A OD2 1
1517ATOM 208 N N . ASN A 1 37 ? 77.416 49.815 -8.369 1.00 99.05 ? 61 ASN A N 1
1518ATOM 209 C CA . ASN A 1 37 ? 77.267 49.995 -6.896 1.00 79.51 ? 61 ASN A CA 1
1519ATOM 210 C C . ASN A 1 37 ? 76.189 49.007 -6.445 1.00 76.95 ? 61 ASN A C 1
1520ATOM 211 O O . ASN A 1 37 ? 75.367 49.375 -5.598 1.00 82.13 ? 61 ASN A O 1
1521ATOM 212 C CB . ASN A 1 37 ? 77.072 51.462 -6.507 1.00 74.75 ? 61 ASN A CB 1
1522ATOM 213 C CG . ASN A 1 37 ? 78.316 52.290 -6.737 1.00 92.63 ? 61 ASN A CG 1
1523ATOM 214 O OD1 . ASN A 1 37 ? 79.432 51.807 -6.562 1.00 92.56 ? 61 ASN A OD1 1
1524ATOM 215 N ND2 . ASN A 1 37 ? 78.134 53.538 -7.134 1.00 93.34 ? 61 ASN A ND2 1
1525ATOM 216 N N . LEU A 1 38 ? 76.225 47.790 -6.986 1.00 67.38 ? 62 LEU A N 1
1526ATOM 217 C CA . LEU A 1 38 ? 75.172 46.792 -6.706 1.00 64.72 ? 62 LEU A CA 1
1527ATOM 218 C C . LEU A 1 38 ? 75.608 45.946 -5.527 1.00 72.09 ? 62 LEU A C 1
1528ATOM 219 O O . LEU A 1 38 ? 76.751 45.480 -5.516 1.00 70.79 ? 62 LEU A O 1
1529ATOM 220 C CB . LEU A 1 38 ? 74.977 45.907 -7.936 1.00 69.29 ? 62 LEU A CB 1
1530ATOM 221 C CG . LEU A 1 38 ? 73.964 44.780 -7.763 1.00 71.22 ? 62 LEU A CG 1
1531ATOM 222 C CD1 . LEU A 1 38 ? 72.576 45.334 -7.501 1.00 69.45 ? 62 LEU A CD1 1
1532ATOM 223 C CD2 . LEU A 1 38 ? 73.959 43.868 -8.976 1.00 61.77 ? 62 LEU A CD2 1
1533ATOM 224 N N . PRO A 1 39 ? 74.724 45.721 -4.543 1.00 65.18 ? 63 PRO A N 1
1534ATOM 225 C CA . PRO A 1 39 ? 75.069 44.858 -3.404 1.00 70.06 ? 63 PRO A CA 1
1535ATOM 226 C C . PRO A 1 39 ? 75.196 43.409 -3.851 1.00 53.09 ? 63 PRO A C 1
1536ATOM 227 O O . PRO A 1 39 ? 74.247 42.822 -4.375 1.00 59.90 ? 63 PRO A O 1
1537ATOM 228 C CB . PRO A 1 39 ? 73.889 45.054 -2.443 1.00 73.82 ? 63 PRO A CB 1
1538ATOM 229 C CG . PRO A 1 39 ? 73.264 46.354 -2.868 1.00 78.79 ? 63 PRO A CG 1
1539ATOM 230 C CD . PRO A 1 39 ? 73.410 46.358 -4.361 1.00 59.62 ? 63 PRO A CD 1
1540ATOM 231 N N . VAL A 1 40 ? 76.375 42.835 -3.645 1.00 48.82 ? 64 VAL A N 1
1541ATOM 232 C CA . VAL A 1 40 ? 76.630 41.442 -3.964 1.00 51.39 ? 64 VAL A CA 1
1542ATOM 233 C C . VAL A 1 40 ? 77.124 40.729 -2.710 1.00 61.31 ? 64 VAL A C 1
1543ATOM 234 O O . VAL A 1 40 ? 77.566 41.343 -1.735 1.00 51.33 ? 64 VAL A O 1
1544ATOM 235 C CB . VAL A 1 40 ? 77.653 41.288 -5.109 1.00 53.36 ? 64 VAL A CB 1
1545ATOM 236 C CG1 . VAL A 1 40 ? 77.144 41.963 -6.375 1.00 55.74 ? 64 VAL A CG1 1
1546ATOM 237 C CG2 . VAL A 1 40 ? 79.006 41.850 -4.702 1.00 50.36 ? 64 VAL A CG2 1
1547ATOM 238 N N . ALA A 1 41 ? 77.020 39.410 -2.743 1.00 55.53 ? 65 ALA A N 1
1548ATOM 239 C CA . ALA A 1 41 ? 77.664 38.536 -1.779 1.00 57.01 ? 65 ALA A CA 1
1549ATOM 240 C C . ALA A 1 41 ? 78.756 37.766 -2.503 1.00 38.60 ? 65 ALA A C 1
1550ATOM 241 O O . ALA A 1 41 ? 78.510 37.169 -3.554 1.00 50.05 ? 65 ALA A O 1
1551ATOM 242 C CB . ALA A 1 41 ? 76.658 37.578 -1.140 1.00 40.44 ? 65 ALA A CB 1
1552ATOM 243 N N . ILE A 1 42 ? 79.959 37.802 -1.958 1.00 46.96 ? 66 ILE A N 1
1553ATOM 244 C CA . ILE A 1 42 ? 81.113 37.137 -2.545 1.00 48.02 ? 66 ILE A CA 1
1554ATOM 245 C C . ILE A 1 42 ? 81.373 35.878 -1.730 1.00 44.48 ? 66 ILE A C 1
1555ATOM 246 O O . ILE A 1 42 ? 81.794 35.953 -0.573 1.00 43.57 ? 66 ILE A O 1
1556ATOM 247 C CB . ILE A 1 42 ? 82.331 38.065 -2.563 1.00 47.48 ? 66 ILE A CB 1
1557ATOM 248 C CG1 . ILE A 1 42 ? 81.971 39.379 -3.261 1.00 50.10 ? 66 ILE A CG1 1
1558ATOM 249 C CG2 . ILE A 1 42 ? 83.494 37.394 -3.235 1.00 54.45 ? 66 ILE A CG2 1
1559ATOM 250 C CD1 . ILE A 1 42 ? 83.099 40.390 -3.280 1.00 52.85 ? 66 ILE A CD1 1
1560ATOM 251 N N . LYS A 1 43 ? 81.106 34.719 -2.318 1.00 41.53 ? 67 LYS A N 1
1561ATOM 252 C CA . LYS A 1 43 ? 81.206 33.438 -1.631 1.00 52.95 ? 67 LYS A CA 1
1562ATOM 253 C C . LYS A 1 43 ? 82.502 32.755 -2.053 1.00 45.22 ? 67 LYS A C 1
1563ATOM 254 O O . LYS A 1 43 ? 82.660 32.383 -3.216 1.00 48.64 ? 67 LYS A O 1
1564ATOM 255 C CB . LYS A 1 43 ? 79.998 32.563 -1.953 1.00 39.96 ? 67 LYS A CB 1
1565ATOM 256 C CG . LYS A 1 43 ? 80.022 31.223 -1.250 1.00 49.79 ? 67 LYS A CG 1
1566ATOM 257 C CD . LYS A 1 43 ? 78.663 30.555 -1.286 1.00 55.86 ? 67 LYS A CD 1
1567ATOM 258 C CE . LYS A 1 43 ? 78.806 29.047 -1.208 1.00 67.31 ? 67 LYS A CE 1
1568ATOM 259 N NZ . LYS A 1 43 ? 77.483 28.366 -1.253 1.00 54.01 ? 67 LYS A NZ 1
1569ATOM 260 N N . HIS A 1 44 ? 83.425 32.597 -1.112 1.00 55.76 ? 68 HIS A N 1
1570ATOM 261 C CA . HIS A 1 44 ? 84.660 31.868 -1.344 1.00 51.79 ? 68 HIS A CA 1
1571ATOM 262 C C . HIS A 1 44 ? 84.481 30.430 -0.880 1.00 51.35 ? 68 HIS A C 1
1572ATOM 263 O O . HIS A 1 44 ? 84.057 30.184 0.258 1.00 56.82 ? 68 HIS A O 1
1573ATOM 264 C CB . HIS A 1 44 ? 85.826 32.526 -0.604 1.00 43.14 ? 68 HIS A CB 1
1574ATOM 265 C CG . HIS A 1 44 ? 86.081 33.945 -1.012 1.00 56.29 ? 68 HIS A CG 1
1575ATOM 266 N ND1 . HIS A 1 44 ? 87.141 34.310 -1.816 1.00 53.64 ? 68 HIS A ND1 1
1576ATOM 267 C CD2 . HIS A 1 44 ? 85.416 35.090 -0.725 1.00 55.02 ? 68 HIS A CD2 1
1577ATOM 268 C CE1 . HIS A 1 44 ? 87.115 35.617 -2.009 1.00 61.69 ? 68 HIS A CE1 1
1578ATOM 269 N NE2 . HIS A 1 44 ? 86.078 36.114 -1.359 1.00 62.04 ? 68 HIS A NE2 1
1579ATOM 270 N N . VAL A 1 45 ? 84.796 29.488 -1.768 1.00 56.55 ? 69 VAL A N 1
1580ATOM 271 C CA . VAL A 1 45 ? 84.669 28.058 -1.516 1.00 67.90 ? 69 VAL A CA 1
1581ATOM 272 C C . VAL A 1 45 ? 86.006 27.410 -1.848 1.00 64.27 ? 69 VAL A C 1
1582ATOM 273 O O . VAL A 1 45 ? 86.422 27.406 -3.010 1.00 73.52 ? 69 VAL A O 1
1583ATOM 274 C CB . VAL A 1 45 ? 83.548 27.424 -2.355 1.00 56.55 ? 69 VAL A CB 1
1584ATOM 275 C CG1 . VAL A 1 45 ? 83.336 25.985 -1.940 1.00 71.71 ? 69 VAL A CG1 1
1585ATOM 276 C CG2 . VAL A 1 45 ? 82.264 28.228 -2.234 1.00 63.74 ? 69 VAL A CG2 1
1586ATOM 277 N N . GLU A 1 46 ? 86.683 26.874 -0.839 1.00 84.59 ? 70 GLU A N 1
1587ATOM 278 C CA . GLU A 1 46 ? 87.949 26.199 -1.086 1.00 76.86 ? 70 GLU A CA 1
1588ATOM 279 C C . GLU A 1 46 ? 87.694 24.892 -1.836 1.00 73.37 ? 70 GLU A C 1
1589ATOM 280 O O . GLU A 1 46 ? 86.719 24.185 -1.567 1.00 81.83 ? 70 GLU A O 1
1590ATOM 281 C CB . GLU A 1 46 ? 88.675 25.962 0.241 1.00 75.81 ? 70 GLU A CB 1
1591ATOM 282 C CG . GLU A 1 46 ? 90.069 25.359 0.126 1.00 102.54 ? 70 GLU A CG 1
1592ATOM 283 C CD . GLU A 1 46 ? 90.816 25.388 1.448 1.00 108.64 ? 70 GLU A CD 1
1593ATOM 284 O OE1 . GLU A 1 46 ? 90.263 25.938 2.426 1.00 105.65 ? 70 GLU A OE1 1
1594ATOM 285 O OE2 . GLU A 1 46 ? 91.954 24.872 1.508 1.00 101.82 ? 70 GLU A OE2 1
1595ATOM 286 N N . LYS A 1 47 ? 88.552 24.591 -2.818 1.00 87.91 ? 71 LYS A N 1
1596ATOM 287 C CA . LYS A 1 47 ? 88.330 23.407 -3.648 1.00 87.27 ? 71 LYS A CA 1
1597ATOM 288 C C . LYS A 1 47 ? 88.411 22.123 -2.833 1.00 92.78 ? 71 LYS A C 1
1598ATOM 289 O O . LYS A 1 47 ? 87.631 21.190 -3.057 1.00 94.93 ? 71 LYS A O 1
1599ATOM 290 C CB . LYS A 1 47 ? 89.337 23.351 -4.796 1.00 83.27 ? 71 LYS A CB 1
1600ATOM 291 C CG . LYS A 1 47 ? 89.804 24.685 -5.322 1.00 88.22 ? 71 LYS A CG 1
1601ATOM 292 C CD . LYS A 1 47 ? 89.900 24.663 -6.841 1.00 85.59 ? 71 LYS A CD 1
1602ATOM 293 C CE . LYS A 1 47 ? 90.183 26.050 -7.382 1.00 82.44 ? 71 LYS A CE 1
1603ATOM 294 N NZ . LYS A 1 47 ? 91.116 26.060 -8.549 1.00 75.47 ? 71 LYS A NZ 1
1604ATOM 295 N N . ASP A 1 48 ? 89.362 22.051 -1.897 1.00 85.27 ? 72 ASP A N 1
1605ATOM 296 C CA . ASP A 1 48 ? 89.523 20.846 -1.089 1.00 76.12 ? 72 ASP A CA 1
1606ATOM 297 C C . ASP A 1 48 ? 88.224 20.479 -0.382 1.00 87.38 ? 72 ASP A C 1
1607ATOM 298 O O . ASP A 1 48 ? 87.884 19.296 -0.264 1.00 80.92 ? 72 ASP A O 1
1608ATOM 299 C CB . ASP A 1 48 ? 90.645 21.051 -0.072 1.00 85.71 ? 72 ASP A CB 1
1609ATOM 300 C CG . ASP A 1 48 ? 92.024 20.865 -0.678 1.00 102.45 ? 72 ASP A CG 1
1610ATOM 301 O OD1 . ASP A 1 48 ? 92.114 20.671 -1.910 1.00 98.38 ? 72 ASP A OD1 1
1611ATOM 302 O OD2 . ASP A 1 48 ? 93.019 20.923 0.079 1.00 90.76 ? 72 ASP A OD2 1
1612ATOM 303 N N . ARG A 1 49 ? 87.479 21.483 0.079 1.00 90.23 ? 73 ARG A N 1
1613ATOM 304 C CA . ARG A 1 49 ? 86.223 21.277 0.789 1.00 87.85 ? 73 ARG A CA 1
1614ATOM 305 C C . ARG A 1 49 ? 85.031 21.089 -0.143 1.00 89.33 ? 73 ARG A C 1
1615ATOM 306 O O . ARG A 1 49 ? 83.905 20.937 0.341 1.00 90.48 ? 73 ARG A O 1
1616ATOM 307 C CB . ARG A 1 49 ? 85.971 22.453 1.739 1.00 70.20 ? 73 ARG A CB 1
1617ATOM 308 C CG . ARG A 1 49 ? 85.104 22.120 2.945 1.00 97.00 ? 73 ARG A CG 1
1618ATOM 309 C CD . ARG A 1 49 ? 85.663 20.958 3.747 1.00 95.75 ? 73 ARG A CD 1
1619ATOM 310 N NE . ARG A 1 49 ? 84.640 20.352 4.591 1.00 103.65 ? 73 ARG A NE 1
1620ATOM 311 C CZ . ARG A 1 49 ? 84.700 20.293 5.915 1.00 112.06 ? 73 ARG A CZ 1
1621ATOM 312 N NH1 . ARG A 1 49 ? 85.730 20.788 6.582 1.00 102.70 ? 73 ARG A NH1 1
1622ATOM 313 N NH2 . ARG A 1 49 ? 83.702 19.724 6.586 1.00 109.17 ? 73 ARG A NH2 1
1623ATOM 314 N N . ILE A 1 50 ? 85.242 21.083 -1.453 1.00 88.21 ? 74 ILE A N 1
1624ATOM 315 C CA . ILE A 1 50 ? 84.155 20.908 -2.407 1.00 96.07 ? 74 ILE A CA 1
1625ATOM 316 C C . ILE A 1 50 ? 83.949 19.415 -2.612 1.00 109.11 ? 74 ILE A C 1
1626ATOM 317 O O . ILE A 1 50 ? 84.874 18.699 -3.013 1.00 99.93 ? 74 ILE A O 1
1627ATOM 318 C CB . ILE A 1 50 ? 84.463 21.607 -3.735 1.00 99.25 ? 74 ILE A CB 1
1628ATOM 319 C CG1 . ILE A 1 50 ? 84.041 23.064 -3.650 1.00 91.34 ? 74 ILE A CG1 1
1629ATOM 320 C CG2 . ILE A 1 50 ? 83.681 20.953 -4.868 1.00 97.05 ? 74 ILE A CG2 1
1630ATOM 321 C CD1 . ILE A 1 50 ? 84.267 23.817 -4.910 1.00 93.47 ? 74 ILE A CD1 1
1631ATOM 322 N N . SER A 1 51 ? 82.735 18.944 -2.338 1.00 118.35 ? 75 SER A N 1
1632ATOM 323 C CA . SER A 1 51 ? 82.415 17.531 -2.478 1.00 115.94 ? 75 SER A CA 1
1633ATOM 324 C C . SER A 1 51 ? 81.802 17.215 -3.838 1.00 111.00 ? 75 SER A C 1
1634ATOM 325 O O . SER A 1 51 ? 82.207 16.247 -4.491 1.00 94.54 ? 75 SER A O 1
1635ATOM 326 C CB . SER A 1 51 ? 81.474 17.104 -1.348 1.00 116.21 ? 75 SER A CB 1
1636ATOM 327 O OG . SER A 1 51 ? 80.389 18.010 -1.224 1.00 116.72 ? 75 SER A OG 1
1637ATOM 328 N N . ASP A 1 52 ? 80.842 18.026 -4.284 1.00 111.78 ? 76 ASP A N 1
1638ATOM 329 C CA . ASP A 1 52 ? 80.089 17.758 -5.505 1.00 105.69 ? 76 ASP A CA 1
1639ATOM 330 C C . ASP A 1 52 ? 80.567 18.683 -6.623 1.00 88.46 ? 76 ASP A C 1
1640ATOM 331 O O . ASP A 1 52 ? 80.293 19.887 -6.606 1.00 88.39 ? 76 ASP A O 1
1641ATOM 332 C CB . ASP A 1 52 ? 78.591 17.915 -5.253 1.00 104.91 ? 76 ASP A CB 1
1642ATOM 333 C CG . ASP A 1 52 ? 77.770 16.836 -5.937 1.00 114.29 ? 76 ASP A CG 1
1643ATOM 334 O OD1 . ASP A 1 52 ? 78.159 15.651 -5.863 1.00 123.39 ? 76 ASP A OD1 1
1644ATOM 335 O OD2 . ASP A 1 52 ? 76.742 17.175 -6.560 1.00 106.62 ? 76 ASP A OD2 1
1645ATOM 336 N N . TRP A 1 53 ? 81.273 18.110 -7.593 1.00 88.63 ? 77 TRP A N 1
1646ATOM 337 C CA . TRP A 1 53 ? 81.767 18.804 -8.772 1.00 95.02 ? 77 TRP A CA 1
1647ATOM 338 C C . TRP A 1 53 ? 80.872 18.506 -9.969 1.00 87.58 ? 77 TRP A C 1
1648ATOM 339 O O . TRP A 1 53 ? 80.208 17.470 -10.029 1.00 97.47 ? 77 TRP A O 1
1649ATOM 340 C CB . TRP A 1 53 ? 83.192 18.362 -9.106 1.00 96.70 ? 77 TRP A CB 1
1650ATOM 341 C CG . TRP A 1 53 ? 84.249 18.872 -8.203 1.00 91.06 ? 77 TRP A CG 1
1651ATOM 342 C CD1 . TRP A 1 53 ? 84.788 18.223 -7.137 1.00 92.15 ? 77 TRP A CD1 1
1652ATOM 343 C CD2 . TRP A 1 53 ? 84.934 20.123 -8.303 1.00 97.66 ? 77 TRP A CD2 1
1653ATOM 344 N NE1 . TRP A 1 53 ? 85.759 18.995 -6.553 1.00 108.44 ? 77 TRP A NE1 1
1654ATOM 345 C CE2 . TRP A 1 53 ? 85.871 20.168 -7.252 1.00 104.49 ? 77 TRP A CE2 1
1655ATOM 346 C CE3 . TRP A 1 53 ? 84.845 21.210 -9.175 1.00 102.37 ? 77 TRP A CE3 1
1656ATOM 347 C CZ2 . TRP A 1 53 ? 86.708 21.259 -7.045 1.00 107.09 ? 77 TRP A CZ2 1
1657ATOM 348 C CZ3 . TRP A 1 53 ? 85.677 22.289 -8.970 1.00 106.29 ? 77 TRP A CZ3 1
1658ATOM 349 C CH2 . TRP A 1 53 ? 86.598 22.306 -7.913 1.00 97.63 ? 77 TRP A CH2 1
1659ATOM 350 N N . GLY A 1 54 ? 80.890 19.412 -10.948 1.00 84.82 ? 78 GLY A N 1
1660ATOM 351 C CA . GLY A 1 54 ? 80.179 19.179 -12.191 1.00 89.84 ? 78 GLY A CA 1
1661ATOM 352 C C . GLY A 1 54 ? 80.802 19.955 -13.327 1.00 95.46 ? 78 GLY A C 1
1662ATOM 353 O O . GLY A 1 54 ? 81.748 20.714 -13.139 1.00 99.23 ? 78 GLY A O 1
1663ATOM 354 N N . GLU A 1 55 ? 80.272 19.744 -14.524 1.00 96.27 ? 79 GLU A N 1
1664ATOM 355 C CA . GLU A 1 55 ? 80.795 20.396 -15.716 1.00 109.60 ? 79 GLU A CA 1
1665ATOM 356 C C . GLU A 1 55 ? 79.781 21.414 -16.215 1.00 109.38 ? 79 GLU A C 1
1666ATOM 357 O O . GLU A 1 55 ? 78.606 21.082 -16.408 1.00 100.07 ? 79 GLU A O 1
1667ATOM 358 C CB . GLU A 1 55 ? 81.117 19.378 -16.814 1.00 106.30 ? 79 GLU A CB 1
1668ATOM 359 C CG . GLU A 1 55 ? 81.538 20.022 -18.127 1.00 118.25 ? 79 GLU A CG 1
1669ATOM 360 C CD . GLU A 1 55 ? 81.599 19.041 -19.278 1.00 129.62 ? 79 GLU A CD 1
1670ATOM 361 O OE1 . GLU A 1 55 ? 81.035 19.347 -20.351 1.00 119.91 ? 79 GLU A OE1 1
1671ATOM 362 O OE2 . GLU A 1 55 ? 82.213 17.965 -19.113 1.00 137.51 ? 79 GLU A OE2 1
1672ATOM 363 N N . LEU A 1 56 ? 80.227 22.652 -16.398 1.00 108.30 ? 80 LEU A N 1
1673ATOM 364 C CA . LEU A 1 56 ? 79.375 23.623 -17.052 1.00 101.17 ? 80 LEU A CA 1
1674ATOM 365 C C . LEU A 1 56 ? 79.163 23.203 -18.501 1.00 115.97 ? 80 LEU A C 1
1675ATOM 366 O O . LEU A 1 56 ? 80.036 22.569 -19.100 1.00 121.25 ? 80 LEU A O 1
1676ATOM 367 C CB . LEU A 1 56 ? 79.988 25.016 -17.025 1.00 104.54 ? 80 LEU A CB 1
1677ATOM 368 C CG . LEU A 1 56 ? 79.746 25.883 -15.796 1.00 103.45 ? 80 LEU A CG 1
1678ATOM 369 C CD1 . LEU A 1 56 ? 80.823 26.939 -15.717 1.00 106.63 ? 80 LEU A CD1 1
1679ATOM 370 C CD2 . LEU A 1 56 ? 78.364 26.507 -15.820 1.00 90.30 ? 80 LEU A CD2 1
1680ATOM 371 N N . PRO A 1 57 ? 78.014 23.546 -19.085 1.00 118.04 ? 81 PRO A N 1
1681ATOM 372 C CA . PRO A 1 57 ? 77.819 23.291 -20.522 1.00 120.78 ? 81 PRO A CA 1
1682ATOM 373 C C . PRO A 1 57 ? 78.979 23.765 -21.384 1.00 112.15 ? 81 PRO A C 1
1683ATOM 374 O O . PRO A 1 57 ? 79.252 23.163 -22.432 1.00 91.23 ? 81 PRO A O 1
1684ATOM 375 C CB . PRO A 1 57 ? 76.527 24.059 -20.824 1.00 113.85 ? 81 PRO A CB 1
1685ATOM 376 C CG . PRO A 1 57 ? 75.753 23.969 -19.540 1.00 109.97 ? 81 PRO A CG 1
1686ATOM 377 C CD . PRO A 1 57 ? 76.782 24.025 -18.431 1.00 98.67 ? 81 PRO A CD 1
1687ATOM 378 N N . ASN A 1 58 ? 79.692 24.810 -20.952 1.00 119.00 ? 82 ASN A N 1
1688ATOM 379 C CA . ASN A 1 58 ? 80.854 25.306 -21.682 1.00 114.24 ? 82 ASN A CA 1
1689ATOM 380 C C . ASN A 1 58 ? 81.954 24.259 -21.802 1.00 108.94 ? 82 ASN A C 1
1690ATOM 381 O O . ASN A 1 58 ? 82.782 24.346 -22.715 1.00 98.27 ? 82 ASN A O 1
1691ATOM 382 C CB . ASN A 1 58 ? 81.418 26.546 -20.986 1.00 116.68 ? 82 ASN A CB 1
1692ATOM 383 C CG . ASN A 1 58 ? 80.518 27.757 -21.136 1.00 114.54 ? 82 ASN A CG 1
1693ATOM 384 O OD1 . ASN A 1 58 ? 80.472 28.382 -22.199 1.00 104.72 ? 82 ASN A OD1 1
1694ATOM 385 N ND2 . ASN A 1 58 ? 79.791 28.093 -20.077 1.00 105.18 ? 82 ASN A ND2 1
1695ATOM 386 N N . GLY A 1 59 ? 81.995 23.285 -20.897 1.00 122.25 ? 83 GLY A N 1
1696ATOM 387 C CA . GLY A 1 59 ? 83.032 22.274 -20.919 1.00 127.15 ? 83 GLY A CA 1
1697ATOM 388 C C . GLY A 1 59 ? 84.138 22.563 -19.924 1.00 126.19 ? 83 GLY A C 1
1698ATOM 389 O O . GLY A 1 59 ? 85.317 22.341 -20.211 1.00 119.85 ? 83 GLY A O 1
1699ATOM 390 N N . THR A 1 60 ? 83.763 23.073 -18.750 1.00 112.47 ? 84 THR A N 1
1700ATOM 391 C CA . THR A 1 60 ? 84.715 23.452 -17.712 1.00 109.86 ? 84 THR A CA 1
1701ATOM 392 C C . THR A 1 60 ? 84.209 22.967 -16.360 1.00 105.44 ? 84 THR A C 1
1702ATOM 393 O O . THR A 1 60 ? 83.024 23.122 -16.046 1.00 98.72 ? 84 THR A O 1
1703ATOM 394 C CB . THR A 1 60 ? 84.930 24.972 -17.679 1.00 97.88 ? 84 THR A CB 1
1704ATOM 395 O OG1 . THR A 1 60 ? 83.787 25.599 -17.090 1.00 106.69 ? 84 THR A OG1 1
1705ATOM 396 C CG2 . THR A 1 60 ? 85.154 25.539 -19.081 1.00 102.92 ? 84 THR A CG2 1
1706ATOM 397 N N . ARG A 1 61 ? 85.110 22.400 -15.557 1.00 109.82 ? 85 ARG A N 1
1707ATOM 398 C CA . ARG A 1 61 ? 84.738 21.791 -14.284 1.00 114.23 ? 85 ARG A CA 1
1708ATOM 399 C C . ARG A 1 61 ? 84.614 22.845 -13.186 1.00 107.97 ? 85 ARG A C 1
1709ATOM 400 O O . ARG A 1 61 ? 85.527 23.651 -12.977 1.00 103.68 ? 85 ARG A O 1
1710ATOM 401 C CB . ARG A 1 61 ? 85.764 20.731 -13.886 1.00 117.76 ? 85 ARG A CB 1
1711ATOM 402 C CG . ARG A 1 61 ? 85.464 20.005 -12.581 1.00 113.60 ? 85 ARG A CG 1
1712ATOM 403 C CD . ARG A 1 61 ? 86.535 18.960 -12.298 1.00 113.54 ? 85 ARG A CD 1
1713ATOM 404 N NE . ARG A 1 61 ? 87.839 19.574 -12.069 1.00 127.30 ? 85 ARG A NE 1
1714ATOM 405 C CZ . ARG A 1 61 ? 88.282 19.983 -10.887 1.00 124.85 ? 85 ARG A CZ 1
1715ATOM 406 N NH1 . ARG A 1 61 ? 87.590 19.775 -9.779 1.00 117.52 ? 85 ARG A NH1 1
1716ATOM 407 N NH2 . ARG A 1 61 ? 89.457 20.602 -10.811 1.00 121.96 ? 85 ARG A NH2 1
1717ATOM 408 N N . VAL A 1 62 ? 83.493 22.813 -12.471 1.00 92.82 ? 86 VAL A N 1
1718ATOM 409 C CA . VAL A 1 62 ? 83.084 23.844 -11.522 1.00 80.01 ? 86 VAL A CA 1
1719ATOM 410 C C . VAL A 1 62 ? 82.410 23.196 -10.316 1.00 85.41 ? 86 VAL A C 1
1720ATOM 411 O O . VAL A 1 62 ? 82.102 21.994 -10.347 1.00 82.15 ? 86 VAL A O 1
1721ATOM 412 C CB . VAL A 1 62 ? 82.133 24.850 -12.189 1.00 72.68 ? 86 VAL A CB 1
1722ATOM 413 C CG1 . VAL A 1 62 ? 82.850 25.603 -13.271 1.00 82.82 ? 86 VAL A CG1 1
1723ATOM 414 C CG2 . VAL A 1 62 ? 80.909 24.140 -12.734 1.00 70.90 ? 86 VAL A CG2 1
1724ATOM 415 N N . PRO A 1 63 ? 82.172 23.937 -9.235 1.00 82.92 ? 87 PRO A N 1
1725ATOM 416 C CA . PRO A 1 63 ? 81.344 23.399 -8.151 1.00 79.15 ? 87 PRO A CA 1
1726ATOM 417 C C . PRO A 1 63 ? 79.912 23.192 -8.617 1.00 72.57 ? 87 PRO A C 1
1727ATOM 418 O O . PRO A 1 63 ? 79.401 23.929 -9.464 1.00 67.82 ? 87 PRO A O 1
1728ATOM 419 C CB . PRO A 1 63 ? 81.424 24.482 -7.065 1.00 61.38 ? 87 PRO A CB 1
1729ATOM 420 C CG . PRO A 1 63 ? 82.589 25.337 -7.445 1.00 73.06 ? 87 PRO A CG 1
1730ATOM 421 C CD . PRO A 1 63 ? 82.676 25.286 -8.922 1.00 80.74 ? 87 PRO A CD 1
1731ATOM 422 N N . MET A 1 64 ? 79.273 22.149 -8.067 1.00 79.61 ? 88 MET A N 1
1732ATOM 423 C CA . MET A 1 64 ? 77.844 21.932 -8.304 1.00 73.99 ? 88 MET A CA 1
1733ATOM 424 C C . MET A 1 64 ? 77.018 23.195 -8.137 1.00 65.28 ? 88 MET A C 1
1734ATOM 425 O O . MET A 1 64 ? 76.099 23.439 -8.926 1.00 60.22 ? 88 MET A O 1
1735ATOM 426 C CB . MET A 1 64 ? 77.283 20.838 -7.387 1.00 83.72 ? 88 MET A CB 1
1736ATOM 427 C CG . MET A 1 64 ? 76.071 20.043 -7.961 1.00 95.54 ? 88 MET A CG 1
1737ATOM 428 S SD . MET A 1 64 ? 75.858 19.757 -9.735 1.00 91.30 ? 88 MET A SD 1
1738ATOM 429 C CE . MET A 1 64 ? 77.465 19.120 -10.129 1.00 77.20 ? 88 MET A CE 1
1739ATOM 430 N N . GLU A 1 65 ? 77.292 23.989 -7.099 1.00 62.01 ? 89 GLU A N 1
1740ATOM 431 C CA . GLU A 1 65 ? 76.482 25.182 -6.879 1.00 56.93 ? 89 GLU A CA 1
1741ATOM 432 C C . GLU A 1 65 ? 76.491 26.099 -8.094 1.00 59.50 ? 89 GLU A C 1
1742ATOM 433 O O . GLU A 1 65 ? 75.472 26.712 -8.418 1.00 60.24 ? 89 GLU A O 1
1743ATOM 434 C CB . GLU A 1 65 ? 76.952 25.944 -5.643 1.00 66.73 ? 89 GLU A CB 1
1744ATOM 435 C CG . GLU A 1 65 ? 75.982 27.057 -5.278 1.00 75.67 ? 89 GLU A CG 1
1745ATOM 436 C CD . GLU A 1 65 ? 76.306 27.734 -3.972 1.00 83.82 ? 89 GLU A CD 1
1746ATOM 437 O OE1 . GLU A 1 65 ? 77.505 27.952 -3.705 1.00 88.81 ? 89 GLU A OE1 1
1747ATOM 438 O OE2 . GLU A 1 65 ? 75.357 28.082 -3.235 1.00 76.59 ? 89 GLU A OE2 1
1748ATOM 439 N N . VAL A 1 66 ? 77.629 26.198 -8.785 1.00 64.53 ? 90 VAL A N 1
1749ATOM 440 C CA . VAL A 1 66 ? 77.688 27.019 -9.991 1.00 55.55 ? 90 VAL A CA 1
1750ATOM 441 C C . VAL A 1 66 ? 76.751 26.464 -11.053 1.00 55.01 ? 90 VAL A C 1
1751ATOM 442 O O . VAL A 1 66 ? 75.971 27.202 -11.662 1.00 60.44 ? 90 VAL A O 1
1752ATOM 443 C CB . VAL A 1 66 ? 79.133 27.113 -10.510 1.00 62.77 ? 90 VAL A CB 1
1753ATOM 444 C CG1 . VAL A 1 66 ? 79.140 27.455 -11.986 1.00 48.37 ? 90 VAL A CG1 1
1754ATOM 445 C CG2 . VAL A 1 66 ? 79.897 28.160 -9.735 1.00 63.67 ? 90 VAL A CG2 1
1755ATOM 446 N N . VAL A 1 67 ? 76.821 25.153 -11.297 1.00 49.56 ? 91 VAL A N 1
1756ATOM 447 C CA . VAL A 1 67 ? 75.942 24.536 -12.289 1.00 61.87 ? 91 VAL A CA 1
1757ATOM 448 C C . VAL A 1 67 ? 74.484 24.826 -11.952 1.00 59.08 ? 91 VAL A C 1
1758ATOM 449 O O . VAL A 1 67 ? 73.728 25.369 -12.771 1.00 58.84 ? 91 VAL A O 1
1759ATOM 450 C CB . VAL A 1 67 ? 76.213 23.022 -12.375 1.00 68.01 ? 91 VAL A CB 1
1760ATOM 451 C CG1 . VAL A 1 67 ? 75.065 22.307 -13.082 1.00 55.28 ? 91 VAL A CG1 1
1761ATOM 452 C CG2 . VAL A 1 67 ? 77.537 22.752 -13.075 1.00 73.34 ? 91 VAL A CG2 1
1762ATOM 453 N N . LEU A 1 68 ? 74.086 24.494 -10.721 1.00 50.30 ? 92 LEU A N 1
1763ATOM 454 C CA . LEU A 1 68 ? 72.707 24.676 -10.284 1.00 51.48 ? 92 LEU A CA 1
1764ATOM 455 C C . LEU A 1 68 ? 72.267 26.125 -10.435 1.00 59.22 ? 92 LEU A C 1
1765ATOM 456 O O . LEU A 1 68 ? 71.209 26.409 -11.010 1.00 61.59 ? 92 LEU A O 1
1766ATOM 457 C CB . LEU A 1 68 ? 72.573 24.223 -8.830 1.00 63.06 ? 92 LEU A CB 1
1767ATOM 458 C CG . LEU A 1 68 ? 72.988 22.777 -8.558 1.00 63.86 ? 92 LEU A CG 1
1768ATOM 459 C CD1 . LEU A 1 68 ? 72.664 22.394 -7.132 1.00 58.42 ? 92 LEU A CD1 1
1769ATOM 460 C CD2 . LEU A 1 68 ? 72.313 21.831 -9.536 1.00 51.31 ? 92 LEU A CD2 1
1770ATOM 461 N N . LEU A 1 69 ? 73.078 27.060 -9.933 1.00 52.72 ? 93 LEU A N 1
1771ATOM 462 C CA . LEU A 1 69 ? 72.709 28.467 -9.976 1.00 53.47 ? 93 LEU A CA 1
1772ATOM 463 C C . LEU A 1 69 ? 72.554 28.946 -11.411 1.00 61.11 ? 93 LEU A C 1
1773ATOM 464 O O . LEU A 1 69 ? 71.555 29.586 -11.753 1.00 70.66 ? 93 LEU A O 1
1774ATOM 465 C CB . LEU A 1 69 ? 73.745 29.300 -9.229 1.00 49.49 ? 93 LEU A CB 1
1775ATOM 466 C CG . LEU A 1 69 ? 73.627 29.244 -7.703 1.00 56.13 ? 93 LEU A CG 1
1776ATOM 467 C CD1 . LEU A 1 69 ? 74.853 29.858 -7.072 1.00 33.11 ? 93 LEU A CD1 1
1777ATOM 468 C CD2 . LEU A 1 69 ? 72.364 29.939 -7.225 1.00 57.17 ? 93 LEU A CD2 1
1778ATOM 469 N N . LYS A 1 70 ? 73.519 28.619 -12.275 1.00 62.04 ? 94 LYS A N 1
1779ATOM 470 C CA . LYS A 1 70 ? 73.402 28.994 -13.678 1.00 58.46 ? 94 LYS A CA 1
1780ATOM 471 C C . LYS A 1 70 ? 72.122 28.444 -14.288 1.00 60.72 ? 94 LYS A C 1
1781ATOM 472 O O . LYS A 1 70 ? 71.508 29.104 -15.137 1.00 61.53 ? 94 LYS A O 1
1782ATOM 473 C CB . LYS A 1 70 ? 74.621 28.505 -14.463 1.00 49.52 ? 94 LYS A CB 1
1783ATOM 474 C CG . LYS A 1 70 ? 75.946 29.136 -14.044 1.00 65.37 ? 94 LYS A CG 1
1784ATOM 475 C CD . LYS A 1 70 ? 76.745 29.659 -15.232 1.00 76.25 ? 94 LYS A CD 1
1785ATOM 476 C CE . LYS A 1 70 ? 76.161 30.946 -15.794 1.00 94.24 ? 94 LYS A CE 1
1786ATOM 477 N NZ . LYS A 1 70 ? 76.784 32.146 -15.150 1.00 92.36 ? 94 LYS A NZ 1
1787ATOM 478 N N . LYS A 1 71 ? 71.686 27.254 -13.854 1.00 61.38 ? 95 LYS A N 1
1788ATOM 479 C CA . LYS A 1 71 ? 70.427 26.729 -14.386 1.00 69.54 ? 95 LYS A CA 1
1789ATOM 480 C C . LYS A 1 71 ? 69.219 27.477 -13.828 1.00 63.20 ? 95 LYS A C 1
1790ATOM 481 O O . LYS A 1 71 ? 68.219 27.644 -14.537 1.00 75.63 ? 95 LYS A O 1
1791ATOM 482 C CB . LYS A 1 71 ? 70.290 25.225 -14.113 1.00 63.27 ? 95 LYS A CB 1
1792ATOM 483 C CG . LYS A 1 71 ? 71.499 24.405 -14.531 1.00 61.61 ? 95 LYS A CG 1
1793ATOM 484 C CD . LYS A 1 71 ? 71.251 22.902 -14.509 1.00 62.49 ? 95 LYS A CD 1
1794ATOM 485 C CE . LYS A 1 71 ? 69.952 22.531 -15.194 1.00 80.35 ? 95 LYS A CE 1
1795ATOM 486 N NZ . LYS A 1 71 ? 70.080 21.253 -15.959 1.00 70.69 ? 95 LYS A NZ 1
1796ATOM 487 N N . VAL A 1 72 ? 69.292 27.953 -12.580 1.00 69.28 ? 96 VAL A N 1
1797ATOM 488 C CA . VAL A 1 72 ? 68.152 28.632 -11.960 1.00 70.92 ? 96 VAL A CA 1
1798ATOM 489 C C . VAL A 1 72 ? 68.242 30.153 -12.007 1.00 79.71 ? 96 VAL A C 1
1799ATOM 490 O O . VAL A 1 72 ? 67.230 30.823 -11.746 1.00 88.96 ? 96 VAL A O 1
1800ATOM 491 C CB . VAL A 1 72 ? 67.952 28.201 -10.490 1.00 48.20 ? 96 VAL A CB 1
1801ATOM 492 C CG1 . VAL A 1 72 ? 67.643 26.717 -10.398 1.00 51.83 ? 96 VAL A CG1 1
1802ATOM 493 C CG2 . VAL A 1 72 ? 69.167 28.562 -9.664 1.00 53.51 ? 96 VAL A CG2 1
1803ATOM 494 N N . SER A 1 73 ? 69.394 30.717 -12.354 1.00 78.10 ? 97 SER A N 1
1804ATOM 495 C CA . SER A 1 73 ? 69.561 32.190 -12.249 1.00 79.53 ? 97 SER A CA 1
1805ATOM 496 C C . SER A 1 73 ? 69.150 32.890 -13.538 1.00 75.54 ? 97 SER A C 1
1806ATOM 497 O O . SER A 1 73 ? 69.317 34.114 -13.624 1.00 77.80 ? 97 SER A O 1
1807ATOM 498 C CB . SER A 1 73 ? 70.967 32.544 -11.865 1.00 74.13 ? 97 SER A CB 1
1808ATOM 499 O OG . SER A 1 73 ? 71.289 32.002 -10.596 1.00 61.10 ? 97 SER A OG 1
1809ATOM 500 N N . SER A 1 74 ? 68.651 32.137 -14.507 1.00 81.43 ? 98 SER A N 1
1810ATOM 501 C CA . SER A 1 74 ? 68.140 32.798 -15.727 1.00 96.57 ? 98 SER A CA 1
1811ATOM 502 C C . SER A 1 74 ? 66.689 33.179 -15.466 1.00 96.61 ? 98 SER A C 1
1812ATOM 503 O O . SER A 1 74 ? 65.834 32.277 -15.447 1.00 98.90 ? 98 SER A O 1
1813ATOM 504 C CB . SER A 1 74 ? 68.288 31.919 -16.925 1.00 91.29 ? 98 SER A CB 1
1814ATOM 505 O OG . SER A 1 74 ? 69.661 31.694 -17.205 1.00 88.09 ? 98 SER A OG 1
1815ATOM 506 N N . GLY A 1 75 ? 66.445 34.462 -15.228 1.00 91.00 ? 99 GLY A N 1
1816ATOM 507 C CA . GLY A 1 75 ? 65.070 34.931 -14.995 1.00 73.54 ? 99 GLY A CA 1
1817ATOM 508 C C . GLY A 1 75 ? 64.845 35.337 -13.559 1.00 84.55 ? 99 GLY A C 1
1818ATOM 509 O O . GLY A 1 75 ? 65.640 34.936 -12.691 1.00 80.90 ? 99 GLY A O 1
1819ATOM 510 N N . PHE A 1 76 ? 63.791 36.109 -13.321 1.00 77.58 ? 100 PHE A N 1
1820ATOM 511 C CA . PHE A 1 76 ? 63.452 36.500 -11.936 1.00 69.45 ? 100 PHE A CA 1
1821ATOM 512 C C . PHE A 1 76 ? 62.989 35.252 -11.197 1.00 70.57 ? 100 PHE A C 1
1822ATOM 513 O O . PHE A 1 76 ? 62.116 34.532 -11.702 1.00 65.63 ? 100 PHE A O 1
1823ATOM 514 C CB . PHE A 1 76 ? 62.406 37.614 -11.923 1.00 68.67 ? 100 PHE A CB 1
1824ATOM 515 C CG . PHE A 1 76 ? 62.910 38.948 -12.403 1.00 76.55 ? 100 PHE A CG 1
1825ATOM 516 C CD1 . PHE A 1 76 ? 64.098 39.471 -11.923 1.00 75.95 ? 100 PHE A CD1 1
1826ATOM 517 C CD2 . PHE A 1 76 ? 62.196 39.679 -13.336 1.00 67.27 ? 100 PHE A CD2 1
1827ATOM 518 C CE1 . PHE A 1 76 ? 64.562 40.698 -12.366 1.00 78.51 ? 100 PHE A CE1 1
1828ATOM 519 C CE2 . PHE A 1 76 ? 62.661 40.906 -13.780 1.00 81.26 ? 100 PHE A CE2 1
1829ATOM 520 C CZ . PHE A 1 76 ? 63.843 41.413 -13.294 1.00 84.35 ? 100 PHE A CZ 1
1830ATOM 521 N N . SER A 1 77 ? 63.576 35.019 -10.030 1.00 73.89 ? 101 SER A N 1
1831ATOM 522 C CA . SER A 1 77 ? 63.240 33.815 -9.239 1.00 71.73 ? 101 SER A CA 1
1832ATOM 523 C C . SER A 1 77 ? 63.343 34.141 -7.757 1.00 70.69 ? 101 SER A C 1
1833ATOM 524 O O . SER A 1 77 ? 63.932 35.164 -7.440 1.00 76.44 ? 101 SER A O 1
1834ATOM 525 C CB . SER A 1 77 ? 64.178 32.704 -9.584 1.00 71.93 ? 101 SER A CB 1
1835ATOM 526 O OG . SER A 1 77 ? 65.509 33.169 -9.753 1.00 85.30 ? 101 SER A OG 1
1836ATOM 527 N N . GLY A 1 78 ? 62.761 33.311 -6.894 1.00 65.96 ? 102 GLY A N 1
1837ATOM 528 C CA . GLY A 1 78 ? 62.956 33.486 -5.444 1.00 49.78 ? 102 GLY A CA 1
1838ATOM 529 C C . GLY A 1 78 ? 64.272 32.849 -5.080 1.00 54.28 ? 102 GLY A C 1
1839ATOM 530 O O . GLY A 1 78 ? 64.362 32.280 -4.007 1.00 59.19 ? 102 GLY A O 1
1840ATOM 531 N N . VAL A 1 79 ? 65.231 32.886 -5.992 1.00 60.28 ? 103 VAL A N 1
1841ATOM 532 C CA . VAL A 1 79 ? 66.550 32.302 -5.798 1.00 58.23 ? 103 VAL A CA 1
1842ATOM 533 C C . VAL A 1 79 ? 67.580 33.407 -5.953 1.00 46.31 ? 103 VAL A C 1
1843ATOM 534 O O . VAL A 1 79 ? 67.549 34.154 -6.937 1.00 60.05 ? 103 VAL A O 1
1844ATOM 535 C CB . VAL A 1 79 ? 66.822 31.162 -6.796 1.00 58.27 ? 103 VAL A CB 1
1845ATOM 536 C CG1 . VAL A 1 79 ? 68.240 30.648 -6.634 1.00 44.85 ? 103 VAL A CG1 1
1846ATOM 537 C CG2 . VAL A 1 79 ? 65.826 30.034 -6.590 1.00 47.77 ? 103 VAL A CG2 1
1847ATOM 538 N N . ILE A 1 80 ? 68.475 33.520 -4.973 1.00 48.88 ? 104 ILE A N 1
1848ATOM 539 C CA . ILE A 1 80 ? 69.595 34.441 -5.100 1.00 46.78 ? 104 ILE A CA 1
1849ATOM 540 C C . ILE A 1 80 ? 70.414 34.032 -6.310 1.00 59.39 ? 104 ILE A C 1
1850ATOM 541 O O . ILE A 1 80 ? 70.921 32.905 -6.389 1.00 58.45 ? 104 ILE A O 1
1851ATOM 542 C CB . ILE A 1 80 ? 70.425 34.465 -3.815 1.00 47.38 ? 104 ILE A CB 1
1852ATOM 543 C CG1 . ILE A 1 80 ? 69.619 35.133 -2.704 1.00 44.96 ? 104 ILE A CG1 1
1853ATOM 544 C CG2 . ILE A 1 80 ? 71.742 35.198 -4.028 1.00 41.34 ? 104 ILE A CG2 1
1854ATOM 545 C CD1 . ILE A 1 80 ? 69.493 36.628 -2.870 1.00 46.33 ? 104 ILE A CD1 1
1855ATOM 546 N N . ARG A 1 81 ? 70.529 34.943 -7.269 1.00 58.08 ? 105 ARG A N 1
1856ATOM 547 C CA . ARG A 1 81 ? 71.088 34.615 -8.568 1.00 61.05 ? 105 ARG A CA 1
1857ATOM 548 C C . ARG A 1 81 ? 72.607 34.702 -8.544 1.00 53.67 ? 105 ARG A C 1
1858ATOM 549 O O . ARG A 1 81 ? 73.187 35.539 -7.849 1.00 44.10 ? 105 ARG A O 1
1859ATOM 550 C CB . ARG A 1 81 ? 70.513 35.551 -9.632 1.00 59.86 ? 105 ARG A CB 1
1860ATOM 551 C CG . ARG A 1 81 ? 69.011 35.373 -9.836 1.00 69.90 ? 105 ARG A CG 1
1861ATOM 552 C CD . ARG A 1 81 ? 68.444 36.384 -10.831 1.00 88.61 ? 105 ARG A CD 1
1862ATOM 553 N NE . ARG A 1 81 ? 68.975 36.234 -12.179 1.00 102.78 ? 105 ARG A NE 1
1863ATOM 554 C CZ . ARG A 1 81 ? 68.719 37.065 -13.183 1.00 103.46 ? 105 ARG A CZ 1
1864ATOM 555 N NH1 . ARG A 1 81 ? 67.935 38.121 -13.023 1.00 97.11 ? 105 ARG A NH1 1
1865ATOM 556 N NH2 . ARG A 1 81 ? 69.259 36.826 -14.377 1.00 67.90 ? 105 ARG A NH2 1
1866ATOM 557 N N . LEU A 1 82 ? 73.250 33.813 -9.296 1.00 64.19 ? 106 LEU A N 1
1867ATOM 558 C CA . LEU A 1 82 ? 74.694 33.865 -9.485 1.00 57.78 ? 106 LEU A CA 1
1868ATOM 559 C C . LEU A 1 82 ? 74.995 34.923 -10.536 1.00 52.25 ? 106 LEU A C 1
1869ATOM 560 O O . LEU A 1 82 ? 74.703 34.726 -11.720 1.00 64.24 ? 106 LEU A O 1
1870ATOM 561 C CB . LEU A 1 82 ? 75.229 32.501 -9.913 1.00 51.47 ? 106 LEU A CB 1
1871ATOM 562 C CG . LEU A 1 82 ? 76.750 32.402 -10.035 1.00 51.62 ? 106 LEU A CG 1
1872ATOM 563 C CD1 . LEU A 1 82 ? 77.369 32.465 -8.642 1.00 56.76 ? 106 LEU A CD1 1
1873ATOM 564 C CD2 . LEU A 1 82 ? 77.160 31.119 -10.749 1.00 44.40 ? 106 LEU A CD2 1
1874ATOM 565 N N . LEU A 1 83 ? 75.555 36.058 -10.109 1.00 40.66 ? 107 LEU A N 1
1875ATOM 566 C CA . LEU A 1 83 ? 75.899 37.106 -11.065 1.00 54.35 ? 107 LEU A CA 1
1876ATOM 567 C C . LEU A 1 83 ? 77.217 36.826 -11.766 1.00 54.00 ? 107 LEU A C 1
1877ATOM 568 O O . LEU A 1 83 ? 77.379 37.183 -12.938 1.00 57.69 ? 107 LEU A O 1
1878ATOM 569 C CB . LEU A 1 83 ? 75.961 38.472 -10.385 1.00 44.24 ? 107 LEU A CB 1
1879ATOM 570 C CG . LEU A 1 83 ? 74.939 38.746 -9.295 1.00 64.95 ? 107 LEU A CG 1
1880ATOM 571 C CD1 . LEU A 1 83 ? 75.213 40.098 -8.688 1.00 67.18 ? 107 LEU A CD1 1
1881ATOM 572 C CD2 . LEU A 1 83 ? 73.556 38.712 -9.910 1.00 61.62 ? 107 LEU A CD2 1
1882ATOM 573 N N . ASP A 1 84 ? 78.164 36.204 -11.078 1.00 55.39 ? 108 ASP A N 1
1883ATOM 574 C CA . ASP A 1 84 ? 79.423 35.860 -11.725 1.00 56.13 ? 108 ASP A CA 1
1884ATOM 575 C C . ASP A 1 84 ? 80.117 34.785 -10.908 1.00 59.97 ? 108 ASP A C 1
1885ATOM 576 O O . ASP A 1 84 ? 79.671 34.409 -9.824 1.00 56.75 ? 108 ASP A O 1
1886ATOM 577 C CB . ASP A 1 84 ? 80.327 37.089 -11.892 1.00 66.54 ? 108 ASP A CB 1
1887ATOM 578 C CG . ASP A 1 84 ? 81.343 36.917 -13.009 1.00 84.17 ? 108 ASP A CG 1
1888ATOM 579 O OD1 . ASP A 1 84 ? 81.315 35.856 -13.673 1.00 84.51 ? 108 ASP A OD1 1
1889ATOM 580 O OD2 . ASP A 1 84 ? 82.171 37.833 -13.218 1.00 82.45 ? 108 ASP A OD2 1
1890ATOM 581 N N . TRP A 1 85 ? 81.229 34.300 -11.443 1.00 59.01 ? 109 TRP A N 1
1891ATOM 582 C CA . TRP A 1 85 ? 82.066 33.377 -10.704 1.00 46.10 ? 109 TRP A CA 1
1892ATOM 583 C C . TRP A 1 85 ? 83.474 33.446 -11.270 1.00 55.79 ? 109 TRP A C 1
1893ATOM 584 O O . TRP A 1 85 ? 83.680 33.792 -12.434 1.00 73.49 ? 109 TRP A O 1
1894ATOM 585 C CB . TRP A 1 85 ? 81.524 31.948 -10.763 1.00 46.64 ? 109 TRP A CB 1
1895ATOM 586 C CG . TRP A 1 85 ? 81.618 31.362 -12.109 1.00 66.40 ? 109 TRP A CG 1
1896ATOM 587 C CD1 . TRP A 1 85 ? 80.841 31.657 -13.190 1.00 71.81 ? 109 TRP A CD1 1
1897ATOM 588 C CD2 . TRP A 1 85 ? 82.584 30.409 -12.552 1.00 78.22 ? 109 TRP A CD2 1
1898ATOM 589 N NE1 . TRP A 1 85 ? 81.249 30.924 -14.276 1.00 82.59 ? 109 TRP A NE1 1
1899ATOM 590 C CE2 . TRP A 1 85 ? 82.321 30.151 -13.910 1.00 76.89 ? 109 TRP A CE2 1
1900ATOM 591 C CE3 . TRP A 1 85 ? 83.642 29.740 -11.930 1.00 71.42 ? 109 TRP A CE3 1
1901ATOM 592 C CZ2 . TRP A 1 85 ? 83.079 29.256 -14.657 1.00 78.10 ? 109 TRP A CZ2 1
1902ATOM 593 C CZ3 . TRP A 1 85 ? 84.390 28.850 -12.675 1.00 89.21 ? 109 TRP A CZ3 1
1903ATOM 594 C CH2 . TRP A 1 85 ? 84.108 28.618 -14.024 1.00 85.14 ? 109 TRP A CH2 1
1904ATOM 595 N N . PHE A 1 86 ? 84.436 33.135 -10.418 1.00 49.41 ? 110 PHE A N 1
1905ATOM 596 C CA . PHE A 1 86 ? 85.849 33.204 -10.739 1.00 57.59 ? 110 PHE A CA 1
1906ATOM 597 C C . PHE A 1 86 ? 86.518 31.958 -10.189 1.00 56.89 ? 110 PHE A C 1
1907ATOM 598 O O . PHE A 1 86 ? 86.136 31.459 -9.126 1.00 57.76 ? 110 PHE A O 1
1908ATOM 599 C CB . PHE A 1 86 ? 86.518 34.453 -10.139 1.00 52.04 ? 110 PHE A CB 1
1909ATOM 600 C CG . PHE A 1 86 ? 85.845 35.749 -10.501 1.00 64.10 ? 110 PHE A CG 1
1910ATOM 601 C CD1 . PHE A 1 86 ? 84.679 36.149 -9.866 1.00 66.63 ? 110 PHE A CD1 1
1911ATOM 602 C CD2 . PHE A 1 86 ? 86.385 36.571 -11.477 1.00 89.55 ? 110 PHE A CD2 1
1912ATOM 603 C CE1 . PHE A 1 86 ? 84.067 37.341 -10.200 1.00 75.65 ? 110 PHE A CE1 1
1913ATOM 604 C CE2 . PHE A 1 86 ? 85.777 37.764 -11.816 1.00 97.46 ? 110 PHE A CE2 1
1914ATOM 605 C CZ . PHE A 1 86 ? 84.616 38.149 -11.175 1.00 93.10 ? 110 PHE A CZ 1
1915ATOM 606 N N . GLU A 1 87 ? 87.504 31.454 -10.913 1.00 63.94 ? 111 GLU A N 1
1916ATOM 607 C CA . GLU A 1 87 ? 88.330 30.362 -10.429 1.00 57.35 ? 111 GLU A CA 1
1917ATOM 608 C C . GLU A 1 87 ? 89.650 30.947 -9.956 1.00 70.25 ? 111 GLU A C 1
1918ATOM 609 O O . GLU A 1 87 ? 90.357 31.600 -10.731 1.00 73.26 ? 111 GLU A O 1
1919ATOM 610 C CB . GLU A 1 87 ? 88.571 29.307 -11.505 1.00 71.15 ? 111 GLU A CB 1
1920ATOM 611 C CG . GLU A 1 87 ? 89.413 28.142 -11.008 1.00 70.58 ? 111 GLU A CG 1
1921ATOM 612 C CD . GLU A 1 87 ? 89.437 26.982 -11.977 1.00 96.22 ? 111 GLU A CD 1
1922ATOM 613 O OE1 . GLU A 1 87 ? 89.323 27.224 -13.200 1.00 110.13 ? 111 GLU A OE1 1
1923ATOM 614 O OE2 . GLU A 1 87 ? 89.558 25.828 -11.512 1.00 93.98 ? 111 GLU A OE2 1
1924ATOM 615 N N . ARG A 1 88 ? 89.960 30.732 -8.694 1.00 62.36 ? 112 ARG A N 1
1925ATOM 616 C CA . ARG A 1 88 ? 91.253 31.040 -8.117 1.00 66.39 ? 112 ARG A CA 1
1926ATOM 617 C C . ARG A 1 88 ? 92.091 29.773 -8.067 1.00 77.21 ? 112 ARG A C 1
1927ATOM 618 O O . ARG A 1 88 ? 91.614 28.688 -8.413 1.00 59.99 ? 112 ARG A O 1
1928ATOM 619 C CB . ARG A 1 88 ? 91.059 31.647 -6.726 1.00 74.44 ? 112 ARG A CB 1
1929ATOM 620 C CG . ARG A 1 88 ? 90.823 33.141 -6.774 1.00 62.18 ? 112 ARG A CG 1
1930ATOM 621 C CD . ARG A 1 88 ? 90.590 33.714 -5.402 1.00 73.27 ? 112 ARG A CD 1
1931ATOM 622 N NE . ARG A 1 88 ? 90.771 35.158 -5.404 1.00 75.86 ? 112 ARG A NE 1
1932ATOM 623 C CZ . ARG A 1 88 ? 90.524 35.941 -4.365 1.00 88.28 ? 112 ARG A CZ 1
1933ATOM 624 N NH1 . ARG A 1 88 ? 90.063 35.448 -3.225 1.00 82.42 ? 112 ARG A NH1 1
1934ATOM 625 N NH2 . ARG A 1 88 ? 90.750 37.248 -4.470 1.00 93.81 ? 112 ARG A NH2 1
1935ATOM 626 N N . PRO A 1 89 ? 93.382 29.873 -7.688 1.00 93.47 ? 113 PRO A N 1
1936ATOM 627 C CA . PRO A 1 89 ? 94.209 28.660 -7.601 1.00 82.05 ? 113 PRO A CA 1
1937ATOM 628 C C . PRO A 1 89 ? 93.599 27.547 -6.761 1.00 80.83 ? 113 PRO A C 1
1938ATOM 629 O O . PRO A 1 89 ? 93.414 26.430 -7.257 1.00 88.71 ? 113 PRO A O 1
1939ATOM 630 C CB . PRO A 1 89 ? 95.510 29.181 -6.984 1.00 89.73 ? 113 PRO A CB 1
1940ATOM 631 C CG . PRO A 1 89 ? 95.616 30.558 -7.525 1.00 87.59 ? 113 PRO A CG 1
1941ATOM 632 C CD . PRO A 1 89 ? 94.206 31.092 -7.566 1.00 85.50 ? 113 PRO A CD 1
1942ATOM 633 N N . ASP A 1 90 ? 93.278 27.829 -5.499 1.00 81.13 ? 114 ASP A N 1
1943ATOM 634 C CA . ASP A 1 90 ? 92.721 26.823 -4.603 1.00 82.32 ? 114 ASP A CA 1
1944ATOM 635 C C . ASP A 1 90 ? 91.367 27.262 -4.056 1.00 77.62 ? 114 ASP A C 1
1945ATOM 636 O O . ASP A 1 90 ? 90.962 26.849 -2.968 1.00 85.81 ? 114 ASP A O 1
1946ATOM 637 C CB . ASP A 1 90 ? 93.692 26.521 -3.462 1.00 86.57 ? 114 ASP A CB 1
1947ATOM 638 C CG . ASP A 1 90 ? 94.640 25.381 -3.789 1.00 83.89 ? 114 ASP A CG 1
1948ATOM 639 O OD1 . ASP A 1 90 ? 94.471 24.751 -4.853 1.00 100.81 ? 114 ASP A OD1 1
1949ATOM 640 O OD2 . ASP A 1 90 ? 95.555 25.114 -2.982 1.00 106.69 ? 114 ASP A OD2 1
1950ATOM 641 N N . SER A 1 91 ? 90.644 28.073 -4.823 1.00 79.01 ? 115 SER A N 1
1951ATOM 642 C CA . SER A 1 91 ? 89.427 28.707 -4.345 1.00 64.75 ? 115 SER A CA 1
1952ATOM 643 C C . SER A 1 91 ? 88.508 29.022 -5.520 1.00 65.11 ? 115 SER A C 1
1953ATOM 644 O O . SER A 1 91 ? 88.979 29.313 -6.622 1.00 70.23 ? 115 SER A O 1
1954ATOM 645 C CB . SER A 1 91 ? 89.772 29.984 -3.568 1.00 61.15 ? 115 SER A CB 1
1955ATOM 646 O OG . SER A 1 91 ? 88.642 30.808 -3.383 1.00 60.49 ? 115 SER A OG 1
1956ATOM 647 N N . PHE A 1 92 ? 87.200 28.942 -5.279 1.00 62.19 ? 116 PHE A N 1
1957ATOM 648 C CA . PHE A 1 92 ? 86.174 29.399 -6.206 1.00 55.09 ? 116 PHE A CA 1
1958ATOM 649 C C . PHE A 1 92 ? 85.429 30.570 -5.587 1.00 59.10 ? 116 PHE A C 1
1959ATOM 650 O O . PHE A 1 92 ? 85.093 30.545 -4.401 1.00 54.39 ? 116 PHE A O 1
1960ATOM 651 C CB . PHE A 1 92 ? 85.188 28.279 -6.544 1.00 66.61 ? 116 PHE A CB 1
1961ATOM 652 C CG . PHE A 1 92 ? 85.570 27.489 -7.758 1.00 72.43 ? 116 PHE A CG 1
1962ATOM 653 C CD1 . PHE A 1 92 ? 85.519 28.061 -9.013 1.00 84.28 ? 116 PHE A CD1 1
1963ATOM 654 C CD2 . PHE A 1 92 ? 85.982 26.175 -7.642 1.00 88.12 ? 116 PHE A CD2 1
1964ATOM 655 C CE1 . PHE A 1 92 ? 85.874 27.336 -10.130 1.00 86.91 ? 116 PHE A CE1 1
1965ATOM 656 C CE2 . PHE A 1 92 ? 86.340 25.454 -8.755 1.00 85.11 ? 116 PHE A CE2 1
1966ATOM 657 C CZ . PHE A 1 92 ? 86.282 26.029 -10.001 1.00 92.00 ? 116 PHE A CZ 1
1967ATOM 658 N N . VAL A 1 93 ? 85.169 31.597 -6.387 1.00 56.52 ? 117 VAL A N 1
1968ATOM 659 C CA . VAL A 1 93 ? 84.565 32.828 -5.897 1.00 49.86 ? 117 VAL A CA 1
1969ATOM 660 C C . VAL A 1 93 ? 83.270 33.047 -6.657 1.00 45.06 ? 117 VAL A C 1
1970ATOM 661 O O . VAL A 1 93 ? 83.289 33.239 -7.873 1.00 57.22 ? 117 VAL A O 1
1971ATOM 662 C CB . VAL A 1 93 ? 85.510 34.026 -6.065 1.00 53.50 ? 117 VAL A CB 1
1972ATOM 663 C CG1 . VAL A 1 93 ? 84.827 35.290 -5.615 1.00 49.06 ? 117 VAL A CG1 1
1973ATOM 664 C CG2 . VAL A 1 93 ? 86.801 33.796 -5.285 1.00 51.72 ? 117 VAL A CG2 1
1974ATOM 665 N N . LEU A 1 94 ? 82.149 33.011 -5.956 1.00 52.65 ? 118 LEU A N 1
1975ATOM 666 C CA . LEU A 1 94 ? 80.849 33.229 -6.573 1.00 44.48 ? 118 LEU A CA 1
1976ATOM 667 C C . LEU A 1 94 ? 80.340 34.608 -6.191 1.00 45.68 ? 118 LEU A C 1
1977ATOM 668 O O . LEU A 1 94 ? 80.360 34.974 -5.017 1.00 45.15 ? 118 LEU A O 1
1978ATOM 669 C CB . LEU A 1 94 ? 79.837 32.161 -6.149 1.00 42.32 ? 118 LEU A CB 1
1979ATOM 670 C CG . LEU A 1 94 ? 80.262 30.693 -6.088 1.00 43.89 ? 118 LEU A CG 1
1980ATOM 671 C CD1 . LEU A 1 94 ? 79.021 29.808 -6.077 1.00 48.52 ? 118 LEU A CD1 1
1981ATOM 672 C CD2 . LEU A 1 94 ? 81.182 30.312 -7.238 1.00 51.13 ? 118 LEU A CD2 1
1982ATOM 673 N N . ILE A 1 95 ? 79.899 35.375 -7.175 1.00 52.02 ? 119 ILE A N 1
1983ATOM 674 C CA . ILE A 1 95 ? 79.264 36.658 -6.935 1.00 46.79 ? 119 ILE A CA 1
1984ATOM 675 C C . ILE A 1 95 ? 77.771 36.426 -7.079 1.00 47.79 ? 119 ILE A C 1
1985ATOM 676 O O . ILE A 1 95 ? 77.274 36.202 -8.191 1.00 62.78 ? 119 ILE A O 1
1986ATOM 677 C CB . ILE A 1 95 ? 79.766 37.735 -7.903 1.00 56.89 ? 119 ILE A CB 1
1987ATOM 678 C CG1 . ILE A 1 95 ? 81.294 37.762 -7.908 1.00 49.44 ? 119 ILE A CG1 1
1988ATOM 679 C CG2 . ILE A 1 95 ? 79.206 39.082 -7.507 1.00 63.04 ? 119 ILE A CG2 1
1989ATOM 680 C CD1 . ILE A 1 95 ? 81.906 38.039 -6.564 1.00 43.98 ? 119 ILE A CD1 1
1990ATOM 681 N N . LEU A 1 96 ? 77.087 36.457 -5.940 1.00 47.83 ? 120 LEU A N 1
1991ATOM 682 C CA . LEU A 1 96 ? 75.660 36.252 -5.766 1.00 61.17 ? 120 LEU A CA 1
1992ATOM 683 C C . LEU A 1 96 ? 74.995 37.575 -5.408 1.00 50.01 ? 120 LEU A C 1
1993ATOM 684 O O . LEU A 1 96 ? 75.654 38.547 -5.048 1.00 47.12 ? 120 LEU A O 1
1994ATOM 685 C CB . LEU A 1 96 ? 75.416 35.230 -4.651 1.00 51.65 ? 120 LEU A CB 1
1995ATOM 686 C CG . LEU A 1 96 ? 76.176 33.925 -4.855 1.00 50.62 ? 120 LEU A CG 1
1996ATOM 687 C CD1 . LEU A 1 96 ? 76.561 33.285 -3.533 1.00 45.79 ? 120 LEU A CD1 1
1997ATOM 688 C CD2 . LEU A 1 96 ? 75.313 32.996 -5.661 1.00 49.63 ? 120 LEU A CD2 1
1998ATOM 689 N N . GLU A 1 97 ? 73.669 37.603 -5.466 1.00 65.84 ? 121 GLU A N 1
1999ATOM 690 C CA . GLU A 1 97 ? 72.948 38.819 -5.117 1.00 62.43 ? 121 GLU A CA 1
2000ATOM 691 C C . GLU A 1 97 ? 72.941 39.012 -3.612 1.00 61.56 ? 121 GLU A C 1
2001ATOM 692 O O . GLU A 1 97 ? 72.829 38.049 -2.847 1.00 71.87 ? 121 GLU A O 1
2002ATOM 693 C CB . GLU A 1 97 ? 71.508 38.774 -5.626 1.00 71.28 ? 121 GLU A CB 1
2003ATOM 694 C CG . GLU A 1 97 ? 71.378 38.593 -7.117 1.00 74.15 ? 121 GLU A CG 1
2004ATOM 695 C CD . GLU A 1 97 ? 69.936 38.466 -7.552 1.00 85.84 ? 121 GLU A CD 1
2005ATOM 696 O OE1 . GLU A 1 97 ? 69.256 37.523 -7.090 1.00 76.25 ? 121 GLU A OE1 1
2006ATOM 697 O OE2 . GLU A 1 97 ? 69.485 39.304 -8.363 1.00 97.11 ? 121 GLU A OE2 1
2007ATOM 698 N N . ARG A 1 98 ? 73.059 40.265 -3.189 1.00 64.49 ? 122 ARG A N 1
2008ATOM 699 C CA . ARG A 1 98 ? 72.865 40.631 -1.787 1.00 56.18 ? 122 ARG A CA 1
2009ATOM 700 C C . ARG A 1 98 ? 71.672 41.565 -1.698 1.00 48.57 ? 122 ARG A C 1
2010ATOM 701 O O . ARG A 1 98 ? 71.786 42.756 -2.039 1.00 57.54 ? 122 ARG A O 1
2011ATOM 702 C CB . ARG A 1 98 ? 74.107 41.296 -1.199 1.00 54.13 ? 122 ARG A CB 1
2012ATOM 703 C CG . ARG A 1 98 ? 74.037 41.507 0.301 1.00 48.65 ? 122 ARG A CG 1
2013ATOM 704 C CD . ARG A 1 98 ? 75.427 41.702 0.875 1.00 57.37 ? 122 ARG A CD 1
2014ATOM 705 N NE . ARG A 1 98 ? 76.087 42.877 0.319 1.00 56.59 ? 122 ARG A NE 1
2015ATOM 706 C CZ . ARG A 1 98 ? 75.743 44.129 0.589 1.00 61.61 ? 122 ARG A CZ 1
2016ATOM 707 N NH1 . ARG A 1 98 ? 74.793 44.413 1.464 1.00 63.09 ? 122 ARG A NH1 1
2017ATOM 708 N NH2 . ARG A 1 98 ? 76.374 45.123 -0.030 1.00 65.70 ? 122 ARG A NH2 1
2018ATOM 709 N N . PRO A 1 99 ? 70.507 41.079 -1.281 1.00 62.20 ? 123 PRO A N 1
2019ATOM 710 C CA . PRO A 1 99 ? 69.404 41.992 -0.966 1.00 61.42 ? 123 PRO A CA 1
2020ATOM 711 C C . PRO A 1 99 ? 69.784 42.899 0.194 1.00 56.04 ? 123 PRO A C 1
2021ATOM 712 O O . PRO A 1 99 ? 70.657 42.585 1.005 1.00 58.84 ? 123 PRO A O 1
2022ATOM 713 C CB . PRO A 1 99 ? 68.254 41.050 -0.586 1.00 54.68 ? 123 PRO A CB 1
2023ATOM 714 C CG . PRO A 1 99 ? 68.641 39.717 -1.163 1.00 50.13 ? 123 PRO A CG 1
2024ATOM 715 C CD . PRO A 1 99 ? 70.133 39.668 -1.090 1.00 48.48 ? 123 PRO A CD 1
2025ATOM 716 N N . GLU A 1 100 ? 69.124 44.048 0.263 1.00 75.00 ? 124 GLU A N 1
2026ATOM 717 C CA . GLU A 1 100 ? 69.404 44.983 1.346 1.00 62.48 ? 124 GLU A CA 1
2027ATOM 718 C C . GLU A 1 100 ? 68.177 45.825 1.673 1.00 70.70 ? 124 GLU A C 1
2028ATOM 719 O O . GLU A 1 100 ? 67.608 46.465 0.778 1.00 69.77 ? 124 GLU A O 1
2029ATOM 720 C CB . GLU A 1 100 ? 70.583 45.889 0.985 1.00 72.33 ? 124 GLU A CB 1
2030ATOM 721 C CG . GLU A 1 100 ? 71.822 45.590 1.798 1.00 91.16 ? 124 GLU A CG 1
2031ATOM 722 C CD . GLU A 1 100 ? 71.723 46.122 3.216 1.00 104.28 ? 124 GLU A CD 1
2032ATOM 723 O OE1 . GLU A 1 100 ? 71.164 47.225 3.405 1.00 103.50 ? 124 GLU A OE1 1
2033ATOM 724 O OE2 . GLU A 1 100 ? 72.186 45.429 4.147 1.00 109.17 ? 124 GLU A OE2 1
2034ATOM 725 N N . PRO A 1 101 ? 67.726 45.844 2.940 1.00 85.78 ? 125 PRO A N 1
2035ATOM 726 C CA . PRO A 1 101 ? 68.244 45.048 4.057 1.00 75.03 ? 125 PRO A CA 1
2036ATOM 727 C C . PRO A 1 101 ? 67.818 43.598 3.930 1.00 74.53 ? 125 PRO A C 1
2037ATOM 728 O O . PRO A 1 101 ? 66.908 43.297 3.157 1.00 67.90 ? 125 PRO A O 1
2038ATOM 729 C CB . PRO A 1 101 ? 67.605 45.701 5.288 1.00 64.96 ? 125 PRO A CB 1
2039ATOM 730 C CG . PRO A 1 101 ? 67.034 47.003 4.794 1.00 87.40 ? 125 PRO A CG 1
2040ATOM 731 C CD . PRO A 1 101 ? 66.646 46.731 3.386 1.00 76.62 ? 125 PRO A CD 1
2041ATOM 732 N N . VAL A 1 102 ? 68.462 42.707 4.678 1.00 65.83 ? 126 VAL A N 1
2042ATOM 733 C CA . VAL A 1 102 ? 68.276 41.279 4.478 1.00 61.91 ? 126 VAL A CA 1
2043ATOM 734 C C . VAL A 1 102 ? 68.483 40.570 5.804 1.00 58.47 ? 126 VAL A C 1
2044ATOM 735 O O . VAL A 1 102 ? 69.272 41.006 6.646 1.00 61.52 ? 126 VAL A O 1
2045ATOM 736 C CB . VAL A 1 102 ? 69.237 40.748 3.387 1.00 57.15 ? 126 VAL A CB 1
2046ATOM 737 C CG1 . VAL A 1 102 ? 70.679 41.011 3.785 1.00 52.76 ? 126 VAL A CG1 1
2047ATOM 738 C CG2 . VAL A 1 102 ? 69.002 39.263 3.121 1.00 52.43 ? 126 VAL A CG2 1
2048ATOM 739 N N . GLN A 1 103 ? 67.747 39.481 5.999 1.00 59.46 ? 127 GLN A N 1
2049ATOM 740 C CA . GLN A 1 103 ? 67.986 38.649 7.170 1.00 55.27 ? 127 GLN A CA 1
2050ATOM 741 C C . GLN A 1 103 ? 67.703 37.187 6.867 1.00 49.86 ? 127 GLN A C 1
2051ATOM 742 O O . GLN A 1 103 ? 66.722 36.861 6.196 1.00 44.84 ? 127 GLN A O 1
2052ATOM 743 C CB . GLN A 1 103 ? 67.141 39.083 8.371 1.00 54.85 ? 127 GLN A CB 1
2053ATOM 744 C CG . GLN A 1 103 ? 67.696 38.575 9.694 1.00 65.68 ? 127 GLN A CG 1
2054ATOM 745 C CD . GLN A 1 103 ? 66.820 38.927 10.872 1.00 62.57 ? 127 GLN A CD 1
2055ATOM 746 O OE1 . GLN A 1 103 ? 65.711 39.431 10.706 1.00 67.90 ? 127 GLN A OE1 1
2056ATOM 747 N NE2 . GLN A 1 103 ? 67.313 38.663 12.074 1.00 63.14 ? 127 GLN A NE2 1
2057ATOM 748 N N . ASP A 1 104 ? 68.594 36.322 7.351 1.00 51.38 ? 128 ASP A N 1
2058ATOM 749 C CA . ASP A 1 104 ? 68.310 34.901 7.500 1.00 48.79 ? 128 ASP A CA 1
2059ATOM 750 C C . ASP A 1 104 ? 66.891 34.698 8.013 1.00 63.00 ? 128 ASP A C 1
2060ATOM 751 O O . ASP A 1 104 ? 66.476 35.338 8.984 1.00 59.59 ? 128 ASP A O 1
2061ATOM 752 C CB . ASP A 1 104 ? 69.299 34.289 8.501 1.00 63.60 ? 128 ASP A CB 1
2062ATOM 753 C CG . ASP A 1 104 ? 70.316 33.380 7.853 1.00 84.04 ? 128 ASP A CG 1
2063ATOM 754 O OD1 . ASP A 1 104 ? 70.227 33.156 6.626 1.00 85.68 ? 128 ASP A OD1 1
2064ATOM 755 O OD2 . ASP A 1 104 ? 71.209 32.893 8.586 1.00 83.76 ? 128 ASP A OD2 1
2065ATOM 756 N N . LEU A 1 105 ? 66.142 33.802 7.363 1.00 44.07 ? 129 LEU A N 1
2066ATOM 757 C CA . LEU A 1 105 ? 64.904 33.350 7.987 1.00 39.90 ? 129 LEU A CA 1
2067ATOM 758 C C . LEU A 1 105 ? 65.187 32.707 9.337 1.00 53.10 ? 129 LEU A C 1
2068ATOM 759 O O . LEU A 1 105 ? 64.344 32.756 10.238 1.00 56.32 ? 129 LEU A O 1
2069ATOM 760 C CB . LEU A 1 105 ? 64.158 32.375 7.081 1.00 53.50 ? 129 LEU A CB 1
2070ATOM 761 C CG . LEU A 1 105 ? 62.793 31.970 7.641 1.00 45.96 ? 129 LEU A CG 1
2071ATOM 762 C CD1 . LEU A 1 105 ? 61.844 33.159 7.695 1.00 47.14 ? 129 LEU A CD1 1
2072ATOM 763 C CD2 . LEU A 1 105 ? 62.188 30.837 6.847 1.00 37.35 ? 129 LEU A CD2 1
2073ATOM 764 N N . PHE A 1 106 ? 66.377 32.128 9.503 1.00 60.94 ? 130 PHE A N 1
2074ATOM 765 C CA . PHE A 1 106 ? 66.781 31.586 10.795 1.00 56.40 ? 130 PHE A CA 1
2075ATOM 766 C C . PHE A 1 106 ? 66.935 32.688 11.833 1.00 60.92 ? 130 PHE A C 1
2076ATOM 767 O O . PHE A 1 106 ? 66.338 32.626 12.913 1.00 66.58 ? 130 PHE A O 1
2077ATOM 768 C CB . PHE A 1 106 ? 68.082 30.801 10.646 1.00 63.10 ? 130 PHE A CB 1
2078ATOM 769 C CG . PHE A 1 106 ? 68.629 30.289 11.944 1.00 64.65 ? 130 PHE A CG 1
2079ATOM 770 C CD1 . PHE A 1 106 ? 68.215 29.069 12.458 1.00 64.26 ? 130 PHE A CD1 1
2080ATOM 771 C CD2 . PHE A 1 106 ? 69.556 31.037 12.659 1.00 58.50 ? 130 PHE A CD2 1
2081ATOM 772 C CE1 . PHE A 1 106 ? 68.721 28.601 13.660 1.00 64.11 ? 130 PHE A CE1 1
2082ATOM 773 C CE2 . PHE A 1 106 ? 70.064 30.579 13.857 1.00 67.28 ? 130 PHE A CE2 1
2083ATOM 774 C CZ . PHE A 1 106 ? 69.647 29.358 14.361 1.00 64.43 ? 130 PHE A CZ 1
2084ATOM 775 N N . ASP A 1 107 ? 67.779 33.684 11.543 1.00 66.41 ? 131 ASP A N 1
2085ATOM 776 C CA . ASP A 1 107 ? 67.910 34.819 12.453 1.00 69.39 ? 131 ASP A CA 1
2086ATOM 777 C C . ASP A 1 107 ? 66.567 35.501 12.656 1.00 67.19 ? 131 ASP A C 1
2087ATOM 778 O O . ASP A 1 107 ? 66.211 35.875 13.782 1.00 74.48 ? 131 ASP A O 1
2088ATOM 779 C CB . ASP A 1 107 ? 68.936 35.825 11.922 1.00 56.38 ? 131 ASP A CB 1
2089ATOM 780 C CG . ASP A 1 107 ? 70.326 35.237 11.800 1.00 68.24 ? 131 ASP A CG 1
2090ATOM 781 O OD1 . ASP A 1 107 ? 70.680 34.375 12.632 1.00 66.99 ? 131 ASP A OD1 1
2091ATOM 782 O OD2 . ASP A 1 107 ? 71.070 35.651 10.881 1.00 87.49 ? 131 ASP A OD2 1
2092ATOM 783 N N . PHE A 1 108 ? 65.806 35.658 11.573 1.00 63.21 ? 132 PHE A N 1
2093ATOM 784 C CA . PHE A 1 108 ? 64.493 36.282 11.661 1.00 62.38 ? 132 PHE A CA 1
2094ATOM 785 C C . PHE A 1 108 ? 63.608 35.558 12.665 1.00 77.60 ? 132 PHE A C 1
2095ATOM 786 O O . PHE A 1 108 ? 63.011 36.185 13.542 1.00 76.25 ? 132 PHE A O 1
2096ATOM 787 C CB . PHE A 1 108 ? 63.840 36.307 10.282 1.00 47.60 ? 132 PHE A CB 1
2097ATOM 788 C CG . PHE A 1 108 ? 62.511 36.988 10.255 1.00 59.12 ? 132 PHE A CG 1
2098ATOM 789 C CD1 . PHE A 1 108 ? 61.347 36.290 10.535 1.00 70.91 ? 132 PHE A CD1 1
2099ATOM 790 C CD2 . PHE A 1 108 ? 62.423 38.335 9.961 1.00 71.21 ? 132 PHE A CD2 1
2100ATOM 791 C CE1 . PHE A 1 108 ? 60.123 36.922 10.512 1.00 72.73 ? 132 PHE A CE1 1
2101ATOM 792 C CE2 . PHE A 1 108 ? 61.203 38.973 9.936 1.00 68.18 ? 132 PHE A CE2 1
2102ATOM 793 C CZ . PHE A 1 108 ? 60.050 38.265 10.213 1.00 72.91 ? 132 PHE A CZ 1
2103ATOM 794 N N . ILE A 1 109 ? 63.510 34.234 12.548 1.00 69.59 ? 133 ILE A N 1
2104ATOM 795 C CA . ILE A 1 109 ? 62.642 33.474 13.441 1.00 54.60 ? 133 ILE A CA 1
2105ATOM 796 C C . ILE A 1 109 ? 63.176 33.513 14.866 1.00 67.77 ? 133 ILE A C 1
2106ATOM 797 O O . ILE A 1 109 ? 62.431 33.787 15.815 1.00 82.06 ? 133 ILE A O 1
2107ATOM 798 C CB . ILE A 1 109 ? 62.481 32.030 12.932 1.00 64.36 ? 133 ILE A CB 1
2108ATOM 799 C CG1 . ILE A 1 109 ? 61.297 31.946 11.972 1.00 72.56 ? 133 ILE A CG1 1
2109ATOM 800 C CG2 . ILE A 1 109 ? 62.290 31.058 14.089 1.00 73.50 ? 133 ILE A CG2 1
2110ATOM 801 C CD1 . ILE A 1 109 ? 61.286 30.708 11.122 1.00 63.52 ? 133 ILE A CD1 1
2111ATOM 802 N N . THR A 1 110 ? 64.477 33.251 15.037 1.00 69.95 ? 134 THR A N 1
2112ATOM 803 C CA . THR A 1 110 ? 65.069 33.238 16.371 1.00 85.27 ? 134 THR A CA 1
2113ATOM 804 C C . THR A 1 110 ? 64.828 34.556 17.097 1.00 76.09 ? 134 THR A C 1
2114ATOM 805 O O . THR A 1 110 ? 64.639 34.577 18.318 1.00 75.11 ? 134 THR A O 1
2115ATOM 806 C CB . THR A 1 110 ? 66.567 32.942 16.271 1.00 78.94 ? 134 THR A CB 1
2116ATOM 807 O OG1 . THR A 1 110 ? 66.799 32.010 15.204 1.00 72.82 ? 134 THR A OG1 1
2117ATOM 808 C CG2 . THR A 1 110 ? 67.083 32.349 17.570 1.00 66.98 ? 134 THR A CG2 1
2118ATOM 809 N N . GLU A 1 111 ? 64.812 35.667 16.355 1.00 82.10 ? 135 GLU A N 1
2119ATOM 810 C CA . GLU A 1 111 ? 64.519 36.970 16.942 1.00 77.88 ? 135 GLU A CA 1
2120ATOM 811 C C . GLU A 1 111 ? 63.025 37.147 17.198 1.00 92.92 ? 135 GLU A C 1
2121ATOM 812 O O . GLU A 1 111 ? 62.601 37.401 18.332 1.00 94.16 ? 135 GLU A O 1
2122ATOM 813 C CB . GLU A 1 111 ? 65.036 38.074 16.019 1.00 73.33 ? 135 GLU A CB 1
2123ATOM 814 C CG . GLU A 1 111 ? 66.355 38.691 16.442 1.00 101.37 ? 135 GLU A CG 1
2124ATOM 815 C CD . GLU A 1 111 ? 66.791 39.798 15.501 1.00 101.57 ? 135 GLU A CD 1
2125ATOM 816 O OE1 . GLU A 1 111 ? 67.986 39.850 15.148 1.00 97.34 ? 135 GLU A OE1 1
2126ATOM 817 O OE2 . GLU A 1 111 ? 65.928 40.606 15.099 1.00 100.61 ? 135 GLU A OE2 1
2127ATOM 818 N N . ARG A 1 112 ? 62.213 37.018 16.148 1.00 82.39 ? 136 ARG A N 1
2128ATOM 819 C CA . ARG A 1 112 ? 60.790 37.330 16.172 1.00 84.31 ? 136 ARG A CA 1
2129ATOM 820 C C . ARG A 1 112 ? 59.936 36.206 16.740 1.00 86.72 ? 136 ARG A C 1
2130ATOM 821 O O . ARG A 1 112 ? 58.704 36.310 16.702 1.00 90.50 ? 136 ARG A O 1
2131ATOM 822 C CB . ARG A 1 112 ? 60.309 37.674 14.757 1.00 90.24 ? 136 ARG A CB 1
2132ATOM 823 C CG . ARG A 1 112 ? 61.189 38.676 14.006 1.00 99.09 ? 136 ARG A CG 1
2133ATOM 824 C CD . ARG A 1 112 ? 60.563 40.064 13.988 1.00 107.07 ? 136 ARG A CD 1
2134ATOM 825 N NE . ARG A 1 112 ? 59.668 40.252 12.851 1.00 110.46 ? 136 ARG A NE 1
2135ATOM 826 C CZ . ARG A 1 112 ? 58.346 40.173 12.915 1.00 123.66 ? 136 ARG A CZ 1
2136ATOM 827 N NH1 . ARG A 1 112 ? 57.728 39.835 14.036 1.00 121.46 ? 136 ARG A NH1 1
2137ATOM 828 N NH2 . ARG A 1 112 ? 57.625 40.430 11.826 1.00 109.37 ? 136 ARG A NH2 1
2138ATOM 829 N N . GLY A 1 113 ? 60.553 35.147 17.257 1.00 82.42 ? 137 GLY A N 1
2139ATOM 830 C CA . GLY A 1 113 ? 59.783 34.019 17.717 1.00 80.56 ? 137 GLY A CA 1
2140ATOM 831 C C . GLY A 1 113 ? 59.019 33.366 16.571 1.00 69.87 ? 137 GLY A C 1
2141ATOM 832 O O . GLY A 1 113 ? 59.306 33.566 15.392 1.00 66.46 ? 137 GLY A O 1
2142ATOM 833 N N . ALA A 1 114 ? 58.022 32.567 16.954 1.00 75.25 ? 138 ALA A N 1
2143ATOM 834 C CA . ALA A 1 114 ? 57.124 31.976 15.974 1.00 64.04 ? 138 ALA A CA 1
2144ATOM 835 C C . ALA A 1 114 ? 56.491 33.065 15.119 1.00 68.55 ? 138 ALA A C 1
2145ATOM 836 O O . ALA A 1 114 ? 56.305 34.203 15.558 1.00 83.91 ? 138 ALA A O 1
2146ATOM 837 C CB . ALA A 1 114 ? 56.039 31.152 16.676 1.00 71.23 ? 138 ALA A CB 1
2147ATOM 838 N N . LEU A 1 115 ? 56.171 32.712 13.882 1.00 73.74 ? 139 LEU A N 1
2148ATOM 839 C CA . LEU A 1 115 ? 55.673 33.663 12.901 1.00 56.73 ? 139 LEU A CA 1
2149ATOM 840 C C . LEU A 1 115 ? 54.158 33.562 12.807 1.00 67.14 ? 139 LEU A C 1
2150ATOM 841 O O . LEU A 1 115 ? 53.602 32.460 12.821 1.00 72.05 ? 139 LEU A O 1
2151ATOM 842 C CB . LEU A 1 115 ? 56.302 33.398 11.534 1.00 59.80 ? 139 LEU A CB 1
2152ATOM 843 C CG . LEU A 1 115 ? 57.602 34.112 11.156 1.00 70.75 ? 139 LEU A CG 1
2153ATOM 844 C CD1 . LEU A 1 115 ? 58.542 34.226 12.340 1.00 57.79 ? 139 LEU A CD1 1
2154ATOM 845 C CD2 . LEU A 1 115 ? 58.275 33.346 10.023 1.00 57.97 ? 139 LEU A CD2 1
2155ATOM 846 N N . GLN A 1 116 ? 53.493 34.715 12.734 1.00 77.26 ? 140 GLN A N 1
2156ATOM 847 C CA . GLN A 1 116 ? 52.063 34.715 12.467 1.00 75.78 ? 140 GLN A CA 1
2157ATOM 848 C C . GLN A 1 116 ? 51.788 33.931 11.194 1.00 62.65 ? 140 GLN A C 1
2158ATOM 849 O O . GLN A 1 116 ? 52.616 33.878 10.280 1.00 73.85 ? 140 GLN A O 1
2159ATOM 850 C CB . GLN A 1 116 ? 51.523 36.143 12.341 1.00 73.73 ? 140 GLN A CB 1
2160ATOM 851 C CG . GLN A 1 116 ? 52.152 37.147 13.299 1.00 84.74 ? 140 GLN A CG 1
2161ATOM 852 C CD . GLN A 1 116 ? 51.154 38.167 13.831 1.00 100.04 ? 140 GLN A CD 1
2162ATOM 853 O OE1 . GLN A 1 116 ? 50.485 38.860 13.063 1.00 90.53 ? 140 GLN A OE1 1
2163ATOM 854 N NE2 . GLN A 1 116 ? 51.058 38.268 15.154 1.00 106.74 ? 140 GLN A NE2 1
2164ATOM 855 N N . GLU A 1 117 ? 50.650 33.258 11.160 1.00 77.38 ? 141 GLU A N 1
2165ATOM 856 C CA . GLU A 1 117 ? 50.378 32.362 10.013 1.00 78.06 ? 141 GLU A CA 1
2166ATOM 857 C C . GLU A 1 117 ? 50.244 33.163 8.724 1.00 67.91 ? 141 GLU A C 1
2167ATOM 858 O O . GLU A 1 117 ? 50.440 32.575 7.671 1.00 73.53 ? 141 GLU A O 1
2168ATOM 859 C CB . GLU A 1 117 ? 49.144 31.531 10.343 1.00 71.20 ? 141 GLU A CB 1
2169ATOM 860 C CG . GLU A 1 117 ? 49.284 30.821 11.673 1.00 74.12 ? 141 GLU A CG 1
2170ATOM 861 C CD . GLU A 1 117 ? 48.291 29.700 11.881 1.00 79.89 ? 141 GLU A CD 1
2171ATOM 862 O OE1 . GLU A 1 117 ? 47.972 29.414 13.044 1.00 78.60 ? 141 GLU A OE1 1
2172ATOM 863 O OE2 . GLU A 1 117 ? 47.838 29.129 10.880 1.00 78.50 ? 141 GLU A OE2 1
2173ATOM 864 N N . GLU A 1 118 ? 49.933 34.448 8.821 1.00 65.79 ? 142 GLU A N 1
2174ATOM 865 C CA . GLU A 1 118 ? 49.850 35.310 7.619 1.00 72.24 ? 142 GLU A CA 1
2175ATOM 866 C C . GLU A 1 118 ? 51.256 35.507 7.066 1.00 68.57 ? 142 GLU A C 1
2176ATOM 867 O O . GLU A 1 118 ? 51.418 35.473 5.840 1.00 67.69 ? 142 GLU A O 1
2177ATOM 868 C CB . GLU A 1 118 ? 49.251 36.653 8.022 1.00 83.11 ? 142 GLU A CB 1
2178ATOM 869 C CG . GLU A 1 118 ? 48.569 37.396 6.894 1.00 88.47 ? 142 GLU A CG 1
2179ATOM 870 C CD . GLU A 1 118 ? 48.354 38.863 7.213 1.00 98.97 ? 142 GLU A CD 1
2180ATOM 871 O OE1 . GLU A 1 118 ? 49.353 39.559 7.461 1.00 95.65 ? 142 GLU A OE1 1
2181ATOM 872 O OE2 . GLU A 1 118 ? 47.189 39.303 7.215 1.00 98.83 ? 142 GLU A OE2 1
2182ATOM 873 N N . LEU A 1 119 ? 52.218 35.723 7.959 1.00 59.15 ? 143 LEU A N 1
2183ATOM 874 C CA . LEU A 1 119 ? 53.624 35.907 7.543 1.00 61.18 ? 143 LEU A CA 1
2184ATOM 875 C C . LEU A 1 119 ? 54.146 34.552 7.078 1.00 67.62 ? 143 LEU A C 1
2185ATOM 876 O O . LEU A 1 119 ? 54.744 34.489 5.998 1.00 58.31 ? 143 LEU A O 1
2186ATOM 877 C CB . LEU A 1 119 ? 54.422 36.418 8.742 1.00 60.91 ? 143 LEU A CB 1
2187ATOM 878 C CG . LEU A 1 119 ? 55.865 36.823 8.459 1.00 63.98 ? 143 LEU A CG 1
2188ATOM 879 C CD1 . LEU A 1 119 ? 55.936 37.760 7.270 1.00 55.52 ? 143 LEU A CD1 1
2189ATOM 880 C CD2 . LEU A 1 119 ? 56.479 37.474 9.684 1.00 73.58 ? 143 LEU A CD2 1
2190ATOM 881 N N . ALA A 1 120 ? 53.905 33.511 7.875 1.00 65.81 ? 144 ALA A N 1
2191ATOM 882 C CA . ALA A 1 120 ? 54.429 32.206 7.489 1.00 59.37 ? 144 ALA A CA 1
2192ATOM 883 C C . ALA A 1 120 ? 53.805 31.727 6.188 1.00 61.00 ? 144 ALA A C 1
2193ATOM 884 O O . ALA A 1 120 ? 54.437 30.988 5.435 1.00 58.98 ? 144 ALA A O 1
2194ATOM 885 C CB . ALA A 1 120 ? 54.189 31.189 8.605 1.00 70.29 ? 144 ALA A CB 1
2195ATOM 886 N N . ARG A 1 121 ? 52.583 32.169 5.896 1.00 61.75 ? 145 ARG A N 1
2196ATOM 887 C CA . ARG A 1 121 ? 51.925 31.824 4.643 1.00 58.69 ? 145 ARG A CA 1
2197ATOM 888 C C . ARG A 1 121 ? 52.595 32.516 3.466 1.00 65.50 ? 145 ARG A C 1
2198ATOM 889 O O . ARG A 1 121 ? 52.956 31.868 2.477 1.00 62.66 ? 145 ARG A O 1
2199ATOM 890 C CB . ARG A 1 121 ? 50.449 32.205 4.719 1.00 60.56 ? 145 ARG A CB 1
2200ATOM 891 C CG . ARG A 1 121 ? 49.630 31.794 3.515 1.00 64.31 ? 145 ARG A CG 1
2201ATOM 892 C CD . ARG A 1 121 ? 48.164 32.111 3.754 1.00 70.09 ? 145 ARG A CD 1
2202ATOM 893 N NE . ARG A 1 121 ? 47.659 31.536 4.994 1.00 65.91 ? 145 ARG A NE 1
2203ATOM 894 C CZ . ARG A 1 121 ? 47.038 32.224 5.944 1.00 85.43 ? 145 ARG A CZ 1
2204ATOM 895 N NH1 . ARG A 1 121 ? 46.931 33.544 5.883 1.00 68.26 ? 145 ARG A NH1 1
2205ATOM 896 N NH2 . ARG A 1 121 ? 46.529 31.574 6.990 1.00 68.83 ? 145 ARG A NH2 1
2206ATOM 897 N N . SER A 1 122 ? 52.745 33.842 3.545 1.00 57.68 ? 146 SER A N 1
2207ATOM 898 C CA . SER A 1 122 ? 53.500 34.556 2.518 1.00 62.17 ? 146 SER A CA 1
2208ATOM 899 C C . SER A 1 122 ? 54.864 33.908 2.294 1.00 61.66 ? 146 SER A C 1
2209ATOM 900 O O . SER A 1 122 ? 55.266 33.628 1.155 1.00 57.08 ? 146 SER A O 1
2210ATOM 901 C CB . SER A 1 122 ? 53.662 36.024 2.912 1.00 54.22 ? 146 SER A CB 1
2211ATOM 902 O OG . SER A 1 122 ? 54.101 36.803 1.810 1.00 68.49 ? 146 SER A OG 1
2212ATOM 903 N N . PHE A 1 123 ? 55.567 33.618 3.389 1.00 55.38 ? 147 PHE A N 1
2213ATOM 904 C CA . PHE A 1 123 ? 56.936 33.128 3.300 1.00 42.27 ? 147 PHE A CA 1
2214ATOM 905 C C . PHE A 1 123 ? 56.993 31.721 2.719 1.00 47.92 ? 147 PHE A C 1
2215ATOM 906 O O . PHE A 1 123 ? 57.796 31.444 1.824 1.00 52.14 ? 147 PHE A O 1
2216ATOM 907 C CB . PHE A 1 123 ? 57.578 33.173 4.684 1.00 56.34 ? 147 PHE A CB 1
2217ATOM 908 C CG . PHE A 1 123 ? 58.111 34.521 5.055 1.00 64.62 ? 147 PHE A CG 1
2218ATOM 909 C CD1 . PHE A 1 123 ? 57.877 35.618 4.235 1.00 49.43 ? 147 PHE A CD1 1
2219ATOM 910 C CD2 . PHE A 1 123 ? 58.837 34.699 6.225 1.00 49.64 ? 147 PHE A CD2 1
2220ATOM 911 C CE1 . PHE A 1 123 ? 58.361 36.864 4.567 1.00 54.23 ? 147 PHE A CE1 1
2221ATOM 912 C CE2 . PHE A 1 123 ? 59.325 35.944 6.569 1.00 52.18 ? 147 PHE A CE2 1
2222ATOM 913 C CZ . PHE A 1 123 ? 59.089 37.030 5.738 1.00 62.70 ? 147 PHE A CZ 1
2223ATOM 914 N N . PHE A 1 124 ? 56.135 30.826 3.200 1.00 48.36 ? 148 PHE A N 1
2224ATOM 915 C CA . PHE A 1 124 ? 56.097 29.437 2.686 1.00 45.78 ? 148 PHE A CA 1
2225ATOM 916 C C . PHE A 1 124 ? 55.787 29.427 1.195 1.00 56.91 ? 148 PHE A C 1
2226ATOM 917 O O . PHE A 1 124 ? 56.447 28.688 0.470 1.00 56.13 ? 148 PHE A O 1
2227ATOM 918 C CB . PHE A 1 124 ? 55.026 28.633 3.408 1.00 54.41 ? 148 PHE A CB 1
2228ATOM 919 C CG . PHE A 1 124 ? 55.202 27.145 3.313 1.00 57.75 ? 148 PHE A CG 1
2229ATOM 920 C CD1 . PHE A 1 124 ? 56.455 26.579 3.452 1.00 52.73 ? 148 PHE A CD1 1
2230ATOM 921 C CD2 . PHE A 1 124 ? 54.119 26.319 3.078 1.00 48.01 ? 148 PHE A CD2 1
2231ATOM 922 C CE1 . PHE A 1 124 ? 56.617 25.211 3.353 1.00 50.67 ? 148 PHE A CE1 1
2232ATOM 923 C CE2 . PHE A 1 124 ? 54.284 24.948 2.990 1.00 65.45 ? 148 PHE A CE2 1
2233ATOM 924 C CZ . PHE A 1 124 ? 55.533 24.396 3.130 1.00 52.75 ? 148 PHE A CZ 1
2234ATOM 925 N N . TRP A 1 125 ? 54.797 30.203 0.771 1.00 57.94 ? 149 TRP A N 1
2235ATOM 926 C CA . TRP A 1 125 ? 54.409 30.268 -0.659 1.00 53.64 ? 149 TRP A CA 1
2236ATOM 927 C C . TRP A 1 125 ? 55.603 30.700 -1.496 1.00 58.17 ? 149 TRP A C 1
2237ATOM 928 O O . TRP A 1 125 ? 55.830 30.095 -2.540 1.00 55.66 ? 149 TRP A O 1
2238ATOM 929 C CB . TRP A 1 125 ? 53.235 31.230 -0.843 1.00 58.83 ? 149 TRP A CB 1
2239ATOM 930 C CG . TRP A 1 125 ? 52.763 31.387 -2.253 1.00 56.65 ? 149 TRP A CG 1
2240ATOM 931 C CD1 . TRP A 1 125 ? 53.275 32.213 -3.209 1.00 51.50 ? 149 TRP A CD1 1
2241ATOM 932 C CD2 . TRP A 1 125 ? 51.659 30.704 -2.867 1.00 57.73 ? 149 TRP A CD2 1
2242ATOM 933 N NE1 . TRP A 1 125 ? 52.581 32.076 -4.378 1.00 77.10 ? 149 TRP A NE1 1
2243ATOM 934 C CE2 . TRP A 1 125 ? 51.580 31.162 -4.197 1.00 73.59 ? 149 TRP A CE2 1
2244ATOM 935 C CE3 . TRP A 1 125 ? 50.731 29.760 -2.424 1.00 56.42 ? 149 TRP A CE3 1
2245ATOM 936 C CZ2 . TRP A 1 125 ? 50.613 30.698 -5.085 1.00 78.02 ? 149 TRP A CZ2 1
2246ATOM 937 C CZ3 . TRP A 1 125 ? 49.777 29.302 -3.301 1.00 61.54 ? 149 TRP A CZ3 1
2247ATOM 938 C CH2 . TRP A 1 125 ? 49.722 29.764 -4.614 1.00 67.90 ? 149 TRP A CH2 1
2248ATOM 939 N N . GLN A 1 126 ? 56.302 31.734 -1.051 1.00 51.99 ? 150 GLN A N 1
2249ATOM 940 C CA . GLN A 1 126 ? 57.466 32.243 -1.805 1.00 55.30 ? 150 GLN A CA 1
2250ATOM 941 C C . GLN A 1 126 ? 58.539 31.156 -1.869 1.00 51.27 ? 150 GLN A C 1
2251ATOM 942 O O . GLN A 1 126 ? 59.123 30.983 -2.943 1.00 57.59 ? 150 GLN A O 1
2252ATOM 943 C CB . GLN A 1 126 ? 57.982 33.509 -1.135 1.00 46.70 ? 150 GLN A CB 1
2253ATOM 944 C CG . GLN A 1 126 ? 57.058 34.699 -1.286 1.00 43.43 ? 150 GLN A CG 1
2254ATOM 945 C CD . GLN A 1 126 ? 57.631 35.857 -0.516 1.00 50.68 ? 150 GLN A CD 1
2255ATOM 946 O OE1 . GLN A 1 126 ? 58.687 36.369 -0.854 1.00 64.21 ? 150 GLN A OE1 1
2256ATOM 947 N NE2 . GLN A 1 126 ? 56.944 36.270 0.534 1.00 62.07 ? 150 GLN A NE2 1
2257ATOM 948 N N . VAL A 1 127 ? 58.779 30.459 -0.762 1.00 39.73 ? 151 VAL A N 1
2258ATOM 949 C CA . VAL A 1 127 ? 59.766 29.344 -0.758 1.00 52.51 ? 151 VAL A CA 1
2259ATOM 950 C C . VAL A 1 127 ? 59.312 28.305 -1.771 1.00 51.59 ? 151 VAL A C 1
2260ATOM 951 O O . VAL A 1 127 ? 60.143 27.824 -2.529 1.00 47.91 ? 151 VAL A O 1
2261ATOM 952 C CB . VAL A 1 127 ? 59.937 28.720 0.636 1.00 49.52 ? 151 VAL A CB 1
2262ATOM 953 C CG1 . VAL A 1 127 ? 60.831 27.495 0.592 1.00 52.64 ? 151 VAL A CG1 1
2263ATOM 954 C CG2 . VAL A 1 127 ? 60.503 29.723 1.616 1.00 51.44 ? 151 VAL A CG2 1
2264ATOM 955 N N . LEU A 1 128 ? 58.023 28.009 -1.784 1.00 40.22 ? 152 LEU A N 1
2265ATOM 956 C CA . LEU A 1 128 ? 57.522 26.966 -2.696 1.00 50.09 ? 152 LEU A CA 1
2266ATOM 957 C C . LEU A 1 128 ? 57.715 27.415 -4.134 1.00 51.14 ? 152 LEU A C 1
2267ATOM 958 O O . LEU A 1 128 ? 58.234 26.622 -4.885 1.00 57.72 ? 152 LEU A O 1
2268ATOM 959 C CB . LEU A 1 128 ? 56.061 26.677 -2.380 1.00 52.29 ? 152 LEU A CB 1
2269ATOM 960 C CG . LEU A 1 128 ? 55.882 25.299 -1.773 1.00 51.24 ? 152 LEU A CG 1
2270ATOM 961 C CD1 . LEU A 1 128 ? 55.423 25.428 -0.344 1.00 56.28 ? 152 LEU A CD1 1
2271ATOM 962 C CD2 . LEU A 1 128 ? 54.938 24.461 -2.605 1.00 60.64 ? 152 LEU A CD2 1
2272ATOM 963 N N . GLU A 1 129 ? 57.376 28.657 -4.459 1.00 56.84 ? 153 GLU A N 1
2273ATOM 964 C CA . GLU A 1 129 ? 57.620 29.192 -5.820 1.00 49.52 ? 153 GLU A CA 1
2274ATOM 965 C C . GLU A 1 129 ? 59.096 29.044 -6.187 1.00 45.13 ? 153 GLU A C 1
2275ATOM 966 O O . GLU A 1 129 ? 59.368 28.723 -7.341 1.00 57.60 ? 153 GLU A O 1
2276ATOM 967 C CB . GLU A 1 129 ? 57.189 30.654 -5.886 1.00 40.23 ? 153 GLU A CB 1
2277ATOM 968 C CG . GLU A 1 129 ? 55.688 30.850 -5.813 1.00 59.74 ? 153 GLU A CG 1
2278ATOM 969 C CD . GLU A 1 129 ? 54.882 30.363 -7.004 1.00 58.49 ? 153 GLU A CD 1
2279ATOM 970 O OE1 . GLU A 1 129 ? 55.428 30.322 -8.122 1.00 59.52 ? 153 GLU A OE1 1
2280ATOM 971 O OE2 . GLU A 1 129 ? 53.702 30.040 -6.810 1.00 65.41 ? 153 GLU A OE2 1
2281ATOM 972 N N . ALA A 1 130 ? 60.001 29.274 -5.240 1.00 49.28 ? 154 ALA A N 1
2282ATOM 973 C CA . ALA A 1 130 ? 61.454 29.167 -5.487 1.00 51.64 ? 154 ALA A CA 1
2283ATOM 974 C C . ALA A 1 130 ? 61.855 27.711 -5.706 1.00 52.83 ? 154 ALA A C 1
2284ATOM 975 O O . ALA A 1 130 ? 62.552 27.448 -6.682 1.00 55.55 ? 154 ALA A O 1
2285ATOM 976 C CB . ALA A 1 130 ? 62.183 29.748 -4.316 1.00 35.98 ? 154 ALA A CB 1
2286ATOM 977 N N . VAL A 1 131 ? 61.458 26.823 -4.801 1.00 48.90 ? 155 VAL A N 1
2287ATOM 978 C CA . VAL A 1 131 ? 61.773 25.374 -4.928 1.00 50.08 ? 155 VAL A CA 1
2288ATOM 979 C C . VAL A 1 131 ? 61.168 24.894 -6.234 1.00 50.20 ? 155 VAL A C 1
2289ATOM 980 O O . VAL A 1 131 ? 61.792 24.078 -6.917 1.00 61.31 ? 155 VAL A O 1
2290ATOM 981 C CB . VAL A 1 131 ? 61.197 24.598 -3.731 1.00 66.56 ? 155 VAL A CB 1
2291ATOM 982 C CG1 . VAL A 1 131 ? 61.316 23.092 -3.892 1.00 48.28 ? 155 VAL A CG1 1
2292ATOM 983 C CG2 . VAL A 1 131 ? 61.832 25.032 -2.424 1.00 52.13 ? 155 VAL A CG2 1
2293ATOM 984 N N . ARG A 1 132 ? 60.015 25.443 -6.585 1.00 54.07 ? 156 ARG A N 1
2294ATOM 985 C CA . ARG A 1 132 ? 59.310 25.014 -7.779 1.00 62.34 ? 156 ARG A CA 1
2295ATOM 986 C C . ARG A 1 132 ? 60.020 25.503 -9.035 1.00 55.96 ? 156 ARG A C 1
2296ATOM 987 O O . ARG A 1 132 ? 60.113 24.777 -10.035 1.00 68.92 ? 156 ARG A O 1
2297ATOM 988 C CB . ARG A 1 132 ? 57.888 25.558 -7.676 1.00 49.18 ? 156 ARG A CB 1
2298ATOM 989 N N . HIS A 1 133 ? 60.529 26.735 -8.993 1.00 52.34 ? 157 HIS A N 1
2299ATOM 990 C CA . HIS A 1 133 ? 61.362 27.245 -10.073 1.00 55.45 ? 157 HIS A CA 1
2300ATOM 991 C C . HIS A 1 133 ? 62.634 26.422 -10.214 1.00 57.81 ? 157 HIS A C 1
2301ATOM 992 O O . HIS A 1 133 ? 63.053 26.103 -11.333 1.00 59.76 ? 157 HIS A O 1
2302ATOM 993 C CB . HIS A 1 133 ? 61.689 28.715 -9.814 1.00 47.49 ? 157 HIS A CB 1
2303ATOM 994 C CG . HIS A 1 133 ? 62.754 29.271 -10.706 1.00 63.02 ? 157 HIS A CG 1
2304ATOM 995 N ND1 . HIS A 1 133 ? 62.473 29.848 -11.925 1.00 61.83 ? 157 HIS A ND1 1
2305ATOM 996 C CD2 . HIS A 1 133 ? 64.096 29.358 -10.547 1.00 58.26 ? 157 HIS A CD2 1
2306ATOM 997 C CE1 . HIS A 1 133 ? 63.597 30.259 -12.484 1.00 67.86 ? 157 HIS A CE1 1
2307ATOM 998 N NE2 . HIS A 1 133 ? 64.597 29.974 -11.669 1.00 67.70 ? 157 HIS A NE2 1
2308ATOM 999 N N . CYS A 1 134 ? 63.260 26.072 -9.085 1.00 40.81 ? 158 CYS A N 1
2309ATOM 1000 C CA . CYS A 1 134 ? 64.430 25.201 -9.127 1.00 45.03 ? 158 CYS A CA 1
2310ATOM 1001 C C . CYS A 1 134 ? 64.091 23.865 -9.769 1.00 56.60 ? 158 CYS A C 1
2311ATOM 1002 O O . CYS A 1 134 ? 64.853 23.356 -10.598 1.00 56.38 ? 158 CYS A O 1
2312ATOM 1003 C CB . CYS A 1 134 ? 64.983 24.985 -7.722 1.00 49.48 ? 158 CYS A CB 1
2313ATOM 1004 S SG . CYS A 1 134 ? 65.606 26.471 -6.962 1.00 45.38 ? 158 CYS A SG 1
2314ATOM 1005 N N . HIS A 1 135 ? 62.946 23.287 -9.401 1.00 55.33 ? 159 HIS A N 1
2315ATOM 1006 C CA A HIS A 1 135 ? 62.548 22.000 -9.962 0.46 57.01 ? 159 HIS A CA 1
2316ATOM 1007 C CA B HIS A 1 135 ? 62.549 21.999 -9.958 0.54 60.01 ? 159 HIS A CA 1
2317ATOM 1008 C C . HIS A 1 135 ? 62.315 22.098 -11.462 1.00 63.63 ? 159 HIS A C 1
2318ATOM 1009 O O . HIS A 1 135 ? 62.676 21.184 -12.215 1.00 62.90 ? 159 HIS A O 1
2319ATOM 1010 C CB A HIS A 1 135 ? 61.292 21.485 -9.265 0.46 66.86 ? 159 HIS A CB 1
2320ATOM 1011 C CB B HIS A 1 135 ? 61.307 21.489 -9.215 0.54 62.07 ? 159 HIS A CB 1
2321ATOM 1012 C CG A HIS A 1 135 ? 61.556 20.864 -7.932 0.46 54.86 ? 159 HIS A CG 1
2322ATOM 1013 C CG B HIS A 1 135 ? 60.255 20.888 -10.098 0.54 67.55 ? 159 HIS A CG 1
2323ATOM 1014 N ND1 A HIS A 1 135 ? 62.259 21.512 -6.941 0.46 43.70 ? 159 HIS A ND1 1
2324ATOM 1015 N ND1 B HIS A 1 135 ? 60.112 19.527 -10.263 0.54 62.98 ? 159 HIS A ND1 1
2325ATOM 1016 C CD2 A HIS A 1 135 ? 61.221 19.654 -7.429 0.46 61.28 ? 159 HIS A CD2 1
2326ATOM 1017 C CD2 B HIS A 1 135 ? 59.273 21.461 -10.834 0.54 70.28 ? 159 HIS A CD2 1
2327ATOM 1018 C CE1 A HIS A 1 135 ? 62.337 20.731 -5.880 0.46 52.54 ? 159 HIS A CE1 1
2328ATOM 1019 C CE1 B HIS A 1 135 ? 59.103 19.288 -11.081 0.54 69.92 ? 159 HIS A CE1 1
2329ATOM 1020 N NE2 A HIS A 1 135 ? 61.713 19.598 -6.149 0.46 64.87 ? 159 HIS A NE2 1
2330ATOM 1021 N NE2 B HIS A 1 135 ? 58.577 20.445 -11.442 0.54 75.21 ? 159 HIS A NE2 1
2331ATOM 1022 N N . ASN A 1 136 ? 61.721 23.204 -11.921 1.00 52.42 ? 160 ASN A N 1
2332ATOM 1023 C CA . ASN A 1 136 ? 61.507 23.361 -13.355 1.00 64.94 ? 160 ASN A CA 1
2333ATOM 1024 C C . ASN A 1 136 ? 62.814 23.596 -14.092 1.00 56.62 ? 160 ASN A C 1
2334ATOM 1025 O O . ASN A 1 136 ? 62.959 23.193 -15.252 1.00 63.50 ? 160 ASN A O 1
2335ATOM 1026 C CB . ASN A 1 136 ? 60.538 24.503 -13.628 1.00 70.60 ? 160 ASN A CB 1
2336ATOM 1027 C CG . ASN A 1 136 ? 59.138 24.012 -13.830 1.00 89.18 ? 160 ASN A CG 1
2337ATOM 1028 O OD1 . ASN A 1 136 ? 58.480 23.605 -12.875 1.00 101.62 ? 160 ASN A OD1 1
2338ATOM 1029 N ND2 . ASN A 1 136 ? 58.682 23.999 -15.078 1.00 94.95 ? 160 ASN A ND2 1
2339ATOM 1030 N N . CYS A 1 137 ? 63.766 24.250 -13.445 1.00 52.16 ? 161 CYS A N 1
2340ATOM 1031 C CA . CYS A 1 137 ? 65.095 24.379 -14.012 1.00 51.51 ? 161 CYS A CA 1
2341ATOM 1032 C C . CYS A 1 137 ? 65.901 23.101 -13.863 1.00 54.88 ? 161 CYS A C 1
2342ATOM 1033 O O . CYS A 1 137 ? 67.078 23.083 -14.233 1.00 69.94 ? 161 CYS A O 1
2343ATOM 1034 C CB . CYS A 1 137 ? 65.822 25.549 -13.351 1.00 48.54 ? 161 CYS A CB 1
2344ATOM 1035 S SG . CYS A 1 137 ? 65.079 27.142 -13.750 1.00 69.11 ? 161 CYS A SG 1
2345ATOM 1036 N N . GLY A 1 138 ? 65.293 22.040 -13.341 1.00 54.17 ? 162 GLY A N 1
2346ATOM 1037 C CA . GLY A 1 138 ? 65.998 20.791 -13.116 1.00 43.44 ? 162 GLY A CA 1
2347ATOM 1038 C C . GLY A 1 138 ? 67.002 20.870 -11.991 1.00 47.62 ? 162 GLY A C 1
2348ATOM 1039 O O . GLY A 1 138 ? 68.091 20.293 -12.099 1.00 59.68 ? 162 GLY A O 1
2349ATOM 1040 N N . VAL A 1 139 ? 66.665 21.575 -10.914 1.00 51.58 ? 163 VAL A N 1
2350ATOM 1041 C CA . VAL A 1 139 ? 67.544 21.739 -9.765 1.00 51.55 ? 163 VAL A CA 1
2351ATOM 1042 C C . VAL A 1 139 ? 66.785 21.320 -8.517 1.00 52.89 ? 163 VAL A C 1
2352ATOM 1043 O O . VAL A 1 139 ? 65.630 21.715 -8.322 1.00 56.82 ? 163 VAL A O 1
2353ATOM 1044 C CB . VAL A 1 139 ? 68.046 23.187 -9.622 1.00 48.83 ? 163 VAL A CB 1
2354ATOM 1045 C CG1 . VAL A 1 139 ? 68.533 23.439 -8.201 1.00 49.59 ? 163 VAL A CG1 1
2355ATOM 1046 C CG2 . VAL A 1 139 ? 69.151 23.460 -10.622 1.00 45.27 ? 163 VAL A CG2 1
2356ATOM 1047 N N . LEU A 1 140 ? 67.457 20.532 -7.685 1.00 47.40 ? 164 LEU A N 1
2357ATOM 1048 C CA . LEU A 1 140 ? 66.912 20.226 -6.350 1.00 47.42 ? 164 LEU A CA 1
2358ATOM 1049 C C . LEU A 1 140 ? 67.868 20.886 -5.359 1.00 47.30 ? 164 LEU A C 1
2359ATOM 1050 O O . LEU A 1 140 ? 69.073 20.734 -5.531 1.00 50.58 ? 164 LEU A O 1
2360ATOM 1051 C CB . LEU A 1 140 ? 66.883 18.718 -6.154 1.00 51.42 ? 164 LEU A CB 1
2361ATOM 1052 C CG . LEU A 1 140 ? 66.095 18.273 -4.934 1.00 57.92 ? 164 LEU A CG 1
2362ATOM 1053 C CD1 . LEU A 1 140 ? 64.606 18.424 -5.183 1.00 50.43 ? 164 LEU A CD1 1
2363ATOM 1054 C CD2 . LEU A 1 140 ? 66.460 16.850 -4.586 1.00 77.23 ? 164 LEU A CD2 1
2364ATOM 1055 N N . HIS A 1 141 ? 67.346 21.619 -4.388 1.00 40.25 ? 165 HIS A N 1
2365ATOM 1056 C CA . HIS A 1 141 ? 68.197 22.345 -3.416 1.00 50.17 ? 165 HIS A CA 1
2366ATOM 1057 C C . HIS A 1 141 ? 68.694 21.387 -2.335 1.00 47.67 ? 165 HIS A C 1
2367ATOM 1058 O O . HIS A 1 141 ? 69.855 21.551 -1.934 1.00 39.29 ? 165 HIS A O 1
2368ATOM 1059 C CB . HIS A 1 141 ? 67.362 23.490 -2.875 1.00 44.73 ? 165 HIS A CB 1
2369ATOM 1060 C CG . HIS A 1 141 ? 68.063 24.420 -1.960 1.00 45.43 ? 165 HIS A CG 1
2370ATOM 1061 N ND1 . HIS A 1 141 ? 68.573 24.023 -0.750 1.00 43.15 ? 165 HIS A ND1 1
2371ATOM 1062 C CD2 . HIS A 1 141 ? 68.266 25.743 -2.045 1.00 50.81 ? 165 HIS A CD2 1
2372ATOM 1063 C CE1 . HIS A 1 141 ? 69.100 25.053 -0.144 1.00 44.52 ? 165 HIS A CE1 1
2373ATOM 1064 N NE2 . HIS A 1 141 ? 68.900 26.107 -0.906 1.00 51.28 ? 165 HIS A NE2 1
2374ATOM 1065 N N . ARG A 1 142 ? 67.832 20.497 -1.841 1.00 47.46 ? 166 ARG A N 1
2375ATOM 1066 C CA . ARG A 1 142 ? 68.194 19.444 -0.845 1.00 52.25 ? 166 ARG A CA 1
2376ATOM 1067 C C . ARG A 1 142 ? 68.517 20.006 0.550 1.00 44.86 ? 166 ARG A C 1
2377ATOM 1068 O O . ARG A 1 142 ? 68.606 19.200 1.466 1.00 57.80 ? 166 ARG A O 1
2378ATOM 1069 C CB . ARG A 1 142 ? 69.317 18.538 -1.364 1.00 46.74 ? 166 ARG A CB 1
2379ATOM 1070 C CG . ARG A 1 142 ? 69.168 18.089 -2.806 1.00 50.63 ? 166 ARG A CG 1
2380ATOM 1071 C CD . ARG A 1 142 ? 69.830 16.762 -3.072 1.00 56.72 ? 166 ARG A CD 1
2381ATOM 1072 N NE . ARG A 1 142 ? 71.250 16.927 -3.299 1.00 60.16 ? 166 ARG A NE 1
2382ATOM 1073 C CZ . ARG A 1 142 ? 72.122 15.936 -3.364 1.00 53.30 ? 166 ARG A CZ 1
2383ATOM 1074 N NH1 . ARG A 1 142 ? 71.716 14.688 -3.221 1.00 46.55 ? 166 ARG A NH1 1
2384ATOM 1075 N NH2 . ARG A 1 142 ? 73.396 16.199 -3.578 1.00 51.66 ? 166 ARG A NH2 1
2385ATOM 1076 N N . ASP A 1 143 ? 68.642 21.318 0.719 1.00 39.40 ? 167 ASP A N 1
2386ATOM 1077 C CA . ASP A 1 143 ? 68.886 21.884 2.069 1.00 47.14 ? 167 ASP A CA 1
2387ATOM 1078 C C . ASP A 1 143 ? 67.922 23.028 2.357 1.00 54.10 ? 167 ASP A C 1
2388ATOM 1079 O O . ASP A 1 143 ? 68.360 24.028 2.922 1.00 49.60 ? 167 ASP A O 1
2389ATOM 1080 C CB . ASP A 1 143 ? 70.345 22.288 2.258 1.00 61.60 ? 167 ASP A CB 1
2390ATOM 1081 C CG . ASP A 1 143 ? 70.888 21.939 3.630 1.00 84.53 ? 167 ASP A CG 1
2391ATOM 1082 O OD1 . ASP A 1 143 ? 70.093 21.491 4.481 1.00 76.71 ? 167 ASP A OD1 1
2392ATOM 1083 O OD2 . ASP A 1 143 ? 72.100 22.126 3.839 1.00 90.35 ? 167 ASP A OD2 1
2393ATOM 1084 N N . ILE A 1 144 ? 66.664 22.894 1.953 1.00 56.02 ? 168 ILE A N 1
2394ATOM 1085 C CA . ILE A 1 144 ? 65.658 23.875 2.331 1.00 46.05 ? 168 ILE A CA 1
2395ATOM 1086 C C . ILE A 1 144 ? 65.622 23.952 3.849 1.00 54.95 ? 168 ILE A C 1
2396ATOM 1087 O O . ILE A 1 144 ? 65.237 22.993 4.526 1.00 69.25 ? 168 ILE A O 1
2397ATOM 1088 C CB . ILE A 1 144 ? 64.278 23.516 1.755 1.00 64.15 ? 168 ILE A CB 1
2398ATOM 1089 C CG1 . ILE A 1 144 ? 64.379 23.289 0.246 1.00 37.77 ? 168 ILE A CG1 1
2399ATOM 1090 C CG2 . ILE A 1 144 ? 63.279 24.608 2.065 1.00 41.93 ? 168 ILE A CG2 1
2400ATOM 1091 C CD1 . ILE A 1 144 ? 64.967 24.477 -0.463 1.00 54.44 ? 168 ILE A CD1 1
2401ATOM 1092 N N . LYS A 1 145 ? 66.057 25.084 4.388 1.00 52.65 ? 169 LYS A N 1
2402ATOM 1093 C CA . LYS A 1 145 ? 66.082 25.320 5.822 1.00 59.42 ? 169 LYS A CA 1
2403ATOM 1094 C C . LYS A 1 145 ? 65.996 26.824 6.031 1.00 66.15 ? 169 LYS A C 1
2404ATOM 1095 O O . LYS A 1 145 ? 66.059 27.602 5.076 1.00 58.65 ? 169 LYS A O 1
2405ATOM 1096 C CB . LYS A 1 145 ? 67.338 24.717 6.473 1.00 54.02 ? 169 LYS A CB 1
2406ATOM 1097 C CG . LYS A 1 145 ? 68.643 25.285 5.939 1.00 57.26 ? 169 LYS A CG 1
2407ATOM 1098 C CD . LYS A 1 145 ? 69.793 25.111 6.927 1.00 70.90 ? 169 LYS A CD 1
2408ATOM 1099 C CE . LYS A 1 145 ? 70.799 24.078 6.449 1.00 77.86 ? 169 LYS A CE 1
2409ATOM 1100 N NZ . LYS A 1 145 ? 72.114 24.186 7.142 1.00 67.55 ? 169 LYS A NZ 1
2410ATOM 1101 N N . ASP A 1 146 ? 65.841 27.241 7.291 1.00 63.97 ? 170 ASP A N 1
2411ATOM 1102 C CA . ASP A 1 146 ? 65.676 28.669 7.540 1.00 53.68 ? 170 ASP A CA 1
2412ATOM 1103 C C . ASP A 1 146 ? 66.951 29.447 7.227 1.00 59.90 ? 170 ASP A C 1
2413ATOM 1104 O O . ASP A 1 146 ? 66.873 30.597 6.777 1.00 55.73 ? 170 ASP A O 1
2414ATOM 1105 C CB . ASP A 1 146 ? 65.235 28.930 8.983 1.00 61.66 ? 170 ASP A CB 1
2415ATOM 1106 C CG . ASP A 1 146 ? 65.920 28.025 9.990 1.00 68.20 ? 170 ASP A CG 1
2416ATOM 1107 O OD1 . ASP A 1 146 ? 66.915 27.360 9.624 1.00 70.08 ? 170 ASP A OD1 1
2417ATOM 1108 O OD2 . ASP A 1 146 ? 65.481 28.010 11.161 1.00 67.28 ? 170 ASP A OD2 1
2418ATOM 1109 N N . GLU A 1 147 ? 68.126 28.844 7.442 1.00 53.96 ? 171 GLU A N 1
2419ATOM 1110 C CA . GLU A 1 147 ? 69.379 29.537 7.152 1.00 57.27 ? 171 GLU A CA 1
2420ATOM 1111 C C . GLU A 1 147 ? 69.609 29.732 5.659 1.00 56.52 ? 171 GLU A C 1
2421ATOM 1112 O O . GLU A 1 147 ? 70.401 30.597 5.269 1.00 54.51 ? 171 GLU A O 1
2422ATOM 1113 C CB . GLU A 1 147 ? 70.567 28.777 7.741 1.00 55.14 ? 171 GLU A CB 1
2423ATOM 1114 C CG . GLU A 1 147 ? 70.534 28.642 9.252 1.00 85.17 ? 171 GLU A CG 1
2424ATOM 1115 C CD . GLU A 1 147 ? 71.063 27.304 9.725 1.00 95.01 ? 171 GLU A CD 1
2425ATOM 1116 O OE1 . GLU A 1 147 ? 70.616 26.833 10.792 1.00 97.10 ? 171 GLU A OE1 1
2426ATOM 1117 O OE2 . GLU A 1 147 ? 71.942 26.737 9.041 1.00 101.63 ? 171 GLU A OE2 1
2427ATOM 1118 N N . ASN A 1 148 ? 68.948 28.948 4.817 1.00 42.30 ? 172 ASN A N 1
2428ATOM 1119 C CA . ASN A 1 148 ? 69.158 29.017 3.383 1.00 47.41 ? 172 ASN A CA 1
2429ATOM 1120 C C . ASN A 1 148 ? 68.077 29.836 2.697 1.00 47.83 ? 172 ASN A C 1
2430ATOM 1121 O O . ASN A 1 148 ? 67.985 29.836 1.466 1.00 51.38 ? 172 ASN A O 1
2431ATOM 1122 C CB . ASN A 1 148 ? 69.243 27.603 2.816 1.00 42.85 ? 172 ASN A CB 1
2432ATOM 1123 C CG . ASN A 1 148 ? 70.583 26.953 3.115 1.00 49.36 ? 172 ASN A CG 1
2433ATOM 1124 O OD1 . ASN A 1 148 ? 71.567 27.641 3.383 1.00 57.05 ? 172 ASN A OD1 1
2434ATOM 1125 N ND2 . ASN A 1 148 ? 70.618 25.627 3.110 1.00 69.41 ? 172 ASN A ND2 1
2435ATOM 1126 N N . ILE A 1 149 ? 67.270 30.541 3.479 1.00 40.14 ? 173 ILE A N 1
2436ATOM 1127 C CA . ILE A 1 149 ? 66.273 31.479 2.988 1.00 39.97 ? 173 ILE A CA 1
2437ATOM 1128 C C . ILE A 1 149 ? 66.661 32.859 3.496 1.00 45.83 ? 173 ILE A C 1
2438ATOM 1129 O O . ILE A 1 149 ? 66.750 33.079 4.710 1.00 53.62 ? 173 ILE A O 1
2439ATOM 1130 C CB . ILE A 1 149 ? 64.865 31.100 3.462 1.00 34.71 ? 173 ILE A CB 1
2440ATOM 1131 C CG1 . ILE A 1 149 ? 64.360 29.886 2.689 1.00 47.23 ? 173 ILE A CG1 1
2441ATOM 1132 C CG2 . ILE A 1 149 ? 63.925 32.289 3.347 1.00 33.15 ? 173 ILE A CG2 1
2442ATOM 1133 C CD1 . ILE A 1 149 ? 63.548 28.929 3.522 1.00 44.68 ? 173 ILE A CD1 1
2443ATOM 1134 N N . LEU A 1 150 ? 66.907 33.782 2.577 1.00 44.04 ? 174 LEU A N 1
2444ATOM 1135 C CA . LEU A 1 150 ? 67.106 35.178 2.919 1.00 42.70 ? 174 LEU A CA 1
2445ATOM 1136 C C . LEU A 1 150 ? 65.791 35.924 2.780 1.00 54.22 ? 174 LEU A C 1
2446ATOM 1137 O O . LEU A 1 150 ? 64.916 35.546 1.996 1.00 44.12 ? 174 LEU A O 1
2447ATOM 1138 C CB . LEU A 1 150 ? 68.159 35.815 2.016 1.00 39.91 ? 174 LEU A CB 1
2448ATOM 1139 C CG . LEU A 1 150 ? 69.538 35.176 2.099 1.00 46.07 ? 174 LEU A CG 1
2449ATOM 1140 C CD1 . LEU A 1 150 ? 70.504 35.982 1.280 1.00 44.78 ? 174 LEU A CD1 1
2450ATOM 1141 C CD2 . LEU A 1 150 ? 69.998 35.090 3.543 1.00 56.75 ? 174 LEU A CD2 1
2451ATOM 1142 N N . ILE A 1 151 ? 65.664 36.997 3.548 1.00 54.97 ? 175 ILE A N 1
2452ATOM 1143 C CA . ILE A 1 151 ? 64.485 37.840 3.544 1.00 54.81 ? 175 ILE A CA 1
2453ATOM 1144 C C . ILE A 1 151 ? 64.949 39.227 3.137 1.00 67.40 ? 175 ILE A C 1
2454ATOM 1145 O O . ILE A 1 151 ? 65.661 39.897 3.902 1.00 63.23 ? 175 ILE A O 1
2455ATOM 1146 C CB . ILE A 1 151 ? 63.804 37.878 4.916 1.00 50.55 ? 175 ILE A CB 1
2456ATOM 1147 C CG1 . ILE A 1 151 ? 63.524 36.461 5.409 1.00 54.98 ? 175 ILE A CG1 1
2457ATOM 1148 C CG2 . ILE A 1 151 ? 62.505 38.662 4.839 1.00 55.94 ? 175 ILE A CG2 1
2458ATOM 1149 C CD1 . ILE A 1 151 ? 62.931 36.421 6.793 1.00 56.10 ? 175 ILE A CD1 1
2459ATOM 1150 N N . ASP A 1 152 ? 64.612 39.622 1.912 1.00 66.26 ? 176 ASP A N 1
2460ATOM 1151 C CA . ASP A 1 152 ? 64.603 41.019 1.504 1.00 64.34 ? 176 ASP A CA 1
2461ATOM 1152 C C . ASP A 1 152 ? 63.503 41.725 2.285 1.00 63.57 ? 176 ASP A C 1
2462ATOM 1153 O O . ASP A 1 152 ? 62.311 41.549 1.994 1.00 61.12 ? 176 ASP A O 1
2463ATOM 1154 C CB . ASP A 1 152 ? 64.364 41.106 0.001 1.00 66.91 ? 176 ASP A CB 1
2464ATOM 1155 C CG . ASP A 1 152 ? 64.518 42.514 -0.543 1.00 84.53 ? 176 ASP A CG 1
2465ATOM 1156 O OD1 . ASP A 1 152 ? 64.634 43.473 0.255 1.00 82.12 ? 176 ASP A OD1 1
2466ATOM 1157 O OD2 . ASP A 1 152 ? 64.488 42.653 -1.786 1.00 78.23 ? 176 ASP A OD2 1
2467ATOM 1158 N N . LEU A 1 153 ? 63.913 42.527 3.272 1.00 64.88 ? 177 LEU A N 1
2468ATOM 1159 C CA . LEU A 1 153 ? 62.998 43.079 4.264 1.00 72.86 ? 177 LEU A CA 1
2469ATOM 1160 C C . LEU A 1 153 ? 62.173 44.241 3.728 1.00 74.91 ? 177 LEU A C 1
2470ATOM 1161 O O . LEU A 1 153 ? 61.017 44.404 4.131 1.00 84.47 ? 177 LEU A O 1
2471ATOM 1162 C CB . LEU A 1 153 ? 63.785 43.524 5.499 1.00 72.79 ? 177 LEU A CB 1
2472ATOM 1163 C CG . LEU A 1 153 ? 64.560 42.435 6.249 1.00 74.05 ? 177 LEU A CG 1
2473ATOM 1164 C CD1 . LEU A 1 153 ? 65.528 43.040 7.256 1.00 70.97 ? 177 LEU A CD1 1
2474ATOM 1165 C CD2 . LEU A 1 153 ? 63.598 41.479 6.938 1.00 66.74 ? 177 LEU A CD2 1
2475ATOM 1166 N N . ASN A 1 154 ? 62.740 45.070 2.848 1.00 74.26 ? 178 ASN A N 1
2476ATOM 1167 C CA . ASN A 1 154 ? 61.962 46.168 2.283 1.00 73.01 ? 178 ASN A CA 1
2477ATOM 1168 C C . ASN A 1 154 ? 60.914 45.665 1.307 1.00 63.46 ? 178 ASN A C 1
2478ATOM 1169 O O . ASN A 1 154 ? 59.867 46.299 1.133 1.00 73.48 ? 178 ASN A O 1
2479ATOM 1170 C CB . ASN A 1 154 ? 62.879 47.169 1.588 1.00 79.34 ? 178 ASN A CB 1
2480ATOM 1171 C CG . ASN A 1 154 ? 63.697 47.974 2.561 1.00 89.91 ? 178 ASN A CG 1
2481ATOM 1172 O OD1 . ASN A 1 154 ? 63.622 47.764 3.774 1.00 86.70 ? 178 ASN A OD1 1
2482ATOM 1173 N ND2 . ASN A 1 154 ? 64.491 48.903 2.040 1.00 75.26 ? 178 ASN A ND2 1
2483ATOM 1174 N N . ARG A 1 155 ? 61.181 44.538 0.665 1.00 71.81 ? 179 ARG A N 1
2484ATOM 1175 C CA . ARG A 1 155 ? 60.316 44.011 -0.368 1.00 74.29 ? 179 ARG A CA 1
2485ATOM 1176 C C . ARG A 1 155 ? 59.574 42.758 0.069 1.00 67.70 ? 179 ARG A C 1
2486ATOM 1177 O O . ARG A 1 155 ? 58.714 42.275 -0.675 1.00 52.02 ? 179 ARG A O 1
2487ATOM 1178 C CB . ARG A 1 155 ? 61.148 43.713 -1.619 1.00 53.07 ? 179 ARG A CB 1
2488ATOM 1179 C CG . ARG A 1 155 ? 61.797 44.927 -2.229 1.00 67.66 ? 179 ARG A CG 1
2489ATOM 1180 C CD . ARG A 1 155 ? 61.793 44.827 -3.732 1.00 67.92 ? 179 ARG A CD 1
2490ATOM 1181 N NE . ARG A 1 155 ? 62.866 45.604 -4.334 1.00 75.96 ? 179 ARG A NE 1
2491ATOM 1182 C CZ . ARG A 1 155 ? 62.672 46.714 -5.030 1.00 84.43 ? 179 ARG A CZ 1
2492ATOM 1183 N NH1 . ARG A 1 155 ? 61.458 47.218 -5.193 1.00 70.68 ? 179 ARG A NH1 1
2493ATOM 1184 N NH2 . ARG A 1 155 ? 63.720 47.337 -5.569 1.00 86.66 ? 179 ARG A NH2 1
2494ATOM 1185 N N . GLY A 1 156 ? 59.876 42.229 1.252 1.00 61.55 ? 180 GLY A N 1
2495ATOM 1186 C CA . GLY A 1 156 ? 59.220 41.024 1.718 1.00 55.85 ? 180 GLY A CA 1
2496ATOM 1187 C C . GLY A 1 156 ? 59.521 39.803 0.882 1.00 51.09 ? 180 GLY A C 1
2497ATOM 1188 O O . GLY A 1 156 ? 58.732 38.854 0.880 1.00 53.33 ? 180 GLY A O 1
2498ATOM 1189 N N . GLU A 1 157 ? 60.648 39.789 0.180 1.00 55.38 ? 181 GLU A N 1
2499ATOM 1190 C CA . GLU A 1 157 ? 60.928 38.734 -0.788 1.00 58.57 ? 181 GLU A CA 1
2500ATOM 1191 C C . GLU A 1 157 ? 61.829 37.684 -0.159 1.00 52.90 ? 181 GLU A C 1
2501ATOM 1192 O O . GLU A 1 157 ? 62.935 37.997 0.288 1.00 60.33 ? 181 GLU A O 1
2502ATOM 1193 C CB . GLU A 1 157 ? 61.576 39.296 -2.051 1.00 71.82 ? 181 GLU A CB 1
2503ATOM 1194 C CG . GLU A 1 157 ? 60.933 40.558 -2.533 1.00 79.64 ? 181 GLU A CG 1
2504ATOM 1195 C CD . GLU A 1 157 ? 60.911 40.701 -4.042 1.00 86.75 ? 181 GLU A CD 1
2505ATOM 1196 O OE1 . GLU A 1 157 ? 61.793 40.133 -4.722 1.00 88.92 ? 181 GLU A OE1 1
2506ATOM 1197 O OE2 . GLU A 1 157 ? 60.028 41.426 -4.546 1.00 75.48 ? 181 GLU A OE2 1
2507ATOM 1198 N N . LEU A 1 158 ? 61.355 36.446 -0.119 1.00 42.76 ? 182 LEU A N 1
2508ATOM 1199 C CA . LEU A 1 158 ? 62.212 35.343 0.275 1.00 48.50 ? 182 LEU A CA 1
2509ATOM 1200 C C . LEU A 1 158 ? 63.045 34.905 -0.923 1.00 53.21 ? 182 LEU A C 1
2510ATOM 1201 O O . LEU A 1 158 ? 62.552 34.837 -2.054 1.00 49.17 ? 182 LEU A O 1
2511ATOM 1202 C CB . LEU A 1 158 ? 61.384 34.176 0.809 1.00 48.26 ? 182 LEU A CB 1
2512ATOM 1203 C CG . LEU A 1 158 ? 60.629 34.381 2.124 1.00 56.35 ? 182 LEU A CG 1
2513ATOM 1204 C CD1 . LEU A 1 158 ? 60.529 33.071 2.895 1.00 49.11 ? 182 LEU A CD1 1
2514ATOM 1205 C CD2 . LEU A 1 158 ? 61.261 35.465 2.977 1.00 55.33 ? 182 LEU A CD2 1
2515ATOM 1206 N N . LYS A 1 159 ? 64.318 34.617 -0.670 1.00 44.72 ? 183 LYS A N 1
2516ATOM 1207 C CA . LYS A 1 159 ? 65.271 34.272 -1.719 1.00 42.09 ? 183 LYS A CA 1
2517ATOM 1208 C C . LYS A 1 159 ? 66.107 33.089 -1.252 1.00 41.69 ? 183 LYS A C 1
2518ATOM 1209 O O . LYS A 1 159 ? 66.730 33.152 -0.190 1.00 49.84 ? 183 LYS A O 1
2519ATOM 1210 C CB . LYS A 1 159 ? 66.174 35.462 -2.049 1.00 45.23 ? 183 LYS A CB 1
2520ATOM 1211 C CG . LYS A 1 159 ? 66.124 35.957 -3.488 1.00 67.10 ? 183 LYS A CG 1
2521ATOM 1212 C CD . LYS A 1 159 ? 64.925 36.837 -3.794 1.00 58.69 ? 183 LYS A CD 1
2522ATOM 1213 C CE . LYS A 1 159 ? 64.841 37.091 -5.290 1.00 64.46 ? 183 LYS A CE 1
2523ATOM 1214 N NZ . LYS A 1 159 ? 64.087 38.327 -5.639 1.00 69.74 ? 183 LYS A NZ 1
2524ATOM 1215 N N . LEU A 1 160 ? 66.122 32.016 -2.036 1.00 45.13 ? 184 LEU A N 1
2525ATOM 1216 C CA . LEU A 1 160 ? 66.895 30.835 -1.672 1.00 47.59 ? 184 LEU A CA 1
2526ATOM 1217 C C . LEU A 1 160 ? 68.392 31.066 -1.871 1.00 40.11 ? 184 LEU A C 1
2527ATOM 1218 O O . LEU A 1 160 ? 68.818 31.780 -2.783 1.00 41.46 ? 184 LEU A O 1
2528ATOM 1219 C CB . LEU A 1 160 ? 66.441 29.641 -2.505 1.00 48.30 ? 184 LEU A CB 1
2529ATOM 1220 C CG . LEU A 1 160 ? 65.291 28.831 -1.922 1.00 45.24 ? 184 LEU A CG 1
2530ATOM 1221 C CD1 . LEU A 1 160 ? 65.093 27.542 -2.709 1.00 55.80 ? 184 LEU A CD1 1
2531ATOM 1222 C CD2 . LEU A 1 160 ? 65.571 28.526 -0.461 1.00 51.66 ? 184 LEU A CD2 1
2532ATOM 1223 N N . ILE A 1 161 ? 69.198 30.445 -1.009 1.00 42.91 ? 185 ILE A N 1
2533ATOM 1224 C CA . ILE A 1 161 ? 70.651 30.480 -1.124 1.00 49.63 ? 185 ILE A CA 1
2534ATOM 1225 C C . ILE A 1 161 ? 71.207 29.083 -0.876 1.00 55.52 ? 185 ILE A C 1
2535ATOM 1226 O O . ILE A 1 161 ? 70.478 28.145 -0.538 1.00 52.76 ? 185 ILE A O 1
2536ATOM 1227 C CB . ILE A 1 161 ? 71.313 31.486 -0.156 1.00 46.56 ? 185 ILE A CB 1
2537ATOM 1228 C CG1 . ILE A 1 161 ? 70.876 31.248 1.285 1.00 45.78 ? 185 ILE A CG1 1
2538ATOM 1229 C CG2 . ILE A 1 161 ? 71.016 32.899 -0.556 1.00 48.66 ? 185 ILE A CG2 1
2539ATOM 1230 C CD1 . ILE A 1 161 ? 71.942 31.595 2.294 1.00 40.79 ? 185 ILE A CD1 1
2540ATOM 1231 N N . ASP A 1 162 ? 72.527 28.968 -1.043 1.00 54.73 ? 186 ASP A N 1
2541ATOM 1232 C CA . ASP A 1 162 ? 73.326 27.773 -0.788 1.00 56.95 ? 186 ASP A CA 1
2542ATOM 1233 C C . ASP A 1 162 ? 72.839 26.526 -1.517 1.00 52.11 ? 186 ASP A C 1
2543ATOM 1234 O O . ASP A 1 162 ? 72.197 25.654 -0.924 1.00 54.80 ? 186 ASP A O 1
2544ATOM 1235 C CB . ASP A 1 162 ? 73.410 27.478 0.708 1.00 54.92 ? 186 ASP A CB 1
2545ATOM 1236 C CG . ASP A 1 162 ? 74.643 26.663 1.055 1.00 70.04 ? 186 ASP A CG 1
2546ATOM 1237 O OD1 . ASP A 1 162 ? 75.545 26.579 0.188 1.00 52.53 ? 186 ASP A OD1 1
2547ATOM 1238 O OD2 . ASP A 1 162 ? 74.698 26.091 2.169 1.00 77.75 ? 186 ASP A OD2 1
2548ATOM 1239 N N . PHE A 1 163 ? 73.188 26.409 -2.793 1.00 52.98 ? 187 PHE A N 1
2549ATOM 1240 C CA . PHE A 1 163 ? 72.947 25.191 -3.546 1.00 61.07 ? 187 PHE A CA 1
2550ATOM 1241 C C . PHE A 1 163 ? 74.119 24.221 -3.468 1.00 57.42 ? 187 PHE A C 1
2551ATOM 1242 O O . PHE A 1 163 ? 74.188 23.279 -4.264 1.00 61.57 ? 187 PHE A O 1
2552ATOM 1243 C CB . PHE A 1 163 ? 72.629 25.536 -4.999 1.00 58.99 ? 187 PHE A CB 1
2553ATOM 1244 C CG . PHE A 1 163 ? 71.291 26.184 -5.175 1.00 53.65 ? 187 PHE A CG 1
2554ATOM 1245 C CD1 . PHE A 1 163 ? 71.107 27.512 -4.837 1.00 58.48 ? 187 PHE A CD1 1
2555ATOM 1246 C CD2 . PHE A 1 163 ? 70.212 25.460 -5.650 1.00 60.67 ? 187 PHE A CD2 1
2556ATOM 1247 C CE1 . PHE A 1 163 ? 69.878 28.116 -4.984 1.00 56.02 ? 187 PHE A CE1 1
2557ATOM 1248 C CE2 . PHE A 1 163 ? 68.975 26.060 -5.802 1.00 57.03 ? 187 PHE A CE2 1
2558ATOM 1249 C CZ . PHE A 1 163 ? 68.809 27.391 -5.467 1.00 56.96 ? 187 PHE A CZ 1
2559ATOM 1250 N N . GLY A 1 164 ? 75.034 24.428 -2.516 1.00 56.06 ? 188 GLY A N 1
2560ATOM 1251 C CA . GLY A 1 164 ? 76.195 23.565 -2.409 1.00 55.08 ? 188 GLY A CA 1
2561ATOM 1252 C C . GLY A 1 164 ? 75.844 22.117 -2.140 1.00 60.65 ? 188 GLY A C 1
2562ATOM 1253 O O . GLY A 1 164 ? 76.578 21.212 -2.545 1.00 68.55 ? 188 GLY A O 1
2563ATOM 1254 N N . SER A 1 165 ? 74.724 21.874 -1.463 1.00 68.45 ? 189 SER A N 1
2564ATOM 1255 C CA . SER A 1 165 ? 74.269 20.523 -1.165 1.00 67.88 ? 189 SER A CA 1
2565ATOM 1256 C C . SER A 1 165 ? 73.207 20.038 -2.141 1.00 68.39 ? 189 SER A C 1
2566ATOM 1257 O O . SER A 1 165 ? 72.656 18.948 -1.954 1.00 62.92 ? 189 SER A O 1
2567ATOM 1258 C CB . SER A 1 165 ? 73.735 20.451 0.266 1.00 82.59 ? 189 SER A CB 1
2568ATOM 1259 O OG . SER A 1 165 ? 74.622 21.085 1.172 1.00 96.64 ? 189 SER A OG 1
2569ATOM 1260 N N . GLY A 1 166 ? 72.908 20.820 -3.177 1.00 57.18 ? 190 GLY A N 1
2570ATOM 1261 C CA . GLY A 1 166 ? 71.881 20.460 -4.127 1.00 59.97 ? 190 GLY A CA 1
2571ATOM 1262 C C . GLY A 1 166 ? 72.399 19.561 -5.237 1.00 72.81 ? 190 GLY A C 1
2572ATOM 1263 O O . GLY A 1 166 ? 73.555 19.138 -5.256 1.00 79.02 ? 190 GLY A O 1
2573ATOM 1264 N N . ALA A 1 167 ? 71.493 19.243 -6.162 1.00 65.58 ? 191 ALA A N 1
2574ATOM 1265 C CA . ALA A 1 167 ? 71.843 18.380 -7.308 1.00 64.61 ? 191 ALA A CA 1
2575ATOM 1266 C C . ALA A 1 167 ? 70.885 18.632 -8.466 1.00 49.45 ? 191 ALA A C 1
2576ATOM 1267 O O . ALA A 1 167 ? 69.933 19.402 -8.305 1.00 54.60 ? 191 ALA A O 1
2577ATOM 1268 C CB . ALA A 1 167 ? 71.741 16.944 -6.899 1.00 67.15 ? 191 ALA A CB 1
2578ATOM 1269 N N . LEU A 1 168 ? 71.132 17.974 -9.593 1.00 54.16 ? 192 LEU A N 1
2579ATOM 1270 C CA . LEU A 1 168 ? 70.212 18.092 -10.746 1.00 56.17 ? 192 LEU A CA 1
2580ATOM 1271 C C . LEU A 1 168 ? 69.009 17.190 -10.479 1.00 60.82 ? 192 LEU A C 1
2581ATOM 1272 O O . LEU A 1 168 ? 69.216 16.101 -9.931 1.00 55.44 ? 192 LEU A O 1
2582ATOM 1273 C CB . LEU A 1 168 ? 70.971 17.695 -12.011 1.00 53.76 ? 192 LEU A CB 1
2583ATOM 1274 C CG . LEU A 1 168 ? 72.226 18.509 -12.307 1.00 55.95 ? 192 LEU A CG 1
2584ATOM 1275 C CD1 . LEU A 1 168 ? 73.427 17.596 -12.483 1.00 76.19 ? 192 LEU A CD1 1
2585ATOM 1276 C CD2 . LEU A 1 168 ? 72.026 19.361 -13.545 1.00 76.26 ? 192 LEU A CD2 1
2586ATOM 1277 N N . LEU A 1 169 ? 67.806 17.634 -10.843 1.00 55.43 ? 193 LEU A N 1
2587ATOM 1278 C CA . LEU A 1 169 ? 66.585 16.854 -10.519 1.00 48.03 ? 193 LEU A CA 1
2588ATOM 1279 C C . LEU A 1 169 ? 66.646 15.486 -11.195 1.00 48.81 ? 193 LEU A C 1
2589ATOM 1280 O O . LEU A 1 169 ? 66.909 15.434 -12.402 1.00 68.07 ? 193 LEU A O 1
2590ATOM 1281 C CB . LEU A 1 169 ? 65.339 17.631 -10.941 1.00 51.98 ? 193 LEU A CB 1
2591ATOM 1282 C CG . LEU A 1 169 ? 64.070 17.322 -10.149 1.00 57.95 ? 193 LEU A CG 1
2592ATOM 1283 C CD1 . LEU A 1 169 ? 64.400 16.828 -8.751 1.00 64.87 ? 193 LEU A CD1 1
2593ATOM 1284 C CD2 . LEU A 1 169 ? 63.171 18.543 -10.077 1.00 67.48 ? 193 LEU A CD2 1
2594ATOM 1285 N N . LYS A 1 170 ? 66.422 14.429 -10.423 1.00 59.84 ? 194 LYS A N 1
2595ATOM 1286 C CA . LYS A 1 170 ? 66.421 13.044 -10.945 1.00 54.06 ? 194 LYS A CA 1
2596ATOM 1287 C C . LYS A 1 170 ? 65.128 12.397 -10.469 1.00 56.78 ? 194 LYS A C 1
2597ATOM 1288 O O . LYS A 1 170 ? 64.719 12.660 -9.329 1.00 65.59 ? 194 LYS A O 1
2598ATOM 1289 C CB . LYS A 1 170 ? 67.597 12.254 -10.374 1.00 53.97 ? 194 LYS A CB 1
2599ATOM 1290 C CG . LYS A 1 170 ? 68.966 12.579 -10.952 1.00 66.54 ? 194 LYS A CG 1
2600ATOM 1291 C CD . LYS A 1 170 ? 70.088 12.341 -9.965 1.00 69.65 ? 194 LYS A CD 1
2601ATOM 1292 C CE . LYS A 1 170 ? 70.257 10.886 -9.586 1.00 89.77 ? 194 LYS A CE 1
2602ATOM 1293 N NZ . LYS A 1 170 ? 69.596 10.567 -8.300 1.00 78.35 ? 194 LYS A NZ 1
2603ATOM 1294 N N . ASP A 1 171 ? 64.509 11.591 -11.320 1.00 53.50 ? 195 ASP A N 1
2604ATOM 1295 C CA . ASP A 1 171 ? 63.260 10.889 -10.934 1.00 61.94 ? 195 ASP A CA 1
2605ATOM 1296 C C . ASP A 1 171 ? 63.684 9.617 -10.204 1.00 54.29 ? 195 ASP A C 1
2606ATOM 1297 O O . ASP A 1 171 ? 62.829 8.989 -9.570 1.00 51.86 ? 195 ASP A O 1
2607ATOM 1298 C CB . ASP A 1 171 ? 62.370 10.698 -12.162 1.00 70.23 ? 195 ASP A CB 1
2608ATOM 1299 C CG . ASP A 1 171 ? 61.949 11.992 -12.829 1.00 72.85 ? 195 ASP A CG 1
2609ATOM 1300 O OD1 . ASP A 1 171 ? 62.725 12.504 -13.653 1.00 75.19 ? 195 ASP A OD1 1
2610ATOM 1301 O OD2 . ASP A 1 171 ? 60.842 12.466 -12.529 1.00 79.17 ? 195 ASP A OD2 1
2611ATOM 1302 N N . THR A 1 172 ? 64.975 9.303 -10.263 1.00 52.98 ? 196 THR A N 1
2612ATOM 1303 C CA . THR A 1 172 ? 65.538 8.120 -9.581 1.00 54.18 ? 196 THR A CA 1
2613ATOM 1304 C C . THR A 1 172 ? 65.821 8.438 -8.117 1.00 49.75 ? 196 THR A C 1
2614ATOM 1305 O O . THR A 1 172 ? 65.499 9.549 -7.675 1.00 48.65 ? 196 THR A O 1
2615ATOM 1306 C CB . THR A 1 172 ? 66.830 7.668 -10.265 1.00 56.87 ? 196 THR A CB 1
2616ATOM 1307 O OG1 . THR A 1 172 ? 67.660 8.805 -10.500 1.00 53.86 ? 196 THR A OG1 1
2617ATOM 1308 C CG2 . THR A 1 172 ? 66.574 6.952 -11.572 1.00 56.61 ? 196 THR A CG2 1
2618ATOM 1309 N N . VAL A 1 173 ? 66.434 7.500 -7.406 1.00 59.17 ? 197 VAL A N 1
2619ATOM 1310 C CA . VAL A 1 173 ? 66.664 7.683 -5.948 1.00 52.03 ? 197 VAL A CA 1
2620ATOM 1311 C C . VAL A 1 173 ? 67.976 8.413 -5.693 1.00 54.30 ? 197 VAL A C 1
2621ATOM 1312 O O . VAL A 1 173 ? 68.923 8.251 -6.478 1.00 62.84 ? 197 VAL A O 1
2622ATOM 1313 C CB . VAL A 1 173 ? 66.633 6.334 -5.208 1.00 49.35 ? 197 VAL A CB 1
2623ATOM 1314 C CG1 . VAL A 1 173 ? 67.740 5.395 -5.653 1.00 51.24 ? 197 VAL A CG1 1
2624ATOM 1315 C CG2 . VAL A 1 173 ? 66.652 6.512 -3.702 1.00 62.22 ? 197 VAL A CG2 1
2625ATOM 1316 N N . TYR A 1 174 ? 67.988 9.250 -4.668 1.00 45.84 ? 198 TYR A N 1
2626ATOM 1317 C CA . TYR A 1 174 ? 69.210 9.909 -4.238 1.00 52.08 ? 198 TYR A CA 1
2627ATOM 1318 C C . TYR A 1 174 ? 69.801 9.126 -3.078 1.00 55.11 ? 198 TYR A C 1
2628ATOM 1319 O O . TYR A 1 174 ? 69.086 8.781 -2.133 1.00 60.73 ? 198 TYR A O 1
2629ATOM 1320 C CB . TYR A 1 174 ? 68.931 11.345 -3.810 1.00 48.91 ? 198 TYR A CB 1
2630ATOM 1321 C CG . TYR A 1 174 ? 68.585 12.261 -4.948 1.00 49.91 ? 198 TYR A CG 1
2631ATOM 1322 C CD1 . TYR A 1 174 ? 67.267 12.414 -5.360 1.00 39.67 ? 198 TYR A CD1 1
2632ATOM 1323 C CD2 . TYR A 1 174 ? 69.571 12.993 -5.600 1.00 45.04 ? 198 TYR A CD2 1
2633ATOM 1324 C CE1 . TYR A 1 174 ? 66.945 13.259 -6.402 1.00 56.26 ? 198 TYR A CE1 1
2634ATOM 1325 C CE2 . TYR A 1 174 ? 69.259 13.843 -6.637 1.00 48.81 ? 198 TYR A CE2 1
2635ATOM 1326 C CZ . TYR A 1 174 ? 67.944 13.975 -7.036 1.00 59.98 ? 198 TYR A CZ 1
2636ATOM 1327 O OH . TYR A 1 174 ? 67.630 14.815 -8.084 1.00 51.36 ? 198 TYR A OH 1
2637ATOM 1328 N N . THR A 1 175 ? 71.101 8.869 -3.152 1.00 58.68 ? 199 THR A N 1
2638ATOM 1329 C CA . THR A 1 175 ? 71.765 8.049 -2.117 1.00 61.95 ? 199 THR A CA 1
2639ATOM 1330 C C . THR A 1 175 ? 72.732 8.931 -1.329 1.00 73.81 ? 199 THR A C 1
2640ATOM 1331 O O . THR A 1 175 ? 73.523 8.377 -0.555 1.00 74.70 ? 199 THR A O 1
2641ATOM 1332 C CB . THR A 1 175 ? 72.454 6.852 -2.776 1.00 55.61 ? 199 THR A CB 1
2642ATOM 1333 O OG1 . THR A 1 175 ? 73.232 7.333 -3.872 1.00 70.48 ? 199 THR A OG1 1
2643ATOM 1334 C CG2 . THR A 1 175 ? 71.472 5.810 -3.264 1.00 50.58 ? 199 THR A CG2 1
2644ATOM 1335 N N . ASP A 1 176 ? 72.647 10.250 -1.509 1.00 60.05 ? 200 ASP A N 1
2645ATOM 1336 C CA . ASP A 1 176 ? 73.566 11.189 -0.821 1.00 67.49 ? 200 ASP A CA 1
2646ATOM 1337 C C . ASP A 1 176 ? 72.770 12.341 -0.212 1.00 69.32 ? 200 ASP A C 1
2647ATOM 1338 O O . ASP A 1 176 ? 71.793 12.762 -0.832 1.00 55.00 ? 200 ASP A O 1
2648ATOM 1339 C CB . ASP A 1 176 ? 74.658 11.693 -1.767 1.00 64.18 ? 200 ASP A CB 1
2649ATOM 1340 C CG . ASP A 1 176 ? 74.168 12.596 -2.882 1.00 71.95 ? 200 ASP A CG 1
2650ATOM 1341 O OD1 . ASP A 1 176 ? 73.262 12.177 -3.625 1.00 70.95 ? 200 ASP A OD1 1
2651ATOM 1342 O OD2 . ASP A 1 176 ? 74.707 13.707 -3.000 1.00 70.80 ? 200 ASP A OD2 1
2652ATOM 1343 N N . PHE A 1 177 ? 73.185 12.814 0.963 1.00 66.17 ? 201 PHE A N 1
2653ATOM 1344 C CA . PHE A 1 177 ? 72.526 13.973 1.611 1.00 52.14 ? 201 PHE A CA 1
2654ATOM 1345 C C . PHE A 1 177 ? 73.567 14.735 2.427 1.00 56.50 ? 201 PHE A C 1
2655ATOM 1346 O O . PHE A 1 177 ? 74.341 14.097 3.146 1.00 68.91 ? 201 PHE A O 1
2656ATOM 1347 C CB . PHE A 1 177 ? 71.359 13.504 2.477 1.00 63.31 ? 201 PHE A CB 1
2657ATOM 1348 C CG . PHE A 1 177 ? 70.450 14.596 2.970 1.00 61.11 ? 201 PHE A CG 1
2658ATOM 1349 C CD1 . PHE A 1 177 ? 69.743 15.382 2.077 1.00 56.77 ? 201 PHE A CD1 1
2659ATOM 1350 C CD2 . PHE A 1 177 ? 70.299 14.835 4.324 1.00 55.65 ? 201 PHE A CD2 1
2660ATOM 1351 C CE1 . PHE A 1 177 ? 68.902 16.383 2.530 1.00 52.14 ? 201 PHE A CE1 1
2661ATOM 1352 C CE2 . PHE A 1 177 ? 69.462 15.842 4.774 1.00 70.37 ? 201 PHE A CE2 1
2662ATOM 1353 C CZ . PHE A 1 177 ? 68.764 16.613 3.877 1.00 77.52 ? 201 PHE A CZ 1
2663ATOM 1354 N N . ASP A 1 178 ? 73.586 16.060 2.298 1.00 63.99 ? 202 ASP A N 1
2664ATOM 1355 C CA . ASP A 1 178 ? 74.566 16.891 3.040 1.00 66.98 ? 202 ASP A CA 1
2665ATOM 1356 C C . ASP A 1 178 ? 73.826 17.923 3.891 1.00 72.27 ? 202 ASP A C 1
2666ATOM 1357 O O . ASP A 1 178 ? 74.466 18.899 4.305 1.00 95.71 ? 202 ASP A O 1
2667ATOM 1358 C CB . ASP A 1 178 ? 75.593 17.514 2.096 1.00 69.43 ? 202 ASP A CB 1
2668ATOM 1359 C CG . ASP A 1 178 ? 76.668 18.292 2.832 1.00 97.25 ? 202 ASP A CG 1
2669ATOM 1360 O OD1 . ASP A 1 178 ? 76.618 18.325 4.076 1.00 102.28 ? 202 ASP A OD1 1
2670ATOM 1361 O OD2 . ASP A 1 178 ? 77.540 18.866 2.154 1.00 94.86 ? 202 ASP A OD2 1
2671ATOM 1362 N N . GLY A 1 179 ? 72.539 17.706 4.154 1.00 73.68 ? 203 GLY A N 1
2672ATOM 1363 C CA . GLY A 1 179 ? 71.777 18.601 5.044 1.00 57.36 ? 203 GLY A CA 1
2673ATOM 1364 C C . GLY A 1 179 ? 71.820 18.117 6.481 1.00 85.43 ? 203 GLY A C 1
2674ATOM 1365 O O . GLY A 1 179 ? 72.311 16.998 6.711 1.00 74.65 ? 203 GLY A O 1
2675ATOM 1366 N N . THR A 1 180 ? 71.326 18.927 7.420 1.00 89.43 ? 204 THR A N 1
2676ATOM 1367 C CA . THR A 1 180 ? 71.406 18.558 8.861 1.00 87.76 ? 204 THR A CA 1
2677ATOM 1368 C C . THR A 1 180 ? 70.432 17.415 9.142 1.00 85.72 ? 204 THR A C 1
2678ATOM 1369 O O . THR A 1 180 ? 69.344 17.399 8.543 1.00 81.53 ? 204 THR A O 1
2679ATOM 1370 C CB . THR A 1 180 ? 71.196 19.778 9.769 1.00 88.20 ? 204 THR A CB 1
2680ATOM 1371 O OG1 . THR A 1 180 ? 72.283 20.675 9.545 1.00 66.47 ? 204 THR A OG1 1
2681ATOM 1372 C CG2 . THR A 1 180 ? 71.129 19.439 11.241 1.00 56.87 ? 204 THR A CG2 1
2682ATOM 1373 N N . ARG A 1 181 ? 70.819 16.507 10.031 1.00 86.73 ? 205 ARG A N 1
2683ATOM 1374 C CA . ARG A 1 181 ? 69.992 15.338 10.313 1.00 91.31 ? 205 ARG A CA 1
2684ATOM 1375 C C . ARG A 1 181 ? 68.582 15.697 10.773 1.00 98.60 ? 205 ARG A C 1
2685ATOM 1376 O O . ARG A 1 181 ? 67.678 14.870 10.627 1.00 110.08 ? 205 ARG A O 1
2686ATOM 1377 C CB . ARG A 1 181 ? 70.651 14.447 11.371 1.00 91.23 ? 205 ARG A CB 1
2687ATOM 1378 C CG . ARG A 1 181 ? 71.980 13.828 10.957 1.00 98.37 ? 205 ARG A CG 1
2688ATOM 1379 C CD . ARG A 1 181 ? 71.853 12.925 9.731 1.00 109.70 ? 205 ARG A CD 1
2689ATOM 1380 N NE . ARG A 1 181 ? 70.990 11.764 9.925 1.00 105.74 ? 205 ARG A NE 1
2690ATOM 1381 C CZ . ARG A 1 181 ? 71.376 10.619 10.472 1.00 105.88 ? 205 ARG A CZ 1
2691ATOM 1382 N NH1 . ARG A 1 181 ? 72.595 10.462 10.961 1.00 123.03 ? 205 ARG A NH1 1
2692ATOM 1383 N NH2 . ARG A 1 181 ? 70.519 9.603 10.523 1.00 95.59 ? 205 ARG A NH2 1
2693ATOM 1384 N N . VAL A 1 182 ? 68.363 16.894 11.322 1.00 88.88 ? 206 VAL A N 1
2694ATOM 1385 C CA . VAL A 1 182 ? 67.008 17.224 11.760 1.00 80.99 ? 206 VAL A CA 1
2695ATOM 1386 C C . VAL A 1 182 ? 66.110 17.532 10.565 1.00 77.53 ? 206 VAL A C 1
2696ATOM 1387 O O . VAL A 1 182 ? 64.905 17.259 10.606 1.00 79.59 ? 206 VAL A O 1
2697ATOM 1388 C CB . VAL A 1 182 ? 67.009 18.382 12.779 1.00 78.71 ? 206 VAL A CB 1
2698ATOM 1389 C CG1 . VAL A 1 182 ? 67.919 18.060 13.956 1.00 74.81 ? 206 VAL A CG1 1
2699ATOM 1390 C CG2 . VAL A 1 182 ? 67.393 19.699 12.134 1.00 66.46 ? 206 VAL A CG2 1
2700ATOM 1391 N N . TYR A 1 183 ? 66.666 18.080 9.484 1.00 81.66 ? 207 TYR A N 1
2701ATOM 1392 C CA . TYR A 1 183 ? 65.882 18.335 8.282 1.00 78.09 ? 207 TYR A CA 1
2702ATOM 1393 C C . TYR A 1 183 ? 65.810 17.127 7.360 1.00 69.85 ? 207 TYR A C 1
2703ATOM 1394 O O . TYR A 1 183 ? 65.137 17.196 6.324 1.00 60.81 ? 207 TYR A O 1
2704ATOM 1395 C CB . TYR A 1 183 ? 66.457 19.523 7.510 1.00 69.50 ? 207 TYR A CB 1
2705ATOM 1396 C CG . TYR A 1 183 ? 66.154 20.861 8.135 1.00 73.74 ? 207 TYR A CG 1
2706ATOM 1397 C CD1 . TYR A 1 183 ? 66.915 21.341 9.197 1.00 74.39 ? 207 TYR A CD1 1
2707ATOM 1398 C CD2 . TYR A 1 183 ? 65.132 21.664 7.641 1.00 75.72 ? 207 TYR A CD2 1
2708ATOM 1399 C CE1 . TYR A 1 183 ? 66.647 22.569 9.769 1.00 77.58 ? 207 TYR A CE1 1
2709ATOM 1400 C CE2 . TYR A 1 183 ? 64.855 22.896 8.210 1.00 77.67 ? 207 TYR A CE2 1
2710ATOM 1401 C CZ . TYR A 1 183 ? 65.617 23.344 9.270 1.00 78.47 ? 207 TYR A CZ 1
2711ATOM 1402 O OH . TYR A 1 183 ? 65.338 24.574 9.827 1.00 86.65 ? 207 TYR A OH 1
2712ATOM 1403 N N . SER A 1 184 ? 66.473 16.028 7.709 1.00 66.50 ? 208 SER A N 1
2713ATOM 1404 C CA . SER A 1 184 ? 66.540 14.903 6.789 1.00 69.56 ? 208 SER A CA 1
2714ATOM 1405 C C . SER A 1 184 ? 65.238 14.105 6.826 1.00 56.42 ? 208 SER A C 1
2715ATOM 1406 O O . SER A 1 184 ? 64.701 13.838 7.902 1.00 59.27 ? 208 SER A O 1
2716ATOM 1407 C CB . SER A 1 184 ? 67.714 13.987 7.129 1.00 65.09 ? 208 SER A CB 1
2717ATOM 1408 O OG . SER A 1 184 ? 67.833 13.797 8.527 1.00 72.11 ? 208 SER A OG 1
2718ATOM 1409 N N . PRO A 1 185 ? 64.722 13.703 5.666 1.00 51.93 ? 209 PRO A N 1
2719ATOM 1410 C CA . PRO A 1 185 ? 63.485 12.937 5.658 1.00 45.33 ? 209 PRO A CA 1
2720ATOM 1411 C C . PRO A 1 185 ? 63.683 11.603 6.345 1.00 53.75 ? 209 PRO A C 1
2721ATOM 1412 O O . PRO A 1 185 ? 64.809 11.070 6.394 1.00 42.38 ? 209 PRO A O 1
2722ATOM 1413 C CB . PRO A 1 185 ? 63.185 12.765 4.161 1.00 45.72 ? 209 PRO A CB 1
2723ATOM 1414 C CG . PRO A 1 185 ? 64.374 13.208 3.427 1.00 45.06 ? 209 PRO A CG 1
2724ATOM 1415 C CD . PRO A 1 185 ? 65.331 13.864 4.338 1.00 48.48 ? 209 PRO A CD 1
2725ATOM 1416 N N . PRO A 1 186 ? 62.616 11.025 6.900 1.00 49.27 ? 210 PRO A N 1
2726ATOM 1417 C CA . PRO A 1 186 ? 62.756 9.724 7.568 1.00 50.07 ? 210 PRO A CA 1
2727ATOM 1418 C C . PRO A 1 186 ? 63.267 8.639 6.649 1.00 52.11 ? 210 PRO A C 1
2728ATOM 1419 O O . PRO A 1 186 ? 63.865 7.672 7.135 1.00 49.99 ? 210 PRO A O 1
2729ATOM 1420 C CB . PRO A 1 186 ? 61.332 9.418 8.057 1.00 47.03 ? 210 PRO A CB 1
2730ATOM 1421 C CG . PRO A 1 186 ? 60.439 10.293 7.244 1.00 44.98 ? 210 PRO A CG 1
2731ATOM 1422 C CD . PRO A 1 186 ? 61.233 11.522 6.939 1.00 41.19 ? 210 PRO A CD 1
2732ATOM 1423 N N . GLU A 1 187 ? 63.057 8.770 5.335 1.00 54.87 ? 211 GLU A N 1
2733ATOM 1424 C CA . GLU A 1 187 ? 63.557 7.768 4.401 1.00 46.32 ? 211 GLU A CA 1
2734ATOM 1425 C C . GLU A 1 187 ? 65.069 7.855 4.231 1.00 44.96 ? 211 GLU A C 1
2735ATOM 1426 O O . GLU A 1 187 ? 65.721 6.823 4.058 1.00 49.05 ? 211 GLU A O 1
2736ATOM 1427 C CB . GLU A 1 187 ? 62.849 7.907 3.054 1.00 41.92 ? 211 GLU A CB 1
2737ATOM 1428 C CG . GLU A 1 187 ? 63.088 9.242 2.385 1.00 56.78 ? 211 GLU A CG 1
2738ATOM 1429 C CD . GLU A 1 187 ? 61.923 10.195 2.558 1.00 54.94 ? 211 GLU A CD 1
2739ATOM 1430 O OE1 . GLU A 1 187 ? 61.319 10.203 3.651 1.00 54.79 ? 211 GLU A OE1 1
2740ATOM 1431 O OE2 . GLU A 1 187 ? 61.622 10.950 1.610 1.00 62.68 ? 211 GLU A OE2 1
2741ATOM 1432 N N . TRP A 1 188 ? 65.652 9.056 4.299 1.00 49.45 ? 212 TRP A N 1
2742ATOM 1433 C CA . TRP A 1 188 ? 67.107 9.144 4.384 1.00 54.69 ? 212 TRP A CA 1
2743ATOM 1434 C C . TRP A 1 188 ? 67.619 8.508 5.669 1.00 60.50 ? 212 TRP A C 1
2744ATOM 1435 O O . TRP A 1 188 ? 68.667 7.853 5.673 1.00 69.62 ? 212 TRP A O 1
2745ATOM 1436 C CB . TRP A 1 188 ? 67.578 10.596 4.306 1.00 52.56 ? 212 TRP A CB 1
2746ATOM 1437 C CG . TRP A 1 188 ? 69.025 10.715 4.674 1.00 52.72 ? 212 TRP A CG 1
2747ATOM 1438 C CD1 . TRP A 1 188 ? 69.535 11.168 5.854 1.00 54.76 ? 212 TRP A CD1 1
2748ATOM 1439 C CD2 . TRP A 1 188 ? 70.150 10.328 3.874 1.00 64.73 ? 212 TRP A CD2 1
2749ATOM 1440 N NE1 . TRP A 1 188 ? 70.907 11.107 5.833 1.00 59.54 ? 212 TRP A NE1 1
2750ATOM 1441 C CE2 . TRP A 1 188 ? 71.310 10.595 4.629 1.00 60.72 ? 212 TRP A CE2 1
2751ATOM 1442 C CE3 . TRP A 1 188 ? 70.290 9.800 2.587 1.00 50.86 ? 212 TRP A CE3 1
2752ATOM 1443 C CZ2 . TRP A 1 188 ? 72.592 10.346 4.142 1.00 60.51 ? 212 TRP A CZ2 1
2753ATOM 1444 C CZ3 . TRP A 1 188 ? 71.563 9.551 2.106 1.00 60.46 ? 212 TRP A CZ3 1
2754ATOM 1445 C CH2 . TRP A 1 188 ? 72.697 9.825 2.881 1.00 72.24 ? 212 TRP A CH2 1
2755ATOM 1446 N N . ILE A 1 189 ? 66.897 8.698 6.773 1.00 52.12 ? 213 ILE A N 1
2756ATOM 1447 C CA . ILE A 1 189 ? 67.351 8.167 8.053 1.00 59.18 ? 213 ILE A CA 1
2757ATOM 1448 C C . ILE A 1 189 ? 67.342 6.644 8.035 1.00 54.53 ? 213 ILE A C 1
2758ATOM 1449 O O . ILE A 1 189 ? 68.334 5.999 8.393 1.00 68.44 ? 213 ILE A O 1
2759ATOM 1450 C CB . ILE A 1 189 ? 66.496 8.732 9.201 1.00 65.16 ? 213 ILE A CB 1
2760ATOM 1451 C CG1 . ILE A 1 189 ? 66.590 10.262 9.221 1.00 59.51 ? 213 ILE A CG1 1
2761ATOM 1452 C CG2 . ILE A 1 189 ? 66.918 8.125 10.531 1.00 63.36 ? 213 ILE A CG2 1
2762ATOM 1453 C CD1 . ILE A 1 189 ? 66.397 10.873 10.591 1.00 81.62 ? 213 ILE A CD1 1
2763ATOM 1454 N N . ARG A 1 190 ? 66.232 6.045 7.601 1.00 59.20 ? 214 ARG A N 1
2764ATOM 1455 C CA . ARG A 1 190 ? 66.118 4.589 7.646 1.00 63.46 ? 214 ARG A CA 1
2765ATOM 1456 C C . ARG A 1 190 ? 66.906 3.926 6.518 1.00 68.05 ? 214 ARG A C 1
2766ATOM 1457 O O . ARG A 1 190 ? 67.647 2.963 6.752 1.00 70.47 ? 214 ARG A O 1
2767ATOM 1458 C CB . ARG A 1 190 ? 64.644 4.173 7.602 1.00 54.53 ? 214 ARG A CB 1
2768ATOM 1459 C CG . ARG A 1 190 ? 63.771 4.936 8.590 1.00 62.44 ? 214 ARG A CG 1
2769ATOM 1460 C CD . ARG A 1 190 ? 62.693 4.089 9.273 1.00 78.31 ? 214 ARG A CD 1
2770ATOM 1461 N NE . ARG A 1 190 ? 61.691 3.551 8.360 1.00 82.33 ? 214 ARG A NE 1
2771ATOM 1462 C CZ . ARG A 1 190 ? 61.720 2.330 7.839 1.00 96.57 ? 214 ARG A CZ 1
2772ATOM 1463 N NH1 . ARG A 1 190 ? 62.662 1.456 8.167 1.00 95.77 ? 214 ARG A NH1 1
2773ATOM 1464 N NH2 . ARG A 1 190 ? 60.761 1.965 6.989 1.00 96.19 ? 214 ARG A NH2 1
2774ATOM 1465 N N . TYR A 1 191 ? 66.770 4.430 5.288 1.00 62.25 ? 215 TYR A N 1
2775ATOM 1466 C CA . TYR A 1 191 ? 67.302 3.754 4.111 1.00 57.29 ? 215 TYR A CA 1
2776ATOM 1467 C C . TYR A 1 191 ? 68.505 4.445 3.483 1.00 59.99 ? 215 TYR A C 1
2777ATOM 1468 O O . TYR A 1 191 ? 69.165 3.838 2.632 1.00 60.16 ? 215 TYR A O 1
2778ATOM 1469 C CB . TYR A 1 191 ? 66.208 3.617 3.040 1.00 54.21 ? 215 TYR A CB 1
2779ATOM 1470 C CG . TYR A 1 191 ? 64.955 2.884 3.472 1.00 76.11 ? 215 TYR A CG 1
2780ATOM 1471 C CD1 . TYR A 1 191 ? 64.936 2.091 4.615 1.00 86.83 ? 215 TYR A CD1 1
2781ATOM 1472 C CD2 . TYR A 1 191 ? 63.787 2.984 2.729 1.00 90.76 ? 215 TYR A CD2 1
2782ATOM 1473 C CE1 . TYR A 1 191 ? 63.787 1.423 5.003 1.00 87.48 ? 215 TYR A CE1 1
2783ATOM 1474 C CE2 . TYR A 1 191 ? 62.637 2.320 3.106 1.00 101.31 ? 215 TYR A CE2 1
2784ATOM 1475 C CZ . TYR A 1 191 ? 62.641 1.541 4.244 1.00 100.68 ? 215 TYR A CZ 1
2785ATOM 1476 O OH . TYR A 1 191 ? 61.495 0.877 4.626 1.00 105.91 ? 215 TYR A OH 1
2786ATOM 1477 N N . HIS A 1 192 ? 68.804 5.687 3.866 1.00 57.79 ? 216 HIS A N 1
2787ATOM 1478 C CA . HIS A 1 192 ? 69.796 6.514 3.172 1.00 56.19 ? 216 HIS A CA 1
2788ATOM 1479 C C . HIS A 1 192 ? 69.517 6.554 1.675 1.00 65.00 ? 216 HIS A C 1
2789ATOM 1480 O O . HIS A 1 192 ? 70.427 6.620 0.846 1.00 68.54 ? 216 HIS A O 1
2790ATOM 1481 C CB . HIS A 1 192 ? 71.224 6.061 3.479 1.00 61.66 ? 216 HIS A CB 1
2791ATOM 1482 C CG . HIS A 1 192 ? 71.572 6.173 4.931 1.00 82.41 ? 216 HIS A CG 1
2792ATOM 1483 N ND1 . HIS A 1 192 ? 72.176 7.291 5.465 1.00 79.75 ? 216 HIS A ND1 1
2793ATOM 1484 C CD2 . HIS A 1 192 ? 71.365 5.324 5.966 1.00 70.17 ? 216 HIS A CD2 1
2794ATOM 1485 C CE1 . HIS A 1 192 ? 72.338 7.122 6.765 1.00 81.49 ? 216 HIS A CE1 1
2795ATOM 1486 N NE2 . HIS A 1 192 ? 71.855 5.937 7.094 1.00 97.31 ? 216 HIS A NE2 1
2796ATOM 1487 N N . ARG A 1 193 ? 68.231 6.516 1.346 1.00 67.91 ? 217 ARG A N 1
2797ATOM 1488 C CA . ARG A 1 193 ? 67.706 6.661 0.002 1.00 53.15 ? 217 ARG A CA 1
2798ATOM 1489 C C . ARG A 1 193 ? 66.513 7.597 0.096 1.00 53.43 ? 217 ARG A C 1
2799ATOM 1490 O O . ARG A 1 193 ? 65.758 7.542 1.071 1.00 57.56 ? 217 ARG A O 1
2800ATOM 1491 C CB . ARG A 1 193 ? 67.287 5.301 -0.585 1.00 52.70 ? 217 ARG A CB 1
2801ATOM 1492 C CG . ARG A 1 193 ? 68.426 4.292 -0.702 1.00 67.13 ? 217 ARG A CG 1
2802ATOM 1493 C CD . ARG A 1 193 ? 67.961 2.946 -1.255 1.00 55.95 ? 217 ARG A CD 1
2803ATOM 1494 N NE . ARG A 1 193 ? 66.837 3.059 -2.178 1.00 72.25 ? 217 ARG A NE 1
2804ATOM 1495 C CZ . ARG A 1 193 ? 66.910 2.815 -3.482 1.00 85.88 ? 217 ARG A CZ 1
2805ATOM 1496 N NH1 . ARG A 1 193 ? 68.044 2.442 -4.055 1.00 77.46 ? 217 ARG A NH1 1
2806ATOM 1497 N NH2 . ARG A 1 193 ? 65.813 2.935 -4.229 1.00 79.99 ? 217 ARG A NH2 1
2807ATOM 1498 N N . TYR A 1 194 ? 66.356 8.470 -0.893 1.00 62.95 ? 218 TYR A N 1
2808ATOM 1499 C CA . TYR A 1 194 ? 65.202 9.357 -0.925 1.00 49.52 ? 218 TYR A CA 1
2809ATOM 1500 C C . TYR A 1 194 ? 64.983 9.827 -2.352 1.00 53.14 ? 218 TYR A C 1
2810ATOM 1501 O O . TYR A 1 194 ? 65.829 9.645 -3.231 1.00 51.03 ? 218 TYR A O 1
2811ATOM 1502 C CB . TYR A 1 194 ? 65.373 10.557 0.003 1.00 45.98 ? 218 TYR A CB 1
2812ATOM 1503 C CG . TYR A 1 194 ? 66.500 11.476 -0.388 1.00 50.13 ? 218 TYR A CG 1
2813ATOM 1504 C CD1 . TYR A 1 194 ? 67.809 11.190 -0.027 1.00 50.56 ? 218 TYR A CD1 1
2814ATOM 1505 C CD2 . TYR A 1 194 ? 66.257 12.627 -1.125 1.00 41.73 ? 218 TYR A CD2 1
2815ATOM 1506 C CE1 . TYR A 1 194 ? 68.843 12.028 -0.381 1.00 52.23 ? 218 TYR A CE1 1
2816ATOM 1507 C CE2 . TYR A 1 194 ? 67.285 13.473 -1.485 1.00 52.20 ? 218 TYR A CE2 1
2817ATOM 1508 C CZ . TYR A 1 194 ? 68.579 13.168 -1.108 1.00 60.08 ? 218 TYR A CZ 1
2818ATOM 1509 O OH . TYR A 1 194 ? 69.619 13.992 -1.462 1.00 52.08 ? 218 TYR A OH 1
2819ATOM 1510 N N . HIS A 1 195 ? 63.837 10.456 -2.564 1.00 51.96 ? 219 HIS A N 1
2820ATOM 1511 C CA . HIS A 1 195 ? 63.476 10.991 -3.863 1.00 46.24 ? 219 HIS A CA 1
2821ATOM 1512 C C . HIS A 1 195 ? 63.339 12.500 -3.762 1.00 38.74 ? 219 HIS A C 1
2822ATOM 1513 O O . HIS A 1 195 ? 62.734 13.007 -2.815 1.00 48.79 ? 219 HIS A O 1
2823ATOM 1514 C CB . HIS A 1 195 ? 62.189 10.348 -4.362 1.00 56.42 ? 219 HIS A CB 1
2824ATOM 1515 C CG . HIS A 1 195 ? 62.378 8.929 -4.787 1.00 53.15 ? 219 HIS A CG 1
2825ATOM 1516 N ND1 . HIS A 1 195 ? 62.675 8.578 -6.085 1.00 56.62 ? 219 HIS A ND1 1
2826ATOM 1517 C CD2 . HIS A 1 195 ? 62.365 7.777 -4.076 1.00 47.09 ? 219 HIS A CD2 1
2827ATOM 1518 C CE1 . HIS A 1 195 ? 62.806 7.266 -6.160 1.00 59.68 ? 219 HIS A CE1 1
2828ATOM 1519 N NE2 . HIS A 1 195 ? 62.623 6.757 -4.956 1.00 60.17 ? 219 HIS A NE2 1
2829ATOM 1520 N N . GLY A 1 196 ? 63.915 13.199 -4.735 1.00 48.69 ? 220 GLY A N 1
2830ATOM 1521 C CA . GLY A 1 196 ? 64.015 14.640 -4.740 1.00 37.30 ? 220 GLY A CA 1
2831ATOM 1522 C C . GLY A 1 196 ? 62.785 15.398 -4.291 1.00 50.88 ? 220 GLY A C 1
2832ATOM 1523 O O . GLY A 1 196 ? 62.809 16.077 -3.260 1.00 43.30 ? 220 GLY A O 1
2833ATOM 1524 N N . ARG A 1 197 ? 61.698 15.275 -5.054 1.00 60.01 ? 221 ARG A N 1
2834ATOM 1525 C CA . ARG A 1 197 ? 60.492 16.047 -4.769 1.00 63.29 ? 221 ARG A CA 1
2835ATOM 1526 C C . ARG A 1 197 ? 59.937 15.736 -3.382 1.00 56.04 ? 221 ARG A C 1
2836ATOM 1527 O O . ARG A 1 197 ? 59.626 16.649 -2.609 1.00 51.75 ? 221 ARG A O 1
2837ATOM 1528 C CB . ARG A 1 197 ? 59.440 15.786 -5.849 1.00 54.53 ? 221 ARG A CB 1
2838ATOM 1529 C CG . ARG A 1 197 ? 59.836 16.293 -7.226 1.00 68.58 ? 221 ARG A CG 1
2839ATOM 1530 C CD . ARG A 1 197 ? 59.375 15.363 -8.324 1.00 88.43 ? 221 ARG A CD 1
2840ATOM 1531 N NE . ARG A 1 197 ? 60.255 15.443 -9.482 1.00 86.21 ? 221 ARG A NE 1
2841ATOM 1532 C CZ . ARG A 1 197 ? 59.931 15.025 -10.698 1.00 113.80 ? 221 ARG A CZ 1
2842ATOM 1533 N NH1 . ARG A 1 197 ? 58.759 14.461 -10.944 1.00 124.69 ? 221 ARG A NH1 1
2843ATOM 1534 N NH2 . ARG A 1 197 ? 60.808 15.168 -11.689 1.00 107.49 ? 221 ARG A NH2 1
2844ATOM 1535 N N . SER A 1 198 ? 59.794 14.451 -3.052 1.00 49.99 ? 222 SER A N 1
2845ATOM 1536 C CA . SER A 1 198 ? 59.179 14.092 -1.781 1.00 42.09 ? 222 SER A CA 1
2846ATOM 1537 C C . SER A 1 198 ? 60.039 14.523 -0.597 1.00 48.07 ? 222 SER A C 1
2847ATOM 1538 O O . SER A 1 198 ? 59.506 14.974 0.424 1.00 65.01 ? 222 SER A O 1
2848ATOM 1539 C CB . SER A 1 198 ? 58.898 12.587 -1.745 1.00 48.29 ? 222 SER A CB 1
2849ATOM 1540 O OG . SER A 1 198 ? 60.019 11.837 -2.190 1.00 54.18 ? 222 SER A OG 1
2850ATOM 1541 N N . ALA A 1 199 ? 61.365 14.424 -0.716 1.00 39.09 ? 223 ALA A N 1
2851ATOM 1542 C CA . ALA A 1 199 ? 62.228 14.902 0.359 1.00 43.77 ? 223 ALA A CA 1
2852ATOM 1543 C C . ALA A 1 199 ? 62.205 16.422 0.463 1.00 42.20 ? 223 ALA A C 1
2853ATOM 1544 O O . ALA A 1 199 ? 62.292 16.977 1.566 1.00 36.13 ? 223 ALA A O 1
2854ATOM 1545 C CB . ALA A 1 199 ? 63.656 14.406 0.143 1.00 34.71 ? 223 ALA A CB 1
2855ATOM 1546 N N . ALA A 1 200 ? 62.087 17.113 -0.670 1.00 42.87 ? 224 ALA A N 1
2856ATOM 1547 C CA . ALA A 1 200 ? 61.928 18.560 -0.632 1.00 46.86 ? 224 ALA A CA 1
2857ATOM 1548 C C . ALA A 1 200 ? 60.629 18.939 0.064 1.00 48.97 ? 224 ALA A C 1
2858ATOM 1549 O O . ALA A 1 200 ? 60.576 19.920 0.811 1.00 43.18 ? 224 ALA A O 1
2859ATOM 1550 C CB . ALA A 1 200 ? 61.975 19.127 -2.051 1.00 41.39 ? 224 ALA A CB 1
2860ATOM 1551 N N . VAL A 1 201 ? 59.572 18.156 -0.154 1.00 38.93 ? 225 VAL A N 1
2861ATOM 1552 C CA . VAL A 1 201 ? 58.303 18.419 0.517 1.00 50.01 ? 225 VAL A CA 1
2862ATOM 1553 C C . VAL A 1 201 ? 58.444 18.171 2.010 1.00 46.23 ? 225 VAL A C 1
2863ATOM 1554 O O . VAL A 1 201 ? 57.880 18.897 2.839 1.00 45.91 ? 225 VAL A O 1
2864ATOM 1555 C CB . VAL A 1 201 ? 57.182 17.561 -0.102 1.00 45.80 ? 225 VAL A CB 1
2865ATOM 1556 C CG1 . VAL A 1 201 ? 55.947 17.574 0.784 1.00 49.69 ? 225 VAL A CG1 1
2866ATOM 1557 C CG2 . VAL A 1 201 ? 56.848 18.050 -1.500 1.00 37.67 ? 225 VAL A CG2 1
2867ATOM 1558 N N . TRP A 1 202 ? 59.201 17.138 2.375 1.00 44.17 ? 226 TRP A N 1
2868ATOM 1559 C CA . TRP A 1 202 ? 59.491 16.900 3.782 1.00 39.98 ? 226 TRP A CA 1
2869ATOM 1560 C C . TRP A 1 202 ? 60.183 18.105 4.409 1.00 40.00 ? 226 TRP A C 1
2870ATOM 1561 O O . TRP A 1 202 ? 59.814 18.557 5.501 1.00 35.96 ? 226 TRP A O 1
2871ATOM 1562 C CB . TRP A 1 202 ? 60.359 15.656 3.934 1.00 42.80 ? 226 TRP A CB 1
2872ATOM 1563 C CG . TRP A 1 202 ? 60.865 15.524 5.320 1.00 53.09 ? 226 TRP A CG 1
2873ATOM 1564 C CD1 . TRP A 1 202 ? 62.018 16.055 5.844 1.00 34.33 ? 226 TRP A CD1 1
2874ATOM 1565 C CD2 . TRP A 1 202 ? 60.201 14.864 6.395 1.00 46.16 ? 226 TRP A CD2 1
2875ATOM 1566 N NE1 . TRP A 1 202 ? 62.118 15.729 7.173 1.00 39.29 ? 226 TRP A NE1 1
2876ATOM 1567 C CE2 . TRP A 1 202 ? 61.014 14.999 7.536 1.00 38.09 ? 226 TRP A CE2 1
2877ATOM 1568 C CE3 . TRP A 1 202 ? 59.004 14.152 6.499 1.00 44.23 ? 226 TRP A CE3 1
2878ATOM 1569 C CZ2 . TRP A 1 202 ? 60.665 14.450 8.766 1.00 57.00 ? 226 TRP A CZ2 1
2879ATOM 1570 C CZ3 . TRP A 1 202 ? 58.661 13.604 7.716 1.00 42.14 ? 226 TRP A CZ3 1
2880ATOM 1571 C CH2 . TRP A 1 202 ? 59.485 13.758 8.836 1.00 53.29 ? 226 TRP A CH2 1
2881ATOM 1572 N N . SER A 1 203 ? 61.225 18.612 3.748 1.00 38.27 ? 227 SER A N 1
2882ATOM 1573 C CA . SER A 1 203 ? 61.926 19.773 4.283 1.00 42.84 ? 227 SER A CA 1
2883ATOM 1574 C C . SER A 1 203 ? 61.028 21.002 4.294 1.00 40.95 ? 227 SER A C 1
2884ATOM 1575 O O . SER A 1 203 ? 61.173 21.865 5.161 1.00 40.67 ? 227 SER A O 1
2885ATOM 1576 C CB . SER A 1 203 ? 63.200 20.043 3.487 1.00 40.10 ? 227 SER A CB 1
2886ATOM 1577 O OG . SER A 1 203 ? 62.914 20.738 2.292 1.00 51.75 ? 227 SER A OG 1
2887ATOM 1578 N N . LEU A 1 204 ? 60.089 21.092 3.356 1.00 36.38 ? 228 LEU A N 1
2888ATOM 1579 C CA . LEU A 1 204 ? 59.109 22.171 3.389 1.00 47.37 ? 228 LEU A CA 1
2889ATOM 1580 C C . LEU A 1 204 ? 58.199 22.048 4.601 1.00 50.97 ? 228 LEU A C 1
2890ATOM 1581 O O . LEU A 1 204 ? 57.804 23.055 5.194 1.00 49.67 ? 228 LEU A O 1
2891ATOM 1582 C CB . LEU A 1 204 ? 58.300 22.176 2.096 1.00 38.63 ? 228 LEU A CB 1
2892ATOM 1583 C CG . LEU A 1 204 ? 59.149 22.648 0.919 1.00 45.23 ? 228 LEU A CG 1
2893ATOM 1584 C CD1 . LEU A 1 204 ? 58.399 22.583 -0.397 1.00 34.35 ? 228 LEU A CD1 1
2894ATOM 1585 C CD2 . LEU A 1 204 ? 59.638 24.065 1.203 1.00 45.51 ? 228 LEU A CD2 1
2895ATOM 1586 N N . GLY A 1 205 ? 57.865 20.820 4.992 1.00 44.98 ? 229 GLY A N 1
2896ATOM 1587 C CA . GLY A 1 205 ? 57.099 20.634 6.213 1.00 44.72 ? 229 GLY A CA 1
2897ATOM 1588 C C . GLY A 1 205 ? 57.883 21.023 7.452 1.00 42.29 ? 229 GLY A C 1
2898ATOM 1589 O O . GLY A 1 205 ? 57.351 21.679 8.353 1.00 57.32 ? 229 GLY A O 1
2899ATOM 1590 N N . ILE A 1 206 ? 59.152 20.610 7.519 1.00 47.28 ? 230 ILE A N 1
2900ATOM 1591 C CA . ILE A 1 206 ? 60.024 21.045 8.612 1.00 45.95 ? 230 ILE A CA 1
2901ATOM 1592 C C . ILE A 1 206 ? 60.108 22.567 8.648 1.00 47.29 ? 230 ILE A C 1
2902ATOM 1593 O O . ILE A 1 206 ? 60.052 23.187 9.719 1.00 53.25 ? 230 ILE A O 1
2903ATOM 1594 C CB . ILE A 1 206 ? 61.420 20.410 8.475 1.00 34.43 ? 230 ILE A CB 1
2904ATOM 1595 C CG1 . ILE A 1 206 ? 61.318 18.885 8.442 1.00 55.34 ? 230 ILE A CG1 1
2905ATOM 1596 C CG2 . ILE A 1 206 ? 62.328 20.879 9.580 1.00 34.81 ? 230 ILE A CG2 1
2906ATOM 1597 C CD1 . ILE A 1 206 ? 61.280 18.233 9.801 1.00 42.16 ? 230 ILE A CD1 1
2907ATOM 1598 N N . LEU A 1 207 ? 60.227 23.189 7.474 1.00 39.61 ? 231 LEU A N 1
2908ATOM 1599 C CA . LEU A 1 207 ? 60.360 24.637 7.386 1.00 46.39 ? 231 LEU A CA 1
2909ATOM 1600 C C . LEU A 1 207 ? 59.082 25.343 7.816 1.00 58.58 ? 231 LEU A C 1
2910ATOM 1601 O O . LEU A 1 207 ? 59.133 26.359 8.517 1.00 50.06 ? 231 LEU A O 1
2911ATOM 1602 C CB . LEU A 1 207 ? 60.730 25.028 5.958 1.00 37.36 ? 231 LEU A CB 1
2912ATOM 1603 C CG . LEU A 1 207 ? 60.745 26.530 5.702 1.00 47.52 ? 231 LEU A CG 1
2913ATOM 1604 C CD1 . LEU A 1 207 ? 61.938 27.162 6.394 1.00 48.31 ? 231 LEU A CD1 1
2914ATOM 1605 C CD2 . LEU A 1 207 ? 60.746 26.819 4.210 1.00 46.03 ? 231 LEU A CD2 1
2915ATOM 1606 N N . LEU A 1 208 ? 57.926 24.826 7.398 1.00 50.48 ? 232 LEU A N 1
2916ATOM 1607 C CA . LEU A 1 208 ? 56.666 25.431 7.803 1.00 43.12 ? 232 LEU A CA 1
2917ATOM 1608 C C . LEU A 1 208 ? 56.458 25.287 9.302 1.00 58.31 ? 232 LEU A C 1
2918ATOM 1609 O O . LEU A 1 208 ? 55.980 26.220 9.960 1.00 61.58 ? 232 LEU A O 1
2919ATOM 1610 C CB . LEU A 1 208 ? 55.507 24.805 7.031 1.00 49.12 ? 232 LEU A CB 1
2920ATOM 1611 C CG . LEU A 1 208 ? 54.161 25.475 7.311 1.00 56.69 ? 232 LEU A CG 1
2921ATOM 1612 C CD1 . LEU A 1 208 ? 54.298 26.991 7.205 1.00 54.42 ? 232 LEU A CD1 1
2922ATOM 1613 C CD2 . LEU A 1 208 ? 53.081 24.963 6.376 1.00 49.78 ? 232 LEU A CD2 1
2923ATOM 1614 N N . TYR A 1 209 ? 56.809 24.125 9.861 1.00 56.87 ? 233 TYR A N 1
2924ATOM 1615 C CA . TYR A 1 209 ? 56.748 23.969 11.308 1.00 52.13 ? 233 TYR A CA 1
2925ATOM 1616 C C . TYR A 1 209 ? 57.625 25.004 11.991 1.00 58.71 ? 233 TYR A C 1
2926ATOM 1617 O O . TYR A 1 209 ? 57.187 25.688 12.920 1.00 58.70 ? 233 TYR A O 1
2927ATOM 1618 C CB . TYR A 1 209 ? 57.166 22.557 11.719 1.00 57.37 ? 233 TYR A CB 1
2928ATOM 1619 C CG . TYR A 1 209 ? 56.982 22.318 13.199 1.00 49.22 ? 233 TYR A CG 1
2929ATOM 1620 C CD1 . TYR A 1 209 ? 57.953 22.714 14.112 1.00 52.83 ? 233 TYR A CD1 1
2930ATOM 1621 C CD2 . TYR A 1 209 ? 55.832 21.720 13.687 1.00 54.60 ? 233 TYR A CD2 1
2931ATOM 1622 C CE1 . TYR A 1 209 ? 57.790 22.521 15.467 1.00 64.55 ? 233 TYR A CE1 1
2932ATOM 1623 C CE2 . TYR A 1 209 ? 55.658 21.515 15.049 1.00 75.33 ? 233 TYR A CE2 1
2933ATOM 1624 C CZ . TYR A 1 209 ? 56.643 21.916 15.933 1.00 75.33 ? 233 TYR A CZ 1
2934ATOM 1625 O OH . TYR A 1 209 ? 56.479 21.717 17.285 1.00 81.59 ? 233 TYR A OH 1
2935ATOM 1626 N N . ASP A 1 210 ? 58.876 25.119 11.542 1.00 62.70 ? 234 ASP A N 1
2936ATOM 1627 C CA . ASP A 1 210 ? 59.790 26.108 12.097 1.00 50.60 ? 234 ASP A CA 1
2937ATOM 1628 C C . ASP A 1 210 ? 59.186 27.504 12.038 1.00 53.98 ? 234 ASP A C 1
2938ATOM 1629 O O . ASP A 1 210 ? 59.247 28.260 13.015 1.00 60.84 ? 234 ASP A O 1
2939ATOM 1630 C CB . ASP A 1 210 ? 61.119 26.049 11.340 1.00 49.05 ? 234 ASP A CB 1
2940ATOM 1631 C CG . ASP A 1 210 ? 62.182 26.935 11.950 1.00 58.67 ? 234 ASP A CG 1
2941ATOM 1632 O OD1 . ASP A 1 210 ? 62.613 26.657 13.089 1.00 73.26 ? 234 ASP A OD1 1
2942ATOM 1633 O OD2 . ASP A 1 210 ? 62.601 27.902 11.283 1.00 62.59 ? 234 ASP A OD2 1
2943ATOM 1634 N N . MET A 1 211 ? 58.566 27.845 10.907 1.00 46.84 ? 235 MET A N 1
2944ATOM 1635 C CA . MET A 1 211 ? 57.992 29.176 10.735 1.00 54.48 ? 235 MET A CA 1
2945ATOM 1636 C C . MET A 1 211 ? 56.878 29.425 11.740 1.00 61.05 ? 235 MET A C 1
2946ATOM 1637 O O . MET A 1 211 ? 56.895 30.420 12.473 1.00 63.79 ? 235 MET A O 1
2947ATOM 1638 C CB . MET A 1 211 ? 57.451 29.346 9.314 1.00 66.46 ? 235 MET A CB 1
2948ATOM 1639 C CG . MET A 1 211 ? 58.473 29.720 8.256 1.00 46.13 ? 235 MET A CG 1
2949ATOM 1640 S SD . MET A 1 211 ? 57.663 29.778 6.651 1.00 55.28 ? 235 MET A SD 1
2950ATOM 1641 C CE . MET A 1 211 ? 59.066 29.777 5.542 1.00 65.46 ? 235 MET A CE 1
2951ATOM 1642 N N . VAL A 1 212 ? 55.893 28.525 11.790 1.00 60.67 ? 236 VAL A N 1
2952ATOM 1643 C CA . VAL A 1 212 ? 54.733 28.772 12.644 1.00 56.77 ? 236 VAL A CA 1
2953ATOM 1644 C C . VAL A 1 212 ? 55.000 28.448 14.103 1.00 62.26 ? 236 VAL A C 1
2954ATOM 1645 O O . VAL A 1 212 ? 54.140 28.714 14.953 1.00 75.09 ? 236 VAL A O 1
2955ATOM 1646 C CB . VAL A 1 212 ? 53.503 27.965 12.188 1.00 62.93 ? 236 VAL A CB 1
2956ATOM 1647 C CG1 . VAL A 1 212 ? 52.922 28.552 10.900 1.00 64.42 ? 236 VAL A CG1 1
2957ATOM 1648 C CG2 . VAL A 1 212 ? 53.832 26.493 12.049 1.00 70.39 ? 236 VAL A CG2 1
2958ATOM 1649 N N . CYS A 1 213 ? 56.175 27.903 14.424 1.00 62.14 ? 237 CYS A N 1
2959ATOM 1650 C CA . CYS A 1 213 ? 56.452 27.395 15.759 1.00 56.32 ? 237 CYS A CA 1
2960ATOM 1651 C C . CYS A 1 213 ? 57.733 27.932 16.378 1.00 62.49 ? 237 CYS A C 1
2961ATOM 1652 O O . CYS A 1 213 ? 57.947 27.716 17.577 1.00 74.82 ? 237 CYS A O 1
2962ATOM 1653 C CB . CYS A 1 213 ? 56.533 25.860 15.734 1.00 55.75 ? 237 CYS A CB 1
2963ATOM 1654 S SG . CYS A 1 213 ? 54.933 25.026 15.664 1.00 76.64 ? 237 CYS A SG 1
2964ATOM 1655 N N . GLY A 1 214 ? 58.593 28.607 15.611 1.00 65.14 ? 238 GLY A N 1
2965ATOM 1656 C CA . GLY A 1 214 ? 59.846 29.124 16.124 1.00 62.65 ? 238 GLY A CA 1
2966ATOM 1657 C C . GLY A 1 214 ? 60.951 28.103 16.273 1.00 58.35 ? 238 GLY A C 1
2967ATOM 1658 O O . GLY A 1 214 ? 62.108 28.491 16.489 1.00 72.02 ? 238 GLY A O 1
2968ATOM 1659 N N . ASP A 1 215 ? 60.643 26.815 16.156 1.00 63.18 ? 239 ASP A N 1
2969ATOM 1660 C CA . ASP A 1 215 ? 61.626 25.763 16.345 1.00 74.97 ? 239 ASP A CA 1
2970ATOM 1661 C C . ASP A 1 215 ? 61.317 24.621 15.384 1.00 63.85 ? 239 ASP A C 1
2971ATOM 1662 O O . ASP A 1 215 ? 60.222 24.526 14.828 1.00 63.56 ? 239 ASP A O 1
2972ATOM 1663 C CB . ASP A 1 215 ? 61.636 25.288 17.809 1.00 74.37 ? 239 ASP A CB 1
2973ATOM 1664 C CG . ASP A 1 215 ? 62.875 24.483 18.163 1.00 93.90 ? 239 ASP A CG 1
2974ATOM 1665 O OD1 . ASP A 1 215 ? 63.948 24.741 17.577 1.00 109.58 ? 239 ASP A OD1 1
2975ATOM 1666 O OD2 . ASP A 1 215 ? 62.776 23.598 19.042 1.00 111.89 ? 239 ASP A OD2 1
2976ATOM 1667 N N . ILE A 1 216 ? 62.308 23.763 15.182 1.00 47.14 ? 240 ILE A N 1
2977ATOM 1668 C CA . ILE A 1 216 ? 62.206 22.600 14.306 1.00 49.64 ? 240 ILE A CA 1
2978ATOM 1669 C C . ILE A 1 216 ? 61.442 21.471 14.997 1.00 60.16 ? 240 ILE A C 1
2979ATOM 1670 O O . ILE A 1 216 ? 61.585 21.276 16.211 1.00 72.02 ? 240 ILE A O 1
2980ATOM 1671 C CB . ILE A 1 216 ? 63.613 22.185 13.849 1.00 50.41 ? 240 ILE A CB 1
2981ATOM 1672 C CG1 . ILE A 1 216 ? 64.535 22.032 15.057 1.00 56.83 ? 240 ILE A CG1 1
2982ATOM 1673 C CG2 . ILE A 1 216 ? 64.187 23.208 12.887 1.00 49.45 ? 240 ILE A CG2 1
2983ATOM 1674 C CD1 . ILE A 1 216 ? 65.378 20.798 15.042 1.00 67.42 ? 240 ILE A CD1 1
2984ATOM 1675 N N . PRO A 1 217 ? 60.611 20.709 14.274 1.00 53.44 ? 241 PRO A N 1
2985ATOM 1676 C CA . PRO A 1 217 ? 59.739 19.738 14.958 1.00 60.93 ? 241 PRO A CA 1
2986ATOM 1677 C C . PRO A 1 217 ? 60.485 18.571 15.585 1.00 56.46 ? 241 PRO A C 1
2987ATOM 1678 O O . PRO A 1 217 ? 60.044 18.066 16.625 1.00 55.30 ? 241 PRO A O 1
2988ATOM 1679 C CB . PRO A 1 217 ? 58.790 19.271 13.843 1.00 53.49 ? 241 PRO A CB 1
2989ATOM 1680 C CG . PRO A 1 217 ? 59.542 19.507 12.594 1.00 49.19 ? 241 PRO A CG 1
2990ATOM 1681 C CD . PRO A 1 217 ? 60.405 20.712 12.817 1.00 47.54 ? 241 PRO A CD 1
2991ATOM 1682 N N . PHE A 1 218 ? 61.599 18.132 14.998 1.00 69.56 ? 242 PHE A N 1
2992ATOM 1683 C CA . PHE A 1 218 ? 62.343 16.972 15.472 1.00 63.17 ? 242 PHE A CA 1
2993ATOM 1684 C C . PHE A 1 218 ? 63.815 17.310 15.627 1.00 70.11 ? 242 PHE A C 1
2994ATOM 1685 O O . PHE A 1 218 ? 64.435 17.843 14.703 1.00 71.36 ? 242 PHE A O 1
2995ATOM 1686 C CB . PHE A 1 218 ? 62.267 15.802 14.505 1.00 59.33 ? 242 PHE A CB 1
2996ATOM 1687 C CG . PHE A 1 218 ? 60.929 15.593 13.884 1.00 65.75 ? 242 PHE A CG 1
2997ATOM 1688 C CD1 . PHE A 1 218 ? 59.848 15.161 14.637 1.00 62.23 ? 242 PHE A CD1 1
2998ATOM 1689 C CD2 . PHE A 1 218 ? 60.763 15.805 12.525 1.00 54.19 ? 242 PHE A CD2 1
2999ATOM 1690 C CE1 . PHE A 1 218 ? 58.618 14.953 14.045 1.00 51.03 ? 242 PHE A CE1 1
3000ATOM 1691 C CE2 . PHE A 1 218 ? 59.544 15.604 11.928 1.00 57.62 ? 242 PHE A CE2 1
3001ATOM 1692 C CZ . PHE A 1 218 ? 58.468 15.174 12.689 1.00 62.84 ? 242 PHE A CZ 1
3002ATOM 1693 N N . GLU A 1 219 ? 64.391 16.931 16.767 1.00 83.74 ? 243 GLU A N 1
3003ATOM 1694 C CA . GLU A 1 219 ? 65.814 17.126 16.999 1.00 96.53 ? 243 GLU A CA 1
3004ATOM 1695 C C . GLU A 1 219 ? 66.624 15.837 16.968 1.00 96.97 ? 243 GLU A C 1
3005ATOM 1696 O O . GLU A 1 219 ? 67.845 15.905 16.793 1.00 103.57 ? 243 GLU A O 1
3006ATOM 1697 C CB . GLU A 1 219 ? 66.047 17.838 18.345 1.00 99.13 ? 243 GLU A CB 1
3007ATOM 1698 C CG . GLU A 1 219 ? 66.711 19.210 18.218 1.00 107.59 ? 243 GLU A CG 1
3008ATOM 1699 C CD . GLU A 1 219 ? 68.147 19.152 17.725 1.00 127.69 ? 243 GLU A CD 1
3009ATOM 1700 O OE1 . GLU A 1 219 ? 68.626 20.173 17.182 1.00 124.28 ? 243 GLU A OE1 1
3010ATOM 1701 O OE2 . GLU A 1 219 ? 68.809 18.110 17.915 1.00 131.36 ? 243 GLU A OE2 1
3011ATOM 1702 N N . HIS A 1 220 ? 65.994 14.676 17.120 1.00 88.31 ? 244 HIS A N 1
3012ATOM 1703 C CA . HIS A 1 220 ? 66.690 13.401 17.077 1.00 89.11 ? 244 HIS A CA 1
3013ATOM 1704 C C . HIS A 1 220 ? 66.158 12.566 15.922 1.00 78.83 ? 244 HIS A C 1
3014ATOM 1705 O O . HIS A 1 220 ? 65.075 12.824 15.392 1.00 69.38 ? 244 HIS A O 1
3015ATOM 1706 C CB . HIS A 1 220 ? 66.527 12.625 18.390 1.00 86.25 ? 244 HIS A CB 1
3016ATOM 1707 C CG . HIS A 1 220 ? 67.042 13.356 19.589 1.00 96.11 ? 244 HIS A CG 1
3017ATOM 1708 N ND1 . HIS A 1 220 ? 68.387 13.482 19.861 1.00 105.56 ? 244 HIS A ND1 1
3018ATOM 1709 C CD2 . HIS A 1 220 ? 66.392 14.002 20.585 1.00 87.77 ? 244 HIS A CD2 1
3019ATOM 1710 C CE1 . HIS A 1 220 ? 68.544 14.175 20.975 1.00 106.41 ? 244 HIS A CE1 1
3020ATOM 1711 N NE2 . HIS A 1 220 ? 67.349 14.503 21.434 1.00 101.25 ? 244 HIS A NE2 1
3021ATOM 1712 N N . ASP A 1 221 ? 66.940 11.554 15.535 1.00 86.78 ? 245 ASP A N 1
3022ATOM 1713 C CA . ASP A 1 221 ? 66.476 10.623 14.512 1.00 74.91 ? 245 ASP A CA 1
3023ATOM 1714 C C . ASP A 1 221 ? 65.186 9.937 14.938 1.00 58.00 ? 245 ASP A C 1
3024ATOM 1715 O O . ASP A 1 221 ? 64.284 9.742 14.121 1.00 59.73 ? 245 ASP A O 1
3025ATOM 1716 C CB . ASP A 1 221 ? 67.555 9.584 14.199 1.00 64.26 ? 245 ASP A CB 1
3026ATOM 1717 C CG . ASP A 1 221 ? 68.816 10.201 13.624 1.00 77.55 ? 245 ASP A CG 1
3027ATOM 1718 O OD1 . ASP A 1 221 ? 68.750 11.349 13.137 1.00 86.74 ? 245 ASP A OD1 1
3028ATOM 1719 O OD2 . ASP A 1 221 ? 69.872 9.533 13.649 1.00 87.15 ? 245 ASP A OD2 1
3029ATOM 1720 N N . GLU A 1 222 ? 65.075 9.581 16.219 1.00 68.50 ? 246 GLU A N 1
3030ATOM 1721 C CA . GLU A 1 222 ? 63.927 8.807 16.679 1.00 66.54 ? 246 GLU A CA 1
3031ATOM 1722 C C . GLU A 1 222 ? 62.624 9.577 16.486 1.00 65.14 ? 246 GLU A C 1
3032ATOM 1723 O O . GLU A 1 222 ? 61.618 9.009 16.041 1.00 58.99 ? 246 GLU A O 1
3033ATOM 1724 C CB . GLU A 1 222 ? 64.129 8.414 18.142 1.00 69.72 ? 246 GLU A CB 1
3034ATOM 1725 C CG . GLU A 1 222 ? 63.512 7.074 18.514 1.00 104.15 ? 246 GLU A CG 1
3035ATOM 1726 C CD . GLU A 1 222 ? 62.122 7.201 19.114 1.00 120.48 ? 246 GLU A CD 1
3036ATOM 1727 O OE1 . GLU A 1 222 ? 61.156 6.724 18.479 1.00 117.11 ? 246 GLU A OE1 1
3037ATOM 1728 O OE2 . GLU A 1 222 ? 61.996 7.744 20.234 1.00 116.39 ? 246 GLU A OE2 1
3038ATOM 1729 N N . GLU A 1 223 ? 62.628 10.877 16.792 1.00 68.06 ? 247 GLU A N 1
3039ATOM 1730 C CA . GLU A 1 223 ? 61.430 11.683 16.576 1.00 67.09 ? 247 GLU A CA 1
3040ATOM 1731 C C . GLU A 1 223 ? 61.092 11.805 15.094 1.00 63.41 ? 247 GLU A C 1
3041ATOM 1732 O O . GLU A 1 223 ? 59.912 11.893 14.738 1.00 74.08 ? 247 GLU A O 1
3042ATOM 1733 C CB . GLU A 1 223 ? 61.599 13.071 17.197 1.00 71.35 ? 247 GLU A CB 1
3043ATOM 1734 C CG . GLU A 1 223 ? 62.309 13.074 18.547 1.00 85.40 ? 247 GLU A CG 1
3044ATOM 1735 C CD . GLU A 1 223 ? 62.603 14.477 19.054 1.00 96.38 ? 247 GLU A CD 1
3045ATOM 1736 O OE1 . GLU A 1 223 ? 63.353 15.211 18.374 1.00 89.68 ? 247 GLU A OE1 1
3046ATOM 1737 O OE2 . GLU A 1 223 ? 62.095 14.841 20.139 1.00 98.18 ? 247 GLU A OE2 1
3047ATOM 1738 N N . ILE A 1 224 ? 62.101 11.811 14.222 1.00 59.64 ? 248 ILE A N 1
3048ATOM 1739 C CA . ILE A 1 224 ? 61.848 11.887 12.783 1.00 61.44 ? 248 ILE A CA 1
3049ATOM 1740 C C . ILE A 1 224 ? 61.231 10.586 12.282 1.00 57.53 ? 248 ILE A C 1
3050ATOM 1741 O O . ILE A 1 224 ? 60.173 10.590 11.645 1.00 56.41 ? 248 ILE A O 1
3051ATOM 1742 C CB . ILE A 1 224 ? 63.140 12.218 12.018 1.00 60.64 ? 248 ILE A CB 1
3052ATOM 1743 C CG1 . ILE A 1 224 ? 63.706 13.552 12.488 1.00 63.49 ? 248 ILE A CG1 1
3053ATOM 1744 C CG2 . ILE A 1 224 ? 62.878 12.254 10.516 1.00 59.59 ? 248 ILE A CG2 1
3054ATOM 1745 C CD1 . ILE A 1 224 ? 64.994 13.935 11.835 1.00 68.22 ? 248 ILE A CD1 1
3055ATOM 1746 N N . ILE A 1 225 ? 61.897 9.459 12.543 1.00 54.66 ? 249 ILE A N 1
3056ATOM 1747 C CA . ILE A 1 225 ? 61.364 8.136 12.228 1.00 61.87 ? 249 ILE A CA 1
3057ATOM 1748 C C . ILE A 1 225 ? 59.926 8.029 12.717 1.00 50.09 ? 249 ILE A C 1
3058ATOM 1749 O O . ILE A 1 225 ? 59.060 7.495 12.013 1.00 50.36 ? 249 ILE A O 1
3059ATOM 1750 C CB . ILE A 1 225 ? 62.222 6.997 12.823 1.00 56.93 ? 249 ILE A CB 1
3060ATOM 1751 C CG1 . ILE A 1 225 ? 63.711 7.188 12.516 1.00 64.54 ? 249 ILE A CG1 1
3061ATOM 1752 C CG2 . ILE A 1 225 ? 61.721 5.639 12.370 1.00 65.54 ? 249 ILE A CG2 1
3062ATOM 1753 C CD1 . ILE A 1 225 ? 64.633 6.656 13.605 1.00 68.60 ? 249 ILE A CD1 1
3063ATOM 1754 N N . ARG A 1 226 ? 59.653 8.548 13.915 1.00 55.69 ? 250 ARG A N 1
3064ATOM 1755 C CA . ARG A 1 226 ? 58.292 8.474 14.429 1.00 61.66 ? 250 ARG A CA 1
3065ATOM 1756 C C . ARG A 1 226 ? 57.356 9.382 13.646 1.00 57.66 ? 250 ARG A C 1
3066ATOM 1757 O O . ARG A 1 226 ? 56.188 9.038 13.430 1.00 65.20 ? 250 ARG A O 1
3067ATOM 1758 C CB . ARG A 1 226 ? 58.266 8.828 15.911 1.00 55.96 ? 250 ARG A CB 1
3068ATOM 1759 C CG . ARG A 1 226 ? 57.014 8.325 16.570 1.00 54.08 ? 250 ARG A CG 1
3069ATOM 1760 C CD . ARG A 1 226 ? 57.129 8.297 18.069 1.00 58.50 ? 250 ARG A CD 1
3070ATOM 1761 N NE . ARG A 1 226 ? 55.824 8.095 18.686 1.00 70.45 ? 250 ARG A NE 1
3071ATOM 1762 C CZ . ARG A 1 226 ? 55.249 8.955 19.514 1.00 81.58 ? 250 ARG A CZ 1
3072ATOM 1763 N NH1 . ARG A 1 226 ? 55.825 10.108 19.820 1.00 61.34 ? 250 ARG A NH1 1
3073ATOM 1764 N NH2 . ARG A 1 226 ? 54.069 8.647 20.052 1.00 79.93 ? 250 ARG A NH2 1
3074ATOM 1765 N N . GLY A 1 227 ? 57.842 10.546 13.220 1.00 54.23 ? 251 GLY A N 1
3075ATOM 1766 C CA . GLY A 1 227 ? 57.039 11.446 12.420 1.00 65.67 ? 251 GLY A CA 1
3076ATOM 1767 C C . GLY A 1 227 ? 55.825 12.028 13.103 1.00 68.89 ? 251 GLY A C 1
3077ATOM 1768 O O . GLY A 1 227 ? 55.005 12.661 12.433 1.00 75.30 ? 251 GLY A O 1
3078ATOM 1769 N N . GLN A 1 228 ? 55.676 11.833 14.409 1.00 62.42 ? 252 GLN A N 1
3079ATOM 1770 C CA . GLN A 1 228 ? 54.592 12.470 15.140 1.00 63.53 ? 252 GLN A CA 1
3080ATOM 1771 C C . GLN A 1 228 ? 54.999 13.898 15.490 1.00 65.79 ? 252 GLN A C 1
3081ATOM 1772 O O . GLN A 1 228 ? 56.098 14.139 15.999 1.00 53.51 ? 252 GLN A O 1
3082ATOM 1773 C CB . GLN A 1 228 ? 54.242 11.659 16.385 1.00 52.26 ? 252 GLN A CB 1
3083ATOM 1774 C CG . GLN A 1 228 ? 52.785 11.772 16.787 1.00 69.30 ? 252 GLN A CG 1
3084ATOM 1775 C CD . GLN A 1 228 ? 52.354 10.664 17.728 1.00 88.37 ? 252 GLN A CD 1
3085ATOM 1776 O OE1 . GLN A 1 228 ? 52.786 9.518 17.590 1.00 77.22 ? 252 GLN A OE1 1
3086ATOM 1777 N NE2 . GLN A 1 228 ? 51.486 10.994 18.680 1.00 91.20 ? 252 GLN A NE2 1
3087ATOM 1778 N N . VAL A 1 229 ? 54.123 14.847 15.186 1.00 75.81 ? 253 VAL A N 1
3088ATOM 1779 C CA . VAL A 1 229 ? 54.459 16.262 15.218 1.00 72.38 ? 253 VAL A CA 1
3089ATOM 1780 C C . VAL A 1 229 ? 53.590 16.921 16.273 1.00 74.73 ? 253 VAL A C 1
3090ATOM 1781 O O . VAL A 1 229 ? 52.356 16.872 16.190 1.00 78.85 ? 253 VAL A O 1
3091ATOM 1782 C CB . VAL A 1 229 ? 54.258 16.920 13.845 1.00 72.85 ? 253 VAL A CB 1
3092ATOM 1783 C CG1 . VAL A 1 229 ? 53.966 18.406 13.984 1.00 68.62 ? 253 VAL A CG1 1
3093ATOM 1784 C CG2 . VAL A 1 229 ? 55.468 16.684 12.984 1.00 75.46 ? 253 VAL A CG2 1
3094ATOM 1785 N N . PHE A 1 230 ? 54.227 17.525 17.264 1.00 78.23 ? 254 PHE A N 1
3095ATOM 1786 C CA . PHE A 1 230 ? 53.528 18.214 18.334 1.00 85.19 ? 254 PHE A CA 1
3096ATOM 1787 C C . PHE A 1 230 ? 53.780 19.706 18.225 1.00 82.94 ? 254 PHE A C 1
3097ATOM 1788 O O . PHE A 1 230 ? 54.908 20.141 17.974 1.00 83.44 ? 254 PHE A O 1
3098ATOM 1789 C CB . PHE A 1 230 ? 53.971 17.688 19.693 1.00 80.69 ? 254 PHE A CB 1
3099ATOM 1790 C CG . PHE A 1 230 ? 53.528 16.291 19.949 1.00 99.92 ? 254 PHE A CG 1
3100ATOM 1791 C CD1 . PHE A 1 230 ? 52.339 15.823 19.406 1.00 104.96 ? 254 PHE A CD1 1
3101ATOM 1792 C CD2 . PHE A 1 230 ? 54.300 15.433 20.699 1.00 104.72 ? 254 PHE A CD2 1
3102ATOM 1793 C CE1 . PHE A 1 230 ? 51.919 14.532 19.636 1.00 102.94 ? 254 PHE A CE1 1
3103ATOM 1794 C CE2 . PHE A 1 230 ? 53.886 14.146 20.936 1.00 104.38 ? 254 PHE A CE2 1
3104ATOM 1795 C CZ . PHE A 1 230 ? 52.694 13.689 20.401 1.00 100.47 ? 254 PHE A CZ 1
3105ATOM 1796 N N . PHE A 1 231 ? 52.720 20.483 18.397 1.00 86.62 ? 255 PHE A N 1
3106ATOM 1797 C CA . PHE A 1 231 ? 52.791 21.926 18.238 1.00 86.00 ? 255 PHE A CA 1
3107ATOM 1798 C C . PHE A 1 231 ? 52.833 22.585 19.607 1.00 87.39 ? 255 PHE A C 1
3108ATOM 1799 O O . PHE A 1 231 ? 52.038 22.253 20.493 1.00 73.66 ? 255 PHE A O 1
3109ATOM 1800 C CB . PHE A 1 231 ? 51.617 22.444 17.408 1.00 58.08 ? 255 PHE A CB 1
3110ATOM 1801 C CG . PHE A 1 231 ? 51.623 21.935 15.998 1.00 68.07 ? 255 PHE A CG 1
3111ATOM 1802 C CD1 . PHE A 1 231 ? 51.043 20.717 15.678 1.00 58.63 ? 255 PHE A CD1 1
3112ATOM 1803 C CD2 . PHE A 1 231 ? 52.267 22.648 15.000 1.00 61.55 ? 255 PHE A CD2 1
3113ATOM 1804 C CE1 . PHE A 1 231 ? 51.066 20.241 14.379 1.00 56.81 ? 255 PHE A CE1 1
3114ATOM 1805 C CE2 . PHE A 1 231 ? 52.300 22.174 13.697 1.00 68.65 ? 255 PHE A CE2 1
3115ATOM 1806 C CZ . PHE A 1 231 ? 51.698 20.970 13.386 1.00 57.90 ? 255 PHE A CZ 1
3116ATOM 1807 N N . ARG A 1 232 ? 53.798 23.484 19.779 1.00 93.56 ? 256 ARG A N 1
3117ATOM 1808 C CA . ARG A 1 232 ? 53.958 24.255 21.000 1.00 86.49 ? 256 ARG A CA 1
3118ATOM 1809 C C . ARG A 1 232 ? 53.248 25.596 20.933 1.00 92.48 ? 256 ARG A C 1
3119ATOM 1810 O O . ARG A 1 232 ? 53.009 26.216 21.978 1.00 90.62 ? 256 ARG A O 1
3120ATOM 1811 C CB . ARG A 1 232 ? 55.446 24.477 21.269 1.00 99.95 ? 256 ARG A CB 1
3121ATOM 1812 C CG . ARG A 1 232 ? 56.190 24.980 20.040 1.00 104.69 ? 256 ARG A CG 1
3122ATOM 1813 C CD . ARG A 1 232 ? 57.666 24.674 20.146 1.00 114.95 ? 256 ARG A CD 1
3123ATOM 1814 N NE . ARG A 1 232 ? 58.065 23.622 19.219 1.00 121.81 ? 256 ARG A NE 1
3124ATOM 1815 C CZ . ARG A 1 232 ? 59.238 23.004 19.254 1.00 124.56 ? 256 ARG A CZ 1
3125ATOM 1816 N NH1 . ARG A 1 232 ? 60.147 23.302 20.166 1.00 125.23 ? 256 ARG A NH1 1
3126ATOM 1817 N NH2 . ARG A 1 232 ? 59.499 22.054 18.360 1.00 112.97 ? 256 ARG A NH2 1
3127ATOM 1818 N N . GLN A 1 233 ? 52.912 26.055 19.732 1.00 73.86 ? 257 GLN A N 1
3128ATOM 1819 C CA . GLN A 1 233 ? 52.186 27.296 19.539 1.00 89.13 ? 257 GLN A CA 1
3129ATOM 1820 C C . GLN A 1 233 ? 50.799 27.006 18.986 1.00 79.61 ? 257 GLN A C 1
3130ATOM 1821 O O . GLN A 1 233 ? 50.550 25.953 18.394 1.00 76.65 ? 257 GLN A O 1
3131ATOM 1822 C CB . GLN A 1 233 ? 52.945 28.232 18.592 1.00 78.47 ? 257 GLN A CB 1
3132ATOM 1823 C CG . GLN A 1 233 ? 53.925 29.139 19.304 1.00 81.14 ? 257 GLN A CG 1
3133ATOM 1824 C CD . GLN A 1 233 ? 53.347 30.518 19.554 1.00 102.26 ? 257 GLN A CD 1
3134ATOM 1825 O OE1 . GLN A 1 233 ? 52.308 30.878 18.999 1.00 114.47 ? 257 GLN A OE1 1
3135ATOM 1826 N NE2 . GLN A 1 233 ? 54.008 31.292 20.406 1.00 110.87 ? 257 GLN A NE2 1
3136ATOM 1827 N N . ARG A 1 234 ? 49.887 27.951 19.208 1.00 66.07 ? 258 ARG A N 1
3137ATOM 1828 C CA . ARG A 1 234 ? 48.575 27.880 18.582 1.00 67.38 ? 258 ARG A CA 1
3138ATOM 1829 C C . ARG A 1 234 ? 48.757 27.955 17.075 1.00 64.47 ? 258 ARG A C 1
3139ATOM 1830 O O . ARG A 1 234 ? 49.199 28.978 16.541 1.00 84.29 ? 258 ARG A O 1
3140ATOM 1831 C CB . ARG A 1 234 ? 47.665 28.999 19.096 1.00 75.58 ? 258 ARG A CB 1
3141ATOM 1832 C CG . ARG A 1 234 ? 46.539 29.420 18.158 1.00 78.76 ? 258 ARG A CG 1
3142ATOM 1833 C CD . ARG A 1 234 ? 45.559 28.299 17.853 1.00 75.93 ? 258 ARG A CD 1
3143ATOM 1834 N NE . ARG A 1 234 ? 44.862 28.531 16.593 1.00 83.35 ? 258 ARG A NE 1
3144ATOM 1835 C CZ . ARG A 1 234 ? 43.644 28.086 16.314 1.00 82.95 ? 258 ARG A CZ 1
3145ATOM 1836 N NH1 . ARG A 1 234 ? 42.964 27.343 17.175 1.00 77.57 ? 258 ARG A NH1 1
3146ATOM 1837 N NH2 . ARG A 1 234 ? 43.097 28.387 15.138 1.00 94.92 ? 258 ARG A NH2 1
3147ATOM 1838 N N . VAL A 1 235 ? 48.450 26.862 16.388 1.00 66.77 ? 259 VAL A N 1
3148ATOM 1839 C CA . VAL A 1 235 ? 48.658 26.742 14.953 1.00 79.68 ? 259 VAL A CA 1
3149ATOM 1840 C C . VAL A 1 235 ? 47.366 26.224 14.354 1.00 75.22 ? 259 VAL A C 1
3150ATOM 1841 O O . VAL A 1 235 ? 46.902 25.141 14.731 1.00 70.37 ? 259 VAL A O 1
3151ATOM 1842 C CB . VAL A 1 235 ? 49.831 25.806 14.615 1.00 71.53 ? 259 VAL A CB 1
3152ATOM 1843 C CG1 . VAL A 1 235 ? 49.980 25.663 13.116 1.00 56.25 ? 259 VAL A CG1 1
3153ATOM 1844 C CG2 . VAL A 1 235 ? 51.119 26.329 15.227 1.00 67.80 ? 259 VAL A CG2 1
3154ATOM 1845 N N . SER A 1 236 ? 46.784 26.996 13.437 1.00 75.14 ? 260 SER A N 1
3155ATOM 1846 C CA . SER A 1 236 ? 45.510 26.657 12.809 1.00 66.80 ? 260 SER A CA 1
3156ATOM 1847 C C . SER A 1 236 ? 45.444 25.193 12.411 1.00 77.25 ? 260 SER A C 1
3157ATOM 1848 O O . SER A 1 236 ? 46.421 24.626 11.918 1.00 75.60 ? 260 SER A O 1
3158ATOM 1849 C CB . SER A 1 236 ? 45.266 27.528 11.579 1.00 78.89 ? 260 SER A CB 1
3159ATOM 1850 O OG . SER A 1 236 ? 45.762 26.902 10.407 1.00 71.40 ? 260 SER A OG 1
3160HETATM 1851 N N . SEP01 A 1 237 ? 44.286 24.592 12.657 1.00 90.20 ? 261 SEP01 A N 1
3161HETATM 1852 C CA . SEP01 A 1 237 ? 44.030 23.198 12.331 1.00 83.95 ? 261 SEP01 A CA 1
3162HETATM 1853 C CB . SEP01 A 1 237 ? 42.550 22.883 12.549 1.00 92.90 ? 261 SEP01 A CB 1
3163HETATM 1854 O OG . SEP01 A 1 237 ? 42.177 23.058 13.914 1.00 118.25 ? 261 SEP01 A OG 1
3164HETATM 1855 C C . SEP01 A 1 237 ? 44.450 22.889 10.892 1.00 84.01 ? 261 SEP01 A C 1
3165HETATM 1856 O O . SEP01 A 1 237 ? 45.009 21.829 10.610 1.00 92.15 ? 261 SEP01 A O 1
3166HETATM 1857 P P . SEP01 A 1 237 ? 41.225 24.345 14.188 1.00 142.54 ? 261 SEP01 A P 1
3167HETATM 1858 O O1P . SEP01 A 1 237 ? 39.827 24.247 13.392 1.00 128.91 ? 261 SEP01 A O1P 1
3168HETATM 1859 O O2P . SEP01 A 1 237 ? 41.980 25.695 13.737 1.00 117.68 ? 261 SEP01 A O2P 1
3169HETATM 1860 O O3P . SEP01 A 1 237 ? 40.897 24.449 15.759 1.00 111.35 ? 261 SEP01 A O3P 1
3170ATOM 1861 N N . GLU A 1 238 ? 44.204 23.841 9.996 1.00 76.97 ? 262 GLU A N 1
3171ATOM 1862 C CA . GLU A 1 238 ? 44.591 23.714 8.595 1.00 65.92 ? 262 GLU A CA 1
3172ATOM 1863 C C . GLU A 1 238 ? 46.108 23.723 8.424 1.00 66.23 ? 262 GLU A C 1
3173ATOM 1864 O O . GLU A 1 238 ? 46.655 22.911 7.682 1.00 68.87 ? 262 GLU A O 1
3174ATOM 1865 C CB . GLU A 1 238 ? 43.960 24.837 7.777 1.00 66.20 ? 262 GLU A CB 1
3175ATOM 1866 C CG . GLU A 1 238 ? 42.456 24.695 7.623 1.00 71.83 ? 262 GLU A CG 1
3176ATOM 1867 C CD . GLU A 1 238 ? 41.752 26.032 7.500 1.00 92.43 ? 262 GLU A CD 1
3177ATOM 1868 O OE1 . GLU A 1 238 ? 42.445 27.072 7.477 1.00 98.47 ? 262 GLU A OE1 1
3178ATOM 1869 O OE2 . GLU A 1 238 ? 40.503 26.044 7.445 1.00 93.78 ? 262 GLU A OE2 1
3179ATOM 1870 N N . CYS A 1 239 ? 46.791 24.650 9.103 1.00 68.30 ? 263 CYS A N 1
3180ATOM 1871 C CA . CYS A 1 239 ? 48.251 24.665 9.041 1.00 70.89 ? 263 CYS A CA 1
3181ATOM 1872 C C . CYS A 1 239 ? 48.836 23.390 9.632 1.00 65.46 ? 263 CYS A C 1
3182ATOM 1873 O O . CYS A 1 239 ? 49.810 22.837 9.103 1.00 60.18 ? 263 CYS A O 1
3183ATOM 1874 C CB . CYS A 1 239 ? 48.807 25.890 9.766 1.00 62.21 ? 263 CYS A CB 1
3184ATOM 1875 S SG . CYS A 1 239 ? 50.595 26.126 9.552 1.00 53.63 ? 263 CYS A SG 1
3185ATOM 1876 N N . GLN A 1 240 ? 48.255 22.910 10.735 1.00 65.06 ? 264 GLN A N 1
3186ATOM 1877 C CA . GLN A 1 240 ? 48.685 21.635 11.297 1.00 62.34 ? 264 GLN A CA 1
3187ATOM 1878 C C . GLN A 1 240 ? 48.514 20.508 10.288 1.00 65.59 ? 264 GLN A C 1
3188ATOM 1879 O O . GLN A 1 240 ? 49.384 19.636 10.172 1.00 64.52 ? 264 GLN A O 1
3189ATOM 1880 C CB . GLN A 1 240 ? 47.913 21.335 12.583 1.00 70.05 ? 264 GLN A CB 1
3190ATOM 1881 C CG . GLN A 1 240 ? 48.291 22.223 13.754 1.00 66.67 ? 264 GLN A CG 1
3191ATOM 1882 C CD . GLN A 1 240 ? 47.849 21.651 15.086 1.00 71.77 ? 264 GLN A CD 1
3192ATOM 1883 O OE1 . GLN A 1 240 ? 47.921 20.443 15.314 1.00 79.11 ? 264 GLN A OE1 1
3193ATOM 1884 N NE2 . GLN A 1 240 ? 47.413 22.522 15.985 1.00 78.85 ? 264 GLN A NE2 1
3194ATOM 1885 N N . HIS A 1 241 ? 47.413 20.517 9.531 1.00 69.62 ? 265 HIS A N 1
3195ATOM 1886 C CA . HIS A 1 241 ? 47.216 19.481 8.523 1.00 75.22 ? 265 HIS A CA 1
3196ATOM 1887 C C . HIS A 1 241 ? 48.271 19.570 7.430 1.00 65.74 ? 265 HIS A C 1
3197ATOM 1888 O O . HIS A 1 241 ? 48.827 18.549 7.014 1.00 72.10 ? 265 HIS A O 1
3198ATOM 1889 C CB . HIS A 1 241 ? 45.820 19.567 7.909 1.00 74.10 ? 265 HIS A CB 1
3199ATOM 1890 C CG . HIS A 1 241 ? 45.595 18.566 6.816 1.00 90.23 ? 265 HIS A CG 1
3200ATOM 1891 N ND1 . HIS A 1 241 ? 45.387 18.928 5.502 1.00 92.39 ? 265 HIS A ND1 1
3201ATOM 1892 C CD2 . HIS A 1 241 ? 45.580 17.212 6.838 1.00 90.03 ? 265 HIS A CD2 1
3202ATOM 1893 C CE1 . HIS A 1 241 ? 45.237 17.842 4.765 1.00 89.71 ? 265 HIS A CE1 1
3203ATOM 1894 N NE2 . HIS A 1 241 ? 45.351 16.787 5.551 1.00 99.01 ? 265 HIS A NE2 1
3204ATOM 1895 N N . LEU A 1 242 ? 48.542 20.782 6.932 1.00 65.12 ? 266 LEU A N 1
3205ATOM 1896 C CA . LEU A 1 242 ? 49.589 20.950 5.927 1.00 64.53 ? 266 LEU A CA 1
3206ATOM 1897 C C . LEU A 1 242 ? 50.919 20.406 6.415 1.00 52.15 ? 266 LEU A C 1
3207ATOM 1898 O O . LEU A 1 242 ? 51.592 19.651 5.706 1.00 50.68 ? 266 LEU A O 1
3208ATOM 1899 C CB . LEU A 1 242 ? 49.740 22.419 5.534 1.00 62.75 ? 266 LEU A CB 1
3209ATOM 1900 C CG . LEU A 1 242 ? 50.453 22.595 4.186 1.00 59.10 ? 266 LEU A CG 1
3210ATOM 1901 C CD1 . LEU A 1 242 ? 50.067 21.502 3.190 1.00 57.81 ? 266 LEU A CD1 1
3211ATOM 1902 C CD2 . LEU A 1 242 ? 50.244 23.983 3.599 1.00 62.28 ? 266 LEU A CD2 1
3212ATOM 1903 N N . ILE A 1 243 ? 51.310 20.777 7.632 1.00 52.63 ? 267 ILE A N 1
3213ATOM 1904 C CA . ILE A 1 243 ? 52.600 20.346 8.157 1.00 56.56 ? 267 ILE A CA 1
3214ATOM 1905 C C . ILE A 1 243 ? 52.638 18.831 8.285 1.00 60.83 ? 267 ILE A C 1
3215ATOM 1906 O O . ILE A 1 243 ? 53.565 18.173 7.798 1.00 55.66 ? 267 ILE A O 1
3216ATOM 1907 C CB . ILE A 1 243 ? 52.877 21.037 9.500 1.00 57.03 ? 267 ILE A CB 1
3217ATOM 1908 C CG1 . ILE A 1 243 ? 52.899 22.552 9.300 1.00 50.74 ? 267 ILE A CG1 1
3218ATOM 1909 C CG2 . ILE A 1 243 ? 54.194 20.537 10.088 1.00 54.00 ? 267 ILE A CG2 1
3219ATOM 1910 C CD1 . ILE A 1 243 ? 53.523 23.302 10.429 1.00 46.73 ? 267 ILE A CD1 1
3220ATOM 1911 N N . ARG A 1 244 ? 51.619 18.251 8.928 1.00 54.07 ? 268 ARG A N 1
3221ATOM 1912 C CA . ARG A 1 244 ? 51.590 16.808 9.143 1.00 63.07 ? 268 ARG A CA 1
3222ATOM 1913 C C . ARG A 1 244 ? 51.472 16.032 7.839 1.00 59.51 ? 268 ARG A C 1
3223ATOM 1914 O O . ARG A 1 244 ? 51.812 14.843 7.803 1.00 57.00 ? 268 ARG A O 1
3224ATOM 1915 C CB . ARG A 1 244 ? 50.433 16.455 10.078 1.00 49.44 ? 268 ARG A CB 1
3225ATOM 1916 C CG . ARG A 1 244 ? 50.728 16.762 11.535 1.00 48.96 ? 268 ARG A CG 1
3226ATOM 1917 C CD . ARG A 1 244 ? 49.729 16.097 12.457 1.00 52.62 ? 268 ARG A CD 1
3227ATOM 1918 N NE . ARG A 1 244 ? 50.020 16.391 13.854 1.00 73.85 ? 268 ARG A NE 1
3228ATOM 1919 C CZ . ARG A 1 244 ? 49.444 17.360 14.552 1.00 74.56 ? 268 ARG A CZ 1
3229ATOM 1920 N NH1 . ARG A 1 244 ? 48.543 18.163 14.007 1.00 67.99 ? 268 ARG A NH1 1
3230ATOM 1921 N NH2 . ARG A 1 244 ? 49.789 17.535 15.825 1.00 56.35 ? 268 ARG A NH2 1
3231ATOM 1922 N N . TRP A 1 245 ? 50.997 16.681 6.777 1.00 48.89 ? 269 TRP A N 1
3232ATOM 1923 C CA . TRP A 1 245 ? 50.953 16.074 5.456 1.00 49.52 ? 269 TRP A CA 1
3233ATOM 1924 C C . TRP A 1 245 ? 52.329 16.102 4.803 1.00 59.88 ? 269 TRP A C 1
3234ATOM 1925 O O . TRP A 1 245 ? 52.835 15.069 4.352 1.00 55.96 ? 269 TRP A O 1
3235ATOM 1926 C CB . TRP A 1 245 ? 49.928 16.821 4.605 1.00 53.87 ? 269 TRP A CB 1
3236ATOM 1927 C CG . TRP A 1 245 ? 49.507 16.141 3.349 1.00 53.87 ? 269 TRP A CG 1
3237ATOM 1928 C CD1 . TRP A 1 245 ? 49.696 14.836 3.010 1.00 51.63 ? 269 TRP A CD1 1
3238ATOM 1929 C CD2 . TRP A 1 245 ? 48.809 16.745 2.258 1.00 58.30 ? 269 TRP A CD2 1
3239ATOM 1930 N NE1 . TRP A 1 245 ? 49.156 14.589 1.769 1.00 66.03 ? 269 TRP A NE1 1
3240ATOM 1931 C CE2 . TRP A 1 245 ? 48.607 15.748 1.287 1.00 58.44 ? 269 TRP A CE2 1
3241ATOM 1932 C CE3 . TRP A 1 245 ? 48.338 18.038 2.009 1.00 55.15 ? 269 TRP A CE3 1
3242ATOM 1933 C CZ2 . TRP A 1 245 ? 47.952 16.001 0.084 1.00 64.51 ? 269 TRP A CZ2 1
3243ATOM 1934 C CZ3 . TRP A 1 245 ? 47.691 18.288 0.818 1.00 64.33 ? 269 TRP A CZ3 1
3244ATOM 1935 C CH2 . TRP A 1 245 ? 47.502 17.274 -0.132 1.00 60.21 ? 269 TRP A CH2 1
3245ATOM 1936 N N . CYS A 1 246 ? 52.944 17.287 4.749 1.00 56.30 ? 270 CYS A N 1
3246ATOM 1937 C CA . CYS A 1 246 ? 54.314 17.409 4.264 1.00 59.73 ? 270 CYS A CA 1
3247ATOM 1938 C C . CYS A 1 246 ? 55.265 16.510 5.038 1.00 50.03 ? 270 CYS A C 1
3248ATOM 1939 O O . CYS A 1 246 ? 56.252 16.018 4.481 1.00 50.94 ? 270 CYS A O 1
3249ATOM 1940 C CB . CYS A 1 246 ? 54.785 18.861 4.370 1.00 39.07 ? 270 CYS A CB 1
3250ATOM 1941 S SG . CYS A 1 246 ? 53.977 20.022 3.246 1.00 68.93 ? 270 CYS A SG 1
3251ATOM 1942 N N . LEU A 1 247 ? 54.990 16.289 6.319 1.00 61.17 ? 271 LEU A N 1
3252ATOM 1943 C CA . LEU A 1 247 ? 55.831 15.462 7.166 1.00 51.81 ? 271 LEU A CA 1
3253ATOM 1944 C C . LEU A 1 247 ? 55.337 14.027 7.242 1.00 45.41 ? 271 LEU A C 1
3254ATOM 1945 O O . LEU A 1 247 ? 55.697 13.308 8.178 1.00 55.36 ? 271 LEU A O 1
3255ATOM 1946 C CB . LEU A 1 247 ? 55.923 16.071 8.569 1.00 46.15 ? 271 LEU A CB 1
3256ATOM 1947 C CG . LEU A 1 247 ? 56.647 17.424 8.602 1.00 45.95 ? 271 LEU A CG 1
3257ATOM 1948 C CD1 . LEU A 1 247 ? 56.886 17.900 10.020 1.00 42.71 ? 271 LEU A CD1 1
3258ATOM 1949 C CD2 . LEU A 1 247 ? 57.955 17.370 7.823 1.00 42.44 ? 271 LEU A CD2 1
3259ATOM 1950 N N . ALA A 1 248 ? 54.512 13.602 6.289 1.00 51.92 ? 272 ALA A N 1
3260ATOM 1951 C CA . ALA A 1 248 ? 54.075 12.214 6.250 1.00 55.09 ? 272 ALA A CA 1
3261ATOM 1952 C C . ALA A 1 248 ? 55.281 11.287 6.183 1.00 51.81 ? 272 ALA A C 1
3262ATOM 1953 O O . ALA A 1 248 ? 56.260 11.561 5.483 1.00 56.55 ? 272 ALA A O 1
3263ATOM 1954 C CB . ALA A 1 248 ? 53.154 11.974 5.052 1.00 44.61 ? 272 ALA A CB 1
3264ATOM 1955 N N . LEU A 1 249 ? 55.213 10.189 6.936 1.00 55.54 ? 273 LEU A N 1
3265ATOM 1956 C CA . LEU A 1 249 ? 56.341 9.268 6.998 1.00 52.56 ? 273 LEU A CA 1
3266ATOM 1957 C C . LEU A 1 249 ? 56.613 8.637 5.641 1.00 54.86 ? 273 LEU A C 1
3267ATOM 1958 O O . LEU A 1 249 ? 57.772 8.473 5.244 1.00 59.71 ? 273 LEU A O 1
3268ATOM 1959 C CB . LEU A 1 249 ? 56.074 8.192 8.047 1.00 58.78 ? 273 LEU A CB 1
3269ATOM 1960 C CG . LEU A 1 249 ? 56.249 8.662 9.487 1.00 64.67 ? 273 LEU A CG 1
3270ATOM 1961 C CD1 . LEU A 1 249 ? 56.193 7.483 10.450 1.00 51.40 ? 273 LEU A CD1 1
3271ATOM 1962 C CD2 . LEU A 1 249 ? 57.558 9.429 9.624 1.00 43.90 ? 273 LEU A CD2 1
3272ATOM 1963 N N . ARG A 1 250 ? 55.561 8.282 4.918 1.00 55.86 ? 274 ARG A N 1
3273ATOM 1964 C CA . ARG A 1 250 ? 55.715 7.707 3.590 1.00 59.68 ? 274 ARG A CA 1
3274ATOM 1965 C C . ARG A 1 250 ? 55.845 8.828 2.567 1.00 60.10 ? 274 ARG A C 1
3275ATOM 1966 O O . ARG A 1 250 ? 54.969 9.700 2.507 1.00 68.97 ? 274 ARG A O 1
3276ATOM 1967 C CB . ARG A 1 250 ? 54.522 6.822 3.259 1.00 58.47 ? 274 ARG A CB 1
3277ATOM 1968 C CG . ARG A 1 250 ? 54.611 5.417 3.841 1.00 74.99 ? 274 ARG A CG 1
3278ATOM 1969 C CD . ARG A 1 250 ? 54.003 4.391 2.902 1.00 86.39 ? 274 ARG A CD 1
3279ATOM 1970 N NE . ARG A 1 250 ? 52.549 4.365 3.008 1.00 82.40 ? 274 ARG A NE 1
3280ATOM 1971 C CZ . ARG A 1 250 ? 51.742 3.820 2.108 1.00 94.62 ? 274 ARG A CZ 1
3281ATOM 1972 N NH1 . ARG A 1 250 ? 52.215 3.247 1.014 1.00 102.81 ? 274 ARG A NH1 1
3282ATOM 1973 N NH2 . ARG A 1 250 ? 50.427 3.851 2.312 1.00 102.35 ? 274 ARG A NH2 1
3283ATOM 1974 N N . PRO A 1 251 ? 56.915 8.859 1.765 1.00 60.42 ? 275 PRO A N 1
3284ATOM 1975 C CA . PRO A 1 251 ? 57.028 9.924 0.751 1.00 60.13 ? 275 PRO A CA 1
3285ATOM 1976 C C . PRO A 1 251 ? 55.856 9.961 -0.215 1.00 52.89 ? 275 PRO A C 1
3286ATOM 1977 O O . PRO A 1 251 ? 55.465 11.043 -0.672 1.00 49.58 ? 275 PRO A O 1
3287ATOM 1978 C CB . PRO A 1 251 ? 58.343 9.579 0.037 1.00 50.26 ? 275 PRO A CB 1
3288ATOM 1979 C CG . PRO A 1 251 ? 59.127 8.818 1.051 1.00 42.60 ? 275 PRO A CG 1
3289ATOM 1980 C CD . PRO A 1 251 ? 58.113 8.002 1.802 1.00 44.09 ? 275 PRO A CD 1
3290ATOM 1981 N N . SER A 1 252 ? 55.283 8.799 -0.540 1.00 54.08 ? 276 SER A N 1
3291ATOM 1982 C CA . SER A 1 252 ? 54.154 8.759 -1.463 1.00 50.90 ? 276 SER A CA 1
3292ATOM 1983 C C . SER A 1 252 ? 52.945 9.485 -0.886 1.00 59.21 ? 276 SER A C 1
3293ATOM 1984 O O . SER A 1 252 ? 52.184 10.125 -1.622 1.00 67.00 ? 276 SER A O 1
3294ATOM 1985 C CB . SER A 1 252 ? 53.801 7.310 -1.794 1.00 70.96 ? 276 SER A CB 1
3295ATOM 1986 O OG . SER A 1 252 ? 53.428 6.604 -0.620 1.00 66.81 ? 276 SER A OG 1
3296ATOM 1987 N N . ASP A 1 253 ? 52.754 9.403 0.433 1.00 52.22 ? 277 ASP A N 1
3297ATOM 1988 C CA . ASP A 1 253 ? 51.652 10.101 1.081 1.00 57.36 ? 277 ASP A CA 1
3298ATOM 1989 C C . ASP A 1 253 ? 51.897 11.599 1.194 1.00 51.61 ? 277 ASP A C 1
3299ATOM 1990 O O . ASP A 1 253 ? 50.983 12.329 1.591 1.00 58.56 ? 277 ASP A O 1
3300ATOM 1991 C CB . ASP A 1 253 ? 51.402 9.506 2.470 1.00 56.47 ? 277 ASP A CB 1
3301ATOM 1992 C CG . ASP A 1 253 ? 50.863 8.089 2.408 1.00 72.76 ? 277 ASP A CG 1
3302ATOM 1993 O OD1 . ASP A 1 253 ? 50.338 7.690 1.346 1.00 85.17 ? 277 ASP A OD1 1
3303ATOM 1994 O OD2 . ASP A 1 253 ? 50.978 7.367 3.419 1.00 68.79 ? 277 ASP A OD2 1
3304ATOM 1995 N N . ARG A 1 254 ? 53.088 12.068 0.848 1.00 51.63 ? 278 ARG A N 1
3305ATOM 1996 C CA . ARG A 1 254 ? 53.432 13.476 0.932 1.00 56.29 ? 278 ARG A CA 1
3306ATOM 1997 C C . ARG A 1 254 ? 52.829 14.250 -0.240 1.00 62.13 ? 278 ARG A C 1
3307ATOM 1998 O O . ARG A 1 254 ? 52.664 13.708 -1.338 1.00 55.22 ? 278 ARG A O 1
3308ATOM 1999 C CB . ARG A 1 254 ? 54.946 13.644 0.946 1.00 47.58 ? 278 ARG A CB 1
3309ATOM 2000 C CG . ARG A 1 254 ? 55.516 13.825 2.337 1.00 58.56 ? 278 ARG A CG 1
3310ATOM 2001 C CD . ARG A 1 254 ? 57.031 13.738 2.337 1.00 56.93 ? 278 ARG A CD 1
3311ATOM 2002 N NE . ARG A 1 254 ? 57.492 12.668 3.210 1.00 42.58 ? 278 ARG A NE 1
3312ATOM 2003 C CZ . ARG A 1 254 ? 58.712 12.150 3.179 1.00 47.92 ? 278 ARG A CZ 1
3313ATOM 2004 N NH1 . ARG A 1 254 ? 59.630 12.594 2.337 1.00 41.51 ? 278 ARG A NH1 1
3314ATOM 2005 N NH2 . ARG A 1 254 ? 59.013 11.152 4.005 1.00 45.08 ? 278 ARG A NH2 1
3315ATOM 2006 N N . PRO A 1 255 ? 52.490 15.517 -0.030 1.00 58.63 ? 279 PRO A N 1
3316ATOM 2007 C CA . PRO A 1 255 ? 51.840 16.294 -1.086 1.00 61.98 ? 279 PRO A CA 1
3317ATOM 2008 C C . PRO A 1 255 ? 52.821 16.759 -2.146 1.00 64.62 ? 279 PRO A C 1
3318ATOM 2009 O O . PRO A 1 255 ? 54.007 16.964 -1.887 1.00 59.74 ? 279 PRO A O 1
3319ATOM 2010 C CB . PRO A 1 255 ? 51.260 17.491 -0.327 1.00 61.41 ? 279 PRO A CB 1
3320ATOM 2011 C CG . PRO A 1 255 ? 52.191 17.670 0.825 1.00 59.71 ? 279 PRO A CG 1
3321ATOM 2012 C CD . PRO A 1 255 ? 52.643 16.291 1.215 1.00 62.81 ? 279 PRO A CD 1
3322ATOM 2013 N N . THR A 1 256 ? 52.300 16.922 -3.360 1.00 64.06 ? 280 THR A N 1
3323ATOM 2014 C CA . THR A 1 256 ? 53.050 17.605 -4.399 1.00 67.74 ? 280 THR A CA 1
3324ATOM 2015 C C . THR A 1 256 ? 53.071 19.104 -4.113 1.00 61.21 ? 280 THR A C 1
3325ATOM 2016 O O . THR A 1 256 ? 52.372 19.607 -3.230 1.00 57.51 ? 280 THR A O 1
3326ATOM 2017 C CB . THR A 1 256 ? 52.440 17.347 -5.778 1.00 58.05 ? 280 THR A CB 1
3327ATOM 2018 O OG1 . THR A 1 256 ? 51.108 17.872 -5.819 1.00 65.11 ? 280 THR A OG1 1
3328ATOM 2019 C CG2 . THR A 1 256 ? 52.395 15.857 -6.075 1.00 48.67 ? 280 THR A CG2 1
3329ATOM 2020 N N . PHE A 1 257 ? 53.888 19.827 -4.879 1.00 59.74 ? 281 PHE A N 1
3330ATOM 2021 C CA . PHE A 1 257 ? 53.913 21.278 -4.734 1.00 55.50 ? 281 PHE A CA 1
3331ATOM 2022 C C . PHE A 1 257 ? 52.580 21.896 -5.139 1.00 53.52 ? 281 PHE A C 1
3332ATOM 2023 O O . PHE A 1 257 ? 52.135 22.878 -4.534 1.00 58.81 ? 281 PHE A O 1
3333ATOM 2024 C CB . PHE A 1 257 ? 55.060 21.875 -5.547 1.00 52.54 ? 281 PHE A CB 1
3334ATOM 2025 C CG . PHE A 1 257 ? 56.401 21.297 -5.212 1.00 59.13 ? 281 PHE A CG 1
3335ATOM 2026 C CD1 . PHE A 1 257 ? 56.865 21.305 -3.910 1.00 72.80 ? 281 PHE A CD1 1
3336ATOM 2027 C CD2 . PHE A 1 257 ? 57.205 20.754 -6.201 1.00 82.65 ? 281 PHE A CD2 1
3337ATOM 2028 C CE1 . PHE A 1 257 ? 58.099 20.778 -3.594 1.00 67.96 ? 281 PHE A CE1 1
3338ATOM 2029 C CE2 . PHE A 1 257 ? 58.442 20.223 -5.888 1.00 77.95 ? 281 PHE A CE2 1
3339ATOM 2030 C CZ . PHE A 1 257 ? 58.889 20.237 -4.583 1.00 64.09 ? 281 PHE A CZ 1
3340ATOM 2031 N N . GLU A 1 258 ? 51.922 21.335 -6.156 1.00 67.11 ? 282 GLU A N 1
3341ATOM 2032 C CA . GLU A 1 258 ? 50.571 21.787 -6.469 1.00 69.40 ? 282 GLU A CA 1
3342ATOM 2033 C C . GLU A 1 258 ? 49.631 21.514 -5.304 1.00 69.32 ? 282 GLU A C 1
3343ATOM 2034 O O . GLU A 1 258 ? 48.832 22.378 -4.923 1.00 64.25 ? 282 GLU A O 1
3344ATOM 2035 C CB . GLU A 1 258 ? 50.045 21.107 -7.735 1.00 67.77 ? 282 GLU A CB 1
3345ATOM 2036 C CG . GLU A 1 258 ? 48.520 21.138 -7.818 1.00 89.96 ? 282 GLU A CG 1
3346ATOM 2037 C CD . GLU A 1 258 ? 47.924 20.004 -8.630 1.00 110.43 ? 282 GLU A CD 1
3347ATOM 2038 O OE1 . GLU A 1 258 ? 48.194 19.936 -9.850 1.00 111.79 ? 282 GLU A OE1 1
3348ATOM 2039 O OE2 . GLU A 1 258 ? 47.177 19.186 -8.045 1.00 102.87 ? 282 GLU A OE2 1
3349ATOM 2040 N N . GLU A 1 259 ? 49.722 20.318 -4.718 1.00 66.40 ? 283 GLU A N 1
3350ATOM 2041 C CA . GLU A 1 259 ? 48.844 19.966 -3.609 1.00 65.15 ? 283 GLU A CA 1
3351ATOM 2042 C C . GLU A 1 259 ? 49.148 20.790 -2.366 1.00 58.74 ? 283 GLU A C 1
3352ATOM 2043 O O . GLU A 1 259 ? 48.242 21.065 -1.571 1.00 66.18 ? 283 GLU A O 1
3353ATOM 2044 C CB . GLU A 1 259 ? 48.950 18.472 -3.302 1.00 61.68 ? 283 GLU A CB 1
3354ATOM 2045 C CG . GLU A 1 259 ? 47.929 17.621 -4.041 1.00 58.31 ? 283 GLU A CG 1
3355ATOM 2046 C CD . GLU A 1 259 ? 48.287 16.147 -4.053 1.00 78.28 ? 283 GLU A CD 1
3356ATOM 2047 O OE1 . GLU A 1 259 ? 47.541 15.362 -4.683 1.00 82.65 ? 283 GLU A OE1 1
3357ATOM 2048 O OE2 . GLU A 1 259 ? 49.315 15.776 -3.442 1.00 52.82 ? 283 GLU A OE2 1
3358ATOM 2049 N N . ILE A 1 260 ? 50.409 21.180 -2.170 1.00 58.27 ? 284 ILE A N 1
3359ATOM 2050 C CA . ILE A 1 260 ? 50.723 22.117 -1.098 1.00 54.00 ? 284 ILE A CA 1
3360ATOM 2051 C C . ILE A 1 260 ? 50.091 23.474 -1.379 1.00 65.37 ? 284 ILE A C 1
3361ATOM 2052 O O . ILE A 1 260 ? 49.424 24.058 -0.519 1.00 69.58 ? 284 ILE A O 1
3362ATOM 2053 C CB . ILE A 1 260 ? 52.245 22.247 -0.909 1.00 59.01 ? 284 ILE A CB 1
3363ATOM 2054 C CG1 . ILE A 1 260 ? 52.826 21.003 -0.236 1.00 51.56 ? 284 ILE A CG1 1
3364ATOM 2055 C CG2 . ILE A 1 260 ? 52.570 23.485 -0.110 1.00 46.48 ? 284 ILE A CG2 1
3365ATOM 2056 C CD1 . ILE A 1 260 ? 54.346 20.966 -0.231 1.00 44.88 ? 284 ILE A CD1 1
3366ATOM 2057 N N . GLN A 1 261 ? 50.287 23.990 -2.591 1.00 61.20 ? 285 GLN A N 1
3367ATOM 2058 C CA . GLN A 1 261 ? 49.857 25.342 -2.914 1.00 56.77 ? 285 GLN A CA 1
3368ATOM 2059 C C . GLN A 1 261 ? 48.349 25.446 -3.085 1.00 61.89 ? 285 GLN A C 1
3369ATOM 2060 O O . GLN A 1 261 ? 47.809 26.554 -3.017 1.00 65.63 ? 285 GLN A O 1
3370ATOM 2061 C CB . GLN A 1 261 ? 50.574 25.805 -4.179 1.00 63.76 ? 285 GLN A CB 1
3371ATOM 2062 C CG . GLN A 1 261 ? 51.997 26.253 -3.923 1.00 49.41 ? 285 GLN A CG 1
3372ATOM 2063 C CD . GLN A 1 261 ? 52.711 26.670 -5.183 1.00 64.23 ? 285 GLN A CD 1
3373ATOM 2064 O OE1 . GLN A 1 261 ? 52.641 25.985 -6.206 1.00 63.97 ? 285 GLN A OE1 1
3374ATOM 2065 N NE2 . GLN A 1 261 ? 53.414 27.794 -5.118 1.00 65.23 ? 285 GLN A NE2 1
3375ATOM 2066 N N . ASN A 1 262 ? 47.665 24.323 -3.296 1.00 67.09 ? 286 ASN A N 1
3376ATOM 2067 C CA . ASN A 1 262 ? 46.221 24.298 -3.468 1.00 67.33 ? 286 ASN A CA 1
3377ATOM 2068 C C . ASN A 1 262 ? 45.492 23.914 -2.190 1.00 62.07 ? 286 ASN A C 1
3378ATOM 2069 O O . ASN A 1 262 ? 44.305 23.587 -2.240 1.00 72.98 ? 286 ASN A O 1
3379ATOM 2070 C CB . ASN A 1 262 ? 45.844 23.329 -4.588 1.00 60.55 ? 286 ASN A CB 1
3380ATOM 2071 C CG . ASN A 1 262 ? 45.690 24.019 -5.920 1.00 84.30 ? 286 ASN A CG 1
3381ATOM 2072 O OD1 . ASN A 1 262 ? 45.237 25.162 -5.995 1.00 102.04 ? 286 ASN A OD1 1
3382ATOM 2073 N ND2 . ASN A 1 262 ? 46.083 23.332 -6.986 1.00 90.30 ? 286 ASN A ND2 1
3383ATOM 2074 N N . HIS A 1 263 ? 46.176 23.943 -1.044 1.00 67.68 ? 287 HIS A N 1
3384ATOM 2075 C CA . HIS A 1 263 ? 45.783 23.545 0.305 1.00 72.61 ? 287 HIS A CA 1
3385ATOM 2076 C C . HIS A 1 263 ? 45.090 24.708 1.015 1.00 68.90 ? 287 HIS A C 1
3386ATOM 2077 O O . HIS A 1 263 ? 45.462 25.867 0.809 1.00 76.30 ? 287 HIS A O 1
3387ATOM 2078 C CB . HIS A 1 263 ? 47.007 23.087 1.101 1.00 61.02 ? 287 HIS A CB 1
3388ATOM 2079 C CG . HIS A 1 263 ? 46.694 22.597 2.479 1.00 64.43 ? 287 HIS A CG 1
3389ATOM 2080 N ND1 . HIS A 1 263 ? 46.429 23.444 3.533 1.00 73.65 ? 287 HIS A ND1 1
3390ATOM 2081 C CD2 . HIS A 1 263 ? 46.594 21.341 2.972 1.00 64.87 ? 287 HIS A CD2 1
3391ATOM 2082 C CE1 . HIS A 1 263 ? 46.186 22.730 4.618 1.00 71.18 ? 287 HIS A CE1 1
3392ATOM 2083 N NE2 . HIS A 1 263 ? 46.278 21.451 4.304 1.00 72.16 ? 287 HIS A NE2 1
3393ATOM 2084 N N . PRO A 1 264 ? 44.030 24.479 1.833 1.00 82.86 ? 288 PRO A N 1
3394ATOM 2085 C CA . PRO A 1 264 ? 43.319 25.559 2.513 1.00 81.36 ? 288 PRO A CA 1
3395ATOM 2086 C C . PRO A 1 264 ? 44.185 26.604 3.227 1.00 83.59 ? 288 PRO A C 1
3396ATOM 2087 O O . PRO A 1 264 ? 43.824 27.754 3.177 1.00 89.62 ? 288 PRO A O 1
3397ATOM 2088 C CB . PRO A 1 264 ? 42.528 24.823 3.598 1.00 71.28 ? 288 PRO A CB 1
3398ATOM 2089 C CG . PRO A 1 264 ? 42.119 23.553 2.928 1.00 77.95 ? 288 PRO A CG 1
3399ATOM 2090 C CD . PRO A 1 264 ? 43.338 23.192 2.111 1.00 79.83 ? 288 PRO A CD 1
3400ATOM 2091 N N . TRP A 1 265 ? 45.249 26.185 3.912 1.00 84.20 ? 289 TRP A N 1
3401ATOM 2092 C CA . TRP A 1 265 ? 46.069 27.149 4.693 1.00 70.77 ? 289 TRP A CA 1
3402ATOM 2093 C C . TRP A 1 265 ? 46.871 28.024 3.739 1.00 73.07 ? 289 TRP A C 1
3403ATOM 2094 O O . TRP A 1 265 ? 47.240 29.125 4.124 1.00 72.56 ? 289 TRP A O 1
3404ATOM 2095 C CB . TRP A 1 265 ? 46.991 26.438 5.680 1.00 65.94 ? 289 TRP A CB 1
3405ATOM 2096 C CG . TRP A 1 265 ? 47.820 27.390 6.477 1.00 58.59 ? 289 TRP A CG 1
3406ATOM 2097 C CD1 . TRP A 1 265 ? 47.430 28.108 7.567 1.00 78.14 ? 289 TRP A CD1 1
3407ATOM 2098 C CD2 . TRP A 1 265 ? 49.179 27.764 6.212 1.00 72.18 ? 289 TRP A CD2 1
3408ATOM 2099 N NE1 . TRP A 1 265 ? 48.460 28.889 8.009 1.00 71.36 ? 289 TRP A NE1 1
3409ATOM 2100 C CE2 . TRP A 1 265 ? 49.544 28.702 7.197 1.00 79.43 ? 289 TRP A CE2 1
3410ATOM 2101 C CE3 . TRP A 1 265 ? 50.117 27.397 5.243 1.00 62.04 ? 289 TRP A CE3 1
3411ATOM 2102 C CZ2 . TRP A 1 265 ? 50.815 29.267 7.247 1.00 78.13 ? 289 TRP A CZ2 1
3412ATOM 2103 C CZ3 . TRP A 1 265 ? 51.369 27.963 5.287 1.00 64.27 ? 289 TRP A CZ3 1
3413ATOM 2104 C CH2 . TRP A 1 265 ? 51.709 28.879 6.280 1.00 71.83 ? 289 TRP A CH2 1
3414ATOM 2105 N N . MET A 1 266 ? 47.101 27.540 2.528 1.00 75.57 ? 290 MET A N 1
3415ATOM 2106 C CA . MET A 1 266 ? 47.913 28.292 1.551 1.00 67.04 ? 290 MET A CA 1
3416ATOM 2107 C C . MET A 1 266 ? 47.008 29.235 0.767 1.00 80.05 ? 290 MET A C 1
3417ATOM 2108 O O . MET A 1 266 ? 47.419 29.695 -0.310 1.00 87.20 ? 290 MET A O 1
3418ATOM 2109 C CB . MET A 1 266 ? 48.599 27.311 0.604 1.00 64.13 ? 290 MET A CB 1
3419ATOM 2110 C CG . MET A 1 266 ? 49.758 26.626 1.263 1.00 61.56 ? 290 MET A CG 1
3420ATOM 2111 S SD . MET A 1 266 ? 51.102 27.789 1.495 1.00 69.71 ? 290 MET A SD 1
3421ATOM 2112 C CE . MET A 1 266 ? 51.950 27.545 -0.059 1.00 57.30 ? 290 MET A CE 1
3422ATOM 2113 N N . GLN A 1 267 ? 45.827 29.519 1.309 1.00 80.12 ? 291 GLN A N 1
3423ATOM 2114 C CA . GLN A 1 267 ? 44.856 30.384 0.597 1.00 99.00 ? 291 GLN A CA 1
3424ATOM 2115 C C . GLN A 1 267 ? 44.960 31.805 1.140 1.00 95.27 ? 291 GLN A C 1
3425ATOM 2116 O O . GLN A 1 267 ? 45.267 31.943 2.334 1.00 97.60 ? 291 GLN A O 1
3426ATOM 2117 C CB . GLN A 1 267 ? 43.443 29.825 0.756 1.00 91.28 ? 291 GLN A CB 1
3427ATOM 2118 C CG . GLN A 1 267 ? 42.997 28.963 -0.414 1.00 100.67 ? 291 GLN A CG 1
3428ATOM 2119 C CD . GLN A 1 267 ? 41.525 29.125 -0.698 1.00 113.85 ? 291 GLN A CD 1
3429ATOM 2120 O OE1 . GLN A 1 267 ? 40.729 29.415 0.191 1.00 112.45 ? 291 GLN A OE1 1
3430ATOM 2121 N NE2 . GLN A 1 267 ? 41.150 28.937 -1.952 1.00 112.86 ? 291 GLN A NE2 1
3431ATOM 2122 N N . ASP A 1 268 ? 44.723 32.806 0.290 1.00 86.48 ? 292 ASP A N 1
3432ATOM 2123 C CA . ASP A 1 268 ? 44.744 34.229 0.726 1.00 92.82 ? 292 ASP A CA 1
3433ATOM 2124 C C . ASP A 1 268 ? 46.171 34.590 1.142 1.00 87.91 ? 292 ASP A C 1
3434ATOM 2125 O O . ASP A 1 268 ? 46.341 35.284 2.158 1.00 73.59 ? 292 ASP A O 1
3435ATOM 2126 C CB . ASP A 1 268 ? 43.667 34.504 1.782 1.00 92.45 ? 292 ASP A CB 1
3436ATOM 2127 C CG . ASP A 1 268 ? 42.350 33.801 1.501 1.00 107.29 ? 292 ASP A CG 1
3437ATOM 2128 O OD1 . ASP A 1 268 ? 41.876 33.883 0.353 1.00 100.18 ? 292 ASP A OD1 1
3438ATOM 2129 O OD2 . ASP A 1 268 ? 41.817 33.166 2.430 1.00 102.26 ? 292 ASP A OD2 1
3439ATOM 2130 N N . VAL A 1 269 ? 47.141 34.136 0.351 1.00 89.19 ? 293 VAL A N 1
3440ATOM 2131 C CA . VAL A 1 269 ? 48.572 34.451 0.610 1.00 80.46 ? 293 VAL A CA 1
3441ATOM 2132 C C . VAL A 1 269 ? 48.801 35.917 0.261 1.00 83.05 ? 293 VAL A C 1
3442ATOM 2133 O O . VAL A 1 269 ? 48.363 36.356 -0.818 1.00 84.99 ? 293 VAL A O 1
3443ATOM 2134 C CB . VAL A 1 269 ? 49.495 33.537 -0.216 1.00 78.45 ? 293 VAL A CB 1
3444ATOM 2135 C CG1 . VAL A 1 269 ? 49.313 33.739 -1.712 1.00 86.37 ? 293 VAL A CG1 1
3445ATOM 2136 C CG2 . VAL A 1 269 ? 50.956 33.684 0.173 1.00 65.21 ? 293 VAL A CG2 1
3446ATOM 2137 N N . LEU A 1 270 ? 49.474 36.635 1.150 1.00 83.80 ? 294 LEU A N 1
3447ATOM 2138 C CA . LEU A 1 270 ? 49.746 38.065 0.911 1.00 83.78 ? 294 LEU A CA 1
3448ATOM 2139 C C . LEU A 1 270 ? 50.944 38.191 -0.023 1.00 77.43 ? 294 LEU A C 1
3449ATOM 2140 O O . LEU A 1 270 ? 51.886 37.403 0.121 1.00 79.31 ? 294 LEU A O 1
3450ATOM 2141 C CB . LEU A 1 270 ? 50.010 38.718 2.264 1.00 85.41 ? 294 LEU A CB 1
3451ATOM 2142 C CG . LEU A 1 270 ? 48.768 38.904 3.128 1.00 80.97 ? 294 LEU A CG 1
3452ATOM 2143 C CD1 . LEU A 1 270 ? 48.965 40.071 4.066 1.00 88.70 ? 294 LEU A CD1 1
3453ATOM 2144 C CD2 . LEU A 1 270 ? 47.535 39.129 2.266 1.00 75.28 ? 294 LEU A CD2 1
3454ATOM 2145 N N . LEU A 1 271 ? 50.889 39.141 -0.953 1.00 85.00 ? 295 LEU A N 1
3455ATOM 2146 C CA . LEU A 1 271 ? 52.029 39.388 -1.866 1.00 84.29 ? 295 LEU A CA 1
3456ATOM 2147 C C . LEU A 1 271 ? 53.207 39.891 -1.036 1.00 73.26 ? 295 LEU A C 1
3457ATOM 2148 O O . LEU A 1 271 ? 52.974 40.438 0.053 1.00 78.02 ? 295 LEU A O 1
3458ATOM 2149 C CB . LEU A 1 271 ? 51.601 40.407 -2.923 1.00 95.30 ? 295 LEU A CB 1
3459ATOM 2150 C CG . LEU A 1 271 ? 50.758 39.853 -4.068 1.00 92.87 ? 295 LEU A CG 1
3460ATOM 2151 C CD1 . LEU A 1 271 ? 50.681 40.854 -5.208 1.00 93.83 ? 295 LEU A CD1 1
3461ATOM 2152 C CD2 . LEU A 1 271 ? 51.317 38.529 -4.561 1.00 78.73 ? 295 LEU A CD2 1
3462ATOM 2153 N N . PRO A 1 272 ? 54.465 39.688 -1.468 1.00 77.40 ? 296 PRO A N 1
3463ATOM 2154 C CA . PRO A 1 272 ? 55.619 40.045 -0.623 1.00 69.17 ? 296 PRO A CA 1
3464ATOM 2155 C C . PRO A 1 272 ? 55.641 41.497 -0.166 1.00 72.80 ? 296 PRO A C 1
3465ATOM 2156 O O . PRO A 1 272 ? 56.128 41.784 0.935 1.00 77.51 ? 296 PRO A O 1
3466ATOM 2157 C CB . PRO A 1 272 ? 56.810 39.723 -1.532 1.00 68.85 ? 296 PRO A CB 1
3467ATOM 2158 C CG . PRO A 1 272 ? 56.321 38.593 -2.366 1.00 64.05 ? 296 PRO A CG 1
3468ATOM 2159 C CD . PRO A 1 272 ? 54.867 38.879 -2.632 1.00 77.42 ? 296 PRO A CD 1
3469ATOM 2160 N N . GLN A 1 273 ? 55.140 42.430 -0.976 1.00 76.90 ? 297 GLN A N 1
3470ATOM 2161 C CA . GLN A 1 273 ? 55.124 43.831 -0.565 1.00 85.56 ? 297 GLN A CA 1
3471ATOM 2162 C C . GLN A 1 273 ? 54.156 44.044 0.594 1.00 90.39 ? 297 GLN A C 1
3472ATOM 2163 O O . GLN A 1 273 ? 54.489 44.700 1.597 1.00 73.30 ? 297 GLN A O 1
3473ATOM 2164 C CB . GLN A 1 273 ? 54.753 44.724 -1.754 1.00 96.62 ? 297 GLN A CB 1
3474ATOM 2165 C CG . GLN A 1 273 ? 53.754 44.100 -2.740 1.00 108.87 ? 297 GLN A CG 1
3475ATOM 2166 C CD . GLN A 1 273 ? 54.400 43.140 -3.734 1.00 102.77 ? 297 GLN A CD 1
3476ATOM 2167 O OE1 . GLN A 1 273 ? 54.816 42.039 -3.371 1.00 79.79 ? 297 GLN A OE1 1
3477ATOM 2168 N NE2 . GLN A 1 273 ? 54.473 43.552 -4.995 1.00 102.32 ? 297 GLN A NE2 1
3478ATOM 2169 N N . GLU A 1 274 ? 52.944 43.493 0.469 1.00 84.19 ? 298 GLU A N 1
3479ATOM 2170 C CA . GLU A 1 274 ? 51.976 43.570 1.555 1.00 91.62 ? 298 GLU A CA 1
3480ATOM 2171 C C . GLU A 1 274 ? 52.530 42.942 2.825 1.00 93.05 ? 298 GLU A C 1
3481ATOM 2172 O O . GLU A 1 274 ? 52.329 43.471 3.925 1.00 91.97 ? 298 GLU A O 1
3482ATOM 2173 C CB . GLU A 1 274 ? 50.666 42.888 1.154 1.00 90.86 ? 298 GLU A CB 1
3483ATOM 2174 C CG . GLU A 1 274 ? 50.196 43.184 -0.260 1.00 92.61 ? 298 GLU A CG 1
3484ATOM 2175 C CD . GLU A 1 274 ? 48.811 42.623 -0.541 1.00 93.73 ? 298 GLU A CD 1
3485ATOM 2176 O OE1 . GLU A 1 274 ? 48.683 41.385 -0.659 1.00 103.41 ? 298 GLU A OE1 1
3486ATOM 2177 O OE2 . GLU A 1 274 ? 47.851 43.416 -0.644 1.00 101.00 ? 298 GLU A OE2 1
3487ATOM 2178 N N . THR A 1 275 ? 53.233 41.812 2.696 1.00 81.30 ? 299 THR A N 1
3488ATOM 2179 C CA . THR A 1 275 ? 53.755 41.156 3.888 1.00 81.69 ? 299 THR A CA 1
3489ATOM 2180 C C . THR A 1 275 ? 54.888 41.970 4.502 1.00 86.31 ? 299 THR A C 1
3490ATOM 2181 O O . THR A 1 275 ? 55.053 41.968 5.728 1.00 84.99 ? 299 THR A O 1
3491ATOM 2182 C CB . THR A 1 275 ? 54.194 39.715 3.567 1.00 76.29 ? 299 THR A CB 1
3492ATOM 2183 O OG1 . THR A 1 275 ? 54.212 38.942 4.772 1.00 89.93 ? 299 THR A OG1 1
3493ATOM 2184 C CG2 . THR A 1 275 ? 55.582 39.664 2.976 1.00 80.40 ? 299 THR A CG2 1
3494ATOM 2185 N N . ALA A 1 276 ? 55.642 42.708 3.678 1.00 85.99 ? 300 ALA A N 1
3495ATOM 2186 C CA . ALA A 1 276 ? 56.668 43.592 4.221 1.00 84.99 ? 300 ALA A CA 1
3496ATOM 2187 C C . ALA A 1 276 ? 56.044 44.738 5.005 1.00 98.60 ? 300 ALA A C 1
3497ATOM 2188 O O . ALA A 1 276 ? 56.558 45.128 6.061 1.00 95.16 ? 300 ALA A O 1
3498ATOM 2189 C CB . ALA A 1 276 ? 57.554 44.132 3.100 1.00 64.02 ? 300 ALA A CB 1
3499ATOM 2190 N N . GLU A 1 277 ? 54.936 45.292 4.508 1.00 99.08 ? 301 GLU A N 1
3500ATOM 2191 C CA . GLU A 1 277 ? 54.290 46.382 5.241 1.00 95.88 ? 301 GLU A CA 1
3501ATOM 2192 C C . GLU A 1 277 ? 53.638 45.883 6.528 1.00 98.12 ? 301 GLU A C 1
3502ATOM 2193 O O . GLU A 1 277 ? 53.769 46.511 7.586 1.00 84.13 ? 301 GLU A O 1
3503ATOM 2194 C CB . GLU A 1 277 ? 53.259 47.095 4.367 1.00 96.83 ? 301 GLU A CB 1
3504ATOM 2195 C CG . GLU A 1 277 ? 53.823 47.715 3.107 1.00 105.66 ? 301 GLU A CG 1
3505ATOM 2196 C CD . GLU A 1 277 ? 52.802 47.776 1.995 1.00 109.46 ? 301 GLU A CD 1
3506ATOM 2197 O OE1 . GLU A 1 277 ? 53.104 48.379 0.945 1.00 108.93 ? 301 GLU A OE1 1
3507ATOM 2198 O OE2 . GLU A 1 277 ? 51.692 47.230 2.177 1.00 118.55 ? 301 GLU A OE2 1
3508ATOM 2199 N N . ILE A 1 278 ? 52.897 44.777 6.448 1.00 92.84 ? 302 ILE A N 1
3509ATOM 2200 C CA . ILE A 1 278 ? 52.130 44.300 7.641 1.00 96.92 ? 302 ILE A CA 1
3510ATOM 2201 C C . ILE A 1 278 ? 53.070 43.685 8.680 1.00 89.16 ? 302 ILE A C 1
3511ATOM 2202 O O . ILE A 1 278 ? 52.814 43.875 9.881 1.00 93.63 ? 302 ILE A O 1
3512ATOM 2203 C CB . ILE A 1 278 ? 51.010 43.330 7.209 1.00 88.22 ? 302 ILE A CB 1
3513ATOM 2204 C CG1 . ILE A 1 278 ? 50.073 43.995 6.198 1.00 88.06 ? 302 ILE A CG1 1
3514ATOM 2205 C CG2 . ILE A 1 278 ? 50.241 42.787 8.402 1.00 74.57 ? 302 ILE A CG2 1
3515ATOM 2206 C CD1 . ILE A 1 278 ? 48.772 43.266 5.987 1.00 72.50 ? 302 ILE A CD1 1
3516ATOM 2207 N N . HIS A 1 279 ? 54.161 43.053 8.256 1.00 93.60 ? 303 HIS A N 1
3517ATOM 2208 C CA . HIS A 1 279 ? 54.986 42.322 9.250 1.00 90.77 ? 303 HIS A CA 1
3518ATOM 2209 C C . HIS A 1 279 ? 56.443 42.772 9.318 1.00 94.43 ? 303 HIS A C 1
3519ATOM 2210 O O . HIS A 1 279 ? 56.984 42.766 10.430 1.00 114.62 ? 303 HIS A O 1
3520ATOM 2211 C CB . HIS A 1 279 ? 54.936 40.832 8.928 1.00 82.59 ? 303 HIS A CB 1
3521ATOM 2212 C CG . HIS A 1 279 ? 53.614 40.202 9.172 1.00 82.35 ? 303 HIS A CG 1
3522ATOM 2213 N ND1 . HIS A 1 279 ? 53.128 39.995 10.440 1.00 78.92 ? 303 HIS A ND1 1
3523ATOM 2214 C CD2 . HIS A 1 279 ? 52.684 39.730 8.319 1.00 76.32 ? 303 HIS A CD2 1
3524ATOM 2215 C CE1 . HIS A 1 279 ? 51.949 39.424 10.359 1.00 81.27 ? 303 HIS A CE1 1
3525ATOM 2216 N NE2 . HIS A 1 279 ? 51.660 39.244 9.076 1.00 79.64 ? 303 HIS A NE2 1
3526ATOM 2217 N N . LEU A 1 280 ? 57.067 43.132 8.200 1.00 82.14 ? 304 LEU A N 1
3527ATOM 2218 C CA . LEU A 1 280 ? 58.532 43.412 8.256 1.00 88.71 ? 304 LEU A CA 1
3528ATOM 2219 C C . LEU A 1 280 ? 58.813 44.919 8.287 1.00 101.23 ? 304 LEU A C 1
3529ATOM 2220 O O . LEU A 1 280 ? 59.953 45.297 7.951 1.00 98.41 ? 304 LEU A O 1
3530ATOM 2221 C CB . LEU A 1 280 ? 59.219 42.736 7.064 1.00 80.89 ? 304 LEU A CB 1
3531ATOM 2222 C CG . LEU A 1 280 ? 58.636 41.404 6.600 1.00 69.59 ? 304 LEU A CG 1
3532ATOM 2223 C CD1 . LEU A 1 280 ? 59.311 40.949 5.323 1.00 75.06 ? 304 LEU A CD1 1
3533ATOM 2224 C CD2 . LEU A 1 280 ? 58.793 40.342 7.667 1.00 68.69 ? 304 LEU A CD2 1
3534ATOM 2225 N N . HIS A 1 281 ? 57.833 45.732 8.693 1.00 115.46 ? 305 HIS A N 1
3535ATOM 2226 C CA . HIS A 1 281 ? 57.984 47.212 8.759 1.00 109.67 ? 305 HIS A CA 1
3536ATOM 2227 C C . HIS A 1 281 ? 58.718 47.710 7.509 1.00 115.30 ? 305 HIS A C 1
3537ATOM 2228 O O . HIS A 1 281 ? 58.032 47.902 6.489 1.00 110.30 ? 305 HIS A O 1
3538ATOM 2229 C CB . HIS A 1 281 ? 58.623 47.614 10.098 1.00 112.37 ? 305 HIS A CB 1
3539ATOM 2230 C CG . HIS A 1 281 ? 58.789 49.081 10.314 1.00 136.06 ? 305 HIS A CG 1
3540ATOM 2231 N ND1 . HIS A 1 281 ? 57.714 49.947 10.363 1.00 136.85 ? 305 HIS A ND1 1
3541ATOM 2232 C CD2 . HIS A 1 281 ? 59.891 49.833 10.527 1.00 134.82 ? 305 HIS A CD2 1
3542ATOM 2233 C CE1 . HIS A 1 281 ? 58.148 51.172 10.575 1.00 135.61 ? 305 HIS A CE1 1
3543ATOM 2234 N NE2 . HIS A 1 281 ? 59.481 51.128 10.679 1.00 141.13 ? 305 HIS A NE2 1
3544HETATM 2235 C C10 . I4M B 2 . ? 75.689 31.411 2.251 1.00 44.21 ? 401 I4M A C10 1
3545HETATM 2236 C C13 . I4M B 2 . ? 74.415 36.065 2.521 1.00 68.49 ? 401 I4M A C13 1
3546HETATM 2237 C C15 . I4M B 2 . ? 72.507 36.819 7.067 1.00 73.75 ? 401 I4M A C15 1
3547HETATM 2238 C C17 . I4M B 2 . ? 74.875 33.614 3.762 1.00 48.92 ? 401 I4M A C17 1
3548HETATM 2239 C C20 . I4M B 2 . ? 76.041 33.879 4.698 1.00 54.65 ? 401 I4M A C20 1
3549HETATM 2240 C C21 . I4M B 2 . ? 75.563 34.689 5.887 1.00 71.38 ? 401 I4M A C21 1
3550HETATM 2241 C C22 . I4M B 2 . ? 73.882 37.221 1.926 1.00 53.91 ? 401 I4M A C22 1
3551HETATM 2242 C C24 . I4M B 2 . ? 74.353 34.886 0.354 1.00 44.88 ? 401 I4M A C24 1
3552HETATM 2243 C C26 . I4M B 2 . ? 74.629 34.954 1.717 1.00 61.33 ? 401 I4M A C26 1
3553HETATM 2244 C C07 . I4M B 2 . ? 74.558 34.421 8.981 1.00 65.16 ? 401 I4M A C07 1
3554HETATM 2245 C C08 . I4M B 2 . ? 75.767 30.296 1.417 1.00 48.87 ? 401 I4M A C08 1
3555HETATM 2246 C C09 . I4M B 2 . ? 75.096 31.489 -0.468 1.00 53.07 ? 401 I4M A C09 1
3556HETATM 2247 C C11 . I4M B 2 . ? 73.580 37.216 0.548 1.00 37.13 ? 401 I4M A C11 1
3557HETATM 2248 C C12 . I4M B 2 . ? 73.807 36.050 -0.214 1.00 43.65 ? 401 I4M A C12 1
3558HETATM 2249 C C14 . I4M B 2 . ? 73.157 38.018 5.137 1.00 66.76 ? 401 I4M A C14 1
3559HETATM 2250 C C16 . I4M B 2 . ? 72.673 38.118 3.679 1.00 58.53 ? 401 I4M A C16 1
3560HETATM 2251 C C18 . I4M B 2 . ? 73.826 36.314 7.587 1.00 59.94 ? 401 I4M A C18 1
3561HETATM 2252 C C19 . I4M B 2 . ? 74.294 34.105 6.599 1.00 84.74 ? 401 I4M A C19 1
3562HETATM 2253 C C23 . I4M B 2 . ? 74.979 32.680 0.239 1.00 47.37 ? 401 I4M A C23 1
3563HETATM 2254 C C25 . I4M B 2 . ? 75.285 32.597 1.584 1.00 52.02 ? 401 I4M A C25 1
3564HETATM 2255 N N04 . I4M B 2 . ? 75.480 30.329 0.110 1.00 49.51 ? 401 I4M A N04 1
3565HETATM 2256 N N05 . I4M B 2 . ? 75.167 33.778 2.317 1.00 56.34 ? 401 I4M A N05 1
3566HETATM 2257 N N06 . I4M B 2 . ? 73.837 34.850 7.779 1.00 84.06 ? 401 I4M A N06 1
3567HETATM 2258 O O01 . I4M B 2 . ? 72.474 36.895 5.657 1.00 56.29 ? 401 I4M A O01 1
3568HETATM 2259 O O02 . I4M B 2 . ? 73.636 38.336 2.669 1.00 61.45 ? 401 I4M A O02 1
3569HETATM 2260 O O03 . I4M B 2 . ? 74.578 33.807 -0.395 1.00 44.09 ? 401 I4M A O03 1
3570HETATM 2261 O O . HOH C 3 . ? 76.254 34.516 -15.077 1.00 63.17 ? 501 HOH A O 1
3571HETATM 2262 O O . HOH C 3 . ? 88.408 46.764 -5.312 1.00 75.64 ? 502 HOH A O 1
3572HETATM 2263 O O . HOH C 3 . ? 54.645 5.796 18.671 1.00 64.58 ? 503 HOH A O 1
3573HETATM 2264 O O . HOH C 3 . ? 90.815 27.420 -15.650 1.00 69.36 ? 504 HOH A O 1
3574HETATM 2265 O O . HOH C 3 . ? 55.098 37.126 13.391 1.00 58.94 ? 505 HOH A O 1
3575HETATM 2266 O O . HOH C 3 . ? 64.755 29.037 13.894 1.00 62.19 ? 506 HOH A O 1
3576HETATM 2267 O O . HOH C 3 . ? 84.506 33.180 -15.294 1.00 30.00 ? 507 HOH A O 1
3577HETATM 2268 O O . HOH C 3 . ? 77.782 47.565 1.811 1.00 59.86 ? 508 HOH A O 1
3578HETATM 2269 O O . HOH C 3 . ? 45.442 14.561 2.913 1.00 56.94 ? 509 HOH A O 1
3579HETATM 2270 O O . HOH C 3 . ? 47.793 11.542 2.705 1.00 59.90 ? 510 HOH A O 1
3580HETATM 2271 O O . HOH C 3 . ? 77.194 29.284 10.380 1.00 72.25 ? 511 HOH A O 1
3581HETATM 2272 O O . HOH C 3 . ? 66.259 45.306 -3.605 1.00 30.00 ? 512 HOH A O 1
3582HETATM 2273 O O . HOH C 3 . ? 49.308 12.702 -1.649 1.00 59.58 ? 513 HOH A O 1
3583HETATM 2274 O O . HOH C 3 . ? 52.737 19.624 22.852 1.00 65.77 ? 514 HOH A O 1
3584HETATM 2275 O O . HOH C 3 . ? 77.673 16.750 -13.626 1.00 69.79 ? 515 HOH A O 1
3585HETATM 2276 O O . HOH C 3 . ? 44.016 16.481 -1.456 1.00 61.84 ? 516 HOH A O 1
3586#
3587loop_
3588_atom_site_anisotrop.id
3589_atom_site_anisotrop.type_symbol
3590_atom_site_anisotrop.pdbx_label_atom_id
3591_atom_site_anisotrop.pdbx_label_alt_id
3592_atom_site_anisotrop.pdbx_label_comp_id
3593_atom_site_anisotrop.pdbx_label_asym_id
3594_atom_site_anisotrop.pdbx_label_seq_id
3595_atom_site_anisotrop.pdbx_PDB_ins_code
3596_atom_site_anisotrop.U[1][1]
3597_atom_site_anisotrop.U[2][2]
3598_atom_site_anisotrop.U[3][3]
3599_atom_site_anisotrop.U[1][2]
3600_atom_site_anisotrop.U[1][3]
3601_atom_site_anisotrop.U[2][3]
3602_atom_site_anisotrop.pdbx_auth_seq_id
3603_atom_site_anisotrop.pdbx_auth_comp_id
3604_atom_site_anisotrop.pdbx_auth_asym_id
3605_atom_site_anisotrop.pdbx_auth_atom_id
36061 N N . GLU A 8 ? 1.3573 1.8804 1.4893 -0.1781 0.0938 0.1082 32 GLU A N
36072 C CA . GLU A 8 ? 1.4429 1.9541 1.5573 -0.2043 0.1009 0.1137 32 GLU A CA
36083 C C . GLU A 8 ? 1.4280 1.8754 1.4917 -0.2166 0.0851 0.1048 32 GLU A C
36094 O O . GLU A 8 ? 1.1876 1.6278 1.2503 -0.2437 0.0756 0.1085 32 GLU A O
36105 C CB . GLU A 8 ? 1.3306 1.8457 1.4353 -0.1961 0.1336 0.1181 32 GLU A CB
36116 N N . PRO A 9 ? 1.4953 1.8960 1.5195 -0.1978 0.0824 0.0942 33 PRO A N
36127 C CA . PRO A 9 ? 1.4153 1.7601 1.4013 -0.2071 0.0672 0.0890 33 PRO A CA
36138 C C . PRO A 9 ? 1.3967 1.7265 1.3873 -0.2070 0.0445 0.0798 33 PRO A C
36149 O O . PRO A 9 ? 1.4432 1.7298 1.4111 -0.2163 0.0343 0.0765 33 PRO A O
361510 C CB . PRO A 9 ? 1.3797 1.6870 1.3240 -0.1884 0.0742 0.0844 33 PRO A CB
361611 C CG . PRO A 9 ? 1.3333 1.6720 1.2895 -0.1697 0.0951 0.0835 33 PRO A CG
361712 C CD . PRO A 9 ? 1.3957 1.7889 1.4069 -0.1688 0.0938 0.0871 33 PRO A CD
361813 N N . LEU A 10 ? 1.2099 1.5725 1.2290 -0.1969 0.0376 0.0768 34 LEU A N
361914 C CA . LEU A 10 ? 1.0984 1.4423 1.1141 -0.1958 0.0179 0.0673 34 LEU A CA
362015 C C . LEU A 10 ? 1.0151 1.3555 1.0344 -0.2260 0.0068 0.0674 34 LEU A C
362116 O O . LEU A 10 ? 1.0902 1.3853 1.0862 -0.2329 -0.0011 0.0590 34 LEU A O
362217 C CB . LEU A 10 ? 1.0747 1.4530 1.1168 -0.1773 0.0132 0.0664 34 LEU A CB
362318 C CG . LEU A 10 ? 1.0300 1.4051 1.0755 -0.1842 -0.0070 0.0606 34 LEU A CG
362419 C CD1 . LEU A 10 ? 0.6978 1.0165 0.7094 -0.1775 -0.0141 0.0478 34 LEU A CD1
362520 C CD2 . LEU A 10 ? 0.9675 1.3831 1.0433 -0.1675 -0.0115 0.0653 34 LEU A CD2
362621 N N . GLU A 11 ? 0.9566 1.3434 1.0059 -0.2451 0.0069 0.0767 35 GLU A N
362722 C CA . GLU A 11 ? 1.1066 1.4908 1.1563 -0.2772 -0.0058 0.0750 35 GLU A CA
362823 C C . GLU A 11 ? 1.0689 1.4121 1.0951 -0.2998 0.0006 0.0746 35 GLU A C
362924 O O . GLU A 11 ? 1.0912 1.4116 1.1061 -0.3255 -0.0076 0.0685 35 GLU A O
363025 C CB . GLU A 11 ? 1.0343 1.4852 1.1259 -0.2936 -0.0113 0.0874 35 GLU A CB
363126 C CG . GLU A 11 ? 1.1194 1.6169 1.2436 -0.2678 -0.0142 0.0937 35 GLU A CG
363227 C CD . GLU A 11 ? 1.2725 1.7875 1.4049 -0.2782 -0.0375 0.0929 35 GLU A CD
363328 O OE1 . GLU A 11 ? 1.2011 1.7658 1.3702 -0.2645 -0.0432 0.1041 35 GLU A OE1
363429 O OE2 . GLU A 11 ? 1.2419 1.7188 1.3428 -0.2999 -0.0492 0.0816 35 GLU A OE2
363530 N N . SER A 12 ? 1.0903 1.4201 1.1060 -0.2917 0.0158 0.0811 36 SER A N
363631 C CA . SER A 12 ? 1.0246 1.3118 1.0177 -0.3106 0.0219 0.0839 36 SER A CA
363732 C C . SER A 12 ? 1.1120 1.3371 1.0734 -0.2956 0.0193 0.0769 36 SER A C
363833 O O . SER A 12 ? 1.0228 1.2034 0.9696 -0.3106 0.0173 0.0735 36 SER A O
363934 C CB . SER A 12 ? 0.9680 1.2756 0.9656 -0.3139 0.0394 0.0982 36 SER A CB
364035 O OG . SER A 12 ? 1.2279 1.5499 1.2233 -0.2849 0.0488 0.0996 36 SER A OG
364136 N N . GLN A 13 ? 1.1013 1.3225 1.0540 -0.2664 0.0200 0.0754 37 GLN A N
364237 C CA . GLN A 13 ? 1.0221 1.1917 0.9509 -0.2517 0.0152 0.0718 37 GLN A CA
364338 C C . GLN A 13 ? 0.9829 1.1255 0.9120 -0.2528 0.0049 0.0590 37 GLN A C
364439 O O . GLN A 13 ? 0.9949 1.0902 0.9116 -0.2509 0.0036 0.0579 37 GLN A O
364540 C CB . GLN A 13 ? 0.9671 1.1423 0.8866 -0.2238 0.0156 0.0711 37 GLN A CB
364641 C CG . GLN A 13 ? 1.0902 1.2547 0.9869 -0.2205 0.0249 0.0823 37 GLN A CG
364742 C CD . GLN A 13 ? 1.2129 1.3458 1.0863 -0.2007 0.0168 0.0810 37 GLN A CD
364843 O OE1 . GLN A 13 ? 0.9569 1.0577 0.8295 -0.1968 0.0052 0.0784 37 GLN A OE1
364944 N NE2 . GLN A 13 ? 1.2676 1.4091 1.1222 -0.1892 0.0237 0.0827 37 GLN A NE2
365045 N N . TYR A 14 ? 0.9443 1.1160 0.8878 -0.2553 -0.0017 0.0507 38 TYR A N
365146 C CA . TYR A 14 ? 0.8457 0.9937 0.7844 -0.2555 -0.0098 0.0375 38 TYR A CA
365247 C C . TYR A 14 ? 0.9008 1.0623 0.8439 -0.2851 -0.0140 0.0324 38 TYR A C
365348 O O . TYR A 14 ? 0.9376 1.1487 0.8989 -0.2959 -0.0171 0.0389 38 TYR A O
365449 C CB . TYR A 14 ? 0.6796 0.8448 0.6238 -0.2300 -0.0165 0.0322 38 TYR A CB
365550 C CG . TYR A 14 ? 0.7965 0.9465 0.7322 -0.2046 -0.0143 0.0358 38 TYR A CG
365651 C CD1 . TYR A 14 ? 0.7375 0.8420 0.6614 -0.1963 -0.0160 0.0340 38 TYR A CD1
365752 C CD2 . TYR A 14 ? 0.7839 0.9642 0.7234 -0.1905 -0.0099 0.0418 38 TYR A CD2
365853 C CE1 . TYR A 14 ? 0.7415 0.8344 0.6565 -0.1772 -0.0178 0.0391 38 TYR A CE1
365954 C CE2 . TYR A 14 ? 0.9143 1.0768 0.8381 -0.1719 -0.0088 0.0438 38 TYR A CE2
366055 C CZ . TYR A 14 ? 0.9093 1.0295 0.8202 -0.1666 -0.0150 0.0431 38 TYR A CZ
366156 O OH . TYR A 14 ? 0.9986 1.1033 0.8929 -0.1518 -0.0178 0.0468 38 TYR A OH
366257 N N . GLN A 15 ? 0.8421 0.9583 0.7686 -0.2992 -0.0132 0.0214 39 GLN A N
366358 C CA . GLN A 15 ? 0.8466 0.9648 0.7660 -0.3298 -0.0183 0.0125 39 GLN A CA
366459 C C . GLN A 15 ? 0.8618 0.9850 0.7755 -0.3212 -0.0274 0.0018 39 GLN A C
366560 O O . GLN A 15 ? 0.9498 1.0344 0.8523 -0.3047 -0.0231 -0.0073 39 GLN A O
366661 C CB . GLN A 15 ? 0.9405 0.9987 0.8391 -0.3519 -0.0080 0.0045 39 GLN A CB
366762 C CG . GLN A 15 ? 1.2081 1.2709 1.0975 -0.3935 -0.0109 0.0001 39 GLN A CG
366863 C CD . GLN A 15 ? 1.5355 1.5275 1.3964 -0.4141 0.0008 -0.0152 39 GLN A CD
366964 O OE1 . GLN A 15 ? 1.4877 1.4688 1.3276 -0.4454 -0.0025 -0.0279 39 GLN A OE1
367065 N NE2 . GLN A 15 ? 1.4252 1.3671 1.2846 -0.3971 0.0150 -0.0134 39 GLN A NE2
367166 N N . VAL A 16 ? 0.8244 0.9970 0.7488 -0.3322 -0.0403 0.0051 40 VAL A N
367267 C CA . VAL A 16 ? 0.8203 1.0050 0.7403 -0.3244 -0.0511 -0.0008 40 VAL A CA
367368 C C . VAL A 16 ? 0.7869 0.9358 0.6743 -0.3547 -0.0531 -0.0162 40 VAL A C
367469 O O . VAL A 16 ? 0.8431 0.9864 0.7194 -0.3890 -0.0541 -0.0183 40 VAL A O
367570 C CB . VAL A 16 ? 0.7256 0.9812 0.6753 -0.3213 -0.0648 0.0138 40 VAL A CB
367671 C CG1 . VAL A 16 ? 0.8278 1.0958 0.7702 -0.3207 -0.0790 0.0105 40 VAL A CG1
367772 C CG2 . VAL A 16 ? 0.9142 1.1956 0.8900 -0.2881 -0.0578 0.0249 40 VAL A CG2
367873 N N . GLY A 17 ? 0.8684 0.9903 0.7375 -0.3440 -0.0524 -0.0277 41 GLY A N
367974 C CA . GLY A 17 ? 0.7031 0.7855 0.5348 -0.3714 -0.0504 -0.0445 41 GLY A CA
368075 C C . GLY A 17 ? 0.8696 0.9731 0.6889 -0.3733 -0.0644 -0.0463 41 GLY A C
368176 O O . GLY A 17 ? 0.7230 0.8846 0.5650 -0.3670 -0.0819 -0.0311 41 GLY A O
368277 N N . PRO A 18 ? 0.7979 0.8526 0.5812 -0.3816 -0.0553 -0.0639 42 PRO A N
368378 C CA . PRO A 18 ? 0.7290 0.7978 0.4917 -0.3883 -0.0682 -0.0657 42 PRO A CA
368479 C C . PRO A 18 ? 0.7379 0.8366 0.5286 -0.3494 -0.0738 -0.0545 42 PRO A C
368580 O O . PRO A 18 ? 0.6204 0.7082 0.4337 -0.3176 -0.0625 -0.0530 42 PRO A O
368681 C CB . PRO A 18 ? 0.9417 0.9403 0.6584 -0.4029 -0.0485 -0.0895 42 PRO A CB
368782 C CG . PRO A 18 ? 0.8665 0.8191 0.5792 -0.4135 -0.0290 -0.0992 42 PRO A CG
368883 C CD . PRO A 18 ? 0.8837 0.8664 0.6438 -0.3851 -0.0307 -0.0822 42 PRO A CD
368984 N N . LEU A 19 ? 0.7932 0.9287 0.5808 -0.3536 -0.0927 -0.0455 43 LEU A N
369085 C CA . LEU A 19 ? 0.6358 0.7921 0.4442 -0.3195 -0.0970 -0.0363 43 LEU A CA
369186 C C . LEU A 19 ? 0.7554 0.8589 0.5391 -0.3082 -0.0803 -0.0524 43 LEU A C
369287 O O . LEU A 19 ? 1.0733 1.1482 0.8162 -0.3310 -0.0777 -0.0643 43 LEU A O
369388 C CB . LEU A 19 ? 0.6738 0.8815 0.4869 -0.3278 -0.1218 -0.0196 43 LEU A CB
369489 C CG . LEU A 19 ? 0.7777 1.0089 0.6176 -0.2912 -0.1261 -0.0073 43 LEU A CG
369590 C CD1 . LEU A 19 ? 0.7093 0.9937 0.6001 -0.2698 -0.1324 0.0119 43 LEU A CD1
369691 C CD2 . LEU A 19 ? 0.7976 1.0416 0.6164 -0.3024 -0.1430 0.0000 43 LEU A CD2
369792 N N . LEU A 20 ? 0.6361 0.7271 0.4440 -0.2746 -0.0684 -0.0525 44 LEU A N
369893 C CA . LEU A 20 ? 0.7332 0.7824 0.5291 -0.2606 -0.0531 -0.0642 44 LEU A CA
369994 C C . LEU A 20 ? 0.8332 0.9000 0.6223 -0.2533 -0.0638 -0.0585 44 LEU A C
370095 O O . LEU A 20 ? 0.9808 1.0190 0.7368 -0.2662 -0.0569 -0.0689 44 LEU A O
370196 C CB . LEU A 20 ? 0.7061 0.7434 0.5330 -0.2296 -0.0423 -0.0624 44 LEU A CB
370297 C CG . LEU A 20 ? 0.8331 0.8396 0.6645 -0.2343 -0.0280 -0.0679 44 LEU A CG
370398 C CD1 . LEU A 20 ? 0.8098 0.8235 0.6737 -0.2056 -0.0273 -0.0581 44 LEU A CD1
370499 C CD2 . LEU A 20 ? 0.8803 0.8304 0.6903 -0.2436 -0.0064 -0.0849 44 LEU A CD2
3705100 N N . GLY A 21 ? 0.7148 0.8257 0.5332 -0.2330 -0.0785 -0.0417 45 GLY A N
3706101 C CA . GLY A 21 ? 0.8042 0.9323 0.6193 -0.2251 -0.0897 -0.0329 45 GLY A CA
3707102 C C . GLY A 21 ? 0.6275 0.8099 0.4760 -0.2107 -0.1073 -0.0121 45 GLY A C
3708103 O O . GLY A 21 ? 0.7937 0.9980 0.6714 -0.1998 -0.1067 -0.0061 45 GLY A O
3709104 N N . SER A 22 ? 0.7486 0.9517 0.5930 -0.2106 -0.1214 -0.0001 46 SER A N
3710105 C CA . SER A 22 ? 0.7518 1.0043 0.6326 -0.1930 -0.1361 0.0218 46 SER A CA
3711106 C C . SER A 22 ? 0.8792 1.1279 0.7571 -0.1770 -0.1406 0.0296 46 SER A C
3712107 O O . SER A 22 ? 0.8852 1.1078 0.7270 -0.1917 -0.1407 0.0235 46 SER A O
3713108 C CB . SER A 22 ? 0.6427 0.9420 0.5305 -0.2171 -0.1565 0.0380 46 SER A CB
3714109 O OG . SER A 22 ? 0.8245 1.1134 0.6699 -0.2485 -0.1681 0.0366 46 SER A OG
3715110 N N . GLY A 23 ? 0.8771 1.1489 0.7914 -0.1475 -0.1424 0.0430 47 GLY A N
3716111 C CA . GLY A 23 ? 0.9414 1.2097 0.8576 -0.1305 -0.1466 0.0528 47 GLY A CA
3717112 C C . GLY A 23 ? 0.8781 1.1619 0.8345 -0.0963 -0.1421 0.0627 47 GLY A C
3718113 O O . GLY A 23 ? 0.9144 1.2317 0.9029 -0.0883 -0.1426 0.0715 47 GLY A O
3719114 N N . GLY A 24 ? 0.6894 0.9470 0.6433 -0.0770 -0.1357 0.0606 48 GLY A N
3720115 C CA . GLY A 24 ? 0.7898 1.0512 0.7744 -0.0458 -0.1284 0.0662 48 GLY A CA
3721116 C C . GLY A 24 ? 0.6208 0.8718 0.6143 -0.0356 -0.1134 0.0521 48 GLY A C
3722117 O O . GLY A 24 ? 0.7677 1.0279 0.7855 -0.0138 -0.1060 0.0565 48 GLY A O
3723118 N N . PHE A 25 ? 0.6391 0.8683 0.6117 -0.0511 -0.1078 0.0356 49 PHE A N
3724119 C CA . PHE A 25 ? 0.5164 0.7380 0.4948 -0.0454 -0.0966 0.0255 49 PHE A CA
3725120 C C . PHE A 25 ? 0.6941 0.9525 0.6902 -0.0530 -0.0980 0.0330 49 PHE A C
3726121 O O . PHE A 25 ? 0.6761 0.9329 0.6782 -0.0473 -0.0882 0.0280 49 PHE A O
3727122 C CB . PHE A 25 ? 0.5063 0.6919 0.4616 -0.0579 -0.0903 0.0089 49 PHE A CB
3728123 C CG . PHE A 25 ? 0.7222 0.9047 0.6575 -0.0844 -0.0942 0.0053 49 PHE A CG
3729124 C CD1 . PHE A 25 ? 0.5685 0.7644 0.5026 -0.1025 -0.0950 0.0043 49 PHE A CD1
3730125 C CD2 . PHE A 25 ? 0.5363 0.6990 0.4505 -0.0932 -0.0954 0.0020 49 PHE A CD2
3731126 C CE1 . PHE A 25 ? 0.7403 0.9271 0.6504 -0.1294 -0.0972 -0.0013 49 PHE A CE1
3732127 C CE2 . PHE A 25 ? 0.7032 0.8571 0.5916 -0.1196 -0.0961 -0.0038 49 PHE A CE2
3733128 C CZ . PHE A 25 ? 0.8133 0.9777 0.6984 -0.1382 -0.0972 -0.0062 49 PHE A CZ
3734129 N N . GLY A 26 ? 0.5433 0.8357 0.5472 -0.0675 -0.1108 0.0463 50 GLY A N
3735130 C CA . GLY A 26 ? 0.6300 0.9596 0.6523 -0.0798 -0.1135 0.0540 50 GLY A CA
3736131 C C . GLY A 26 ? 0.6933 1.0154 0.6895 -0.1130 -0.1200 0.0464 50 GLY A C
3737132 O O . GLY A 26 ? 0.6068 0.9129 0.5763 -0.1285 -0.1281 0.0434 50 GLY A O
3738133 N N . SER A 27 ? 0.5527 0.8813 0.5523 -0.1255 -0.1147 0.0424 51 SER A N
3739134 C CA . SER A 27 ? 0.4432 0.7600 0.4172 -0.1585 -0.1187 0.0342 51 SER A CA
3740135 C C . SER A 27 ? 0.5279 0.8096 0.4903 -0.1600 -0.1031 0.0190 51 SER A C
3741136 O O . SER A 27 ? 0.4438 0.7395 0.4253 -0.1522 -0.0958 0.0227 51 SER A O
3742137 C CB . SER A 27 ? 0.4725 0.8392 0.4653 -0.1798 -0.1325 0.0495 51 SER A CB
3743138 O OG . SER A 27 ? 0.5807 0.9781 0.5812 -0.1824 -0.1508 0.0659 51 SER A OG
3744139 N N . VAL A 28 ? 0.5649 0.8008 0.4973 -0.1695 -0.0968 0.0035 52 VAL A N
3745140 C CA . VAL A 28 ? 0.5928 0.7924 0.5171 -0.1698 -0.0827 -0.0081 52 VAL A CA
3746141 C C . VAL A 28 ? 0.5135 0.7002 0.4187 -0.2019 -0.0815 -0.0149 52 VAL A C
3747142 O O . VAL A 28 ? 0.7584 0.9364 0.6394 -0.2236 -0.0865 -0.0202 52 VAL A O
3748143 C CB . VAL A 28 ? 0.5971 0.7541 0.5096 -0.1557 -0.0738 -0.0190 52 VAL A CB
3749144 C CG1 . VAL A 28 ? 0.5204 0.6425 0.4302 -0.1560 -0.0612 -0.0271 52 VAL A CG1
3750145 C CG2 . VAL A 28 ? 0.5869 0.7540 0.5156 -0.1272 -0.0758 -0.0130 52 VAL A CG2
3751146 N N . TYR A 29 ? 0.5531 0.7362 0.4654 -0.2070 -0.0744 -0.0148 53 TYR A N
3752147 C CA . TYR A 29 ? 0.5310 0.6965 0.4262 -0.2375 -0.0709 -0.0214 53 TYR A CA
3753148 C C . TYR A 29 ? 0.6166 0.7324 0.5044 -0.2330 -0.0543 -0.0311 53 TYR A C
3754149 O O . TYR A 29 ? 0.5680 0.6791 0.4711 -0.2095 -0.0493 -0.0268 53 TYR A O
3755150 C CB . TYR A 29 ? 0.5038 0.7113 0.4179 -0.2515 -0.0772 -0.0093 53 TYR A CB
3756151 C CG . TYR A 29 ? 0.6480 0.9102 0.5774 -0.2594 -0.0948 0.0042 53 TYR A CG
3757152 C CD1 . TYR A 29 ? 0.5396 0.8382 0.4971 -0.2320 -0.0998 0.0169 53 TYR A CD1
3758153 C CD2 . TYR A 29 ? 0.6026 0.8796 0.5194 -0.2954 -0.1070 0.0056 53 TYR A CD2
3759154 C CE1 . TYR A 29 ? 0.5818 0.9327 0.5608 -0.2368 -0.1160 0.0331 53 TYR A CE1
3760155 C CE2 . TYR A 29 ? 0.7013 1.0339 0.6373 -0.3034 -0.1266 0.0223 53 TYR A CE2
3761156 C CZ . TYR A 29 ? 0.5783 0.9490 0.5487 -0.2723 -0.1308 0.0373 53 TYR A CZ
3762157 O OH . TYR A 29 ? 0.7502 1.1779 0.7469 -0.2776 -0.1503 0.0576 53 TYR A OH
3763158 N N . SER A 30 ? 0.7763 0.8532 0.6395 -0.2565 -0.0458 -0.0436 54 SER A N
3764159 C CA . SER A 30 ? 0.6885 0.7202 0.5503 -0.2552 -0.0296 -0.0493 54 SER A CA
3765160 C C . SER A 30 ? 0.6385 0.6879 0.5139 -0.2623 -0.0308 -0.0387 54 SER A C
3766161 O O . SER A 30 ? 0.7259 0.8045 0.5998 -0.2851 -0.0390 -0.0346 54 SER A O
3767162 C CB . SER A 30 ? 0.8854 0.8672 0.7169 -0.2795 -0.0163 -0.0663 54 SER A CB
3768163 O OG . SER A 30 ? 0.9151 0.8558 0.7489 -0.2823 -0.0006 -0.0690 54 SER A OG
3769164 N N . GLY A 31 ? 0.7847 0.8185 0.6737 -0.2441 -0.0234 -0.0324 55 GLY A N
3770165 C CA . GLY A 31 ? 0.8269 0.8735 0.7254 -0.2503 -0.0225 -0.0213 55 GLY A CA
3771166 C C . GLY A 31 ? 0.7721 0.7727 0.6711 -0.2447 -0.0104 -0.0194 55 GLY A C
3772167 O O . GLY A 31 ? 0.7880 0.7555 0.6889 -0.2290 -0.0043 -0.0235 55 GLY A O
3773168 N N . ILE A 32 ? 0.8331 0.8340 0.7335 -0.2578 -0.0072 -0.0107 56 ILE A N
3774169 C CA . ILE A 32 ? 0.9405 0.9002 0.8428 -0.2541 0.0026 -0.0039 56 ILE A CA
3775170 C C . ILE A 32 ? 0.8390 0.8253 0.7485 -0.2487 -0.0009 0.0132 56 ILE A C
3776171 O O . ILE A 32 ? 0.9226 0.9366 0.8320 -0.2671 -0.0015 0.0177 56 ILE A O
3777172 C CB . ILE A 32 ? 0.9950 0.9124 0.8841 -0.2816 0.0147 -0.0117 56 ILE A CB
3778173 C CG1 . ILE A 32 ? 1.1243 1.0062 1.0002 -0.2863 0.0230 -0.0307 56 ILE A CG1
3779174 C CG2 . ILE A 32 ? 1.0519 0.9311 0.9472 -0.2774 0.0241 0.0004 56 ILE A CG2
3780175 C CD1 . ILE A 32 ? 1.2881 1.1074 1.1519 -0.3036 0.0419 -0.0395 56 ILE A CD1
3781176 N N . ARG A 33 ? 0.8794 0.8589 0.7942 -0.2254 -0.0033 0.0232 57 ARG A N
3782177 C CA . ARG A 33 ? 0.9825 0.9767 0.8953 -0.2230 -0.0042 0.0393 57 ARG A CA
3783178 C C . ARG A 33 ? 0.9670 0.9313 0.8754 -0.2427 0.0044 0.0474 57 ARG A C
3784179 O O . ARG A 33 ? 1.1342 1.0530 1.0447 -0.2403 0.0093 0.0500 57 ARG A O
3785180 C CB . ARG A 33 ? 0.9194 0.9053 0.8320 -0.1986 -0.0107 0.0486 57 ARG A CB
3786181 C CG . ARG A 33 ? 0.8827 0.8885 0.7838 -0.1966 -0.0119 0.0626 57 ARG A CG
3787182 C CD . ARG A 33 ? 0.7738 0.7799 0.6679 -0.1752 -0.0213 0.0676 57 ARG A CD
3788183 N NE . ARG A 33 ? 1.0044 0.9732 0.9036 -0.1677 -0.0274 0.0774 57 ARG A NE
3789184 C CZ . ARG A 33 ? 0.9062 0.8698 0.8047 -0.1515 -0.0390 0.0826 57 ARG A CZ
3790185 N NH1 . ARG A 33 ? 0.9033 0.8903 0.7907 -0.1416 -0.0444 0.0762 57 ARG A NH1
3791186 N NH2 . ARG A 33 ? 0.7706 0.7045 0.6818 -0.1458 -0.0451 0.0954 57 ARG A NH2
3792187 N N . VAL A 34 ? 0.9876 0.9773 0.8932 -0.2621 0.0077 0.0525 58 VAL A N
3793188 C CA . VAL A 34 ? 1.0931 1.0532 0.9935 -0.2839 0.0165 0.0603 58 VAL A CA
3794189 C C . VAL A 34 ? 1.0993 1.0339 0.9946 -0.2728 0.0174 0.0795 58 VAL A C
3795190 O O . VAL A 34 ? 1.1656 1.0617 1.0581 -0.2852 0.0246 0.0884 58 VAL A O
3796191 C CB . VAL A 34 ? 1.0401 1.0387 0.9424 -0.3094 0.0193 0.0624 58 VAL A CB
3797192 C CG1 . VAL A 34 ? 1.1219 1.0845 1.0180 -0.3391 0.0280 0.0630 58 VAL A CG1
3798193 C CG2 . VAL A 34 ? 0.8880 0.9304 0.7995 -0.3133 0.0120 0.0497 58 VAL A CG2
3799194 N N . SER A 35 ? 1.1291 1.0816 1.0209 -0.2510 0.0097 0.0870 59 SER A N
3800195 C CA . SER A 35 ? 1.1575 1.0853 1.0407 -0.2410 0.0060 0.1066 59 SER A CA
3801196 C C . SER A 35 ? 1.2540 1.1324 1.1501 -0.2329 0.0052 0.1104 59 SER A C
3802197 O O . SER A 35 ? 1.3547 1.1983 1.2510 -0.2393 0.0091 0.1263 59 SER A O
3803198 C CB . SER A 35 ? 1.1395 1.0921 1.0126 -0.2210 -0.0040 0.1096 59 SER A CB
3804199 O OG . SER A 35 ? 1.0684 1.0664 0.9395 -0.2215 -0.0007 0.0988 59 SER A OG
3805200 N N . ASP A 36 ? 1.2840 1.1588 1.1936 -0.2182 0.0020 0.0968 60 ASP A N
3806201 C CA . ASP A 36 ? 1.1430 0.9777 1.0717 -0.2044 0.0025 0.1014 60 ASP A CA
3807202 C C . ASP A 36 ? 1.3087 1.1163 1.2476 -0.2114 0.0164 0.0818 60 ASP A C
3808203 O O . ASP A 36 ? 1.2973 1.0715 1.2560 -0.1985 0.0218 0.0825 60 ASP A O
3809204 C CB . ASP A 36 ? 1.1163 0.9668 1.0531 -0.1805 -0.0117 0.1041 60 ASP A CB
3810205 C CG . ASP A 36 ? 1.5305 1.3913 1.4539 -0.1745 -0.0258 0.1262 60 ASP A CG
3811206 O OD1 . ASP A 36 ? 1.4086 1.2893 1.3285 -0.1608 -0.0386 0.1261 60 ASP A OD1
3812207 O OD2 . ASP A 36 ? 1.7170 1.5641 1.6295 -0.1857 -0.0240 0.1435 60 ASP A OD2
3813208 N N . ASN A 37 ? 1.3389 1.1600 1.2645 -0.2326 0.0229 0.0649 61 ASN A N
3814209 C CA . ASN A 37 ? 1.0972 0.9018 1.0218 -0.2410 0.0326 0.0421 61 ASN A CA
3815210 C C . ASN A 37 ? 1.0588 0.8689 0.9960 -0.2172 0.0283 0.0347 61 ASN A C
3816211 O O . ASN A 37 ? 1.1333 0.9104 1.0770 -0.2146 0.0404 0.0226 61 ASN A O
3817212 C CB . ASN A 37 ? 1.0566 0.8016 0.9820 -0.2544 0.0510 0.0389 61 ASN A CB
3818213 C CG . ASN A 37 ? 1.2902 1.0301 1.1992 -0.2850 0.0561 0.0406 61 ASN A CG
3819214 O OD1 . ASN A 37 ? 1.2780 1.0627 1.1762 -0.2999 0.0477 0.0383 61 ASN A OD1
3820215 N ND2 . ASN A 37 ? 1.3168 1.0024 1.2273 -0.2943 0.0708 0.0458 61 ASN A ND2
3821216 N N . LEU A 38 ? 0.9238 0.7735 0.8629 -0.2009 0.0132 0.0413 62 LEU A N
3822217 C CA . LEU A 38 ? 0.8834 0.7404 0.8353 -0.1787 0.0068 0.0378 62 LEU A CA
3823218 C C . LEU A 38 ? 0.9723 0.8519 0.9151 -0.1831 0.0068 0.0177 62 LEU A C
3824219 O O . LEU A 38 ? 0.9483 0.8630 0.8783 -0.1940 0.0012 0.0141 62 LEU A O
3825220 C CB . LEU A 38 ? 0.9321 0.8159 0.8846 -0.1625 -0.0095 0.0531 62 LEU A CB
3826221 C CG . LEU A 38 ? 0.9492 0.8421 0.9146 -0.1419 -0.0180 0.0501 62 LEU A CG
3827222 C CD1 . LEU A 38 ? 0.9276 0.7913 0.9198 -0.1279 -0.0188 0.0640 62 LEU A CD1
3828223 C CD2 . LEU A 38 ? 0.8224 0.7506 0.7740 -0.1341 -0.0323 0.0542 62 LEU A CD2
3829224 N N . PRO A 39 ? 0.8880 0.7497 0.8387 -0.1752 0.0133 0.0062 63 PRO A N
3830225 C CA . PRO A 39 ? 0.9472 0.8290 0.8857 -0.1802 0.0120 -0.0108 63 PRO A CA
3831226 C C . PRO A 39 ? 0.7173 0.6419 0.6580 -0.1646 -0.0039 -0.0063 63 PRO A C
3832227 O O . PRO A 39 ? 0.7989 0.7236 0.7535 -0.1448 -0.0098 0.0007 63 PRO A O
3833228 C CB . PRO A 39 ? 1.0041 0.8495 0.9512 -0.1736 0.0264 -0.0215 63 PRO A CB
3834229 C CG . PRO A 39 ? 1.0765 0.8781 1.0390 -0.1721 0.0399 -0.0133 63 PRO A CG
3835230 C CD . PRO A 39 ? 0.8243 0.6443 0.7967 -0.1633 0.0252 0.0088 63 PRO A CD
3836231 N N . VAL A 40 ? 0.6552 0.6159 0.5840 -0.1743 -0.0107 -0.0097 64 VAL A N
3837232 C CA . VAL A 40 ? 0.6745 0.6729 0.6053 -0.1599 -0.0222 -0.0070 64 VAL A CA
3838233 C C . VAL A 40 ? 0.7957 0.8139 0.7198 -0.1665 -0.0250 -0.0179 64 VAL A C
3839234 O O . VAL A 40 ? 0.6757 0.6860 0.5885 -0.1872 -0.0206 -0.0263 64 VAL A O
3840235 C CB . VAL A 40 ? 0.6902 0.7185 0.6189 -0.1608 -0.0267 0.0040 64 VAL A CB
3841236 C CG1 . VAL A 40 ? 0.7271 0.7346 0.6563 -0.1561 -0.0259 0.0169 64 VAL A CG1
3842237 C CG2 . VAL A 40 ? 0.6470 0.6952 0.5715 -0.1839 -0.0242 0.0028 64 VAL A CG2
3843238 N N . ALA A 41 ? 0.7134 0.7548 0.6418 -0.1501 -0.0329 -0.0170 65 ALA A N
3844239 C CA . ALA A 41 ? 0.7242 0.7928 0.6490 -0.1534 -0.0389 -0.0213 65 ALA A CA
3845240 C C . ALA A 41 ? 0.4741 0.5849 0.4076 -0.1466 -0.0452 -0.0119 65 ALA A C
3846241 O O . ALA A 41 ? 0.6165 0.7307 0.5544 -0.1291 -0.0456 -0.0068 65 ALA A O
3847242 C CB . ALA A 41 ? 0.5176 0.5761 0.4429 -0.1391 -0.0404 -0.0269 65 ALA A CB
3848243 N N . ILE A 42 ? 0.5687 0.7108 0.5049 -0.1613 -0.0492 -0.0093 66 ILE A N
3849244 C CA . ILE A 42 ? 0.5621 0.7483 0.5142 -0.1550 -0.0519 0.0011 66 ILE A CA
3850245 C C . ILE A 42 ? 0.5058 0.7176 0.4665 -0.1452 -0.0602 0.0030 66 ILE A C
3851246 O O . ILE A 42 ? 0.4910 0.7154 0.4491 -0.1610 -0.0681 0.0029 66 ILE A O
3852247 C CB . ILE A 42 ? 0.5452 0.7551 0.5036 -0.1785 -0.0514 0.0071 66 ILE A CB
3853248 C CG1 . ILE A 42 ? 0.5932 0.7698 0.5404 -0.1896 -0.0427 0.0055 66 ILE A CG1
3854249 C CG2 . ILE A 42 ? 0.6098 0.8675 0.5916 -0.1698 -0.0503 0.0192 66 ILE A CG2
3855250 C CD1 . ILE A 42 ? 0.6209 0.8149 0.5722 -0.2160 -0.0412 0.0108 66 ILE A CD1
3856251 N N . LYS A 43 ? 0.4646 0.6809 0.4325 -0.1206 -0.0587 0.0052 67 LYS A N
3857252 C CA . LYS A 43 ? 0.6007 0.8340 0.5772 -0.1076 -0.0651 0.0081 67 LYS A CA
3858253 C C . LYS A 43 ? 0.4790 0.7574 0.4816 -0.0983 -0.0637 0.0205 67 LYS A C
3859254 O O . LYS A 43 ? 0.5201 0.8003 0.5279 -0.0832 -0.0532 0.0220 67 LYS A O
3860255 C CB . LYS A 43 ? 0.4489 0.6525 0.4169 -0.0872 -0.0630 0.0017 67 LYS A CB
3861256 C CG . LYS A 43 ? 0.5672 0.7820 0.5425 -0.0737 -0.0684 0.0050 67 LYS A CG
3862257 C CD . LYS A 43 ? 0.6594 0.8397 0.6233 -0.0610 -0.0677 -0.0029 67 LYS A CD
3863258 C CE . LYS A 43 ? 0.7986 0.9874 0.7715 -0.0416 -0.0688 0.0016 67 LYS A CE
3864259 N NZ . LYS A 43 ? 0.6449 0.8002 0.6071 -0.0319 -0.0687 -0.0058 67 LYS A NZ
3865260 N N . HIS A 44 ? 0.5949 0.9095 0.6140 -0.1080 -0.0735 0.0303 68 HIS A N
3866261 C CA . HIS A 44 ? 0.5170 0.8798 0.5711 -0.0970 -0.0725 0.0457 68 HIS A CA
3867262 C C . HIS A 44 ? 0.5067 0.8733 0.5711 -0.0748 -0.0763 0.0507 68 HIS A C
3868263 O O . HIS A 44 ? 0.5825 0.9412 0.6354 -0.0814 -0.0890 0.0507 68 HIS A O
3869264 C CB . HIS A 44 ? 0.3867 0.7929 0.4595 -0.1218 -0.0842 0.0580 68 HIS A CB
3870265 C CG . HIS A 44 ? 0.5580 0.9594 0.6213 -0.1461 -0.0801 0.0537 68 HIS A CG
3871266 N ND1 . HIS A 44 ? 0.5041 0.9403 0.5938 -0.1495 -0.0717 0.0637 68 HIS A ND1
3872267 C CD2 . HIS A 44 ? 0.5652 0.9287 0.5967 -0.1679 -0.0812 0.0411 68 HIS A CD2
3873268 C CE1 . HIS A 44 ? 0.6172 1.0368 0.6898 -0.1737 -0.0696 0.0579 68 HIS A CE1
3874269 N NE2 . HIS A 44 ? 0.6484 1.0226 0.6861 -0.1845 -0.0750 0.0440 68 HIS A NE2
3875270 N N . VAL A 45 ? 0.5636 0.9384 0.6467 -0.0495 -0.0632 0.0547 69 VAL A N
3876271 C CA . VAL A 45 ? 0.7038 1.0773 0.7987 -0.0254 -0.0627 0.0596 69 VAL A CA
3877272 C C . VAL A 45 ? 0.6271 1.0472 0.7677 -0.0096 -0.0541 0.0769 69 VAL A C
3878273 O O . VAL A 45 ? 0.7403 1.1637 0.8893 0.0008 -0.0347 0.0746 69 VAL A O
3879274 C CB . VAL A 45 ? 0.5847 0.9100 0.6540 -0.0080 -0.0511 0.0443 69 VAL A CB
3880275 C CG1 . VAL A 45 ? 0.7764 1.0940 0.8543 0.0132 -0.0516 0.0485 69 VAL A CG1
3881276 C CG2 . VAL A 45 ? 0.7012 0.9860 0.7347 -0.0231 -0.0571 0.0296 69 VAL A CG2
3882277 N N . GLU A 46 ? 0.8623 1.3188 1.0331 -0.0080 -0.0677 0.0956 70 GLU A N
3883278 C CA . GLU A 46 ? 0.7304 1.2350 0.9549 0.0101 -0.0593 0.1158 70 GLU A CA
3884279 C C . GLU A 46 ? 0.6932 1.1716 0.9230 0.0442 -0.0380 0.1113 70 GLU A C
3885280 O O . GLU A 46 ? 0.8227 1.2603 1.0263 0.0531 -0.0409 0.1022 70 GLU A O
3886281 C CB . GLU A 46 ? 0.6911 1.2420 0.9473 0.0017 -0.0835 0.1405 70 GLU A CB
3887282 C CG . GLU A 46 ? 0.9870 1.5983 1.3109 0.0190 -0.0785 0.1675 70 GLU A CG
3888283 C CD . GLU A 46 ? 1.0369 1.7002 1.3906 0.0025 -0.1089 0.1950 70 GLU A CD
3889284 O OE1 . GLU A 46 ? 1.0175 1.6656 1.3310 -0.0251 -0.1321 0.1898 70 GLU A OE1
3890285 O OE2 . GLU A 46 ? 0.9108 1.6301 1.3279 0.0161 -0.1094 0.2224 70 GLU A OE2
3891286 N N . LYS A 47 ? 0.8600 1.3587 1.1214 0.0619 -0.0140 0.1161 71 LYS A N
3892287 C CA . LYS A 47 ? 0.8635 1.3295 1.1230 0.0922 0.0111 0.1080 71 LYS A CA
3893288 C C . LYS A 47 ? 0.9231 1.3923 1.2099 0.1137 0.0053 0.1230 71 LYS A C
3894289 O O . LYS A 47 ? 0.9742 1.3955 1.2371 0.1299 0.0142 0.1111 71 LYS A O
3895290 C CB . LYS A 47 ? 0.7956 1.2836 1.0847 0.1064 0.0420 0.1108 71 LYS A CB
3896291 C CG . LYS A 47 ? 0.8511 1.3633 1.1375 0.0834 0.0445 0.1093 71 LYS A CG
3897292 C CD . LYS A 47 ? 0.8323 1.3202 1.0994 0.0929 0.0787 0.0946 71 LYS A CD
3898293 C CE . LYS A 47 ? 0.7915 1.2945 1.0464 0.0673 0.0797 0.0923 71 LYS A CE
3899294 N NZ . LYS A 47 ? 0.6909 1.2117 0.9648 0.0766 0.1144 0.0941 71 LYS A NZ
3900295 N N . ASP A 48 ? 0.7924 1.3179 1.1297 0.1130 -0.0106 0.1507 72 ASP A N
3901296 C CA . ASP A 48 ? 0.6641 1.1964 1.0317 0.1336 -0.0180 0.1703 72 ASP A CA
3902297 C C . ASP A 48 ? 0.8399 1.3219 1.1581 0.1272 -0.0344 0.1585 72 ASP A C
3903298 O O . ASP A 48 ? 0.7668 1.2203 1.0873 0.1493 -0.0277 0.1608 72 ASP A O
3904299 C CB . ASP A 48 ? 0.7431 1.3471 1.1662 0.1252 -0.0415 0.2044 72 ASP A CB
3905300 C CG . ASP A 48 ? 0.9134 1.5719 1.4075 0.1442 -0.0213 0.2245 72 ASP A CG
3906301 O OD1 . ASP A 48 ? 0.8689 1.5064 1.3628 0.1621 0.0137 0.2091 72 ASP A OD1
3907302 O OD2 . ASP A 48 ? 0.7250 1.4484 1.2750 0.1399 -0.0403 0.2565 72 ASP A OD2
3908303 N N . ARG A 49 ? 0.8952 1.3636 1.1694 0.0970 -0.0533 0.1457 73 ARG A N
3909304 C CA . ARG A 49 ? 0.8950 1.3189 1.1239 0.0879 -0.0670 0.1345 73 ARG A CA
3910305 C C . ARG A 49 ? 0.9487 1.3113 1.1342 0.0939 -0.0502 0.1062 73 ARG A C
3911306 O O . ARG A 49 ? 0.9873 1.3126 1.1379 0.0864 -0.0592 0.0958 73 ARG A O
3912307 C CB . ARG A 49 ? 0.6763 1.1118 0.8793 0.0529 -0.0914 0.1334 73 ARG A CB
3913308 C CG . ARG A 49 ? 1.0340 1.4450 1.2067 0.0429 -0.1094 0.1343 73 ARG A CG
3914309 C CD . ARG A 49 ? 0.9998 1.4331 1.2050 0.0588 -0.1198 0.1618 73 ARG A CD
3915310 N NE . ARG A 49 ? 1.1237 1.5189 1.2955 0.0563 -0.1285 0.1591 73 ARG A NE
3916311 C CZ . ARG A 49 ? 1.2287 1.6381 1.3912 0.0400 -0.1517 0.1762 73 ARG A CZ
3917312 N NH1 . ARG A 49 ? 1.0857 1.5473 1.2690 0.0234 -0.1718 0.1979 73 ARG A NH1
3918313 N NH2 . ARG A 49 ? 1.2159 1.5864 1.3456 0.0382 -0.1553 0.1721 73 ARG A NH2
3919314 N N . ILE A 50 ? 0.9379 1.2898 1.1240 0.1055 -0.0265 0.0945 74 ILE A N
3920315 C CA . ILE A 50 ? 1.0705 1.3663 1.2132 0.1080 -0.0133 0.0694 74 ILE A CA
3921316 C C . ILE A 50 ? 1.2454 1.5088 1.3916 0.1338 0.0007 0.0684 74 ILE A C
3922317 O O . ILE A 50 ? 1.1131 1.3904 1.2933 0.1563 0.0196 0.0779 74 ILE A O
3923318 C CB . ILE A 50 ? 1.1145 1.4096 1.2472 0.1049 0.0051 0.0575 74 ILE A CB
3924319 C CG1 . ILE A 50 ? 1.0209 1.3200 1.1297 0.0767 -0.0092 0.0505 74 ILE A CG1
3925320 C CG2 . ILE A 50 ? 1.1169 1.3575 1.2130 0.1151 0.0233 0.0368 74 ILE A CG2
3926321 C CD1 . ILE A 50 ? 1.0533 1.3495 1.1484 0.0709 0.0063 0.0409 74 ILE A CD1
3927322 N N . SER A 51 ? 1.3882 1.6073 1.5014 0.1306 -0.0067 0.0572 75 SER A N
3928323 C CA . SER A 51 ? 1.3710 1.5521 1.4821 0.1514 0.0053 0.0548 75 SER A CA
3929324 C C . SER A 51 ? 1.3372 1.4688 1.4115 0.1546 0.0250 0.0304 75 SER A C
3930325 O O . SER A 51 ? 1.1337 1.2442 1.2141 0.1752 0.0482 0.0273 75 SER A O
3931326 C CB . SER A 51 ? 1.3855 1.5472 1.4829 0.1442 -0.0140 0.0586 75 SER A CB
3932327 O OG . SER A 51 ? 1.4085 1.5555 1.4708 0.1200 -0.0275 0.0444 75 SER A OG
3933328 N N . ASP A 52 ? 1.3665 1.4784 1.4021 0.1339 0.0165 0.0138 76 ASP A N
3934329 C CA . ASP A 52 ? 1.3193 1.3832 1.3133 0.1312 0.0283 -0.0078 76 ASP A CA
3935330 C C . ASP A 52 ? 1.1014 1.1767 1.0829 0.1238 0.0395 -0.0150 76 ASP A C
3936331 O O . ASP A 52 ? 1.0978 1.1897 1.0711 0.1051 0.0258 -0.0152 76 ASP A O
3937332 C CB . ASP A 52 ? 1.3300 1.3636 1.2928 0.1134 0.0094 -0.0178 76 ASP A CB
3938333 C CG . ASP A 52 ? 1.4774 1.4563 1.4086 0.1165 0.0174 -0.0331 76 ASP A CG
3939334 O OD1 . ASP A 52 ? 1.5957 1.5561 1.5363 0.1348 0.0317 -0.0313 76 ASP A OD1
3940335 O OD2 . ASP A 52 ? 1.3999 1.3535 1.2976 0.0998 0.0091 -0.0460 76 ASP A OD2
3941336 N N . TRP A 53 ? 1.1084 1.1716 1.0874 0.1384 0.0666 -0.0209 77 TRP A N
3942337 C CA . TRP A 53 ? 1.1936 1.2613 1.1554 0.1324 0.0827 -0.0284 77 TRP A CA
3943338 C C . TRP A 53 ? 1.1380 1.1494 1.0401 0.1229 0.0899 -0.0504 77 TRP A C
3944339 O O . TRP A 53 ? 1.2847 1.2528 1.1658 0.1274 0.0920 -0.0605 77 TRP A O
3945340 C CB . TRP A 53 ? 1.1952 1.2865 1.1927 0.1543 0.1127 -0.0205 77 TRP A CB
3946341 C CG . TRP A 53 ? 1.0825 1.2382 1.1391 0.1592 0.1057 0.0031 77 TRP A CG
3947342 C CD1 . TRP A 53 ? 1.0711 1.2539 1.1764 0.1755 0.1004 0.0224 77 TRP A CD1
3948343 C CD2 . TRP A 53 ? 1.1452 1.3468 1.2184 0.1457 0.1021 0.0117 77 TRP A CD2
3949344 N NE1 . TRP A 53 ? 1.2413 1.4866 1.3923 0.1714 0.0915 0.0428 77 TRP A NE1
3950345 C CE2 . TRP A 53 ? 1.1936 1.4506 1.3260 0.1529 0.0933 0.0357 77 TRP A CE2
3951346 C CE3 . TRP A 53 ? 1.2152 1.4159 1.2586 0.1268 0.1045 0.0030 77 TRP A CE3
3952347 C CZ2 . TRP A 53 ? 1.1988 1.5096 1.3605 0.1400 0.0867 0.0493 77 TRP A CZ2
3953348 C CZ3 . TRP A 53 ? 1.2380 1.4894 1.3111 0.1160 0.1001 0.0165 77 TRP A CZ3
3954349 C CH2 . TRP A 53 ? 1.0906 1.3965 1.2222 0.1218 0.0914 0.0386 77 TRP A CH2
3955350 N N . GLY A 54 ? 1.1128 1.1241 0.9859 0.1079 0.0933 -0.0568 78 GLY A N
3956351 C CA . GLY A 54 ? 1.2134 1.1742 1.0258 0.0960 0.0997 -0.0756 78 GLY A CA
3957352 C C . GLY A 54 ? 1.2901 1.2576 1.0793 0.0876 0.1164 -0.0787 78 GLY A C
3958353 O O . GLY A 54 ? 1.3114 1.3238 1.1349 0.0905 0.1226 -0.0662 78 GLY A O
3959354 N N . GLU A 55 ? 1.3362 1.2575 1.0641 0.0749 0.1235 -0.0949 79 GLU A N
3960355 C CA . GLU A 55 ? 1.5169 1.4363 1.2111 0.0644 0.1411 -0.0989 79 GLU A CA
3961356 C C . GLU A 55 ? 1.5301 1.4406 1.1853 0.0369 0.1122 -0.0974 79 GLU A C
3962357 O O . GLU A 55 ? 1.4355 1.3110 1.0558 0.0240 0.0922 -0.1049 79 GLU A O
3963358 C CB . GLU A 55 ? 1.5072 1.3778 1.1540 0.0697 0.1762 -0.1184 79 GLU A CB
3964359 C CG . GLU A 55 ? 1.6775 1.5387 1.2766 0.0549 0.1950 -0.1240 79 GLU A CG
3965360 C CD . GLU A 55 ? 1.8635 1.6639 1.3976 0.0532 0.2274 -0.1473 79 GLU A CD
3966361 O OE1 . GLU A 55 ? 1.7759 1.5415 1.2384 0.0277 0.2220 -0.1569 79 GLU A OE1
3967362 O OE2 . GLU A 55 ? 1.9621 1.7475 1.5152 0.0766 0.2586 -0.1553 79 GLU A OE2
3968363 N N . LEU A 56 ? 1.5022 1.4456 1.1673 0.0277 0.1093 -0.0857 80 LEU A N
3969364 C CA . LEU A 56 ? 1.4285 1.3603 1.0551 0.0029 0.0863 -0.0822 80 LEU A CA
3970365 C C . LEU A 56 ? 1.6566 1.5408 1.2089 -0.0107 0.0995 -0.0965 80 LEU A C
3971366 O O . LEU A 56 ? 1.7341 1.6042 1.2684 -0.0015 0.1346 -0.1075 80 LEU A O
3972367 C CB . LEU A 56 ? 1.4504 1.4218 1.0999 -0.0044 0.0844 -0.0667 80 LEU A CB
3973368 C CG . LEU A 56 ? 1.4072 1.4148 1.1086 -0.0049 0.0599 -0.0522 80 LEU A CG
3974369 C CD1 . LEU A 56 ? 1.4247 1.4723 1.1544 -0.0075 0.0703 -0.0401 80 LEU A CD1
3975370 C CD2 . LEU A 56 ? 1.2523 1.2426 0.9362 -0.0216 0.0278 -0.0477 80 LEU A CD2
3976371 N N . PRO A 57 ? 1.7060 1.5647 1.2143 -0.0333 0.0724 -0.0959 81 PRO A N
3977372 C CA . PRO A 57 ? 1.7821 1.5962 1.2110 -0.0523 0.0811 -0.1075 81 PRO A CA
3978373 C C . PRO A 57 ? 1.6781 1.4984 1.0847 -0.0539 0.1134 -0.1076 81 PRO A C
3979374 O O . PRO A 57 ? 1.4468 1.2277 0.7918 -0.0609 0.1385 -0.1234 81 PRO A O
3980375 C CB . PRO A 57 ? 1.7040 1.5116 1.1102 -0.0768 0.0396 -0.0954 81 PRO A CB
3981376 C CG . PRO A 57 ? 1.6292 1.4564 1.0929 -0.0671 0.0143 -0.0886 81 PRO A CG
3982377 C CD . PRO A 57 ? 1.4513 1.3178 0.9801 -0.0423 0.0331 -0.0851 81 PRO A CD
3983378 N N . ASN A 58 ? 1.7333 1.6007 1.1875 -0.0485 0.1156 -0.0912 82 ASN A N
3984379 C CA . ASN A 58 ? 1.6728 1.5527 1.1153 -0.0498 0.1475 -0.0890 82 ASN A CA
3985380 C C . ASN A 58 ? 1.6046 1.4793 1.0551 -0.0287 0.1932 -0.1037 82 ASN A C
3986381 O O . ASN A 58 ? 1.4818 1.3497 0.9023 -0.0319 0.2269 -0.1082 82 ASN A O
3987382 C CB . ASN A 58 ? 1.6654 1.5995 1.1682 -0.0475 0.1398 -0.0685 82 ASN A CB
3988383 C CG . ASN A 58 ? 1.6347 1.5743 1.1429 -0.0633 0.0978 -0.0534 82 ASN A CG
3989384 O OD1 . ASN A 58 ? 1.5205 1.4394 1.0191 -0.0673 0.0709 -0.0559 82 ASN A OD1
3990385 N ND2 . ASN A 58 ? 1.5008 1.4678 1.0276 -0.0722 0.0936 -0.0370 82 ASN A ND2
3991386 N N . GLY A 59 ? 1.7582 1.6360 1.2506 -0.0065 0.1968 -0.1097 83 GLY A N
3992387 C CA . GLY A 59 ? 1.8152 1.6897 1.3264 0.0175 0.2401 -0.1204 83 GLY A CA
3993388 C C . GLY A 59 ? 1.7523 1.6903 1.3521 0.0396 0.2504 -0.1036 83 GLY A C
3994389 O O . GLY A 59 ? 1.6588 1.6137 1.2813 0.0543 0.2896 -0.1036 83 GLY A O
3995390 N N . THR A 60 ? 1.5497 1.5236 1.2000 0.0406 0.2156 -0.0887 84 THR A N
3996391 C CA . THR A 60 ? 1.4693 1.5052 1.1998 0.0554 0.2168 -0.0708 84 THR A CA
3997392 C C . THR A 60 ? 1.3953 1.4425 1.1684 0.0670 0.1906 -0.0655 84 THR A C
3998393 O O . THR A 60 ? 1.3241 1.3509 1.0758 0.0548 0.1589 -0.0678 84 THR A O
3999394 C CB . THR A 60 ? 1.3008 1.3742 1.0441 0.0366 0.2010 -0.0550 84 THR A CB
4000395 O OG1 . THR A 60 ? 1.4160 1.4843 1.1535 0.0221 0.1598 -0.0502 84 THR A OG1
4001396 C CG2 . THR A 60 ? 1.3897 1.4435 1.0773 0.0195 0.2206 -0.0592 84 THR A CG2
4002397 N N . ARG A 61 ? 1.4186 1.5002 1.2538 0.0901 0.2040 -0.0564 85 ARG A N
4003398 C CA . ARG A 61 ? 1.4591 1.5492 1.3321 0.1023 0.1830 -0.0504 85 ARG A CA
4004399 C C . ARG A 61 ? 1.3529 1.4872 1.2623 0.0904 0.1496 -0.0337 85 ARG A C
4005400 O O . ARG A 61 ? 1.2705 1.4524 1.2166 0.0869 0.1525 -0.0198 85 ARG A O
4006401 C CB . ARG A 61 ? 1.4805 1.5886 1.4054 0.1320 0.2098 -0.0442 85 ARG A CB
4007402 C CG . ARG A 61 ? 1.4126 1.5282 1.3755 0.1456 0.1897 -0.0352 85 ARG A CG
4008403 C CD . ARG A 61 ? 1.3879 1.5211 1.4051 0.1766 0.2178 -0.0256 85 ARG A CD
4009404 N NE . ARG A 61 ? 1.5195 1.7193 1.5979 0.1822 0.2273 -0.0050 85 ARG A NE
4010405 C CZ . ARG A 61 ? 1.4507 1.7072 1.5858 0.1817 0.2029 0.0182 85 ARG A CZ
4011406 N NH1 . ARG A 61 ? 1.3572 1.6112 1.4968 0.1788 0.1711 0.0239 85 ARG A NH1
4012407 N NH2 . ARG A 61 ? 1.3766 1.6936 1.5637 0.1823 0.2110 0.0363 85 ARG A NH2
4013408 N N . VAL A 62 ? 1.1701 1.2873 1.0692 0.0832 0.1198 -0.0356 86 VAL A N
4014409 C CA . VAL A 62 ? 0.9932 1.1363 0.9105 0.0681 0.0892 -0.0250 86 VAL A CA
4015410 C C . VAL A 62 ? 1.0578 1.1955 0.9918 0.0746 0.0694 -0.0229 86 VAL A C
4016411 O O . VAL A 62 ? 1.0292 1.1375 0.9547 0.0885 0.0769 -0.0304 86 VAL A O
4017412 C CB . VAL A 62 ? 0.9232 1.0424 0.7960 0.0451 0.0739 -0.0306 86 VAL A CB
4018413 C CG1 . VAL A 62 ? 1.0540 1.1817 0.9109 0.0362 0.0917 -0.0292 86 VAL A CG1
4019414 C CG2 . VAL A 62 ? 0.9336 1.0004 0.7597 0.0424 0.0672 -0.0449 86 VAL A CG2
4020415 N N . PRO A 63 ? 1.0112 1.1732 0.9664 0.0640 0.0459 -0.0134 87 PRO A N
4021416 C CA . PRO A 63 ? 0.9655 1.1157 0.9262 0.0663 0.0274 -0.0129 87 PRO A CA
4022417 C C . PRO A 63 ? 0.9120 1.0145 0.8309 0.0585 0.0180 -0.0265 87 PRO A C
4023418 O O . PRO A 63 ? 0.8667 0.9537 0.7563 0.0446 0.0146 -0.0321 87 PRO A O
4024419 C CB . PRO A 63 ? 0.7224 0.9053 0.7047 0.0513 0.0081 -0.0022 87 PRO A CB
4025420 C CG . PRO A 63 ? 0.8519 1.0717 0.8524 0.0455 0.0177 0.0060 87 PRO A CG
4026421 C CD . PRO A 63 ? 0.9655 1.1639 0.9382 0.0479 0.0373 -0.0032 87 PRO A CD
4027422 N N . MET A 64 ? 1.0088 1.0891 0.9271 0.0670 0.0128 -0.0298 88 MET A N
4028423 C CA . MET A 64 ? 0.9611 1.0020 0.8481 0.0575 0.0001 -0.0401 88 MET A CA
4029424 C C . MET A 64 ? 0.8509 0.8966 0.7328 0.0386 -0.0187 -0.0379 88 MET A C
4030425 O O . MET A 64 ? 0.8044 0.8250 0.6586 0.0278 -0.0261 -0.0440 88 MET A O
4031426 C CB . MET A 64 ? 1.0865 1.1116 0.9829 0.0661 -0.0060 -0.0399 88 MET A CB
4032427 C CG . MET A 64 ? 1.2632 1.2409 1.1261 0.0612 -0.0101 -0.0527 88 MET A CG
4033428 S SD . MET A 64 ? 1.2397 1.1776 1.0515 0.0544 0.0012 -0.0687 88 MET A SD
4034429 C CE . MET A 64 ? 1.0552 1.0009 0.8772 0.0759 0.0336 -0.0694 88 MET A CE
4035430 N N . GLU A 65 ? 0.7906 0.8664 0.6991 0.0337 -0.0270 -0.0285 89 GLU A N
4036431 C CA . GLU A 65 ? 0.7275 0.8023 0.6331 0.0174 -0.0409 -0.0272 89 GLU A CA
4037432 C C . GLU A 65 ? 0.7684 0.8381 0.6543 0.0075 -0.0389 -0.0281 89 GLU A C
4038433 O O . GLU A 65 ? 0.7871 0.8401 0.6616 -0.0030 -0.0501 -0.0284 89 GLU A O
4039434 C CB . GLU A 65 ? 0.8337 0.9376 0.7640 0.0112 -0.0460 -0.0192 89 GLU A CB
4040435 C CG . GLU A 65 ? 0.9510 1.0453 0.8789 -0.0036 -0.0564 -0.0199 89 GLU A CG
4041436 C CD . GLU A 65 ? 1.0429 1.1560 0.9859 -0.0127 -0.0602 -0.0156 89 GLU A CD
4042437 O OE1 . GLU A 65 ? 1.0926 1.2345 1.0471 -0.0145 -0.0571 -0.0096 89 GLU A OE1
4043438 O OE2 . GLU A 65 ? 0.9561 1.0549 0.8990 -0.0197 -0.0655 -0.0182 89 GLU A OE2
4044439 N N . VAL A 66 ? 0.8278 0.9124 0.7114 0.0107 -0.0243 -0.0266 90 VAL A N
4045440 C CA . VAL A 66 ? 0.7243 0.8021 0.5841 0.0002 -0.0209 -0.0263 90 VAL A CA
4046441 C C . VAL A 66 ? 0.7428 0.7829 0.5643 -0.0027 -0.0245 -0.0343 90 VAL A C
4047442 O O . VAL A 66 ? 0.8223 0.8485 0.6255 -0.0157 -0.0366 -0.0313 90 VAL A O
4048443 C CB . VAL A 66 ? 0.8058 0.9077 0.6716 0.0046 -0.0007 -0.0232 90 VAL A CB
4049444 C CG1 . VAL A 66 ? 0.6423 0.7256 0.4701 -0.0036 0.0078 -0.0261 90 VAL A CG1
4050445 C CG2 . VAL A 66 ? 0.7946 0.9332 0.6915 -0.0030 -0.0032 -0.0129 90 VAL A CG2
4051446 N N . VAL A 67 ? 0.6842 0.7061 0.4926 0.0083 -0.0147 -0.0433 91 VAL A N
4052447 C CA . VAL A 67 ? 0.8672 0.8499 0.6335 0.0019 -0.0190 -0.0526 91 VAL A CA
4053448 C C . VAL A 67 ? 0.8349 0.8060 0.6038 -0.0089 -0.0444 -0.0492 91 VAL A C
4054449 O O . VAL A 67 ? 0.8442 0.8015 0.5898 -0.0233 -0.0578 -0.0461 91 VAL A O
4055450 C CB . VAL A 67 ? 0.9561 0.9166 0.7114 0.0156 -0.0033 -0.0641 91 VAL A CB
4056451 C CG1 . VAL A 67 ? 0.8230 0.7403 0.5372 0.0050 -0.0136 -0.0744 91 VAL A CG1
4057452 C CG2 . VAL A 67 ? 1.0249 0.9901 0.7718 0.0254 0.0258 -0.0681 91 VAL A CG2
4058453 N N . LEU A 68 ? 0.7109 0.6897 0.5108 -0.0023 -0.0512 -0.0477 92 LEU A N
4059454 C CA . LEU A 68 ? 0.7254 0.6955 0.5352 -0.0105 -0.0710 -0.0444 92 LEU A CA
4060455 C C . LEU A 68 ? 0.8166 0.7976 0.6357 -0.0218 -0.0824 -0.0339 92 LEU A C
4061456 O O . LEU A 68 ? 0.8538 0.8217 0.6645 -0.0323 -0.0981 -0.0294 92 LEU A O
4062457 C CB . LEU A 68 ? 0.8580 0.8382 0.6997 -0.0017 -0.0713 -0.0436 92 LEU A CB
4063458 C CG . LEU A 68 ? 0.8734 0.8417 0.7115 0.0113 -0.0606 -0.0506 92 LEU A CG
4064459 C CD1 . LEU A 68 ? 0.7928 0.7687 0.6584 0.0165 -0.0645 -0.0469 92 LEU A CD1
4065460 C CD2 . LEU A 68 ? 0.7378 0.6695 0.5421 0.0065 -0.0629 -0.0603 92 LEU A CD2
4066461 N N . LEU A 69 ? 0.7199 0.7249 0.5582 -0.0206 -0.0752 -0.0286 93 LEU A N
4067462 C CA . LEU A 69 ? 0.7238 0.7349 0.5731 -0.0305 -0.0830 -0.0189 93 LEU A CA
4068463 C C . LEU A 69 ? 0.8344 0.8333 0.6541 -0.0405 -0.0885 -0.0135 93 LEU A C
4069464 O O . LEU A 69 ? 0.9572 0.9476 0.7801 -0.0487 -0.1036 -0.0042 93 LEU A O
4070465 C CB . LEU A 69 ? 0.6587 0.6940 0.5275 -0.0303 -0.0729 -0.0161 93 LEU A CB
4071466 C CG . LEU A 69 ? 0.7305 0.7758 0.6264 -0.0270 -0.0728 -0.0178 93 LEU A CG
4072467 C CD1 . LEU A 69 ? 0.4268 0.4969 0.3344 -0.0298 -0.0641 -0.0157 93 LEU A CD1
4073468 C CD2 . LEU A 69 ? 0.7426 0.7757 0.6540 -0.0327 -0.0817 -0.0143 93 LEU A CD2
4074469 N N . LYS A 70 ? 0.8562 0.8539 0.6473 -0.0400 -0.0758 -0.0180 94 LYS A N
4075470 C CA . LYS A 70 ? 0.8283 0.8110 0.5818 -0.0519 -0.0800 -0.0134 94 LYS A CA
4076471 C C . LYS A 70 ? 0.8724 0.8305 0.6042 -0.0602 -0.0994 -0.0131 94 LYS A C
4077472 O O . LYS A 70 ? 0.8912 0.8407 0.6061 -0.0733 -0.1147 -0.0016 94 LYS A O
4078473 C CB . LYS A 70 ? 0.7257 0.7073 0.4487 -0.0492 -0.0581 -0.0215 94 LYS A CB
4079474 C CG . LYS A 70 ? 0.9087 0.9200 0.6552 -0.0442 -0.0402 -0.0183 94 LYS A CG
4080475 C CD . LYS A 70 ? 1.0570 1.0676 0.7724 -0.0528 -0.0266 -0.0149 94 LYS A CD
4081476 C CE . LYS A 70 ? 1.2906 1.2946 0.9954 -0.0688 -0.0423 -0.0005 94 LYS A CE
4082477 N NZ . LYS A 70 ? 1.2471 1.2761 0.9862 -0.0713 -0.0384 0.0090 94 LYS A NZ
4083478 N N . LYS A 71 ? 0.8839 0.8311 0.6172 -0.0542 -0.1007 -0.0234 95 LYS A N
4084479 C CA . LYS A 71 ? 1.0003 0.9261 0.7160 -0.0654 -0.1214 -0.0224 95 LYS A CA
4085480 C C . LYS A 71 ? 0.9027 0.8395 0.6590 -0.0689 -0.1421 -0.0077 95 LYS A C
4086481 O O . LYS A 71 ? 1.0660 0.9944 0.8133 -0.0821 -0.1637 0.0027 95 LYS A O
4087482 C CB . LYS A 71 ? 0.9306 0.8379 0.6355 -0.0599 -0.1160 -0.0377 95 LYS A CB
4088483 C CG . LYS A 71 ? 0.9243 0.8189 0.5977 -0.0518 -0.0904 -0.0526 95 LYS A CG
4089484 C CD . LYS A 71 ? 0.9516 0.8171 0.6059 -0.0489 -0.0854 -0.0675 95 LYS A CD
4090485 C CE . LYS A 71 ? 1.1958 1.0355 0.8214 -0.0690 -0.1094 -0.0678 95 LYS A CE
4091486 N NZ . LYS A 71 ? 1.1050 0.9028 0.6779 -0.0748 -0.0986 -0.0861 95 LYS A NZ
4092487 N N . VAL A 72 ? 0.9586 0.9140 0.7596 -0.0583 -0.1353 -0.0056 96 VAL A N
4093488 C CA . VAL A 72 ? 0.9629 0.9261 0.8056 -0.0594 -0.1485 0.0065 96 VAL A CA
4094489 C C . VAL A 72 ? 1.0645 1.0377 0.9262 -0.0615 -0.1487 0.0205 96 VAL A C
4095490 O O . VAL A 72 ? 1.1693 1.1455 1.0651 -0.0625 -0.1591 0.0333 96 VAL A O
4096491 C CB . VAL A 72 ? 0.6612 0.6319 0.5384 -0.0489 -0.1398 -0.0005 96 VAL A CB
4097492 C CG1 . VAL A 72 ? 0.7159 0.6736 0.5799 -0.0476 -0.1416 -0.0112 96 VAL A CG1
4098493 C CG2 . VAL A 72 ? 0.7216 0.7057 0.6056 -0.0407 -0.1207 -0.0066 96 VAL A CG2
4099494 N N . SER A 73 ? 1.0486 1.0265 0.8925 -0.0619 -0.1360 0.0192 97 SER A N
4100495 C CA . SER A 73 ? 1.0584 1.0425 0.9207 -0.0643 -0.1333 0.0311 97 SER A CA
4101496 C C . SER A 73 ? 1.0160 0.9917 0.8624 -0.0752 -0.1486 0.0488 97 SER A C
4102497 O O . SER A 73 ? 1.0395 1.0163 0.9001 -0.0776 -0.1468 0.0610 97 SER A O
4103498 C CB . SER A 73 ? 0.9886 0.9843 0.8435 -0.0623 -0.1135 0.0236 97 SER A CB
4104499 O OG . SER A 73 ? 0.8134 0.8198 0.6884 -0.0539 -0.1026 0.0121 97 SER A OG
4105500 N N . SER A 74 ? 1.1047 1.0698 0.9193 -0.0836 -0.1641 0.0514 98 SER A N
4106501 C CA . SER A 74 ? 1.3045 1.2622 1.1026 -0.0964 -0.1837 0.0718 98 SER A CA
4107502 C C . SER A 74 ? 1.2882 1.2503 1.1322 -0.0957 -0.2044 0.0893 98 SER A C
4108503 O O . SER A 74 ? 1.3139 1.2764 1.1673 -0.0962 -0.2157 0.0857 98 SER A O
4109504 C CB . SER A 74 ? 1.2632 1.2054 1.0001 -0.1098 -0.1920 0.0669 98 SER A CB
4110505 O OG . SER A 74 ? 1.2380 1.1755 0.9337 -0.1145 -0.1760 0.0632 98 SER A OG
4111506 N N . GLY A 75 ? 1.2056 1.1708 1.0814 -0.0942 -0.2076 0.1089 99 GLY A N
4112507 C CA . GLY A 75 ? 0.9643 0.9356 0.8943 -0.0902 -0.2227 0.1283 99 GLY A CA
4113508 C C . GLY A 75 ? 1.0848 1.0607 1.0670 -0.0751 -0.2022 0.1204 99 GLY A C
4114509 O O . GLY A 75 ? 1.0412 1.0171 1.0157 -0.0695 -0.1805 0.0990 99 GLY A O
4115510 N N . PHE A 76 ? 0.9772 0.9568 1.0137 -0.0693 -0.2092 0.1396 100 PHE A N
4116511 C CA . PHE A 76 ? 0.8578 0.8376 0.9434 -0.0562 -0.1884 0.1322 100 PHE A CA
4117512 C C . PHE A 76 ? 0.8662 0.8541 0.9609 -0.0531 -0.1871 0.1168 100 PHE A C
4118513 O O . PHE A 76 ? 0.7987 0.7952 0.8999 -0.0581 -0.2083 0.1257 100 PHE A O
4119514 C CB . PHE A 76 ? 0.8280 0.8079 0.9733 -0.0491 -0.1927 0.1583 100 PHE A CB
4120515 C CG . PHE A 76 ? 0.9326 0.8987 1.0773 -0.0494 -0.1869 0.1723 100 PHE A CG
4121516 C CD1 . PHE A 76 ? 0.9379 0.8908 1.0572 -0.0505 -0.1632 0.1545 100 PHE A CD1
4122517 C CD2 . PHE A 76 ? 0.8060 0.7730 0.9771 -0.0499 -0.2065 0.2052 100 PHE A CD2
4123518 C CE1 . PHE A 76 ? 0.9756 0.9133 1.0940 -0.0528 -0.1573 0.1674 100 PHE A CE1
4124519 C CE2 . PHE A 76 ? 0.9886 0.9396 1.1592 -0.0503 -0.2007 0.2198 100 PHE A CE2
4125520 C CZ . PHE A 76 ? 1.0423 0.9772 1.1855 -0.0521 -0.1751 0.1998 100 PHE A CZ
4126521 N N . SER A 77 ? 0.9097 0.8946 1.0032 -0.0469 -0.1635 0.0949 101 SER A N
4127522 C CA . SER A 77 ? 0.8783 0.8683 0.9789 -0.0438 -0.1595 0.0808 101 SER A CA
4128523 C C . SER A 77 ? 0.8584 0.8434 0.9842 -0.0358 -0.1329 0.0689 101 SER A C
4129524 O O . SER A 77 ? 0.9320 0.9075 1.0649 -0.0339 -0.1179 0.0692 101 SER A O
4130525 C CB . SER A 77 ? 0.8985 0.8876 0.9470 -0.0488 -0.1618 0.0634 101 SER A CB
4131526 O OG . SER A 77 ? 1.0809 1.0665 1.0937 -0.0510 -0.1528 0.0568 101 SER A OG
4132527 N N . GLY A 78 ? 0.7940 0.7823 0.9300 -0.0329 -0.1266 0.0581 102 GLY A N
4133528 C CA . GLY A 78 ? 0.5889 0.5702 0.7323 -0.0288 -0.1013 0.0432 102 GLY A CA
4134529 C C . GLY A 78 ? 0.6611 0.6425 0.7587 -0.0321 -0.0954 0.0251 102 GLY A C
4135530 O O . GLY A 78 ? 0.7252 0.7054 0.8181 -0.0312 -0.0832 0.0126 102 GLY A O
4136531 N N . VAL A 79 ? 0.7472 0.7313 0.8120 -0.0360 -0.1042 0.0255 103 VAL A N
4137532 C CA . VAL A 79 ? 0.7320 0.7207 0.7599 -0.0376 -0.0991 0.0121 103 VAL A CA
4138533 C C . VAL A 79 ? 0.5852 0.5736 0.6006 -0.0423 -0.0913 0.0123 103 VAL A C
4139534 O O . VAL A 79 ? 0.7606 0.7459 0.7751 -0.0452 -0.0983 0.0239 103 VAL A O
4140535 C CB . VAL A 79 ? 0.7408 0.7329 0.7403 -0.0382 -0.1130 0.0108 103 VAL A CB
4141536 C CG1 . VAL A 79 ? 0.5785 0.5773 0.5484 -0.0368 -0.1045 -0.0004 103 VAL A CG1
4142537 C CG2 . VAL A 79 ? 0.6051 0.5948 0.6152 -0.0363 -0.1207 0.0095 103 VAL A CG2
4143538 N N . ILE A 80 ? 0.6201 0.6116 0.6254 -0.0449 -0.0780 0.0012 104 ILE A N
4144539 C CA . ILE A 80 ? 0.5973 0.5915 0.5888 -0.0524 -0.0716 0.0007 104 ILE A CA
4145540 C C . ILE A 80 ? 0.7610 0.7666 0.7288 -0.0526 -0.0800 0.0043 104 ILE A C
4146541 O O . ILE A 80 ? 0.7506 0.7668 0.7033 -0.0483 -0.0820 -0.0016 104 ILE A O
4147542 C CB . ILE A 80 ? 0.6058 0.6054 0.5889 -0.0583 -0.0599 -0.0110 104 ILE A CB
4148543 C CG1 . ILE A 80 ? 0.5761 0.5567 0.5755 -0.0613 -0.0472 -0.0156 104 ILE A CG1
4149544 C CG2 . ILE A 80 ? 0.5312 0.5402 0.4994 -0.0682 -0.0564 -0.0109 104 ILE A CG2
4150545 C CD1 . ILE A 80 ? 0.5963 0.5585 0.6054 -0.0675 -0.0383 -0.0115 104 ILE A CD1
4151546 N N . ARG A 81 ? 0.7475 0.7482 0.7113 -0.0575 -0.0830 0.0145 105 ARG A N
4152547 C CA . ARG A 81 ? 0.7918 0.7982 0.7297 -0.0591 -0.0899 0.0193 105 ARG A CA
4153548 C C . ARG A 81 ? 0.6984 0.7207 0.6200 -0.0635 -0.0792 0.0139 105 ARG A C
4154549 O O . ARG A 81 ? 0.5731 0.5992 0.5031 -0.0703 -0.0704 0.0121 105 ARG A O
4155550 C CB . ARG A 81 ? 0.7804 0.7747 0.7192 -0.0639 -0.0991 0.0358 105 ARG A CB
4156551 C CG . ARG A 81 ? 0.9042 0.8897 0.8620 -0.0598 -0.1140 0.0455 105 ARG A CG
4157552 C CD . ARG A 81 ? 1.1457 1.1235 1.0978 -0.0656 -0.1288 0.0656 105 ARG A CD
4158553 N NE . ARG A 81 ? 1.3206 1.2885 1.2960 -0.0672 -0.1234 0.0782 105 ARG A NE
4159554 C CZ . ARG A 81 ? 1.3179 1.2774 1.3356 -0.0612 -0.1224 0.0868 105 ARG A CZ
4160555 N NH1 . ARG A 81 ? 1.2275 1.1911 1.2711 -0.0540 -0.1273 0.0852 105 ARG A NH1
4161556 N NH2 . ARG A 81 ? 0.8661 0.8114 0.9022 -0.0622 -0.1144 0.0976 105 ARG A NH2
4162557 N N . LEU A 82 ? 0.8361 0.8675 0.7354 -0.0603 -0.0789 0.0110 106 LEU A N
4163558 C CA . LEU A 82 ? 0.7520 0.8024 0.6411 -0.0633 -0.0675 0.0090 106 LEU A CA
4164559 C C . LEU A 82 ? 0.6882 0.7335 0.5638 -0.0735 -0.0663 0.0196 106 LEU A C
4165560 O O . LEU A 82 ? 0.8515 0.8860 0.7033 -0.0746 -0.0716 0.0249 106 LEU A O
4166561 C CB . LEU A 82 ? 0.6747 0.7330 0.5478 -0.0539 -0.0629 0.0020 106 LEU A CB
4167562 C CG . LEU A 82 ? 0.6686 0.7519 0.5408 -0.0534 -0.0483 0.0010 106 LEU A CG
4168563 C CD1 . LEU A 82 ? 0.7172 0.8232 0.6163 -0.0535 -0.0457 -0.0009 106 LEU A CD1
4169564 C CD2 . LEU A 82 ? 0.5835 0.6662 0.4375 -0.0426 -0.0397 -0.0051 106 LEU A CD2
4170565 N N . LEU A 83 ? 0.5358 0.5862 0.4230 -0.0832 -0.0600 0.0231 107 LEU A N
4171566 C CA . LEU A 83 ? 0.7152 0.7595 0.5902 -0.0940 -0.0577 0.0346 107 LEU A CA
4172567 C C . LEU A 83 ? 0.7095 0.7745 0.5677 -0.0972 -0.0459 0.0342 107 LEU A C
4173568 O O . LEU A 83 ? 0.7664 0.8241 0.6014 -0.1034 -0.0443 0.0430 107 LEU A O
4174569 C CB . LEU A 83 ? 0.5840 0.6200 0.4767 -0.1049 -0.0538 0.0383 107 LEU A CB
4175570 C CG . LEU A 83 ? 0.8446 0.8635 0.7596 -0.1016 -0.0567 0.0340 107 LEU A CG
4176571 C CD1 . LEU A 83 ? 0.8738 0.8799 0.7990 -0.1148 -0.0480 0.0349 107 LEU A CD1
4177572 C CD2 . LEU A 83 ? 0.8076 0.8064 0.7273 -0.0936 -0.0686 0.0438 107 LEU A CD2
4178573 N N . ASP A 84 ? 0.7142 0.8056 0.5847 -0.0932 -0.0371 0.0260 108 ASP A N
4179574 C CA . ASP A 84 ? 0.7183 0.8331 0.5812 -0.0935 -0.0229 0.0268 108 ASP A CA
4180575 C C . ASP A 84 ? 0.7513 0.8933 0.6340 -0.0822 -0.0173 0.0191 108 ASP A C
4181576 O O . ASP A 84 ? 0.7053 0.8475 0.6035 -0.0771 -0.0255 0.0138 108 ASP A O
4182577 C CB . ASP A 84 ? 0.8442 0.9711 0.7127 -0.1101 -0.0148 0.0355 108 ASP A CB
4183578 C CG . ASP A 84 ? 1.0674 1.2098 0.9208 -0.1120 0.0014 0.0397 108 ASP A CG
4184579 O OD1 . ASP A 84 ? 1.0789 1.2182 0.9139 -0.1001 0.0077 0.0344 108 ASP A OD1
4185580 O OD2 . ASP A 84 ? 1.0395 1.1950 0.8983 -0.1262 0.0099 0.0476 108 ASP A OD2
4186581 N N . TRP A 85 ? 0.7310 0.8964 0.6147 -0.0780 -0.0018 0.0200 109 TRP A N
4187582 C CA . TRP A 85 ? 0.5480 0.7448 0.4588 -0.0667 0.0046 0.0175 109 TRP A CA
4188583 C C . TRP A 85 ? 0.6556 0.8852 0.5791 -0.0682 0.0239 0.0239 109 TRP A C
4189584 O O . TRP A 85 ? 0.8904 1.1110 0.7910 -0.0733 0.0358 0.0263 109 TRP A O
4190585 C CB . TRP A 85 ? 0.5629 0.7447 0.4646 -0.0477 0.0049 0.0088 109 TRP A CB
4191586 C CG . TRP A 85 ? 0.8286 0.9941 0.7001 -0.0414 0.0196 0.0048 109 TRP A CG
4192587 C CD1 . TRP A 85 ? 0.9214 1.0540 0.7529 -0.0489 0.0161 0.0036 109 TRP A CD1
4193588 C CD2 . TRP A 85 ? 0.9716 1.1519 0.8483 -0.0276 0.0417 0.0022 109 TRP A CD2
4194589 N NE1 . TRP A 85 ? 1.0707 1.1933 0.8742 -0.0431 0.0345 -0.0019 109 TRP A NE1
4195590 C CE2 . TRP A 85 ? 0.9799 1.1298 0.8117 -0.0288 0.0530 -0.0038 109 TRP A CE2
4196591 C CE3 . TRP A 85 ? 0.8605 1.0763 0.7767 -0.0143 0.0535 0.0056 109 TRP A CE3
4197592 C CZ2 . TRP A 85 ? 0.9987 1.1482 0.8207 -0.0170 0.0797 -0.0098 109 TRP A CZ2
4198593 C CZ3 . TRP A 85 ? 1.0852 1.3042 1.0002 0.0004 0.0795 0.0023 109 TRP A CZ3
4199594 C CH2 . TRP A 85 ? 1.0615 1.2453 0.9280 -0.0010 0.0945 -0.0069 109 TRP A CH2
4200595 N N . PHE A 86 ? 0.5488 0.8183 0.5102 -0.0648 0.0264 0.0285 110 PHE A N
4201596 C CA . PHE A 86 ? 0.6296 0.9407 0.6178 -0.0661 0.0439 0.0376 110 PHE A CA
4202597 C C . PHE A 86 ? 0.5989 0.9406 0.6221 -0.0459 0.0502 0.0401 110 PHE A C
4203598 O O . PHE A 86 ? 0.6055 0.9482 0.6408 -0.0402 0.0346 0.0390 110 PHE A O
4204599 C CB . PHE A 86 ? 0.5426 0.8815 0.5531 -0.0897 0.0366 0.0472 110 PHE A CB
4205600 C CG . PHE A 86 ? 0.7163 1.0220 0.6972 -0.1094 0.0298 0.0463 110 PHE A CG
4206601 C CD1 . PHE A 86 ? 0.7651 1.0366 0.7301 -0.1142 0.0121 0.0400 110 PHE A CD1
4207602 C CD2 . PHE A 86 ? 1.0409 1.3491 1.0124 -0.1223 0.0430 0.0533 110 PHE A CD2
4208603 C CE1 . PHE A 86 ? 0.8967 1.1369 0.8408 -0.1296 0.0077 0.0414 110 PHE A CE1
4209604 C CE2 . PHE A 86 ? 1.1602 1.4361 1.1068 -0.1394 0.0367 0.0553 110 PHE A CE2
4210605 C CZ . PHE A 86 ? 1.1203 1.3620 1.0552 -0.1420 0.0189 0.0497 110 PHE A CZ
4211606 N N . GLU A 87 ? 0.6747 1.0398 0.7147 -0.0347 0.0746 0.0444 111 GLU A N
4212607 C CA . GLU A 87 ? 0.5647 0.9652 0.6493 -0.0143 0.0837 0.0514 111 GLU A CA
4213608 C C . GLU A 87 ? 0.6900 1.1518 0.8272 -0.0252 0.0847 0.0692 111 GLU A C
4214609 O O . GLU A 87 ? 0.7208 1.1998 0.8629 -0.0351 0.1016 0.0743 111 GLU A O
4215610 C CB . GLU A 87 ? 0.7479 1.1330 0.8224 0.0082 0.1142 0.0445 111 GLU A CB
4216611 C CG . GLU A 87 ? 0.7122 1.1310 0.8387 0.0330 0.1263 0.0534 111 GLU A CG
4217612 C CD . GLU A 87 ? 1.0525 1.4415 1.1619 0.0569 0.1578 0.0422 111 GLU A CD
4218613 O OE1 . GLU A 87 ? 1.2525 1.6129 1.3192 0.0513 0.1780 0.0317 111 GLU A OE1
4219614 O OE2 . GLU A 87 ? 1.0150 1.4055 1.1501 0.0799 0.1626 0.0441 111 GLU A OE2
4220615 N N . ARG A 88 ? 0.5667 1.0615 0.7412 -0.0258 0.0655 0.0796 112 ARG A N
4221616 C CA . ARG A 88 ? 0.5770 1.1368 0.8088 -0.0348 0.0624 0.0996 112 ARG A CA
4222617 C C . ARG A 88 ? 0.6846 1.2808 0.9682 -0.0059 0.0779 0.1120 112 ARG A C
4223618 O O . ARG A 88 ? 0.4818 1.0461 0.7513 0.0196 0.0909 0.1027 112 ARG A O
4224619 C CB . ARG A 88 ? 0.6738 1.2455 0.9092 -0.0577 0.0287 0.1046 112 ARG A CB
4225620 C CG . ARG A 88 ? 0.5331 1.0894 0.7399 -0.0902 0.0197 0.0994 112 ARG A CG
4226621 C CD . ARG A 88 ? 0.6741 1.2333 0.8764 -0.1139 -0.0096 0.1007 112 ARG A CD
4227622 N NE . ARG A 88 ? 0.7122 1.2688 0.9015 -0.1470 -0.0147 0.0999 112 ARG A NE
4228623 C CZ . ARG A 88 ? 0.8779 1.4250 1.0513 -0.1740 -0.0357 0.0967 112 ARG A CZ
4229624 N NH1 . ARG A 88 ? 0.8085 1.3490 0.9742 -0.1731 -0.0542 0.0944 112 ARG A NH1
4230625 N NH2 . ARG A 88 ? 0.9538 1.4948 1.1158 -0.2038 -0.0366 0.0956 112 ARG A NH2
4231626 N N . PRO A 89 ? 0.8467 1.5103 1.1943 -0.0091 0.0786 0.1344 113 PRO A N
4232627 C CA . PRO A 89 ? 0.6695 1.3712 1.0767 0.0213 0.0941 0.1501 113 PRO A CA
4233628 C C . PRO A 89 ? 0.6611 1.3432 1.0669 0.0411 0.0789 0.1500 113 PRO A C
4234629 O O . PRO A 89 ? 0.7700 1.4260 1.1746 0.0711 0.1011 0.1435 113 PRO A O
4235630 C CB . PRO A 89 ? 0.7172 1.4986 1.1935 0.0056 0.0829 0.1777 113 PRO A CB
4236631 C CG . PRO A 89 ? 0.6991 1.4786 1.1505 -0.0257 0.0851 0.1717 113 PRO A CG
4237632 C CD . PRO A 89 ? 0.7232 1.4307 1.0946 -0.0393 0.0714 0.1468 113 PRO A CD
4238633 N N . ASP A 90 ? 0.6633 1.3538 1.0656 0.0234 0.0427 0.1563 114 ASP A N
4239634 C CA . ASP A 90 ? 0.6845 1.3586 1.0847 0.0390 0.0264 0.1588 114 ASP A CA
4240635 C C . ASP A 90 ? 0.6646 1.2849 0.9997 0.0207 0.0038 0.1396 114 ASP A C
4241636 O O . ASP A 90 ? 0.7711 1.3873 1.1021 0.0194 -0.0190 0.1446 114 ASP A O
4242637 C CB . ASP A 90 ? 0.6949 1.4354 1.1590 0.0379 0.0047 0.1899 114 ASP A CB
4243638 C CG . ASP A 90 ? 0.6259 1.4033 1.1581 0.0734 0.0279 0.2098 114 ASP A CG
4244639 O OD1 . ASP A 90 ? 0.8549 1.5981 1.3773 0.0991 0.0627 0.1957 114 ASP A OD1
4245640 O OD2 . ASP A 90 ? 0.8728 1.7123 1.4684 0.0750 0.0116 0.2402 114 ASP A OD2
4246641 N N . SER A 91 ? 0.7129 1.2911 0.9980 0.0074 0.0113 0.1188 115 SER A N
4247642 C CA . SER A 91 ? 0.5653 1.0980 0.7969 -0.0119 -0.0079 0.1027 115 SER A CA
4248643 C C . SER A 91 ? 0.6043 1.0829 0.7868 -0.0103 0.0079 0.0815 115 SER A C
4249644 O O . SER A 91 ? 0.6673 1.1502 0.8508 -0.0087 0.0290 0.0801 115 SER A O
4250645 C CB . SER A 91 ? 0.5110 1.0687 0.7439 -0.0467 -0.0289 0.1089 115 SER A CB
4251646 O OG . SER A 91 ? 0.5359 1.0450 0.7173 -0.0652 -0.0386 0.0912 115 SER A OG
4252647 N N . PHE A 92 ? 0.5976 1.0270 0.7383 -0.0116 -0.0026 0.0667 116 PHE A N
4253648 C CA . PHE A 92 ? 0.5397 0.9194 0.6339 -0.0157 0.0039 0.0497 116 PHE A CA
4254649 C C . PHE A 92 ? 0.6048 0.9655 0.6751 -0.0406 -0.0143 0.0441 116 PHE A C
4255650 O O . PHE A 92 ? 0.5449 0.9057 0.6161 -0.0476 -0.0313 0.0450 116 PHE A O
4256651 C CB . PHE A 92 ? 0.7082 1.0450 0.7776 0.0045 0.0085 0.0378 116 PHE A CB
4257652 C CG . PHE A 92 ? 0.7856 1.1141 0.8523 0.0236 0.0343 0.0340 116 PHE A CG
4258653 C CD1 . PHE A 92 ? 0.9509 1.2619 0.9893 0.0168 0.0485 0.0269 116 PHE A CD1
4259654 C CD2 . PHE A 92 ? 0.9743 1.3094 1.0643 0.0479 0.0457 0.0377 116 PHE A CD2
4260655 C CE1 . PHE A 92 ? 0.9918 1.2906 1.0198 0.0320 0.0749 0.0213 116 PHE A CE1
4261656 C CE2 . PHE A 92 ? 0.9427 1.2642 1.0269 0.0651 0.0737 0.0317 116 PHE A CE2
4262657 C CZ . PHE A 92 ? 1.0475 1.3500 1.0980 0.0563 0.0890 0.0224 116 PHE A CZ
4263658 N N . VAL A 93 ? 0.5860 0.9279 0.6337 -0.0540 -0.0092 0.0388 117 VAL A N
4264659 C CA . VAL A 93 ? 0.5144 0.8365 0.5436 -0.0770 -0.0217 0.0345 117 VAL A CA
4265660 C C . VAL A 93 ? 0.4819 0.7542 0.4759 -0.0739 -0.0204 0.0239 117 VAL A C
4266661 O O . VAL A 93 ? 0.6445 0.9058 0.6237 -0.0718 -0.0092 0.0236 117 VAL A O
4267662 C CB . VAL A 93 ? 0.5483 0.8955 0.5889 -0.0993 -0.0188 0.0423 117 VAL A CB
4268663 C CG1 . VAL A 93 ? 0.5095 0.8267 0.5281 -0.1220 -0.0283 0.0362 117 VAL A CG1
4269664 C CG2 . VAL A 93 ? 0.4938 0.8967 0.5748 -0.1047 -0.0237 0.0559 117 VAL A CG2
4270665 N N . LEU A 94 ? 0.5921 0.8356 0.5729 -0.0743 -0.0317 0.0166 118 LEU A N
4271666 C CA . LEU A 94 ? 0.5111 0.7122 0.4667 -0.0718 -0.0335 0.0096 118 LEU A CA
4272667 C C . LEU A 94 ? 0.5349 0.7167 0.4840 -0.0905 -0.0386 0.0086 118 LEU A C
4273668 O O . LEU A 94 ? 0.5252 0.7098 0.4805 -0.1015 -0.0442 0.0063 118 LEU A O
4274669 C CB . LEU A 94 ? 0.4922 0.6733 0.4425 -0.0574 -0.0398 0.0029 118 LEU A CB
4275670 C CG . LEU A 94 ? 0.5042 0.6994 0.4640 -0.0387 -0.0357 0.0032 118 LEU A CG
4276671 C CD1 . LEU A 94 ? 0.5781 0.7414 0.5240 -0.0277 -0.0408 -0.0044 118 LEU A CD1
4277672 C CD2 . LEU A 94 ? 0.5910 0.8003 0.5514 -0.0300 -0.0204 0.0060 118 LEU A CD2
4278673 N N . ILE A 95 ? 0.6274 0.7871 0.5622 -0.0949 -0.0358 0.0108 119 ILE A N
4279674 C CA . ILE A 95 ? 0.5712 0.7049 0.5019 -0.1090 -0.0384 0.0109 119 ILE A CA
4280675 C C . ILE A 95 ? 0.5969 0.6980 0.5211 -0.0986 -0.0446 0.0081 119 ILE A C
4281676 O O . ILE A 95 ? 0.7947 0.8835 0.7070 -0.0914 -0.0467 0.0124 119 ILE A O
4282677 C CB . ILE A 95 ? 0.7022 0.8334 0.6259 -0.1213 -0.0322 0.0193 119 ILE A CB
4283678 C CG1 . ILE A 95 ? 0.5909 0.7615 0.5260 -0.1301 -0.0250 0.0237 119 ILE A CG1
4284679 C CG2 . ILE A 95 ? 0.7899 0.8920 0.7132 -0.1357 -0.0330 0.0198 119 ILE A CG2
4285680 C CD1 . ILE A 95 ? 0.5102 0.7001 0.4607 -0.1442 -0.0292 0.0210 119 ILE A CD1
4286681 N N . LEU A 96 ? 0.5991 0.6877 0.5306 -0.0994 -0.0475 0.0016 120 LEU A N
4287682 C CA . LEU A 96 ? 0.7758 0.8381 0.7103 -0.0906 -0.0519 -0.0009 120 LEU A CA
4288683 C C . LEU A 96 ? 0.6415 0.6763 0.5825 -0.1002 -0.0475 -0.0002 120 LEU A C
4289684 O O . LEU A 96 ? 0.6061 0.6392 0.5451 -0.1154 -0.0412 -0.0011 120 LEU A O
4290685 C CB . LEU A 96 ? 0.6517 0.7201 0.5908 -0.0839 -0.0539 -0.0089 120 LEU A CB
4291686 C CG . LEU A 96 ? 0.6309 0.7247 0.5677 -0.0734 -0.0559 -0.0089 120 LEU A CG
4292687 C CD1 . LEU A 96 ? 0.5629 0.6718 0.5051 -0.0739 -0.0573 -0.0128 120 LEU A CD1
4293688 C CD2 . LEU A 96 ? 0.6248 0.7053 0.5559 -0.0594 -0.0604 -0.0090 120 LEU A CD2
4294689 N N . GLU A 97 ? 0.8460 0.8583 0.7974 -0.0918 -0.0498 0.0017 121 GLU A N
4295690 C CA . GLU A 97 ? 0.8082 0.7917 0.7721 -0.0971 -0.0422 0.0033 121 GLU A CA
4296691 C C . GLU A 97 ? 0.8004 0.7744 0.7643 -0.1051 -0.0314 -0.0102 121 GLU A C
4297692 O O . GLU A 97 ? 0.9284 0.9125 0.8897 -0.1008 -0.0330 -0.0179 121 GLU A O
4298693 C CB . GLU A 97 ? 0.9194 0.8864 0.9027 -0.0845 -0.0477 0.0125 121 GLU A CB
4299694 C CG . GLU A 97 ? 0.9558 0.9284 0.9330 -0.0800 -0.0612 0.0269 121 GLU A CG
4300695 C CD . GLU A 97 ? 1.1002 1.0620 1.0993 -0.0699 -0.0712 0.0382 121 GLU A CD
4301696 O OE1 . GLU A 97 ? 0.9739 0.9406 0.9826 -0.0622 -0.0747 0.0326 121 GLU A OE1
4302697 O OE2 . GLU A 97 ? 1.2436 1.1936 1.2524 -0.0705 -0.0765 0.0547 121 GLU A OE2
4303698 N N . ARG A 98 ? 0.8456 0.7965 0.8084 -0.1183 -0.0196 -0.0132 122 ARG A N
4304699 C CA . ARG A 98 ? 0.7490 0.6795 0.7060 -0.1286 -0.0061 -0.0275 122 ARG A CA
4305700 C C . ARG A 98 ? 0.6593 0.5503 0.6360 -0.1234 0.0085 -0.0263 122 ARG A C
4306701 O O . ARG A 98 ? 0.7797 0.6476 0.7591 -0.1308 0.0166 -0.0221 122 ARG A O
4307702 C CB . ARG A 98 ? 0.7298 0.6627 0.6643 -0.1527 -0.0022 -0.0351 122 ARG A CB
4308703 C CG . ARG A 98 ? 0.6730 0.5861 0.5895 -0.1679 0.0094 -0.0516 122 ARG A CG
4309704 C CD . ARG A 98 ? 0.7854 0.7169 0.6775 -0.1932 0.0039 -0.0567 122 ARG A CD
4310705 N NE . ARG A 98 ? 0.7797 0.7013 0.6693 -0.2087 0.0075 -0.0531 122 ARG A NE
4311706 C CZ . ARG A 98 ? 0.8607 0.7368 0.7434 -0.2214 0.0244 -0.0603 122 ARG A CZ
4312707 N NH1 . ARG A 98 ? 0.8947 0.7310 0.7715 -0.2210 0.0415 -0.0731 122 ARG A NH1
4313708 N NH2 . ARG A 98 ? 0.9154 0.7836 0.7972 -0.2348 0.0264 -0.0547 122 ARG A NH2
4314709 N N . PRO A 99 ? 0.8288 0.7110 0.8235 -0.1100 0.0134 -0.0280 123 PRO A N
4315710 C CA . PRO A 99 ? 0.8234 0.6682 0.8422 -0.1048 0.0327 -0.0280 123 PRO A CA
4316711 C C . PRO A 99 ? 0.7739 0.5856 0.7700 -0.1240 0.0550 -0.0458 123 PRO A C
4317712 O O . PRO A 99 ? 0.8175 0.6383 0.7800 -0.1410 0.0537 -0.0590 123 PRO A O
4318713 C CB . PRO A 99 ? 0.7287 0.5795 0.7693 -0.0893 0.0335 -0.0281 123 PRO A CB
4319714 C CG . PRO A 99 ? 0.6613 0.5505 0.6929 -0.0836 0.0098 -0.0229 123 PRO A CG
4320715 C CD . PRO A 99 ? 0.6464 0.5519 0.6437 -0.0987 0.0032 -0.0292 123 PRO A CD
4321716 N N . GLU A 100 ? 1.0214 0.7928 1.0356 -0.1222 0.0757 -0.0452 124 GLU A N
4322717 C CA . GLU A 100 ? 0.8852 0.6153 0.8735 -0.1420 0.1007 -0.0645 124 GLU A CA
4323718 C C . GLU A 100 ? 0.9946 0.6785 1.0134 -0.1305 0.1305 -0.0659 124 GLU A C
4324719 O O . GLU A 100 ? 0.9734 0.6469 1.0304 -0.1154 0.1316 -0.0478 124 GLU A O
4325720 C CB . GLU A 100 ? 1.0204 0.7430 0.9849 -0.1628 0.0970 -0.0646 124 GLU A CB
4326721 C CG . GLU A 100 ? 1.2689 1.0072 1.1876 -0.1897 0.0898 -0.0798 124 GLU A CG
4327722 C CD . GLU A 100 ? 1.4602 1.1554 1.3466 -0.2104 0.1144 -0.1035 124 GLU A CD
4328723 O OE1 . GLU A 100 ? 1.4659 1.1091 1.3576 -0.2122 0.1407 -0.1100 124 GLU A OE1
4329724 O OE2 . GLU A 100 ? 1.5276 1.2386 1.3819 -0.2249 0.1084 -0.1151 124 GLU A OE2
4330725 N N . PRO A 101 ? 1.2000 0.8551 1.2042 -0.1367 0.1563 -0.0857 125 PRO A N
4331726 C CA . PRO A 101 ? 1.0753 0.7413 1.0343 -0.1543 0.1545 -0.1044 125 PRO A CA
4332727 C C . PRO A 101 ? 1.0488 0.7590 1.0240 -0.1378 0.1355 -0.0957 125 PRO A C
4333728 O O . PRO A 101 ? 0.9446 0.6688 0.9664 -0.1140 0.1299 -0.0789 125 PRO A O
4334729 C CB . PRO A 101 ? 0.9711 0.5823 0.9149 -0.1630 0.1939 -0.1257 125 PRO A CB
4335730 C CG . PRO A 101 ? 1.2582 0.8267 1.2361 -0.1529 0.2169 -0.1198 125 PRO A CG
4336731 C CD . PRO A 101 ? 1.0916 0.6969 1.1229 -0.1272 0.1924 -0.0906 125 PRO A CD
4337732 N N . VAL A 102 ? 0.9442 0.6754 0.8817 -0.1514 0.1247 -0.1054 126 VAL A N
4338733 C CA . VAL A 102 ? 0.8769 0.6501 0.8254 -0.1376 0.1038 -0.0962 126 VAL A CA
4339734 C C . VAL A 102 ? 0.8466 0.6193 0.7559 -0.1524 0.1084 -0.1107 126 VAL A C
4340735 O O . VAL A 102 ? 0.9053 0.6623 0.7699 -0.1778 0.1138 -0.1245 126 VAL A O
4341736 C CB . VAL A 102 ? 0.8019 0.6181 0.7514 -0.1346 0.0718 -0.0821 126 VAL A CB
4342737 C CG1 . VAL A 102 ? 0.7573 0.5816 0.6658 -0.1597 0.0636 -0.0897 126 VAL A CG1
4343738 C CG2 . VAL A 102 ? 0.7263 0.5789 0.6869 -0.1195 0.0528 -0.0736 126 VAL A CG2
4344739 N N . GLN A 103 ? 0.8485 0.6375 0.7731 -0.1384 0.1057 -0.1066 127 GLN A N
4345740 C CA . GLN A 103 ? 0.8066 0.5998 0.6934 -0.1514 0.1057 -0.1160 127 GLN A CA
4346741 C C . GLN A 103 ? 0.7202 0.5492 0.6251 -0.1349 0.0862 -0.1038 127 GLN A C
4347742 O O . GLN A 103 ? 0.6403 0.4757 0.5879 -0.1143 0.0864 -0.0941 127 GLN A O
4348743 C CB . GLN A 103 ? 0.8211 0.5709 0.6919 -0.1600 0.1408 -0.1326 127 GLN A CB
4349744 C CG . GLN A 103 ? 0.9792 0.7248 0.7918 -0.1842 0.1412 -0.1444 127 GLN A CG
4350745 C CD . GLN A 103 ? 0.9621 0.6623 0.7530 -0.1936 0.1788 -0.1618 127 GLN A CD
4351746 O OE1 . GLN A 103 ? 1.0252 0.7011 0.8538 -0.1779 0.2063 -0.1638 127 GLN A OE1
4352747 N NE2 . GLN A 103 ? 0.9933 0.6822 0.7236 -0.2198 0.1810 -0.1734 127 GLN A NE2
4353748 N N . ASP A 104 ? 0.7423 0.5945 0.6154 -0.1451 0.0684 -0.1030 128 ASP A N
4354749 C CA . ASP A 104 ? 0.7002 0.5747 0.5788 -0.1343 0.0565 -0.0954 128 ASP A CA
4355750 C C . ASP A 104 ? 0.8815 0.7345 0.7777 -0.1262 0.0793 -0.0993 128 ASP A C
4356751 O O . ASP A 104 ? 0.8558 0.6759 0.7325 -0.1387 0.1058 -0.1126 128 ASP A O
4357752 C CB . ASP A 104 ? 0.8987 0.7855 0.7325 -0.1526 0.0450 -0.0970 128 ASP A CB
4358753 C CG . ASP A 104 ? 1.1417 1.0697 0.9816 -0.1449 0.0158 -0.0830 128 ASP A CG
4359754 O OD1 . ASP A 104 ? 1.1462 1.0902 1.0189 -0.1264 0.0061 -0.0744 128 ASP A OD1
4360755 O OD2 . ASP A 104 ? 1.1425 1.0863 0.9537 -0.1581 0.0032 -0.0798 128 ASP A OD2
4361756 N N . LEU A 105 ? 0.6238 0.4942 0.5564 -0.1068 0.0704 -0.0881 129 LEU A N
4362757 C CA . LEU A 105 ? 0.5700 0.4276 0.5185 -0.1016 0.0893 -0.0898 129 LEU A CA
4363758 C C . LEU A 105 ? 0.7549 0.6051 0.6576 -0.1176 0.0952 -0.0969 129 LEU A C
4364759 O O . LEU A 105 ? 0.8050 0.6322 0.7026 -0.1224 0.1212 -0.1045 129 LEU A O
4365760 C CB . LEU A 105 ? 0.7205 0.6008 0.7115 -0.0825 0.0741 -0.0757 129 LEU A CB
4366761 C CG . LEU A 105 ? 0.6194 0.4901 0.6366 -0.0775 0.0942 -0.0753 129 LEU A CG
4367762 C CD1 . LEU A 105 ? 0.6304 0.4790 0.6818 -0.0730 0.1227 -0.0787 129 LEU A CD1
4368763 C CD2 . LEU A 105 ? 0.4914 0.3854 0.5422 -0.0642 0.0749 -0.0618 129 LEU A CD2
4369764 N N . PHE A 106 ? 0.8588 0.7284 0.7283 -0.1263 0.0723 -0.0931 130 PHE A N
4370765 C CA . PHE A 106 ? 0.8190 0.6830 0.6408 -0.1442 0.0735 -0.0964 130 PHE A CA
4371766 C C . PHE A 106 ? 0.9018 0.7324 0.6804 -0.1687 0.0961 -0.1131 130 PHE A C
4372767 O O . PHE A 106 ? 0.9910 0.7959 0.7429 -0.1803 0.1185 -0.1219 130 PHE A O
4373768 C CB . PHE A 106 ? 0.8988 0.7950 0.7037 -0.1464 0.0421 -0.0848 130 PHE A CB
4374769 C CG . PHE A 106 ? 0.9352 0.8298 0.6912 -0.1663 0.0378 -0.0836 130 PHE A CG
4375770 C CD1 . PHE A 106 ? 0.9308 0.8283 0.6826 -0.1616 0.0351 -0.0749 130 PHE A CD1
4376771 C CD2 . PHE A 106 ? 0.8738 0.7631 0.5860 -0.1920 0.0350 -0.0898 130 PHE A CD2
4377772 C CE1 . PHE A 106 ? 0.9452 0.8410 0.6498 -0.1809 0.0293 -0.0707 130 PHE A CE1
4378773 C CE2 . PHE A 106 ? 1.0012 0.8902 0.6650 -0.2133 0.0275 -0.0863 130 PHE A CE2
4379774 C CZ . PHE A 106 ? 0.9652 0.8577 0.6250 -0.2071 0.0245 -0.0758 130 PHE A CZ
4380775 N N . ASP A 107 ? 0.9762 0.8046 0.7426 -0.1794 0.0910 -0.1183 131 ASP A N
4381776 C CA . ASP A 107 ? 1.0411 0.8312 0.7640 -0.2050 0.1139 -0.1365 131 ASP A CA
4382777 C C . ASP A 107 ? 1.0200 0.7704 0.7625 -0.1978 0.1532 -0.1489 131 ASP A C
4383778 O O . ASP A 107 ? 1.1382 0.8511 0.8407 -0.2161 0.1813 -0.1646 131 ASP A O
4384779 C CB . ASP A 107 ? 0.8776 0.6708 0.5938 -0.2160 0.1028 -0.1391 131 ASP A CB
4385780 C CG . ASP A 107 ? 1.0191 0.8539 0.7196 -0.2247 0.0668 -0.1263 131 ASP A CG
4386781 O OD1 . ASP A 107 ? 1.0092 0.8566 0.6794 -0.2353 0.0548 -0.1208 131 ASP A OD1
4387782 O OD2 . ASP A 107 ? 1.2495 1.1048 0.9697 -0.2210 0.0516 -0.1201 131 ASP A OD2
4388783 N N . PHE A 108 ? 0.9463 0.7047 0.7507 -0.1716 0.1562 -0.1408 132 PHE A N
4389784 C CA . PHE A 108 ? 0.9349 0.6625 0.7728 -0.1606 0.1925 -0.1475 132 PHE A CA
4390785 C C . PHE A 108 ? 1.1348 0.8507 0.9630 -0.1626 0.2142 -0.1517 132 PHE A C
4391786 O O . PHE A 108 ? 1.1370 0.8125 0.9474 -0.1722 0.2524 -0.1674 132 PHE A O
4392787 C CB . PHE A 108 ? 0.7164 0.4661 0.6261 -0.1322 0.1827 -0.1314 132 PHE A CB
4393788 C CG . PHE A 108 ? 0.8545 0.5797 0.8120 -0.1180 0.2168 -0.1330 132 PHE A CG
4394789 C CD1 . PHE A 108 ? 0.9908 0.7217 0.9818 -0.1062 0.2312 -0.1278 132 PHE A CD1
4395790 C CD2 . PHE A 108 ? 1.0121 0.7087 0.9847 -0.1163 0.2358 -0.1382 132 PHE A CD2
4396791 C CE1 . PHE A 108 ? 1.0022 0.7154 1.0460 -0.0918 0.2637 -0.1267 132 PHE A CE1
4397792 C CE2 . PHE A 108 ? 0.9640 0.6388 0.9879 -0.1006 0.2688 -0.1370 132 PHE A CE2
4398793 C CZ . PHE A 108 ? 1.0077 0.6931 1.0696 -0.0878 0.2829 -0.1308 132 PHE A CZ
4399794 N N . ILE A 109 ? 1.0191 0.7671 0.8577 -0.1540 0.1927 -0.1380 133 ILE A N
4400795 C CA . ILE A 109 ? 0.8343 0.5733 0.6669 -0.1557 0.2123 -0.1394 133 ILE A CA
4401796 C C . ILE A 109 ? 1.0363 0.7480 0.7907 -0.1857 0.2249 -0.1535 133 ILE A C
4402797 O O . ILE A 109 ? 1.2353 0.9124 0.9701 -0.1953 0.2623 -0.1665 133 ILE A O
4403798 C CB . ILE A 109 ? 0.9362 0.7131 0.7962 -0.1412 0.1843 -0.1208 133 ILE A CB
4404799 C CG1 . ILE A 109 ? 1.0103 0.8009 0.9458 -0.1166 0.1888 -0.1103 133 ILE A CG1
4405800 C CG2 . ILE A 109 ? 1.0669 0.8371 0.8887 -0.1539 0.1918 -0.1210 133 ILE A CG2
4406801 C CD1 . ILE A 109 ? 0.8747 0.7009 0.8380 -0.1030 0.1560 -0.0931 133 ILE A CD1
4407802 N N . THR A 110 ? 1.0740 0.8011 0.7826 -0.2019 0.1942 -0.1502 134 THR A N
4408803 C CA . THR A 110 ? 1.3013 1.0069 0.9318 -0.2339 0.1988 -0.1600 134 THR A CA
4409804 C C . THR A 110 ? 1.2151 0.8682 0.8077 -0.2543 0.2375 -0.1846 134 THR A C
4410805 O O . THR A 110 ? 1.2333 0.8532 0.7672 -0.2780 0.2606 -0.1973 134 THR A O
4411806 C CB . THR A 110 ? 1.2211 0.9572 0.8210 -0.2470 0.1570 -0.1496 134 THR A CB
4412807 O OG1 . THR A 110 ? 1.1118 0.8930 0.7622 -0.2214 0.1257 -0.1292 134 THR A OG1
4413808 C CG2 . THR A 110 ? 1.0948 0.8253 0.6249 -0.2751 0.1493 -0.1480 134 THR A CG2
4414809 N N . GLU A 111 ? 1.2851 0.9262 0.9082 -0.2461 0.2469 -0.1916 135 GLU A N
4415810 C CA . GLU A 111 ? 1.2601 0.8451 0.8537 -0.2622 0.2878 -0.2157 135 GLU A CA
4416811 C C . GLU A 111 ? 1.4483 1.0042 1.0781 -0.2459 0.3351 -0.2232 135 GLU A C
4417812 O O . GLU A 111 ? 1.4947 1.0065 1.0765 -0.2647 0.3726 -0.2415 135 GLU A O
4418813 C CB . GLU A 111 ? 1.1957 0.7774 0.8133 -0.2579 0.2808 -0.2179 135 GLU A CB
4419814 C CG . GLU A 111 ? 1.5770 1.1466 1.1281 -0.2923 0.2649 -0.2282 135 GLU A CG
4420815 C CD . GLU A 111 ? 1.5723 1.1363 1.1507 -0.2878 0.2611 -0.2296 135 GLU A CD
4421816 O OE1 . GLU A 111 ? 1.5148 1.1058 1.0777 -0.3007 0.2269 -0.2225 135 GLU A OE1
4422817 O OE2 . GLU A 111 ? 1.5564 1.0905 1.1758 -0.2704 0.2927 -0.2356 135 GLU A OE2
4423818 N N . ARG A 112 ? 1.2783 0.8590 0.9931 -0.2119 0.3342 -0.2084 136 ARG A N
4424819 C CA . ARG A 112 ? 1.2911 0.8520 1.0604 -0.1922 0.3770 -0.2110 136 ARG A CA
4425820 C C . ARG A 112 ? 1.3141 0.8879 1.0929 -0.1875 0.3877 -0.2042 136 ARG A C
4426821 O O . ARG A 112 ? 1.3454 0.9128 1.1806 -0.1693 0.4206 -0.2022 136 ARG A O
4427822 C CB . ARG A 112 ? 1.3277 0.9148 1.1864 -0.1601 0.3657 -0.1937 136 ARG A CB
4428823 C CG . ARG A 112 ? 1.4427 1.0239 1.2982 -0.1626 0.3492 -0.1952 136 ARG A CG
4429824 C CD . ARG A 112 ? 1.5504 1.0851 1.4328 -0.1556 0.3922 -0.2064 136 ARG A CD
4430825 N NE . ARG A 112 ? 1.5543 1.1121 1.5307 -0.1221 0.3905 -0.1855 136 ARG A NE
4431826 C CZ . ARG A 112 ? 1.7010 1.2584 1.7392 -0.1017 0.4201 -0.1787 136 ARG A CZ
4432827 N NH1 . ARG A 112 ? 1.6872 1.2232 1.7046 -0.1096 0.4557 -0.1917 136 ARG A NH1
4433828 N NH2 . ARG A 112 ? 1.4835 1.0646 1.6074 -0.0737 0.4132 -0.1567 136 ARG A NH2
4434829 N N . GLY A 113 ? 1.2701 0.8624 0.9992 -0.2032 0.3611 -0.1988 137 GLY A N
4435830 C CA . GLY A 113 ? 1.2385 0.8442 0.9781 -0.1988 0.3680 -0.1898 137 GLY A CA
4436831 C C . GLY A 113 ? 1.0585 0.7076 0.8885 -0.1671 0.3505 -0.1678 137 GLY A C
4437832 O O . GLY A 113 ? 0.9922 0.6674 0.8657 -0.1507 0.3227 -0.1570 137 GLY A O
4438833 N N . ALA A 114 ? 1.1163 0.7718 0.9710 -0.1614 0.3676 -0.1612 138 ALA A N
4439834 C CA . ALA A 114 ? 0.9330 0.6262 0.8739 -0.1354 0.3556 -0.1413 138 ALA A CA
4440835 C C . ALA A 114 ? 0.9667 0.6594 0.9787 -0.1147 0.3706 -0.1395 138 ALA A C
4441836 O O . ALA A 114 ? 1.1763 0.8314 1.1806 -0.1180 0.4083 -0.1552 138 ALA A O
4442837 C CB . ALA A 114 ? 1.0185 0.7121 0.9759 -0.1359 0.3814 -0.1369 138 ALA A CB
4443838 N N . LEU A 115 ? 0.9967 0.7289 1.0761 -0.0942 0.3407 -0.1195 139 LEU A N
4444839 C CA . LEU A 115 ? 0.7560 0.4948 0.9046 -0.0742 0.3442 -0.1114 139 LEU A CA
4445840 C C . LEU A 115 ? 0.8554 0.6081 1.0873 -0.0574 0.3696 -0.0989 139 LEU A C
4446841 O O . LEU A 115 ? 0.9017 0.6804 1.1554 -0.0564 0.3595 -0.0872 139 LEU A O
4447842 C CB . LEU A 115 ? 0.7770 0.5509 0.9442 -0.0647 0.2932 -0.0957 139 LEU A CB
4448843 C CG . LEU A 115 ? 0.9341 0.6977 1.0565 -0.0721 0.2736 -0.1034 139 LEU A CG
4449844 C CD1 . LEU A 115 ? 0.8089 0.5417 0.8451 -0.0969 0.2851 -0.1240 139 LEU A CD1
4450845 C CD2 . LEU A 115 ? 0.7585 0.5597 0.8846 -0.0667 0.2235 -0.0886 139 LEU A CD2
4451846 N N . GLN A 116 ? 0.9733 0.7081 1.2540 -0.0446 0.4038 -0.1002 140 GLN A N
4452847 C CA . GLN A 116 ? 0.9156 0.6719 1.2918 -0.0253 0.4242 -0.0829 140 GLN A CA
4453848 C C . GLN A 116 ? 0.7126 0.5227 1.1453 -0.0140 0.3744 -0.0558 140 GLN A C
4454849 O O . GLN A 116 ? 0.8560 0.6801 1.2698 -0.0142 0.3318 -0.0502 140 GLN A O
4455850 C CB . GLN A 116 ? 0.8801 0.6123 1.3088 -0.0091 0.4615 -0.0836 140 GLN A CB
4456851 C CG . GLN A 116 ? 1.0638 0.7344 1.4216 -0.0229 0.5011 -0.1133 140 GLN A CG
4457852 C CD . GLN A 116 ? 1.2525 0.8912 1.6573 -0.0117 0.5595 -0.1173 140 GLN A CD
4458853 O OE1 . GLN A 116 ? 1.1001 0.7547 1.5851 0.0086 0.5581 -0.0958 140 GLN A OE1
4459854 N NE2 . GLN A 116 ? 1.3708 0.9696 1.7151 -0.0321 0.5956 -0.1361 140 GLN A NE2
4460855 N N . GLU A 117 ? 0.8670 0.7065 1.3668 -0.0064 0.3809 -0.0394 141 GLU A N
4461856 C CA . GLU A 117 ? 0.8446 0.7324 1.3890 -0.0016 0.3333 -0.0154 141 GLU A CA
4462857 C C . GLU A 117 ? 0.6892 0.5985 1.2925 0.0145 0.3076 0.0042 141 GLU A C
4463858 O O . GLU A 117 ? 0.7496 0.6879 1.3563 0.0136 0.2598 0.0182 141 GLU A O
4464859 C CB . GLU A 117 ? 0.7285 0.6427 1.3339 -0.0002 0.3476 -0.0018 141 GLU A CB
4465860 C CG . GLU A 117 ? 0.7922 0.6864 1.3377 -0.0174 0.3701 -0.0180 141 GLU A CG
4466861 C CD . GLU A 117 ? 0.8372 0.7642 1.4340 -0.0200 0.3676 -0.0016 141 GLU A CD
4467862 O OE1 . GLU A 117 ? 0.8377 0.7494 1.3995 -0.0329 0.3930 -0.0113 141 GLU A OE1
4468863 O OE2 . GLU A 117 ? 0.7813 0.7491 1.4521 -0.0112 0.3394 0.0218 141 GLU A OE2
4469864 N N . GLU A 118 ? 0.6533 0.5458 1.3005 0.0286 0.3395 0.0059 142 GLU A N
4470865 C CA . GLU A 118 ? 0.7128 0.6213 1.4107 0.0434 0.3152 0.0262 142 GLU A CA
4471866 C C . GLU A 118 ? 0.6965 0.5894 1.3196 0.0347 0.2831 0.0156 142 GLU A C
4472867 O O . GLU A 118 ? 0.6728 0.5922 1.3070 0.0371 0.2386 0.0327 142 GLU A O
4473868 C CB . GLU A 118 ? 0.8360 0.7239 1.5981 0.0616 0.3634 0.0298 142 GLU A CB
4474869 C CG . GLU A 118 ? 0.8811 0.7776 1.7027 0.0794 0.3490 0.0524 142 GLU A CG
4475870 C CD . GLU A 118 ? 1.0340 0.8777 1.8488 0.0880 0.3956 0.0372 142 GLU A CD
4476871 O OE1 . GLU A 118 ? 1.0361 0.8372 1.7608 0.0729 0.4050 0.0086 142 GLU A OE1
4477872 O OE2 . GLU A 118 ? 1.0107 0.8582 1.8865 0.0979 0.4125 0.0565 142 GLU A OE2
4478873 N N . LEU A 119 ? 0.6178 0.4694 1.1603 0.0218 0.3040 -0.0123 143 LEU A N
4479874 C CA . LEU A 119 ? 0.6716 0.5109 1.1420 0.0111 0.2757 -0.0231 143 LEU A CA
4480875 C C . LEU A 119 ? 0.7567 0.6245 1.1881 0.0008 0.2309 -0.0200 143 LEU A C
4481876 O O . LEU A 119 ? 0.6377 0.5210 1.0569 0.0010 0.1931 -0.0118 143 LEU A O
4482877 C CB . LEU A 119 ? 0.7091 0.4999 1.1054 -0.0037 0.3091 -0.0526 143 LEU A CB
4483878 C CG . LEU A 119 ? 0.7769 0.5524 1.1018 -0.0168 0.2867 -0.0648 143 LEU A CG
4484879 C CD1 . LEU A 119 ? 0.6545 0.4402 1.0147 -0.0048 0.2635 -0.0484 143 LEU A CD1
4485880 C CD2 . LEU A 119 ? 0.9362 0.6609 1.1987 -0.0329 0.3243 -0.0922 143 LEU A CD2
4486881 N N . ALA A 120 ? 0.7404 0.6115 1.1485 -0.0088 0.2371 -0.0270 144 ALA A N
4487882 C CA . ALA A 120 ? 0.6624 0.5562 1.0373 -0.0170 0.1982 -0.0235 144 ALA A CA
4488883 C C . ALA A 120 ? 0.6513 0.5830 1.0835 -0.0082 0.1632 0.0003 144 ALA A C
4489884 O O . ALA A 120 ? 0.6303 0.5763 1.0344 -0.0127 0.1261 0.0038 144 ALA A O
4490885 C CB . ALA A 120 ? 0.8116 0.6999 1.1592 -0.0280 0.2143 -0.0321 144 ALA A CB
4491886 N N . ARG A 121 ? 0.6289 0.5763 1.1411 0.0036 0.1747 0.0174 145 ARG A N
4492887 C CA . ARG A 121 ? 0.5587 0.5435 1.1277 0.0092 0.1392 0.0428 145 ARG A CA
4493888 C C . ARG A 121 ? 0.6471 0.6344 1.2073 0.0134 0.1101 0.0508 145 ARG A C
4494889 O O . ARG A 121 ? 0.6113 0.6161 1.1534 0.0078 0.0702 0.0585 145 ARG A O
4495890 C CB . ARG A 121 ? 0.5444 0.5487 1.2080 0.0208 0.1605 0.0620 145 ARG A CB
4496891 C CG . ARG A 121 ? 0.5561 0.6037 1.2837 0.0229 0.1222 0.0913 145 ARG A CG
4497892 C CD . ARG A 121 ? 0.5879 0.6594 1.4157 0.0340 0.1462 0.1118 145 ARG A CD
4498893 N NE . ARG A 121 ? 0.5365 0.6009 1.3668 0.0294 0.1832 0.0996 145 ARG A NE
4499894 C CZ . ARG A 121 ? 0.7756 0.8258 1.6447 0.0398 0.2348 0.0953 145 ARG A CZ
4500895 N NH1 . ARG A 121 ? 0.5511 0.5867 1.4555 0.0563 0.2585 0.0992 145 ARG A NH1
4501896 N NH2 . ARG A 121 ? 0.5661 0.6130 1.4361 0.0330 0.2659 0.0864 145 ARG A NH2
4502897 N N . SER A 122 ? 0.5510 0.5179 1.1228 0.0224 0.1317 0.0492 146 SER A N
4503898 C CA . SER A 122 ? 0.6143 0.5785 1.1693 0.0246 0.1072 0.0556 146 SER A CA
4504899 C C . SER A 122 ? 0.6372 0.5957 1.1097 0.0115 0.0822 0.0402 146 SER A C
4505900 O O . SER A 122 ? 0.5780 0.5525 1.0381 0.0091 0.0460 0.0504 146 SER A O
4506901 C CB . SER A 122 ? 0.5219 0.4537 1.0848 0.0328 0.1406 0.0495 146 SER A CB
4507902 O OG . SER A 122 ? 0.7010 0.6340 1.2675 0.0371 0.1178 0.0630 146 SER A OG
4508903 N N . PHE A 123 ? 0.5839 0.5204 0.9998 0.0023 0.1016 0.0168 147 PHE A N
4509904 C CA . PHE A 123 ? 0.4437 0.3752 0.7872 -0.0084 0.0821 0.0035 147 PHE A CA
4510905 C C . PHE A 123 ? 0.5117 0.4664 0.8428 -0.0126 0.0500 0.0092 147 PHE A C
4511906 O O . PHE A 123 ? 0.5724 0.5347 0.8740 -0.0151 0.0222 0.0110 147 PHE A O
4512907 C CB . PHE A 123 ? 0.6483 0.5530 0.9392 -0.0185 0.1096 -0.0194 147 PHE A CB
4513908 C CG . PHE A 123 ? 0.7690 0.6444 1.0419 -0.0208 0.1322 -0.0304 147 PHE A CG
4514909 C CD1 . PHE A 123 ? 0.5648 0.4374 0.8759 -0.0109 0.1317 -0.0188 147 PHE A CD1
4515910 C CD2 . PHE A 123 ? 0.6071 0.4559 0.8231 -0.0347 0.1531 -0.0515 147 PHE A CD2
4516911 C CE1 . PHE A 123 ? 0.6420 0.4828 0.9358 -0.0140 0.1537 -0.0294 147 PHE A CE1
4517912 C CE2 . PHE A 123 ? 0.6565 0.4744 0.8518 -0.0404 0.1738 -0.0632 147 PHE A CE2
4518913 C CZ . PHE A 123 ? 0.7784 0.5907 1.0132 -0.0296 0.1753 -0.0530 147 PHE A CZ
4519914 N N . PHE A 124 ? 0.5077 0.4709 0.8588 -0.0144 0.0559 0.0112 148 PHE A N
4520915 C CA . PHE A 124 ? 0.4726 0.4526 0.8142 -0.0196 0.0277 0.0163 148 PHE A CA
4521916 C C . PHE A 124 ? 0.5967 0.5976 0.9679 -0.0174 -0.0048 0.0345 148 PHE A C
4522917 O O . PHE A 124 ? 0.5967 0.6018 0.9341 -0.0227 -0.0323 0.0340 148 PHE A O
4523918 C CB . PHE A 124 ? 0.5711 0.5563 0.9399 -0.0227 0.0420 0.0183 148 PHE A CB
4524919 C CG . PHE A 124 ? 0.6220 0.6114 0.9610 -0.0309 0.0212 0.0166 148 PHE A CG
4525920 C CD1 . PHE A 124 ? 0.5841 0.5605 0.8589 -0.0349 0.0124 0.0041 148 PHE A CD1
4526921 C CD2 . PHE A 124 ? 0.4797 0.4863 0.8580 -0.0349 0.0093 0.0289 148 PHE A CD2
4527922 C CE1 . PHE A 124 ? 0.5664 0.5425 0.8162 -0.0405 -0.0044 0.0032 148 PHE A CE1
4528923 C CE2 . PHE A 124 ? 0.7113 0.7156 1.0597 -0.0435 -0.0086 0.0263 148 PHE A CE2
4529924 C CZ . PHE A 124 ? 0.5778 0.5649 0.8617 -0.0450 -0.0142 0.0132 148 PHE A CZ
4530925 N N . TRP A 125 ? 0.5843 0.5979 1.0192 -0.0101 -0.0016 0.0518 149 TRP A N
4531926 C CA . TRP A 125 ? 0.5136 0.5481 0.9764 -0.0101 -0.0350 0.0726 149 TRP A CA
4532927 C C . TRP A 125 ? 0.5902 0.6155 1.0045 -0.0114 -0.0531 0.0692 149 TRP A C
4533928 O O . TRP A 125 ? 0.5626 0.5968 0.9555 -0.0185 -0.0847 0.0754 149 TRP A O
4534929 C CB . TRP A 125 ? 0.5475 0.5968 1.0909 0.0003 -0.0252 0.0943 149 TRP A CB
4535930 C CG . TRP A 125 ? 0.5021 0.5746 1.0759 -0.0011 -0.0614 0.1196 149 TRP A CG
4536931 C CD1 . TRP A 125 ? 0.4409 0.5098 1.0061 0.0022 -0.0760 0.1294 149 TRP A CD1
4537932 C CD2 . TRP A 125 ? 0.4924 0.5950 1.1062 -0.0093 -0.0901 0.1396 149 TRP A CD2
4538933 N NE1 . TRP A 125 ? 0.7464 0.8413 1.3416 -0.0033 -0.1126 0.1553 149 TRP A NE1
4539934 C CE2 . TRP A 125 ? 0.6848 0.8012 1.3101 -0.0113 -0.1229 0.1618 149 TRP A CE2
4540935 C CE3 . TRP A 125 ? 0.4617 0.5805 1.1015 -0.0173 -0.0919 0.1419 149 TRP A CE3
4541936 C CZ2 . TRP A 125 ? 0.7194 0.8660 1.3790 -0.0225 -0.1593 0.1858 149 TRP A CZ2
4542937 C CZ3 . TRP A 125 ? 0.5042 0.6530 1.1811 -0.0282 -0.1269 0.1649 149 TRP A CZ3
4543938 C CH2 . TRP A 125 ? 0.5771 0.7400 1.2627 -0.0314 -0.1612 0.1866 149 TRP A CH2
4544939 N N . GLN A 126 ? 0.5251 0.5309 0.9194 -0.0065 -0.0321 0.0587 150 GLN A N
4545940 C CA . GLN A 126 ? 0.5847 0.5825 0.9339 -0.0089 -0.0462 0.0553 150 GLN A CA
4546941 C C . GLN A 126 ? 0.5552 0.5508 0.8422 -0.0171 -0.0599 0.0405 150 GLN A C
4547942 O O . GLN A 126 ? 0.6438 0.6429 0.9015 -0.0209 -0.0826 0.0434 150 GLN A O
4548943 C CB . GLN A 126 ? 0.4866 0.4620 0.8257 -0.0051 -0.0187 0.0451 150 GLN A CB
4549944 C CG . GLN A 126 ? 0.4272 0.3996 0.8231 0.0049 -0.0077 0.0618 150 GLN A CG
4550945 C CD . GLN A 126 ? 0.5348 0.4775 0.9135 0.0062 0.0208 0.0491 150 GLN A CD
4551946 O OE1 . GLN A 126 ? 0.7271 0.6591 1.0534 -0.0015 0.0165 0.0374 150 GLN A OE1
4552947 N NE2 . GLN A 126 ? 0.6692 0.5972 1.0919 0.0147 0.0523 0.0504 150 GLN A NE2
4553948 N N . VAL A 127 ? 0.4184 0.4068 0.6845 -0.0196 -0.0448 0.0256 151 VAL A N
4554949 C CA . VAL A 127 ? 0.5981 0.5843 0.8126 -0.0249 -0.0561 0.0141 151 VAL A CA
4555950 C C . VAL A 127 ? 0.5826 0.5790 0.7987 -0.0291 -0.0829 0.0222 151 VAL A C
4556951 O O . VAL A 127 ? 0.5502 0.5438 0.7263 -0.0320 -0.0983 0.0175 151 VAL A O
4557952 C CB . VAL A 127 ? 0.5695 0.5460 0.7659 -0.0272 -0.0360 0.0009 151 VAL A CB
4558953 C CG1 . VAL A 127 ? 0.6240 0.5993 0.7770 -0.0302 -0.0489 -0.0064 151 VAL A CG1
4559954 C CG2 . VAL A 127 ? 0.6041 0.5665 0.7839 -0.0280 -0.0121 -0.0097 151 VAL A CG2
4560955 N N . LEU A 128 ? 0.4196 0.4269 0.6815 -0.0306 -0.0873 0.0341 152 LEU A N
4561956 C CA . LEU A 128 ? 0.5415 0.5572 0.8045 -0.0389 -0.1147 0.0423 152 LEU A CA
4562957 C C . LEU A 128 ? 0.5566 0.5772 0.8091 -0.0421 -0.1392 0.0527 152 LEU A C
4563958 O O . LEU A 128 ? 0.6547 0.6697 0.8685 -0.0503 -0.1588 0.0492 152 LEU A O
4564959 C CB . LEU A 128 ? 0.5448 0.5759 0.8662 -0.0418 -0.1147 0.0555 152 LEU A CB
4565960 C CG . LEU A 128 ? 0.5402 0.5608 0.8460 -0.0440 -0.0980 0.0423 152 LEU A CG
4566961 C CD1 . LEU A 128 ? 0.5841 0.6126 0.9417 -0.0407 -0.0739 0.0476 152 LEU A CD1
4567962 C CD2 . LEU A 128 ? 0.6650 0.6843 0.9546 -0.0559 -0.1211 0.0428 152 LEU A CD2
4568963 N N . GLU A 129 ? 0.6164 0.6438 0.8995 -0.0363 -0.1368 0.0654 153 GLU A N
4569964 C CA . GLU A 129 ? 0.5280 0.5580 0.7954 -0.0402 -0.1595 0.0767 153 GLU A CA
4570965 C C . GLU A 129 ? 0.4995 0.5142 0.7011 -0.0415 -0.1583 0.0603 153 GLU A C
4571966 O O . GLU A 129 ? 0.6702 0.6820 0.8362 -0.0498 -0.1786 0.0619 153 GLU A O
4572967 C CB . GLU A 129 ? 0.3930 0.4294 0.7062 -0.0319 -0.1535 0.0940 153 GLU A CB
4573968 C CG . GLU A 129 ? 0.6083 0.6645 0.9971 -0.0285 -0.1549 0.1148 153 GLU A CG
4574969 C CD . GLU A 129 ? 0.5808 0.6569 0.9846 -0.0412 -0.1917 0.1345 153 GLU A CD
4575970 O OE1 . GLU A 129 ? 0.6098 0.6822 0.9697 -0.0515 -0.2170 0.1377 153 GLU A OE1
4576971 O OE2 . GLU A 129 ? 0.6437 0.7392 1.1023 -0.0428 -0.1949 0.1470 153 GLU A OE2
4577972 N N . ALA A 130 ? 0.5611 0.5660 0.7452 -0.0348 -0.1342 0.0447 154 ALA A N
4578973 C CA . ALA A 130 ? 0.6115 0.6078 0.7426 -0.0353 -0.1318 0.0316 154 ALA A CA
4579974 C C . ALA A 130 ? 0.6411 0.6316 0.7345 -0.0395 -0.1407 0.0211 154 ALA A C
4580975 O O . ALA A 130 ? 0.6897 0.6753 0.7457 -0.0433 -0.1513 0.0185 154 ALA A O
4581976 C CB . ALA A 130 ? 0.4173 0.4077 0.5422 -0.0301 -0.1066 0.0194 154 ALA A CB
4582977 N N . VAL A 131 ? 0.5895 0.5776 0.6910 -0.0389 -0.1340 0.0147 155 VAL A N
4583978 C CA . VAL A 131 ? 0.6185 0.5961 0.6880 -0.0419 -0.1397 0.0051 155 VAL A CA
4584979 C C . VAL A 131 ? 0.6243 0.5985 0.6844 -0.0528 -0.1635 0.0114 155 VAL A C
4585980 O O . VAL A 131 ? 0.7839 0.7436 0.8019 -0.0566 -0.1695 0.0026 155 VAL A O
4586981 C CB . VAL A 131 ? 0.8227 0.7976 0.9088 -0.0406 -0.1281 0.0009 155 VAL A CB
4587982 C CG1 . VAL A 131 ? 0.6023 0.5641 0.6682 -0.0464 -0.1380 -0.0041 155 VAL A CG1
4588983 C CG2 . VAL A 131 ? 0.6444 0.6176 0.7186 -0.0334 -0.1071 -0.0081 155 VAL A CG2
4589984 N N . ARG A 132 ? 0.6564 0.6430 0.7550 -0.0587 -0.1770 0.0274 156 ARG A N
4590985 C CA . ARG A 132 ? 0.7633 0.7498 0.8555 -0.0734 -0.2041 0.0368 156 ARG A CA
4591986 C C . ARG A 132 ? 0.6978 0.6786 0.7500 -0.0782 -0.2162 0.0389 156 ARG A C
4592987 O O . ARG A 132 ? 0.8804 0.8473 0.8911 -0.0911 -0.2319 0.0351 156 ARG A O
4593988 C CB . ARG A 132 ? 0.5681 0.5767 0.7238 -0.0766 -0.2143 0.0575 156 ARG A CB
4594989 N N . HIS A 133 ? 0.6465 0.6347 0.7076 -0.0696 -0.2073 0.0445 157 HIS A N
4595990 C CA . HIS A 133 ? 0.7014 0.6834 0.7221 -0.0735 -0.2137 0.0458 157 HIS A CA
4596991 C C . HIS A 133 ? 0.7554 0.7200 0.7211 -0.0716 -0.2015 0.0252 157 HIS A C
4597992 O O . HIS A 133 ? 0.7997 0.7514 0.7193 -0.0810 -0.2106 0.0221 157 HIS A O
4598993 C CB . HIS A 133 ? 0.5895 0.5807 0.6341 -0.0643 -0.2027 0.0549 157 HIS A CB
4599994 C CG . HIS A 133 ? 0.8024 0.7869 0.8052 -0.0670 -0.2027 0.0543 157 HIS A CG
4600995 N ND1 . HIS A 133 ? 0.7908 0.7759 0.7827 -0.0772 -0.2231 0.0716 157 HIS A ND1
4601996 C CD2 . HIS A 133 ? 0.7543 0.7335 0.7257 -0.0616 -0.1848 0.0405 157 HIS A CD2
4602997 C CE1 . HIS A 133 ? 0.8827 0.8605 0.8351 -0.0782 -0.2155 0.0670 157 HIS A CE1
4603998 N NE2 . HIS A 133 ? 0.8847 0.8604 0.8270 -0.0685 -0.1921 0.0482 157 HIS A NE2
4604999 N N . CYS A 134 ? 0.5390 0.5028 0.5088 -0.0598 -0.1801 0.0120 158 CYS A N
46051000 C CA . CYS A 134 ? 0.6108 0.5612 0.5390 -0.0553 -0.1678 -0.0046 158 CYS A CA
46061001 C C . CYS A 134 ? 0.7744 0.7039 0.6722 -0.0646 -0.1778 -0.0123 158 CYS A C
46071002 O O . CYS A 134 ? 0.7924 0.7049 0.6449 -0.0671 -0.1747 -0.0220 158 CYS A O
46081003 C CB . CYS A 134 ? 0.6602 0.6160 0.6038 -0.0428 -0.1480 -0.0128 158 CYS A CB
46091004 S SG . CYS A 134 ? 0.5953 0.5685 0.5605 -0.0360 -0.1341 -0.0086 158 CYS A SG
46101005 N N . HIS A 135 ? 0.7506 0.6792 0.6724 -0.0708 -0.1878 -0.0087 159 HIS A N
46111006 C CA A HIS A 135 ? 0.7894 0.6946 0.6821 -0.0830 -0.1979 -0.0165 159 HIS A CA
46121007 C CA B HIS A 135 ? 0.8273 0.7326 0.7201 -0.0829 -0.1979 -0.0166 159 HIS A CA
46131008 C C . HIS A 135 ? 0.8891 0.7837 0.7449 -0.1011 -0.2186 -0.0126 159 HIS A C
46141009 O O . HIS A 135 ? 0.9064 0.7723 0.7112 -0.1098 -0.2186 -0.0259 159 HIS A O
46151010 C CB A HIS A 135 ? 0.8995 0.8100 0.8310 -0.0889 -0.2059 -0.0106 159 HIS A CB
46161011 C CB B HIS A 135 ? 0.8384 0.7492 0.7709 -0.0882 -0.2051 -0.0107 159 HIS A CB
46171012 C CG A HIS A 135 ? 0.7434 0.6511 0.6900 -0.0761 -0.1859 -0.0187 159 HIS A CG
46181013 C CG B HIS A 135 ? 0.9139 0.8155 0.8374 -0.1102 -0.2304 -0.0058 159 HIS A CG
46191014 N ND1 A HIS A 135 ? 0.5919 0.5134 0.5550 -0.0602 -0.1670 -0.0193 159 HIS A ND1
46201015 N ND1 B HIS A 135 ? 0.8754 0.7486 0.7691 -0.1206 -0.2324 -0.0183 159 HIS A ND1
46211016 C CD2 A HIS A 135 ? 0.8309 0.7219 0.7754 -0.0788 -0.1827 -0.0253 159 HIS A CD2
46221017 C CD2 B HIS A 135 ? 0.9368 0.8543 0.8792 -0.1254 -0.2560 0.0118 159 HIS A CD2
46231018 C CE1 A HIS A 135 ? 0.7039 0.6190 0.6734 -0.0539 -0.1543 -0.0248 159 HIS A CE1
46241019 C CE1 B HIS A 135 ? 0.9652 0.8363 0.8553 -0.1438 -0.2590 -0.0103 159 HIS A CE1
46251020 N NE2 A HIS A 135 ? 0.8695 0.7659 0.8294 -0.0639 -0.1628 -0.0281 159 HIS A NE2
46261021 N NE2 B HIS A 135 ? 1.0121 0.9125 0.9331 -0.1470 -0.2750 0.0093 159 HIS A NE2
46271022 N N . ASN A 136 ? 0.7328 0.6475 0.6112 -0.1075 -0.2355 0.0061 160 ASN A N
46281023 C CA . ASN A 136 ? 0.9073 0.8130 0.7470 -0.1269 -0.2579 0.0131 160 ASN A CA
46291024 C C . ASN A 136 ? 0.8248 0.7155 0.6108 -0.1240 -0.2442 0.0029 160 ASN A C
46301025 O O . ASN A 136 ? 0.9384 0.8064 0.6679 -0.1406 -0.2534 -0.0024 160 ASN A O
46311026 C CB . ASN A 136 ? 0.9554 0.8884 0.8388 -0.1329 -0.2804 0.0401 160 ASN A CB
46321027 C CG . ASN A 136 ? 1.1797 1.1205 1.0881 -0.1507 -0.3077 0.0529 160 ASN A CG
46331028 O OD1 . ASN A 136 ? 1.3189 1.2699 1.2723 -0.1456 -0.3029 0.0530 160 ASN A OD1
46341029 N ND2 . ASN A 136 ? 1.2649 1.2009 1.1418 -0.1741 -0.3371 0.0641 160 ASN A ND2
46351030 N N . CYS A 137 ? 0.7593 0.6620 0.5606 -0.1050 -0.2217 0.0000 161 CYS A N
46361031 C CA . CYS A 137 ? 0.7692 0.6613 0.5268 -0.1006 -0.2044 -0.0103 161 CYS A CA
46371032 C C . CYS A 137 ? 0.8304 0.6989 0.5559 -0.0935 -0.1839 -0.0324 161 CYS A C
46381033 O O . CYS A 137 ? 1.0335 0.8948 0.7291 -0.0868 -0.1645 -0.0418 161 CYS A O
46391034 C CB . CYS A 137 ? 0.7132 0.6288 0.5022 -0.0854 -0.1893 -0.0041 161 CYS A CB
46401035 S SG . CYS A 137 ? 0.9573 0.8919 0.7766 -0.0923 -0.2086 0.0221 161 CYS A SG
46411036 N N . GLY A 138 ? 0.8227 0.6790 0.5567 -0.0946 -0.1864 -0.0395 162 GLY A N
46421037 C CA . GLY A 138 ? 0.7034 0.5344 0.4128 -0.0859 -0.1661 -0.0584 162 GLY A CA
46431038 C C . GLY A 138 ? 0.7408 0.5889 0.4797 -0.0622 -0.1426 -0.0611 162 GLY A C
46441039 O O . GLY A 138 ? 0.9050 0.7405 0.6222 -0.0511 -0.1214 -0.0726 162 GLY A O
46451040 N N . VAL A 139 ? 0.7652 0.6415 0.5532 -0.0550 -0.1453 -0.0502 163 VAL A N
46461041 C CA . VAL A 139 ? 0.7500 0.6445 0.5642 -0.0370 -0.1272 -0.0508 163 VAL A CA
46471042 C C . VAL A 139 ? 0.7540 0.6530 0.6027 -0.0339 -0.1292 -0.0479 163 VAL A C
46481043 O O . VAL A 139 ? 0.7930 0.6994 0.6665 -0.0426 -0.1429 -0.0394 163 VAL A O
46491044 C CB . VAL A 139 ? 0.7004 0.6221 0.5326 -0.0341 -0.1246 -0.0415 163 VAL A CB
46501045 C CG1 . VAL A 139 ? 0.6927 0.6344 0.5573 -0.0221 -0.1129 -0.0398 163 VAL A CG1
46511046 C CG2 . VAL A 139 ? 0.6670 0.5865 0.4665 -0.0335 -0.1149 -0.0452 163 VAL A CG2
46521047 N N . LEU A 140 ? 0.6846 0.5798 0.5366 -0.0213 -0.1149 -0.0534 164 LEU A N
46531048 C CA . LEU A 140 ? 0.6727 0.5745 0.5545 -0.0173 -0.1131 -0.0494 164 LEU A CA
46541049 C C . LEU A 140 ? 0.6572 0.5837 0.5562 -0.0066 -0.1018 -0.0452 164 LEU A C
46551050 O O . LEU A 140 ? 0.7006 0.6319 0.5893 0.0035 -0.0911 -0.0476 164 LEU A O
46561051 C CB . LEU A 140 ? 0.7359 0.6118 0.6061 -0.0136 -0.1080 -0.0561 164 LEU A CB
46571052 C CG . LEU A 140 ? 0.8092 0.6859 0.7056 -0.0162 -0.1104 -0.0509 164 LEU A CG
46581053 C CD1 . LEU A 140 ? 0.7134 0.5841 0.6185 -0.0329 -0.1264 -0.0484 164 LEU A CD1
46591054 C CD2 . LEU A 140 ? 1.0640 0.9190 0.9515 -0.0077 -0.1008 -0.0545 164 LEU A CD2
46601055 N N . HIS A 141 ? 0.5539 0.4958 0.4796 -0.0100 -0.1032 -0.0389 165 HIS A N
46611056 C CA . HIS A 141 ? 0.6693 0.6315 0.6055 -0.0050 -0.0940 -0.0359 165 HIS A CA
46621057 C C . HIS A 141 ? 0.6377 0.5991 0.5743 0.0027 -0.0869 -0.0352 165 HIS A C
46631058 O O . HIS A 141 ? 0.5271 0.5037 0.4619 0.0091 -0.0811 -0.0328 165 HIS A O
46641059 C CB . HIS A 141 ? 0.5895 0.5613 0.5487 -0.0124 -0.0945 -0.0314 165 HIS A CB
46651060 C CG . HIS A 141 ? 0.5919 0.5797 0.5545 -0.0124 -0.0858 -0.0304 165 HIS A CG
46661061 N ND1 . HIS A 141 ? 0.5622 0.5552 0.5222 -0.0103 -0.0794 -0.0301 165 HIS A ND1
46671062 C CD2 . HIS A 141 ? 0.6555 0.6535 0.6215 -0.0166 -0.0835 -0.0290 165 HIS A CD2
46681063 C CE1 . HIS A 141 ? 0.5752 0.5816 0.5348 -0.0151 -0.0746 -0.0295 165 HIS A CE1
46691064 N NE2 . HIS A 141 ? 0.6588 0.6671 0.6225 -0.0188 -0.0759 -0.0297 165 HIS A NE2
46701065 N N . ARG A 142 ? 0.6388 0.5846 0.5800 0.0008 -0.0884 -0.0351 166 ARG A N
46711066 C CA . ARG A 142 ? 0.7022 0.6415 0.6416 0.0075 -0.0831 -0.0322 166 ARG A CA
46721067 C C . ARG A 142 ? 0.6004 0.5567 0.5474 0.0058 -0.0785 -0.0260 166 ARG A C
46731068 O O . ARG A 142 ? 0.7667 0.7177 0.7118 0.0085 -0.0760 -0.0207 166 ARG A O
46741069 C CB . ARG A 142 ? 0.6386 0.5726 0.5646 0.0206 -0.0784 -0.0332 166 ARG A CB
46751070 C CG . ARG A 142 ? 0.7018 0.6117 0.6104 0.0207 -0.0795 -0.0419 166 ARG A CG
46761071 C CD . ARG A 142 ? 0.7890 0.6788 0.6872 0.0341 -0.0702 -0.0435 166 ARG A CD
46771072 N NE . ARG A 142 ? 0.8277 0.7329 0.7251 0.0471 -0.0604 -0.0422 166 ARG A NE
46781073 C CZ . ARG A 142 ? 0.7444 0.6393 0.6414 0.0631 -0.0484 -0.0408 166 ARG A CZ
46791074 N NH1 . ARG A 142 ? 0.6698 0.5352 0.5639 0.0684 -0.0449 -0.0407 166 ARG A NH1
46801075 N NH2 . ARG A 142 ? 0.7152 0.6296 0.6180 0.0745 -0.0382 -0.0384 166 ARG A NH2
46811076 N N . ASP A 143 ? 0.5240 0.4974 0.4756 -0.0003 -0.0772 -0.0262 167 ASP A N
46821077 C CA . ASP A 143 ? 0.6185 0.6029 0.5696 -0.0065 -0.0723 -0.0226 167 ASP A CA
46831078 C C . ASP A 143 ? 0.7037 0.6873 0.6645 -0.0172 -0.0671 -0.0265 167 ASP A C
46841079 O O . ASP A 143 ? 0.6449 0.6380 0.6016 -0.0241 -0.0626 -0.0277 167 ASP A O
46851080 C CB . ASP A 143 ? 0.7967 0.8029 0.7408 -0.0039 -0.0734 -0.0182 167 ASP A CB
46861081 C CG . ASP A 143 ? 1.0873 1.1013 1.0231 -0.0097 -0.0729 -0.0111 167 ASP A CG
46871082 O OD1 . ASP A 143 ? 0.9944 0.9934 0.9267 -0.0130 -0.0701 -0.0094 167 ASP A OD1
46881083 O OD2 . ASP A 143 ? 1.1550 1.1908 1.0869 -0.0126 -0.0761 -0.0059 167 ASP A OD2
46891084 N N . ILE A 144 ? 0.7271 0.6983 0.7031 -0.0192 -0.0671 -0.0278 168 ILE A N
46901085 C CA . ILE A 144 ? 0.5955 0.5645 0.5896 -0.0266 -0.0587 -0.0292 168 ILE A CA
46911086 C C . ILE A 144 ? 0.7127 0.6779 0.6974 -0.0337 -0.0457 -0.0301 168 ILE A C
46921087 O O . ILE A 144 ? 0.8977 0.8547 0.8787 -0.0346 -0.0431 -0.0275 168 ILE A O
46931088 C CB . ILE A 144 ? 0.8189 0.7804 0.8379 -0.0273 -0.0626 -0.0267 168 ILE A CB
46941089 C CG1 . ILE A 144 ? 0.4854 0.4474 0.5024 -0.0241 -0.0781 -0.0258 168 ILE A CG1
46951090 C CG2 . ILE A 144 ? 0.5279 0.4904 0.5750 -0.0318 -0.0519 -0.0256 168 ILE A CG2
46961091 C CD1 . ILE A 144 ? 0.6940 0.6655 0.7089 -0.0235 -0.0803 -0.0257 168 ILE A CD1
46971092 N N . LYS A 145 ? 0.6854 0.6537 0.6615 -0.0407 -0.0373 -0.0339 169 LYS A N
46981093 C CA . LYS A 145 ? 0.7796 0.7407 0.7373 -0.0516 -0.0241 -0.0368 169 LYS A CA
46991094 C C . LYS A 145 ? 0.8665 0.8219 0.8251 -0.0599 -0.0109 -0.0442 169 LYS A C
47001095 O O . LYS A 145 ? 0.7650 0.7246 0.7390 -0.0559 -0.0145 -0.0446 169 LYS A O
47011096 C CB . LYS A 145 ? 0.7177 0.6886 0.6461 -0.0543 -0.0328 -0.0321 169 LYS A CB
47021097 C CG . LYS A 145 ? 0.7550 0.7443 0.6764 -0.0537 -0.0427 -0.0312 169 LYS A CG
47031098 C CD . LYS A 145 ? 0.9322 0.9341 0.8278 -0.0626 -0.0488 -0.0254 169 LYS A CD
47041099 C CE . LYS A 145 ? 1.0121 1.0331 0.9131 -0.0495 -0.0634 -0.0141 169 LYS A CE
47051100 N NZ . LYS A 145 ? 0.8788 0.9225 0.7653 -0.0577 -0.0730 -0.0050 169 LYS A NZ
47061101 N N . ASP A 146 ? 0.8500 0.7918 0.7888 -0.0727 0.0057 -0.0502 170 ASP A N
47071102 C CA . ASP A 146 ? 0.7246 0.6527 0.6625 -0.0812 0.0227 -0.0595 170 ASP A CA
47081103 C C . ASP A 146 ? 0.8063 0.7438 0.7258 -0.0875 0.0129 -0.0614 170 ASP A C
47091104 O O . ASP A 146 ? 0.7525 0.6822 0.6830 -0.0888 0.0203 -0.0658 170 ASP A O
47101105 C CB . ASP A 146 ? 0.8415 0.7469 0.7544 -0.0960 0.0462 -0.0681 170 ASP A CB
47111106 C CG . ASP A 146 ? 0.9367 0.8456 0.8091 -0.1066 0.0383 -0.0647 170 ASP A CG
47121107 O OD1 . ASP A 146 ? 0.9556 0.8860 0.8211 -0.1023 0.0152 -0.0557 170 ASP A OD1
47131108 O OD2 . ASP A 146 ? 0.9398 0.8294 0.7871 -0.1195 0.0564 -0.0701 170 ASP A OD2
47141109 N N . GLU A 147 ? 0.7331 0.6883 0.6288 -0.0913 -0.0034 -0.0562 171 GLU A N
47151110 C CA . GLU A 147 ? 0.7743 0.7440 0.6576 -0.0986 -0.0133 -0.0561 171 GLU A CA
47161111 C C . GLU A 147 ? 0.7515 0.7348 0.6612 -0.0849 -0.0232 -0.0516 171 GLU A C
47171112 O O . GLU A 147 ? 0.7248 0.7155 0.6306 -0.0912 -0.0261 -0.0526 171 GLU A O
47181113 C CB . GLU A 147 ? 0.7478 0.7391 0.6081 -0.1047 -0.0293 -0.0476 171 GLU A CB
47191114 C CG . GLU A 147 ? 1.1442 1.1233 0.9685 -0.1230 -0.0233 -0.0498 171 GLU A CG
47201115 C CD . GLU A 147 ? 1.2658 1.2625 1.0818 -0.1191 -0.0391 -0.0355 171 GLU A CD
47211116 O OE1 . GLU A 147 ? 1.3048 1.2872 1.0974 -0.1282 -0.0332 -0.0346 171 GLU A OE1
47221117 O OE2 . GLU A 147 ? 1.3351 1.3585 1.1678 -0.1069 -0.0558 -0.0243 171 GLU A OE2
47231118 N N . ASN A 148 ? 0.5629 0.5485 0.4958 -0.0689 -0.0287 -0.0466 172 ASN A N
47241119 C CA . ASN A 148 ? 0.6185 0.6146 0.5682 -0.0581 -0.0388 -0.0422 172 ASN A CA
47251120 C C . ASN A 148 ? 0.6203 0.6027 0.5944 -0.0549 -0.0324 -0.0428 172 ASN A C
47261121 O O . ASN A 148 ? 0.6592 0.6470 0.6461 -0.0471 -0.0419 -0.0376 172 ASN A O
47271122 C CB . ASN A 148 ? 0.5565 0.5616 0.5100 -0.0452 -0.0506 -0.0362 172 ASN A CB
47281123 C CG . ASN A 148 ? 0.6375 0.6618 0.5760 -0.0442 -0.0586 -0.0314 172 ASN A CG
47291124 O OD1 . ASN A 148 ? 0.7335 0.7714 0.6626 -0.0529 -0.0597 -0.0308 172 ASN A OD1
47301125 N ND2 . ASN A 148 ? 0.8910 0.9165 0.8298 -0.0341 -0.0640 -0.0265 172 ASN A ND2
47311126 N N . ILE A 149 ? 0.5270 0.4910 0.5073 -0.0611 -0.0155 -0.0482 173 ILE A N
47321127 C CA . ILE A 149 ? 0.5193 0.4703 0.5292 -0.0574 -0.0063 -0.0466 173 ILE A CA
47331128 C C . ILE A 149 ? 0.6027 0.5377 0.6011 -0.0688 0.0091 -0.0542 173 ILE A C
47341129 O O . ILE A 149 ? 0.7135 0.6340 0.6899 -0.0805 0.0242 -0.0641 173 ILE A O
47351130 C CB . ILE A 149 ? 0.4473 0.3884 0.4830 -0.0528 0.0053 -0.0456 173 ILE A CB
47361131 C CG1 . ILE A 149 ? 0.5962 0.5506 0.6478 -0.0434 -0.0121 -0.0370 173 ILE A CG1
47371132 C CG2 . ILE A 149 ? 0.4217 0.3476 0.4904 -0.0502 0.0218 -0.0442 173 ILE A CG2
47381133 C CD1 . ILE A 149 ? 0.5633 0.5135 0.6210 -0.0436 -0.0047 -0.0377 173 ILE A CD1
47391134 N N . LEU A 150 ? 0.5767 0.5111 0.5854 -0.0674 0.0055 -0.0499 174 LEU A N
47401135 C CA . LEU A 150 ? 0.5689 0.4818 0.5719 -0.0776 0.0218 -0.0564 174 LEU A CA
47411136 C C . LEU A 150 ? 0.7089 0.6009 0.7503 -0.0688 0.0385 -0.0528 174 LEU A C
47421137 O O . LEU A 150 ? 0.5659 0.4681 0.6423 -0.0553 0.0295 -0.0406 174 LEU A O
47431138 C CB . LEU A 150 ? 0.5334 0.4558 0.5272 -0.0818 0.0101 -0.0519 174 LEU A CB
47441139 C CG . LEU A 150 ? 0.6128 0.5603 0.5775 -0.0894 -0.0045 -0.0530 174 LEU A CG
47451140 C CD1 . LEU A 150 ? 0.5957 0.5507 0.5552 -0.0955 -0.0106 -0.0489 174 LEU A CD1
47461141 C CD2 . LEU A 150 ? 0.7600 0.7017 0.6945 -0.1053 0.0035 -0.0639 174 LEU A CD2
47471142 N N . ILE A 151 ? 0.7304 0.5924 0.7659 -0.0776 0.0630 -0.0630 175 ILE A N
47481143 C CA . ILE A 151 ? 0.7230 0.5612 0.7984 -0.0683 0.0849 -0.0600 175 ILE A CA
47491144 C C . ILE A 151 ? 0.8901 0.7069 0.9640 -0.0736 0.0922 -0.0599 175 ILE A C
47501145 O O . ILE A 151 ? 0.8573 0.6507 0.8944 -0.0910 0.1065 -0.0752 175 ILE A O
47511146 C CB . ILE A 151 ? 0.6795 0.4920 0.7490 -0.0733 0.1158 -0.0742 175 ILE A CB
47521147 C CG1 . ILE A 151 ? 0.7313 0.5639 0.7937 -0.0719 0.1078 -0.0743 175 ILE A CG1
47531148 C CG2 . ILE A 151 ? 0.7370 0.5287 0.8596 -0.0594 0.1409 -0.0684 175 ILE A CG2
47541149 C CD1 . ILE A 151 ? 0.7585 0.5661 0.8070 -0.0795 0.1386 -0.0882 175 ILE A CD1
47551150 N N . ASP A 152 ? 0.8611 0.6861 0.9705 -0.0611 0.0799 -0.0419 176 ASP A N
47561151 C CA . ASP A 152 ? 0.8406 0.6392 0.9649 -0.0609 0.0918 -0.0370 176 ASP A CA
47571152 C C . ASP A 152 ? 0.8319 0.5960 0.9874 -0.0540 0.1267 -0.0420 176 ASP A C
47581153 O O . ASP A 152 ? 0.7806 0.5527 0.9888 -0.0362 0.1295 -0.0277 176 ASP A O
47591154 C CB . ASP A 152 ? 0.8558 0.6745 1.0120 -0.0484 0.0677 -0.0126 176 ASP A CB
47601155 C CG . ASP A 152 ? 1.0836 0.8767 1.2514 -0.0491 0.0757 -0.0039 176 ASP A CG
47611156 O OD1 . ASP A 152 ? 1.0687 0.8241 1.2273 -0.0570 0.1036 -0.0173 176 ASP A OD1
47621157 O OD2 . ASP A 152 ? 0.9934 0.8013 1.1778 -0.0426 0.0545 0.0169 176 ASP A OD2
47631158 N N . LEU A 153 ? 0.8722 0.5976 0.9953 -0.0692 0.1541 -0.0621 177 LEU A N
47641159 C CA . LEU A 153 ? 0.9811 0.6675 1.1198 -0.0661 0.1943 -0.0738 177 LEU A CA
47651160 C C . LEU A 153 ? 0.9972 0.6575 1.1916 -0.0494 0.2134 -0.0600 177 LEU A C
47661161 O O . LEU A 153 ? 1.1083 0.7541 1.3471 -0.0346 0.2406 -0.0577 177 LEU A O
47671162 C CB . LEU A 153 ? 1.0139 0.6632 1.0884 -0.0924 0.2166 -0.1019 177 LEU A CB
47681163 C CG . LEU A 153 ? 1.0406 0.7124 1.0604 -0.1104 0.2008 -0.1144 177 LEU A CG
47691164 C CD1 . LEU A 153 ? 1.0349 0.6733 0.9882 -0.1412 0.2143 -0.1378 177 LEU A CD1
47701165 C CD2 . LEU A 153 ? 0.9408 0.6210 0.9742 -0.1015 0.2122 -0.1164 177 LEU A CD2
47711166 N N . ASN A 154 ? 0.9908 0.6443 1.1864 -0.0510 0.2015 -0.0492 178 ASN A N
47721167 C CA . ASN A 154 ? 0.9645 0.5932 1.2162 -0.0336 0.2173 -0.0317 178 ASN A CA
47731168 C C . ASN A 154 ? 0.8078 0.4758 1.1274 -0.0092 0.1959 -0.0006 178 ASN A C
47741169 O O . ASN A 154 ? 0.9181 0.5728 1.3009 0.0102 0.2137 0.0158 178 ASN A O
47751170 C CB . ASN A 154 ? 1.0576 0.6677 1.2893 -0.0438 0.2089 -0.0266 178 ASN A CB
47761171 C CG . ASN A 154 ? 1.2263 0.7873 1.4025 -0.0683 0.2361 -0.0552 178 ASN A CG
47771172 O OD1 . ASN A 154 ? 1.2026 0.7427 1.3487 -0.0791 0.2603 -0.0798 178 ASN A OD1
47781173 N ND2 . ASN A 154 ? 1.0534 0.5941 1.2122 -0.0797 0.2320 -0.0520 178 ASN A ND2
47791174 N N . ARG A 155 ? 0.9015 0.6171 1.2099 -0.0105 0.1581 0.0084 179 ARG A N
47801175 C CA . ARG A 155 ? 0.9024 0.6561 1.2641 0.0066 0.1312 0.0376 179 ARG A CA
47811176 C C . ARG A 155 ? 0.8038 0.5869 1.1818 0.0116 0.1271 0.0354 179 ARG A C
47821177 O O . ARG A 155 ? 0.5787 0.3933 1.0046 0.0238 0.1062 0.0590 179 ARG A O
47831178 C CB . ARG A 155 ? 0.6336 0.4148 0.9681 -0.0003 0.0909 0.0511 179 ARG A CB
47841179 C CG . ARG A 155 ? 0.8299 0.5865 1.1545 -0.0050 0.0918 0.0589 179 ARG A CG
47851180 C CD . ARG A 155 ? 0.8199 0.6041 1.1567 -0.0008 0.0553 0.0880 179 ARG A CD
47861181 N NE . ARG A 155 ? 0.9385 0.7079 1.2396 -0.0129 0.0494 0.0900 179 ARG A NE
47871182 C CZ . ARG A 155 ? 1.0436 0.7932 1.3710 -0.0074 0.0503 0.1121 179 ARG A CZ
47881183 N NH1 . ARG A 155 ? 0.8500 0.5926 1.2430 0.0116 0.0571 0.1348 179 ARG A NH1
47891184 N NH2 . ARG A 155 ? 1.0883 0.8259 1.3785 -0.0210 0.0447 0.1131 179 ARG A NH2
47901185 N N . GLY A 156 ? 0.7425 0.5155 1.0807 0.0006 0.1453 0.0091 180 GLY A N
47911186 C CA . GLY A 156 ? 0.6582 0.4560 1.0078 0.0037 0.1427 0.0069 180 GLY A CA
47921187 C C . GLY A 156 ? 0.5888 0.4285 0.9238 0.0011 0.1011 0.0166 180 GLY A C
47931188 O O . GLY A 156 ? 0.6001 0.4642 0.9618 0.0066 0.0924 0.0239 180 GLY A O
47941189 N N . GLU A 157 ? 0.6550 0.5017 0.9475 -0.0082 0.0772 0.0162 181 GLU A N
47951190 C CA . GLU A 157 ? 0.6884 0.5695 0.9676 -0.0095 0.0402 0.0262 181 GLU A CA
47961191 C C . GLU A 157 ? 0.6320 0.5210 0.8569 -0.0210 0.0354 0.0066 181 GLU A C
47971192 O O . GLU A 157 ? 0.7448 0.6217 0.9256 -0.0326 0.0419 -0.0082 181 GLU A O
47981193 C CB . GLU A 157 ? 0.8583 0.7438 1.1267 -0.0115 0.0181 0.0401 181 GLU A CB
47991194 C CG . GLU A 157 ? 0.9472 0.8172 1.2617 -0.0019 0.0260 0.0591 181 GLU A CG
48001195 C CD . GLU A 157 ? 1.0281 0.9155 1.3524 0.0002 -0.0058 0.0849 181 GLU A CD
48011196 O OE1 . GLU A 157 ? 1.0658 0.9676 1.3452 -0.0094 -0.0281 0.0823 181 GLU A OE1
48021197 O OE2 . GLU A 157 ? 0.8687 0.7540 1.2454 0.0111 -0.0071 0.1087 181 GLU A OE2
48031198 N N . LEU A 158 ? 0.4949 0.4045 0.7254 -0.0186 0.0235 0.0082 182 LEU A N
48041199 C CA . LEU A 158 ? 0.5799 0.4993 0.7634 -0.0270 0.0143 -0.0052 182 LEU A CA
48051200 C C . LEU A 158 ? 0.6418 0.5791 0.8010 -0.0288 -0.0143 0.0013 182 LEU A C
48061201 O O . LEU A 158 ? 0.5797 0.5284 0.7600 -0.0239 -0.0333 0.0173 182 LEU A O
48071202 C CB . LEU A 158 ? 0.5688 0.4984 0.7665 -0.0242 0.0151 -0.0060 182 LEU A CB
48081203 C CG . LEU A 158 ? 0.6716 0.5840 0.8852 -0.0242 0.0469 -0.0149 182 LEU A CG
48091204 C CD1 . LEU A 158 ? 0.5839 0.5032 0.7788 -0.0286 0.0468 -0.0223 182 LEU A CD1
48101205 C CD2 . LEU A 158 ? 0.6774 0.5610 0.8636 -0.0323 0.0725 -0.0301 182 LEU A CD2
48111206 N N . LYS A 159 ? 0.5483 0.4880 0.6627 -0.0368 -0.0169 -0.0104 183 LYS A N
48121207 C CA . LYS A 159 ? 0.5186 0.4731 0.6076 -0.0385 -0.0373 -0.0066 183 LYS A CA
48131208 C C . LYS A 159 ? 0.5204 0.4865 0.5773 -0.0412 -0.0420 -0.0167 183 LYS A C
48141209 O O . LYS A 159 ? 0.6312 0.5937 0.6687 -0.0481 -0.0305 -0.0273 183 LYS A O
48151210 C CB . LYS A 159 ? 0.5653 0.5127 0.6405 -0.0450 -0.0333 -0.0063 183 LYS A CB
48161211 C CG . LYS A 159 ? 0.8385 0.7895 0.9215 -0.0425 -0.0484 0.0095 183 LYS A CG
48171212 C CD . LYS A 159 ? 0.7215 0.6607 0.8475 -0.0360 -0.0453 0.0243 183 LYS A CD
48181213 C CE . LYS A 159 ? 0.7912 0.7377 0.9202 -0.0351 -0.0665 0.0434 183 LYS A CE
48191214 N NZ . LYS A 159 ? 0.8499 0.7828 1.0170 -0.0303 -0.0627 0.0611 183 LYS A NZ
48201215 N N . LEU A 160 ? 0.5623 0.5403 0.6124 -0.0368 -0.0588 -0.0127 184 LEU A N
48211216 C CA . LEU A 160 ? 0.5989 0.5858 0.6234 -0.0364 -0.0623 -0.0200 184 LEU A CA
48221217 C C . LEU A 160 ? 0.5092 0.5067 0.5079 -0.0401 -0.0632 -0.0230 184 LEU A C
48231218 O O . LEU A 160 ? 0.5267 0.5266 0.5220 -0.0419 -0.0669 -0.0183 184 LEU A O
48241219 C CB . LEU A 160 ? 0.6070 0.5971 0.6309 -0.0311 -0.0771 -0.0162 184 LEU A CB
48251220 C CG . LEU A 160 ? 0.5637 0.5488 0.6063 -0.0293 -0.0762 -0.0160 184 LEU A CG
48261221 C CD1 . LEU A 160 ? 0.7009 0.6857 0.7334 -0.0274 -0.0910 -0.0148 184 LEU A CD1
48271222 C CD2 . LEU A 160 ? 0.6488 0.6312 0.6830 -0.0310 -0.0620 -0.0241 184 LEU A CD2
48281223 N N . ILE A 161 ? 0.5473 0.5531 0.5299 -0.0417 -0.0601 -0.0288 185 ILE A N
48291224 C CA . ILE A 161 ? 0.6325 0.6553 0.5978 -0.0444 -0.0620 -0.0292 185 ILE A CA
48301225 C C . ILE A 161 ? 0.7061 0.7405 0.6629 -0.0370 -0.0665 -0.0292 185 ILE A C
48311226 O O . ILE A 161 ? 0.6730 0.6988 0.6329 -0.0316 -0.0678 -0.0300 185 ILE A O
48321227 C CB . ILE A 161 ? 0.5957 0.6202 0.5533 -0.0580 -0.0536 -0.0331 185 ILE A CB
48331228 C CG1 . ILE A 161 ? 0.5907 0.6056 0.5430 -0.0638 -0.0462 -0.0388 185 ILE A CG1
48341229 C CG2 . ILE A 161 ? 0.6244 0.6350 0.5893 -0.0646 -0.0475 -0.0326 185 ILE A CG2
48351230 C CD1 . ILE A 161 ? 0.5310 0.5555 0.4634 -0.0786 -0.0447 -0.0418 185 ILE A CD1
48361231 N N . ASP A 162 ? 0.6920 0.7464 0.6411 -0.0366 -0.0679 -0.0268 186 ASP A N
48371232 C CA . ASP A 162 ? 0.7161 0.7853 0.6625 -0.0280 -0.0704 -0.0238 186 ASP A CA
48381233 C C . ASP A 162 ? 0.6593 0.7163 0.6044 -0.0146 -0.0726 -0.0246 186 ASP A C
48391234 O O . ASP A 162 ? 0.6967 0.7424 0.6429 -0.0109 -0.0738 -0.0253 186 ASP A O
48401235 C CB . ASP A 162 ? 0.6900 0.7630 0.6335 -0.0337 -0.0706 -0.0227 186 ASP A CB
48411236 C CG . ASP A 162 ? 0.8726 0.9705 0.8182 -0.0279 -0.0748 -0.0143 186 ASP A CG
48421237 O OD1 . ASP A 162 ? 0.6428 0.7577 0.5954 -0.0208 -0.0741 -0.0106 186 ASP A OD1
48431238 O OD2 . ASP A 162 ? 0.9705 1.0713 0.9124 -0.0300 -0.0780 -0.0099 186 ASP A OD2
48441239 N N . PHE A 163 ? 0.6722 0.7292 0.6116 -0.0091 -0.0722 -0.0250 187 PHE A N
48451240 C CA . PHE A 163 ? 0.7824 0.8246 0.7132 0.0013 -0.0724 -0.0278 187 PHE A CA
48461241 C C . PHE A 163 ? 0.7315 0.7862 0.6639 0.0137 -0.0659 -0.0252 187 PHE A C
48471242 O O . PHE A 163 ? 0.7924 0.8325 0.7146 0.0231 -0.0612 -0.0290 187 PHE A O
48481243 C CB . PHE A 163 ? 0.7648 0.7950 0.6816 -0.0015 -0.0744 -0.0302 187 PHE A CB
48491244 C CG . PHE A 163 ? 0.7003 0.7166 0.6215 -0.0104 -0.0833 -0.0292 187 PHE A CG
48501245 C CD1 . PHE A 163 ? 0.7551 0.7781 0.6887 -0.0185 -0.0833 -0.0254 187 PHE A CD1
48511246 C CD2 . PHE A 163 ? 0.7975 0.7941 0.7138 -0.0111 -0.0912 -0.0311 187 PHE A CD2
48521247 C CE1 . PHE A 163 ? 0.7237 0.7353 0.6694 -0.0239 -0.0895 -0.0218 187 PHE A CE1
48531248 C CE2 . PHE A 163 ? 0.7493 0.7391 0.6785 -0.0187 -0.1005 -0.0265 187 PHE A CE2
48541249 C CZ . PHE A 163 ? 0.7399 0.7379 0.6864 -0.0235 -0.0989 -0.0211 187 PHE A CZ
48551250 N N . GLY A 164 ? 0.7014 0.7818 0.6468 0.0132 -0.0652 -0.0181 188 GLY A N
48561251 C CA . GLY A 164 ? 0.6793 0.7776 0.6358 0.0264 -0.0597 -0.0112 188 GLY A CA
48571252 C C . GLY A 164 ? 0.7564 0.8353 0.7126 0.0394 -0.0584 -0.0108 188 GLY A C
48581253 O O . GLY A 164 ? 0.8540 0.9340 0.8167 0.0547 -0.0494 -0.0081 188 GLY A O
48591254 N N . SER A 165 ? 0.8637 0.9230 0.8140 0.0337 -0.0649 -0.0133 189 SER A N
48601255 C CA . SER A 165 ? 0.8645 0.9015 0.8131 0.0431 -0.0640 -0.0127 189 SER A CA
48611256 C C . SER A 165 ? 0.8880 0.8903 0.8203 0.0422 -0.0632 -0.0242 189 SER A C
48621257 O O . SER A 165 ? 0.8279 0.8063 0.7563 0.0466 -0.0628 -0.0254 189 SER A O
48631258 C CB . SER A 165 ? 1.0497 1.0872 1.0010 0.0356 -0.0708 -0.0067 189 SER A CB
48641259 O OG . SER A 165 ? 1.2148 1.2832 1.1739 0.0298 -0.0749 0.0031 189 SER A OG
48651260 N N . GLY A 166 ? 0.7508 0.7496 0.6724 0.0347 -0.0643 -0.0312 190 GLY A N
48661261 C CA . GLY A 166 ? 0.8017 0.7710 0.7060 0.0295 -0.0680 -0.0400 190 GLY A CA
48671262 C C . GLY A 166 ? 0.9779 0.9267 0.8619 0.0381 -0.0582 -0.0473 190 GLY A C
48681263 O O . GLY A 166 ? 1.0518 1.0095 0.9410 0.0517 -0.0457 -0.0450 190 GLY A O
48691264 N N . ALA A 167 ? 0.9034 0.8240 0.7643 0.0289 -0.0635 -0.0559 191 ALA A N
48701265 C CA . ALA A 167 ? 0.9109 0.8023 0.7418 0.0325 -0.0531 -0.0665 191 ALA A CA
48711266 C C . ALA A 167 ? 0.7356 0.6058 0.5374 0.0142 -0.0655 -0.0732 191 ALA A C
48721267 O O . ALA A 167 ? 0.7941 0.6731 0.6073 0.0017 -0.0825 -0.0676 191 ALA A O
48731268 C CB . ALA A 167 ? 0.9527 0.8166 0.7821 0.0429 -0.0447 -0.0700 191 ALA A CB
48741269 N N . LEU A 168 ? 0.8172 0.6593 0.5813 0.0123 -0.0563 -0.0844 192 LEU A N
48751270 C CA . LEU A 168 ? 0.8627 0.6802 0.5915 -0.0084 -0.0707 -0.0904 192 LEU A CA
48761271 C C . LEU A 168 ? 0.9303 0.7225 0.6579 -0.0179 -0.0831 -0.0936 192 LEU A C
48771272 O O . LEU A 168 ? 0.8658 0.6409 0.5998 -0.0076 -0.0727 -0.0976 192 LEU A O
48781273 C CB . LEU A 168 ? 0.8583 0.6466 0.5377 -0.0112 -0.0555 -0.1036 192 LEU A CB
48791274 C CG . LEU A 168 ? 0.8800 0.6894 0.5565 -0.0026 -0.0386 -0.1017 192 LEU A CG
48801275 C CD1 . LEU A 168 ? 1.1392 0.9389 0.8168 0.0187 -0.0079 -0.1093 192 LEU A CD1
48811276 C CD2 . LEU A 168 ? 1.1582 0.9526 0.7867 -0.0219 -0.0442 -0.1057 192 LEU A CD2
48821277 N N . LEU A 169 ? 0.8643 0.6554 0.5866 -0.0383 -0.1061 -0.0897 193 LEU A N
48831278 C CA . LEU A 169 ? 0.7743 0.5483 0.5025 -0.0505 -0.1204 -0.0900 193 LEU A CA
48841279 C C . LEU A 169 ? 0.8165 0.5406 0.4975 -0.0582 -0.1133 -0.1067 193 LEU A C
48851280 O O . LEU A 169 ? 1.0839 0.7850 0.7174 -0.0715 -0.1146 -0.1158 193 LEU A O
48861281 C CB . LEU A 169 ? 0.8146 0.6052 0.5552 -0.0705 -0.1475 -0.0785 193 LEU A CB
48871282 C CG . LEU A 169 ? 0.8808 0.6711 0.6499 -0.0811 -0.1625 -0.0727 193 LEU A CG
48881283 C CD1 . LEU A 169 ? 0.9563 0.7516 0.7569 -0.0641 -0.1470 -0.0722 193 LEU A CD1
48891284 C CD2 . LEU A 169 ? 0.9783 0.8016 0.7842 -0.0909 -0.1833 -0.0554 193 LEU A CD2
48901285 N N . LYS A 170 ? 0.9598 0.6636 0.6503 -0.0506 -0.1043 -0.1111 194 LYS A N
48911286 C CA . LYS A 170 ? 0.9184 0.5684 0.5672 -0.0579 -0.0957 -0.1275 194 LYS A CA
48921287 C C . LYS A 170 ? 0.9513 0.5897 0.6162 -0.0722 -0.1114 -0.1243 194 LYS A C
48931288 O O . LYS A 170 ? 1.0373 0.7054 0.7495 -0.0654 -0.1165 -0.1109 194 LYS A O
48941289 C CB . LYS A 170 ? 0.9248 0.5552 0.5706 -0.0315 -0.0637 -0.1352 194 LYS A CB
48951290 C CG . LYS A 170 ? 1.0678 0.7049 0.7554 -0.0147 -0.0576 -0.1258 194 LYS A CG
48961291 C CD . LYS A 170 ? 1.1119 0.7315 0.8028 0.0125 -0.0283 -0.1288 194 LYS A CD
48971292 C CE . LYS A 170 ? 1.3619 1.0002 1.0489 0.0281 -0.0104 -0.1303 194 LYS A CE
48981293 N NZ . LYS A 170 ? 1.1959 0.8573 0.9238 0.0575 0.0070 -0.1179 194 LYS A NZ
48991294 N N . ASP A 171 ? 0.9385 0.5328 0.5614 -0.0947 -0.1187 -0.1368 195 ASP A N
49001295 C CA . ASP A 171 ? 1.0453 0.6262 0.6820 -0.1117 -0.1335 -0.1343 195 ASP A CA
49011296 C C . ASP A 171 ? 0.9606 0.5045 0.5976 -0.0978 -0.1120 -0.1414 195 ASP A C
49021297 O O . ASP A 171 ? 0.9250 0.4625 0.5829 -0.1072 -0.1203 -0.1362 195 ASP A O
49031298 C CB . ASP A 171 ? 1.1748 0.7264 0.7670 -0.1476 -0.1559 -0.1427 195 ASP A CB
49041299 C CG . ASP A 171 ? 1.1974 0.7836 0.7871 -0.1624 -0.1796 -0.1324 195 ASP A CG
49051300 O OD1 . ASP A 171 ? 1.2486 0.8186 0.7896 -0.1661 -0.1742 -0.1421 195 ASP A OD1
49061301 O OD2 . ASP A 171 ? 1.2467 0.8762 0.8851 -0.1689 -0.2016 -0.1134 195 ASP A OD2
49071302 N N . THR A 172 ? 0.9582 0.4786 0.5762 -0.0753 -0.0840 -0.1511 196 THR A N
49081303 C CA . THR A 172 ? 0.9808 0.4704 0.6074 -0.0564 -0.0619 -0.1533 196 THR A CA
49091304 C C . THR A 172 ? 0.8898 0.4264 0.5741 -0.0330 -0.0593 -0.1329 196 THR A C
49101305 O O . THR A 172 ? 0.8486 0.4371 0.5627 -0.0320 -0.0719 -0.1204 196 THR A O
49111306 C CB . THR A 172 ? 1.0407 0.4893 0.6309 -0.0396 -0.0312 -0.1693 196 THR A CB
49121307 O OG1 . THR A 172 ? 0.9878 0.4744 0.5844 -0.0246 -0.0237 -0.1656 196 THR A OG1
49131308 C CG2 . THR A 172 ? 1.0800 0.4667 0.6041 -0.0661 -0.0303 -0.1924 196 THR A CG2
49141309 N N . VAL A 173 ? 1.0119 0.5272 0.7093 -0.0148 -0.0423 -0.1293 197 VAL A N
49151310 C CA . VAL A 173 ? 0.8931 0.4461 0.6379 0.0025 -0.0421 -0.1091 197 VAL A CA
49161311 C C . VAL A 173 ? 0.9031 0.4936 0.6666 0.0280 -0.0301 -0.1012 197 VAL A C
49171312 O O . VAL A 173 ? 1.0225 0.5972 0.7679 0.0411 -0.0121 -0.1103 197 VAL A O
49181313 C CB . VAL A 173 ? 0.8701 0.3845 0.6203 0.0102 -0.0310 -0.1050 197 VAL A CB
49191314 C CG1 . VAL A 173 ? 0.9132 0.3872 0.6466 0.0328 -0.0039 -0.1128 197 VAL A CG1
49201315 C CG2 . VAL A 173 ? 1.0068 0.5586 0.7989 0.0209 -0.0352 -0.0829 197 VAL A CG2
49211316 N N . TYR A 174 ? 0.7673 0.4074 0.5667 0.0333 -0.0391 -0.0845 198 TYR A N
49221317 C CA . TYR A 174 ? 0.8259 0.5053 0.6476 0.0543 -0.0310 -0.0738 198 TYR A CA
49231318 C C . TYR A 174 ? 0.8564 0.5352 0.7021 0.0733 -0.0223 -0.0581 198 TYR A C
49241319 O O . TYR A 174 ? 0.9251 0.6010 0.7816 0.0665 -0.0302 -0.0489 198 TYR A O
49251320 C CB . TYR A 174 ? 0.7622 0.4926 0.6036 0.0457 -0.0463 -0.0656 198 TYR A CB
49261321 C CG . TYR A 174 ? 0.7784 0.5161 0.6017 0.0312 -0.0548 -0.0759 198 TYR A CG
49271322 C CD1 . TYR A 174 ? 0.6549 0.3830 0.4693 0.0084 -0.0711 -0.0806 198 TYR A CD1
49281323 C CD2 . TYR A 174 ? 0.7122 0.4691 0.5300 0.0395 -0.0474 -0.0783 198 TYR A CD2
49291324 C CE1 . TYR A 174 ? 0.8675 0.6037 0.6664 -0.0053 -0.0817 -0.0862 198 TYR A CE1
49301325 C CE2 . TYR A 174 ? 0.7645 0.5268 0.5633 0.0254 -0.0558 -0.0853 198 TYR A CE2
49311326 C CZ . TYR A 174 ? 0.9129 0.6644 0.7016 0.0032 -0.0739 -0.0885 198 TYR A CZ
49321327 O OH . TYR A 174 ? 0.8078 0.5655 0.5781 -0.0112 -0.0849 -0.0919 198 TYR A OH
49331328 N N . THR A 175 ? 0.8970 0.5799 0.7526 0.0969 -0.0058 -0.0532 199 THR A N
49341329 C CA . THR A 175 ? 0.9300 0.6128 0.8111 0.1171 0.0017 -0.0346 199 THR A CA
49351330 C C . THR A 175 ? 1.0500 0.7907 0.9639 0.1287 -0.0038 -0.0146 199 THR A C
49361331 O O . THR A 175 ? 1.0504 0.7993 0.9884 0.1450 -0.0011 0.0053 199 THR A O
49371332 C CB . THR A 175 ? 0.8666 0.5051 0.7411 0.1372 0.0262 -0.0407 199 THR A CB
49381333 O OG1 . THR A 175 ? 1.0569 0.7010 0.9202 0.1430 0.0396 -0.0539 199 THR A OG1
49391334 C CG2 . THR A 175 ? 0.8353 0.4090 0.6774 0.1236 0.0302 -0.0567 199 THR A CG2
49401335 N N . ASP A 176 ? 0.8623 0.6424 0.7770 0.1189 -0.0127 -0.0178 200 ASP A N
49411336 C CA . ASP A 176 ? 0.9297 0.7637 0.8707 0.1242 -0.0196 -0.0011 200 ASP A CA
49421337 C C . ASP A 176 ? 0.9461 0.8052 0.8826 0.1021 -0.0368 -0.0022 200 ASP A C
49431338 O O . ASP A 176 ? 0.7752 0.6206 0.6939 0.0862 -0.0415 -0.0168 200 ASP A O
49441339 C CB . ASP A 176 ? 0.8767 0.7350 0.8267 0.1359 -0.0086 -0.0035 200 ASP A CB
49451340 C CG . ASP A 176 ? 0.9829 0.8420 0.9089 0.1199 -0.0108 -0.0220 200 ASP A CG
49461341 O OD1 . ASP A 176 ? 0.9929 0.8131 0.8899 0.1089 -0.0102 -0.0386 200 ASP A OD1
49471342 O OD2 . ASP A 176 ? 0.9519 0.8504 0.8877 0.1167 -0.0147 -0.0187 200 ASP A OD2
49481343 N N . PHE A 177 ? 0.8887 0.7837 0.8416 0.1007 -0.0458 0.0143 201 PHE A N
49491344 C CA . PHE A 177 ? 0.7052 0.6220 0.6539 0.0811 -0.0575 0.0131 201 PHE A CA
49501345 C C . PHE A 177 ? 0.7409 0.7021 0.7038 0.0814 -0.0636 0.0274 201 PHE A C
49511346 O O . PHE A 177 ? 0.8883 0.8633 0.8667 0.0939 -0.0642 0.0448 201 PHE A O
49521347 C CB . PHE A 177 ? 0.8557 0.7525 0.7972 0.0692 -0.0624 0.0158 201 PHE A CB
49531348 C CG . PHE A 177 ? 0.8246 0.7355 0.7619 0.0497 -0.0686 0.0108 201 PHE A CG
49541349 C CD1 . PHE A 177 ? 0.7714 0.6803 0.7053 0.0403 -0.0696 -0.0037 201 PHE A CD1
49551350 C CD2 . PHE A 177 ? 0.7514 0.6756 0.6873 0.0404 -0.0723 0.0215 201 PHE A CD2
49561351 C CE1 . PHE A 177 ? 0.7081 0.6284 0.6445 0.0253 -0.0725 -0.0069 201 PHE A CE1
49571352 C CE2 . PHE A 177 ? 0.9365 0.8687 0.8685 0.0235 -0.0729 0.0153 201 PHE A CE2
49581353 C CZ . PHE A 177 ? 1.0263 0.9570 0.9622 0.0175 -0.0721 0.0013 201 PHE A CZ
49591354 N N . ASP A 178 ? 0.8299 0.8130 0.7885 0.0667 -0.0688 0.0211 202 ASP A N
49601355 C CA . ASP A 178 ? 0.8514 0.8744 0.8190 0.0621 -0.0754 0.0322 202 ASP A CA
49611356 C C . ASP A 178 ? 0.9204 0.9507 0.8749 0.0403 -0.0814 0.0276 202 ASP A C
49621357 O O . ASP A 178 ? 1.2075 1.2658 1.1632 0.0312 -0.0858 0.0303 202 ASP A O
49631358 C CB . ASP A 178 ? 0.8709 0.9170 0.8503 0.0696 -0.0706 0.0296 202 ASP A CB
49641359 C CG . ASP A 178 ? 1.2032 1.2845 1.2073 0.0808 -0.0730 0.0493 202 ASP A CG
49651360 O OD1 . ASP A 178 ? 1.2582 1.3635 1.2646 0.0705 -0.0852 0.0632 202 ASP A OD1
49661361 O OD2 . ASP A 178 ? 1.1660 1.2508 1.1874 0.0992 -0.0622 0.0516 202 ASP A OD2
49671362 N N . GLY A 179 ? 0.9505 0.9552 0.8938 0.0311 -0.0797 0.0203 203 GLY A N
49681363 C CA . GLY A 179 ? 0.7467 0.7540 0.6787 0.0125 -0.0806 0.0180 203 GLY A CA
49691364 C C . GLY A 179 ? 1.1060 1.1128 1.0272 0.0070 -0.0842 0.0319 203 GLY A C
49701365 O O . GLY A 179 ? 0.9690 0.9724 0.8951 0.0188 -0.0874 0.0451 203 GLY A O
49711366 N N . THR A 180 ? 1.1620 1.1694 1.0665 -0.0116 -0.0824 0.0292 204 THR A N
49721367 C CA . THR A 180 ? 1.1476 1.1538 1.0329 -0.0216 -0.0860 0.0422 204 THR A CA
49731368 C C . THR A 180 ? 1.1323 1.1091 1.0155 -0.0187 -0.0799 0.0446 204 THR A C
49741369 O O . THR A 180 ? 1.0827 1.0405 0.9747 -0.0182 -0.0710 0.0322 204 THR A O
49751370 C CB . THR A 180 ? 1.1604 1.1696 1.0211 -0.0450 -0.0820 0.0354 204 THR A CB
49761371 O OG1 . THR A 180 ? 0.8768 0.9151 0.7337 -0.0514 -0.0926 0.0406 204 THR A OG1
49771372 C CG2 . THR A 180 ? 0.7780 0.7726 0.6104 -0.0594 -0.0795 0.0433 204 THR A CG2
49781373 N N . ARG A 181 ? 1.1490 1.1239 1.0226 -0.0175 -0.0863 0.0631 205 ARG A N
49791374 C CA . ARG A 181 ? 1.2171 1.1632 1.0890 -0.0144 -0.0811 0.0685 205 ARG A CA
49801375 C C . ARG A 181 ? 1.3200 1.2461 1.1803 -0.0308 -0.0674 0.0565 205 ARG A C
49811376 O O . ARG A 181 ? 1.4709 1.3733 1.3384 -0.0285 -0.0611 0.0557 205 ARG A O
49821377 C CB . ARG A 181 ? 1.2196 1.1676 1.0791 -0.0137 -0.0908 0.0935 205 ARG A CB
49831378 C CG . ARG A 181 ? 1.2965 1.2632 1.1779 0.0068 -0.1025 0.1104 205 ARG A CG
49841379 C CD . ARG A 181 ? 1.4387 1.3844 1.3449 0.0291 -0.0952 0.1042 205 ARG A CD
49851380 N NE . ARG A 181 ? 1.4024 1.3107 1.3044 0.0313 -0.0889 0.1077 205 ARG A NE
49861381 C CZ . ARG A 181 ? 1.4074 1.3037 1.3119 0.0411 -0.0928 0.1299 205 ARG A CZ
49871382 N NH1 . ARG A 181 ? 1.6129 1.5353 1.5264 0.0499 -0.1047 0.1534 205 ARG A NH1
49881383 N NH2 . ARG A 181 ? 1.2912 1.1492 1.1917 0.0416 -0.0853 0.1305 205 ARG A NH2
49891384 N N . VAL A 182 ? 1.1995 1.1333 1.0441 -0.0476 -0.0610 0.0473 206 VAL A N
49901385 C CA . VAL A 182 ? 1.1075 1.0224 0.9472 -0.0609 -0.0434 0.0366 206 VAL A CA
49911386 C C . VAL A 182 ? 1.0545 0.9649 0.9265 -0.0535 -0.0369 0.0218 206 VAL A C
49921387 O O . VAL A 182 ? 1.0816 0.9767 0.9656 -0.0577 -0.0257 0.0180 206 VAL A O
49931388 C CB . VAL A 182 ? 1.0877 1.0053 0.8977 -0.0815 -0.0339 0.0302 206 VAL A CB
49941389 C CG1 . VAL A 182 ? 1.0487 0.9720 0.8216 -0.0928 -0.0448 0.0469 206 VAL A CG1
49951390 C CG2 . VAL A 182 ? 0.9247 0.8572 0.7432 -0.0820 -0.0338 0.0166 206 VAL A CG2
49961391 N N . TYR A 183 ? 1.0968 1.0219 0.9842 -0.0439 -0.0446 0.0152 207 TYR A N
49971392 C CA . TYR A 183 ? 1.0435 0.9652 0.9582 -0.0382 -0.0426 0.0044 207 TYR A CA
49981393 C C . TYR A 183 ? 0.9391 0.8491 0.8659 -0.0259 -0.0507 0.0071 207 TYR A C
49991394 O O . TYR A 183 ? 0.8199 0.7254 0.7650 -0.0239 -0.0523 -0.0006 207 TYR A O
50001395 C CB . TYR A 183 ? 0.9268 0.8660 0.8478 -0.0358 -0.0461 -0.0037 207 TYR A CB
50011396 C CG . TYR A 183 ? 0.9815 0.9236 0.8965 -0.0489 -0.0341 -0.0114 207 TYR A CG
50021397 C CD1 . TYR A 183 ? 0.9975 0.9452 0.8838 -0.0602 -0.0325 -0.0093 207 TYR A CD1
50031398 C CD2 . TYR A 183 ? 1.0002 0.9384 0.9384 -0.0507 -0.0246 -0.0200 207 TYR A CD2
50041399 C CE1 . TYR A 183 ? 1.0430 0.9862 0.9184 -0.0740 -0.0187 -0.0190 207 TYR A CE1
50051400 C CE2 . TYR A 183 ? 1.0270 0.9626 0.9615 -0.0609 -0.0096 -0.0276 207 TYR A CE2
50061401 C CZ . TYR A 183 ? 1.0487 0.9839 0.9490 -0.0730 -0.0054 -0.0288 207 TYR A CZ
50071402 O OH . TYR A 183 ? 1.1584 1.0840 1.0500 -0.0848 0.0123 -0.0390 207 TYR A OH
50081403 N N . SER A 184 ? 0.9026 0.8055 0.8187 -0.0186 -0.0560 0.0186 208 SER A N
50091404 C CA . SER A 184 ? 0.9443 0.8302 0.8684 -0.0063 -0.0609 0.0192 208 SER A CA
50101405 C C . SER A 184 ? 0.7841 0.6448 0.7149 -0.0137 -0.0561 0.0179 208 SER A C
50111406 O O . SER A 184 ? 0.8247 0.6782 0.7492 -0.0232 -0.0494 0.0250 208 SER A O
50121407 C CB . SER A 184 ? 0.8906 0.7756 0.8070 0.0066 -0.0660 0.0337 208 SER A CB
50131408 O OG . SER A 184 ? 0.9837 0.8708 0.8853 -0.0011 -0.0658 0.0479 208 SER A OG
50141409 N N . PRO A 185 ? 0.7284 0.5750 0.6697 -0.0118 -0.0596 0.0093 209 PRO A N
50151410 C CA . PRO A 185 ? 0.6491 0.4739 0.5991 -0.0218 -0.0572 0.0088 209 PRO A CA
50161411 C C . PRO A 185 ? 0.7682 0.5680 0.7062 -0.0187 -0.0546 0.0201 209 PRO A C
50171412 O O . PRO A 185 ? 0.6294 0.4244 0.5562 -0.0046 -0.0570 0.0272 209 PRO A O
50181413 C CB . PRO A 185 ? 0.6556 0.4702 0.6115 -0.0214 -0.0655 -0.0024 209 PRO A CB
50191414 C CG . PRO A 185 ? 0.6469 0.4722 0.5930 -0.0084 -0.0693 -0.0069 209 PRO A CG
50201415 C CD . PRO A 185 ? 0.6839 0.5328 0.6254 -0.0022 -0.0660 0.0007 209 PRO A CD
50211416 N N . PRO A 186 ? 0.7149 0.4990 0.6581 -0.0311 -0.0490 0.0242 210 PRO A N
50221417 C CA . PRO A 186 ? 0.7384 0.4948 0.6692 -0.0292 -0.0462 0.0368 210 PRO A CA
50231418 C C . PRO A 186 ? 0.7759 0.5027 0.7014 -0.0174 -0.0508 0.0344 210 PRO A C
50241419 O O . PRO A 186 ? 0.7592 0.4655 0.6746 -0.0080 -0.0488 0.0471 210 PRO A O
50251420 C CB . PRO A 186 ? 0.6995 0.4455 0.6418 -0.0477 -0.0385 0.0385 210 PRO A CB
50261421 C CG . PRO A 186 ? 0.6594 0.4235 0.6261 -0.0565 -0.0407 0.0256 210 PRO A CG
50271422 C CD . PRO A 186 ? 0.6029 0.3947 0.5675 -0.0471 -0.0441 0.0194 210 PRO A CD
50281423 N N . GLU A 187 ? 0.8111 0.5327 0.7411 -0.0180 -0.0560 0.0191 211 GLU A N
50291424 C CA . GLU A 187 ? 0.7180 0.4055 0.6364 -0.0081 -0.0566 0.0132 211 GLU A CA
50301425 C C . GLU A 187 ? 0.7000 0.3963 0.6121 0.0145 -0.0547 0.0167 211 GLU A C
50311426 O O . GLU A 187 ? 0.7638 0.4307 0.6692 0.0283 -0.0492 0.0207 211 GLU A O
50321427 C CB . GLU A 187 ? 0.6656 0.3435 0.5835 -0.0198 -0.0633 -0.0043 211 GLU A CB
50331428 C CG . GLU A 187 ? 0.8406 0.5533 0.7637 -0.0184 -0.0694 -0.0125 211 GLU A CG
50341429 C CD . GLU A 187 ? 0.8007 0.5407 0.7460 -0.0351 -0.0744 -0.0127 211 GLU A CD
50351430 O OE1 . GLU A 187 ? 0.7920 0.5395 0.7502 -0.0421 -0.0686 -0.0033 211 GLU A OE1
50361431 O OE2 . GLU A 187 ? 0.8922 0.6463 0.8429 -0.0408 -0.0830 -0.0209 211 GLU A OE2
50371432 N N . TRP A 188 ? 0.7420 0.4778 0.6592 0.0188 -0.0578 0.0165 212 TRP A N
50381433 C CA . TRP A 188 ? 0.8029 0.5545 0.7204 0.0386 -0.0565 0.0248 212 TRP A CA
50391434 C C . TRP A 188 ? 0.8765 0.6277 0.7946 0.0456 -0.0557 0.0470 212 TRP A C
50401435 O O . TRP A 188 ? 0.9923 0.7379 0.9150 0.0646 -0.0533 0.0582 212 TRP A O
50411436 C CB . TRP A 188 ? 0.7601 0.5545 0.6826 0.0376 -0.0610 0.0213 212 TRP A CB
50421437 C CG . TRP A 188 ? 0.7526 0.5706 0.6801 0.0540 -0.0615 0.0343 212 TRP A CG
50431438 C CD1 . TRP A 188 ? 0.7688 0.6146 0.6972 0.0517 -0.0665 0.0499 212 TRP A CD1
50441439 C CD2 . TRP A 188 ? 0.9032 0.7195 0.8368 0.0738 -0.0567 0.0344 212 TRP A CD2
50451440 N NE1 . TRP A 188 ? 0.8190 0.6854 0.7579 0.0682 -0.0685 0.0616 212 TRP A NE1
50461441 C CE2 . TRP A 188 ? 0.8373 0.6869 0.7828 0.0837 -0.0607 0.0526 212 TRP A CE2
50471442 C CE3 . TRP A 188 ? 0.7380 0.5274 0.6668 0.0829 -0.0483 0.0205 212 TRP A CE3
50481443 C CZ2 . TRP A 188 ? 0.8255 0.6867 0.7869 0.1045 -0.0559 0.0593 212 TRP A CZ2
50491444 C CZ3 . TRP A 188 ? 0.8542 0.6498 0.7931 0.1039 -0.0400 0.0246 212 TRP A CZ3
50501445 C CH2 . TRP A 188 ? 0.9840 0.8175 0.9434 0.1157 -0.0434 0.0447 212 TRP A CH2
50511446 N N . ILE A 189 ? 0.7695 0.5268 0.6838 0.0305 -0.0569 0.0551 213 ILE A N
50521447 C CA . ILE A 189 ? 0.8608 0.6185 0.7693 0.0333 -0.0582 0.0783 213 ILE A CA
50531448 C C . ILE A 189 ? 0.8162 0.5313 0.7245 0.0427 -0.0537 0.0881 213 ILE A C
50541449 O O . ILE A 189 ? 0.9917 0.7041 0.9046 0.0597 -0.0550 0.1069 213 ILE A O
50551450 C CB . ILE A 189 ? 0.9363 0.7052 0.8340 0.0121 -0.0569 0.0822 213 ILE A CB
50561451 C CG1 . ILE A 189 ? 0.8528 0.6584 0.7500 0.0041 -0.0587 0.0718 213 ILE A CG1
50571452 C CG2 . ILE A 189 ? 0.9193 0.6849 0.8032 0.0116 -0.0594 0.1074 213 ILE A CG2
50581453 C CD1 . ILE A 189 ? 1.1339 0.9540 1.0131 -0.0120 -0.0565 0.0802 213 ILE A CD1
50591454 N N . ARG A 190 ? 0.8875 0.5686 0.7932 0.0315 -0.0485 0.0768 214 ARG A N
50601455 C CA . ARG A 190 ? 0.9581 0.5923 0.8607 0.0369 -0.0428 0.0854 214 ARG A CA
50611456 C C . ARG A 190 ? 1.0240 0.6319 0.9299 0.0573 -0.0371 0.0774 214 ARG A C
50621457 O O . ARG A 190 ? 1.0609 0.6456 0.9710 0.0754 -0.0320 0.0931 214 ARG A O
50631458 C CB . ARG A 190 ? 0.8555 0.4624 0.7542 0.0143 -0.0395 0.0763 214 ARG A CB
50641459 C CG . ARG A 190 ? 0.9466 0.5804 0.8455 -0.0058 -0.0398 0.0807 214 ARG A CG
50651460 C CD . ARG A 190 ? 1.1581 0.7632 1.0539 -0.0231 -0.0335 0.0891 214 ARG A CD
50661461 N NE . ARG A 190 ? 1.2161 0.7929 1.1193 -0.0361 -0.0323 0.0738 214 ARG A NE
50671462 C CZ . ARG A 190 ? 1.4144 0.9438 1.3112 -0.0330 -0.0301 0.0726 214 ARG A CZ
50681463 N NH1 . ARG A 190 ? 1.4159 0.9190 1.3039 -0.0144 -0.0266 0.0875 214 ARG A NH1
50691464 N NH2 . ARG A 190 ? 1.4160 0.9225 1.3161 -0.0499 -0.0315 0.0571 214 ARG A NH2
50701465 N N . TYR A 191 ? 0.9506 0.5602 0.8543 0.0550 -0.0365 0.0540 215 TYR A N
50711466 C CA . TYR A 191 ? 0.9012 0.4761 0.7995 0.0691 -0.0271 0.0412 215 TYR A CA
50721467 C C . TYR A 191 ? 0.9229 0.5274 0.8289 0.0879 -0.0247 0.0374 215 TYR A C
50731468 O O . TYR A 191 ? 0.9353 0.5118 0.8386 0.1041 -0.0122 0.0298 215 TYR A O
50741469 C CB . TYR A 191 ? 0.8777 0.4224 0.7596 0.0487 -0.0276 0.0165 215 TYR A CB
50751470 C CG . TYR A 191 ? 1.1669 0.6809 1.0441 0.0273 -0.0294 0.0182 215 TYR A CG
50761471 C CD1 . TYR A 191 ? 1.3064 0.8048 1.1881 0.0304 -0.0257 0.0394 215 TYR A CD1
50771472 C CD2 . TYR A 191 ? 1.3590 0.8613 1.2282 0.0025 -0.0358 0.0007 215 TYR A CD2
50781473 C CE1 . TYR A 191 ? 1.3251 0.7956 1.2033 0.0094 -0.0258 0.0414 215 TYR A CE1
50791474 C CE2 . TYR A 191 ? 1.5005 0.9785 1.3702 -0.0187 -0.0376 0.0033 215 TYR A CE2
50801475 C CZ . TYR A 191 ? 1.4966 0.9581 1.3706 -0.0152 -0.0312 0.0229 215 TYR A CZ
50811476 O OH . TYR A 191 ? 1.5705 1.0079 1.4457 -0.0377 -0.0315 0.0261 215 TYR A OH
50821477 N N . HIS A 192 ? 0.8745 0.5320 0.7895 0.0853 -0.0340 0.0417 216 HIS A N
50831478 C CA . HIS A 192 ? 0.8413 0.5303 0.7634 0.0975 -0.0327 0.0357 216 HIS A CA
50841479 C C . HIS A 192 ? 0.9664 0.6312 0.8720 0.0933 -0.0263 0.0101 216 HIS A C
50851480 O O . HIS A 192 ? 1.0107 0.6766 0.9168 0.1083 -0.0167 0.0035 216 HIS A O
50861481 C CB . HIS A 192 ? 0.9002 0.6000 0.8425 0.1244 -0.0264 0.0551 216 HIS A CB
50871482 C CG . HIS A 192 ? 1.1486 0.8790 1.1035 0.1250 -0.0375 0.0825 216 HIS A CG
50881483 N ND1 . HIS A 192 ? 1.0943 0.8780 1.0578 0.1219 -0.0485 0.0916 216 HIS A ND1
50891484 C CD2 . HIS A 192 ? 0.9994 0.7123 0.9545 0.1251 -0.0402 0.1029 216 HIS A CD2
50901485 C CE1 . HIS A 192 ? 1.1110 0.9087 1.0766 0.1189 -0.0583 0.1158 216 HIS A CE1
50911486 N NE2 . HIS A 192 ? 1.3267 1.0830 1.2878 0.1215 -0.0535 0.1241 216 HIS A NE2
50921487 N N . ARG A 193 ? 1.0152 0.6592 0.9058 0.0710 -0.0320 -0.0034 217 ARG A N
50931488 C CA . ARG A 193 ? 0.8419 0.4658 0.7119 0.0586 -0.0323 -0.0262 217 ARG A CA
50941489 C C . ARG A 193 ? 0.8359 0.4848 0.7095 0.0346 -0.0477 -0.0300 217 ARG A C
50951490 O O . ARG A 193 ? 0.8821 0.5377 0.7674 0.0244 -0.0526 -0.0199 217 ARG A O
50961491 C CB . ARG A 193 ? 0.8644 0.4250 0.7129 0.0544 -0.0234 -0.0371 217 ARG A CB
50971492 C CG . ARG A 193 ? 1.0581 0.5863 0.9062 0.0806 -0.0036 -0.0334 217 ARG A CG
50981493 C CD . ARG A 193 ? 0.9485 0.4060 0.7715 0.0745 0.0076 -0.0462 217 ARG A CD
50991494 N NE . ARG A 193 ? 1.1717 0.6079 0.9655 0.0448 -0.0023 -0.0676 217 ARG A NE
51001495 C CZ . ARG A 193 ? 1.3685 0.7673 1.1274 0.0382 0.0058 -0.0904 217 ARG A CZ
51011496 N NH1 . ARG A 193 ? 1.2727 0.6485 1.0219 0.0610 0.0284 -0.0972 217 ARG A NH1
51021497 N NH2 . ARG A 193 ? 1.3075 0.6915 1.0405 0.0072 -0.0087 -0.1059 217 ARG A NH2
51031498 N N . TYR A 194 ? 0.9542 0.6177 0.8197 0.0262 -0.0539 -0.0428 218 TYR A N
51041499 C CA . TYR A 194 ? 0.7733 0.4600 0.6481 0.0052 -0.0680 -0.0448 218 TYR A CA
51051500 C C . TYR A 194 ? 0.8268 0.5091 0.6831 -0.0053 -0.0752 -0.0597 218 TYR A C
51061501 O O . TYR A 194 ? 0.8127 0.4791 0.6470 0.0040 -0.0672 -0.0692 218 TYR A O
51071502 C CB . TYR A 194 ? 0.7048 0.4397 0.6023 0.0082 -0.0709 -0.0335 218 TYR A CB
51081503 C CG . TYR A 194 ? 0.7485 0.5111 0.6451 0.0209 -0.0687 -0.0347 218 TYR A CG
51091504 C CD1 . TYR A 194 ? 0.7513 0.5199 0.6497 0.0408 -0.0596 -0.0271 218 TYR A CD1
51101505 C CD2 . TYR A 194 ? 0.6347 0.4190 0.5319 0.0126 -0.0762 -0.0413 218 TYR A CD2
51111506 C CE1 . TYR A 194 ? 0.7620 0.5590 0.6635 0.0506 -0.0574 -0.0271 218 TYR A CE1
51121507 C CE2 . TYR A 194 ? 0.7596 0.5681 0.6557 0.0224 -0.0734 -0.0419 218 TYR A CE2
51131508 C CZ . TYR A 194 ? 0.8562 0.6718 0.7547 0.0407 -0.0637 -0.0354 218 TYR A CZ
51141509 O OH . TYR A 194 ? 0.7451 0.5876 0.6462 0.0490 -0.0606 -0.0349 218 TYR A OH
51151510 N N . HIS A 195 ? 0.8033 0.5012 0.6699 -0.0251 -0.0898 -0.0601 219 HIS A N
51161511 C CA . HIS A 195 ? 0.7359 0.4342 0.5867 -0.0388 -0.1016 -0.0698 219 HIS A CA
51171512 C C . HIS A 195 ? 0.6174 0.3625 0.4920 -0.0394 -0.1095 -0.0625 219 HIS A C
51181513 O O . HIS A 195 ? 0.7258 0.4961 0.6318 -0.0419 -0.1112 -0.0522 219 HIS A O
51191514 C CB . HIS A 195 ? 0.8753 0.5491 0.7195 -0.0640 -0.1152 -0.0743 219 HIS A CB
51201515 C CG . HIS A 195 ? 0.8636 0.4820 0.6737 -0.0667 -0.1071 -0.0860 219 HIS A CG
51211516 N ND1 . HIS A 195 ? 0.9335 0.5177 0.7001 -0.0741 -0.1069 -0.1022 219 HIS A ND1
51221517 C CD2 . HIS A 195 ? 0.7972 0.3844 0.6076 -0.0627 -0.0965 -0.0841 219 HIS A CD2
51231518 C CE1 . HIS A 195 ? 0.9979 0.5297 0.7398 -0.0747 -0.0952 -0.1116 219 HIS A CE1
51241519 N NE2 . HIS A 195 ? 0.9944 0.5275 0.7642 -0.0671 -0.0894 -0.0998 219 HIS A NE2
51251520 N N . GLY A 196 ? 0.7464 0.4994 0.6041 -0.0374 -0.1118 -0.0681 220 GLY A N
51261521 C CA . GLY A 196 ? 0.5831 0.3751 0.4589 -0.0356 -0.1167 -0.0616 220 GLY A CA
51271522 C C . GLY A 196 ? 0.7347 0.5521 0.6463 -0.0476 -0.1282 -0.0515 220 GLY A C
51281523 O O . GLY A 196 ? 0.6216 0.4637 0.5598 -0.0408 -0.1214 -0.0437 220 GLY A O
51291524 N N . ARG A 197 ? 0.8522 0.6631 0.7650 -0.0666 -0.1449 -0.0511 221 ARG A N
51301525 C CA . ARG A 197 ? 0.8702 0.7092 0.8252 -0.0769 -0.1558 -0.0389 221 ARG A CA
51311526 C C . ARG A 197 ? 0.7656 0.6112 0.7525 -0.0746 -0.1449 -0.0325 221 ARG A C
51321527 O O . ARG A 197 ? 0.6913 0.5635 0.7116 -0.0702 -0.1383 -0.0243 221 ARG A O
51331528 C CB . ARG A 197 ? 0.7627 0.5946 0.7147 -0.0997 -0.1787 -0.0370 221 ARG A CB
51341529 C CG . ARG A 197 ? 0.9526 0.7812 0.8719 -0.1057 -0.1915 -0.0404 221 ARG A CG
51351530 C CD . ARG A 197 ? 1.2269 1.0242 1.1087 -0.1283 -0.2082 -0.0479 221 ARG A CD
51361531 N NE . ARG A 197 ? 1.2234 1.0006 1.0517 -0.1295 -0.2084 -0.0588 221 ARG A NE
51371532 C CZ . ARG A 197 ? 1.5952 1.3475 1.3809 -0.1524 -0.2253 -0.0649 221 ARG A CZ
51381533 N NH1 . ARG A 197 ? 1.7336 1.4791 1.5249 -0.1773 -0.2465 -0.0608 221 ARG A NH1
51391534 N NH2 . ARG A 197 ? 1.5388 1.2722 1.2731 -0.1523 -0.2206 -0.0753 221 ARG A NH2
51401535 N N . SER A 198 ? 0.7021 0.5203 0.6769 -0.0785 -0.1411 -0.0364 222 SER A N
51411536 C CA . SER A 198 ? 0.5917 0.4139 0.5936 -0.0795 -0.1310 -0.0291 222 SER A CA
51421537 C C . SER A 198 ? 0.6631 0.4971 0.6663 -0.0622 -0.1129 -0.0265 222 SER A C
51431538 O O . SER A 198 ? 0.8630 0.7142 0.8930 -0.0632 -0.1036 -0.0192 222 SER A O
51441539 C CB . SER A 198 ? 0.6880 0.4738 0.6729 -0.0884 -0.1311 -0.0330 222 SER A CB
51451540 O OG . SER A 198 ? 0.7872 0.5410 0.7303 -0.0782 -0.1256 -0.0435 222 SER A OG
51461541 N N . ALA A 199 ? 0.5616 0.3875 0.5361 -0.0477 -0.1071 -0.0318 223 ALA A N
51471542 C CA . ALA A 199 ? 0.6156 0.4568 0.5906 -0.0346 -0.0943 -0.0275 223 ALA A CA
51481543 C C . ALA A 199 ? 0.5797 0.4516 0.5722 -0.0341 -0.0934 -0.0255 223 ALA A C
51491544 O O . ALA A 199 ? 0.4954 0.3808 0.4968 -0.0321 -0.0827 -0.0213 223 ALA A O
51501545 C CB . ALA A 199 ? 0.5137 0.3434 0.4616 -0.0194 -0.0898 -0.0309 223 ALA A CB
51511546 N N . ALA A 200 ? 0.5847 0.4649 0.5792 -0.0372 -0.1038 -0.0283 224 ALA A N
51521547 C CA . ALA A 200 ? 0.6202 0.5254 0.6350 -0.0373 -0.1028 -0.0249 224 ALA A CA
51531548 C C . ALA A 200 ? 0.6306 0.5467 0.6832 -0.0452 -0.0981 -0.0179 224 ALA A C
51541549 O O . ALA A 200 ? 0.5475 0.4774 0.6159 -0.0427 -0.0861 -0.0157 224 ALA A O
51551550 C CB . ALA A 200 ? 0.5515 0.4608 0.5603 -0.0403 -0.1167 -0.0262 224 ALA A CB
51561551 N N . VAL A 201 ? 0.5010 0.4095 0.5688 -0.0556 -0.1055 -0.0146 225 VAL A N
51571552 C CA . VAL A 201 ? 0.6228 0.5443 0.7331 -0.0629 -0.0987 -0.0065 225 VAL A CA
51581553 C C . VAL A 201 ? 0.5780 0.4942 0.6843 -0.0598 -0.0776 -0.0068 225 VAL A C
51591554 O O . VAL A 201 ? 0.5614 0.4895 0.6934 -0.0606 -0.0617 -0.0033 225 VAL A O
51601555 C CB . VAL A 201 ? 0.5650 0.4819 0.6933 -0.0776 -0.1138 -0.0016 225 VAL A CB
51611556 C CG1 . VAL A 201 ? 0.5946 0.5245 0.7687 -0.0845 -0.1024 0.0075 225 VAL A CG1
51621557 C CG2 . VAL A 201 ? 0.4560 0.3833 0.5921 -0.0844 -0.1363 0.0022 225 VAL A CG2
51631558 N N . TRP A 202 ? 0.5697 0.4661 0.6425 -0.0566 -0.0759 -0.0102 226 TRP A N
51641559 C CA . TRP A 202 ? 0.5224 0.4133 0.5835 -0.0547 -0.0589 -0.0083 226 TRP A CA
51651560 C C . TRP A 202 ? 0.5206 0.4253 0.5738 -0.0491 -0.0478 -0.0106 226 TRP A C
51661561 O O . TRP A 202 ? 0.4665 0.3742 0.5256 -0.0533 -0.0306 -0.0092 226 TRP A O
51671562 C CB . TRP A 202 ? 0.5766 0.4452 0.6043 -0.0495 -0.0620 -0.0084 226 TRP A CB
51681563 C CG . TRP A 202 ? 0.7136 0.5796 0.7241 -0.0475 -0.0488 -0.0035 226 TRP A CG
51691564 C CD1 . TRP A 202 ? 0.4801 0.3551 0.4690 -0.0403 -0.0459 -0.0031 226 TRP A CD1
51701565 C CD2 . TRP A 202 ? 0.6290 0.4839 0.6409 -0.0558 -0.0375 0.0033 226 TRP A CD2
51711566 N NE1 . TRP A 202 ? 0.5500 0.4193 0.5235 -0.0445 -0.0357 0.0040 226 TRP A NE1
51721567 C CE2 . TRP A 202 ? 0.5353 0.3909 0.5211 -0.0535 -0.0292 0.0078 226 TRP A CE2
51731568 C CE3 . TRP A 202 ? 0.6013 0.4461 0.6333 -0.0669 -0.0343 0.0071 226 TRP A CE3
51741569 C CZ2 . TRP A 202 ? 0.7823 0.6266 0.7569 -0.0617 -0.0172 0.0160 226 TRP A CZ2
51751570 C CZ3 . TRP A 202 ? 0.5807 0.4149 0.6055 -0.0739 -0.0204 0.0147 226 TRP A CZ3
51761571 C CH2 . TRP A 202 ? 0.7327 0.5654 0.7268 -0.0712 -0.0116 0.0191 226 TRP A CH2
51771572 N N . SER A 203 ? 0.5023 0.4131 0.5389 -0.0411 -0.0560 -0.0147 227 SER A N
51781573 C CA . SER A 203 ? 0.5591 0.4818 0.5869 -0.0387 -0.0472 -0.0173 227 SER A CA
51791574 C C . SER A 203 ? 0.5214 0.4545 0.5800 -0.0428 -0.0379 -0.0179 227 SER A C
51801575 O O . SER A 203 ? 0.5188 0.4536 0.5728 -0.0452 -0.0224 -0.0208 227 SER A O
51811576 C CB . SER A 203 ? 0.5287 0.4578 0.5371 -0.0305 -0.0577 -0.0204 227 SER A CB
51821577 O OG . SER A 203 ? 0.6689 0.6052 0.6922 -0.0300 -0.0664 -0.0222 227 SER A OG
51831578 N N . LEU A 204 ? 0.4511 0.3899 0.5414 -0.0443 -0.0468 -0.0144 228 LEU A N
51841579 C CA . LEU A 204 ? 0.5732 0.5232 0.7034 -0.0460 -0.0371 -0.0108 228 LEU A CA
51851580 C C . LEU A 204 ? 0.6137 0.5603 0.7627 -0.0514 -0.0149 -0.0091 228 LEU A C
51861581 O O . LEU A 204 ? 0.5904 0.5392 0.7577 -0.0511 0.0052 -0.0104 228 LEU A O
51871582 C CB . LEU A 204 ? 0.4484 0.4088 0.6107 -0.0478 -0.0561 -0.0031 228 LEU A CB
51881583 C CG . LEU A 204 ? 0.5375 0.5009 0.6802 -0.0436 -0.0731 -0.0048 228 LEU A CG
51891584 C CD1 . LEU A 204 ? 0.3898 0.3613 0.5542 -0.0489 -0.0953 0.0039 228 LEU A CD1
51901585 C CD2 . LEU A 204 ? 0.5387 0.5073 0.6833 -0.0384 -0.0605 -0.0069 228 LEU A CD2
51911586 N N . GLY A 205 ? 0.5426 0.4806 0.6858 -0.0566 -0.0157 -0.0066 229 GLY A N
51921587 C CA . GLY A 205 ? 0.5374 0.4704 0.6916 -0.0631 0.0076 -0.0049 229 GLY A CA
51931588 C C . GLY A 205 ? 0.5236 0.4451 0.6381 -0.0646 0.0264 -0.0118 229 GLY A C
51941589 O O . GLY A 205 ? 0.7122 0.6303 0.8353 -0.0688 0.0521 -0.0144 229 GLY A O
51951590 N N . ILE A 206 ? 0.6038 0.5186 0.6740 -0.0622 0.0144 -0.0142 230 ILE A N
51961591 C CA . ILE A 206 ? 0.6029 0.5105 0.6326 -0.0663 0.0262 -0.0189 230 ILE A CA
51971592 C C . ILE A 206 ? 0.6167 0.5281 0.6520 -0.0667 0.0387 -0.0268 230 ILE A C
51981593 O O . ILE A 206 ? 0.7018 0.6025 0.7191 -0.0752 0.0608 -0.0328 230 ILE A O
51991594 C CB . ILE A 206 ? 0.4692 0.3768 0.4622 -0.0618 0.0071 -0.0165 230 ILE A CB
52001595 C CG1 . ILE A 206 ? 0.7388 0.6365 0.7275 -0.0601 -0.0025 -0.0084 230 ILE A CG1
52011596 C CG2 . ILE A 206 ? 0.4883 0.3932 0.4412 -0.0692 0.0144 -0.0185 230 ILE A CG2
52021597 C CD1 . ILE A 206 ? 0.5849 0.4693 0.5476 -0.0689 0.0087 -0.0022 230 ILE A CD1
52031598 N N . LEU A 207 ? 0.5083 0.4312 0.5655 -0.0587 0.0259 -0.0272 231 LEU A N
52041599 C CA . LEU A 207 ? 0.5916 0.5154 0.6556 -0.0581 0.0363 -0.0334 231 LEU A CA
52051600 C C . LEU A 207 ? 0.7350 0.6540 0.8369 -0.0594 0.0625 -0.0341 231 LEU A C
52061601 O O . LEU A 207 ? 0.6346 0.5410 0.7266 -0.0637 0.0852 -0.0426 231 LEU A O
52071602 C CB . LEU A 207 ? 0.4679 0.4047 0.5471 -0.0496 0.0152 -0.0305 231 LEU A CB
52081603 C CG . LEU A 207 ? 0.5920 0.5284 0.6852 -0.0480 0.0248 -0.0340 231 LEU A CG
52091604 C CD1 . LEU A 207 ? 0.6193 0.5475 0.6689 -0.0550 0.0312 -0.0433 231 LEU A CD1
52101605 C CD2 . LEU A 207 ? 0.5613 0.5106 0.6772 -0.0405 0.0039 -0.0269 231 LEU A CD2
52111606 N N . LEU A 208 ? 0.6142 0.5426 0.7612 -0.0564 0.0607 -0.0252 232 LEU A N
52121607 C CA . LEU A 208 ? 0.5055 0.4340 0.6988 -0.0558 0.0873 -0.0230 232 LEU A CA
52131608 C C . LEU A 208 ? 0.7127 0.6225 0.8805 -0.0655 0.1184 -0.0305 232 LEU A C
52141609 O O . LEU A 208 ? 0.7541 0.6522 0.9334 -0.0665 0.1500 -0.0368 232 LEU A O
52151610 C CB . LEU A 208 ? 0.5562 0.5042 0.8058 -0.0530 0.0750 -0.0091 232 LEU A CB
52161611 C CG . LEU A 208 ? 0.6285 0.5844 0.9412 -0.0497 0.1013 -0.0026 232 LEU A CG
52171612 C CD1 . LEU A 208 ? 0.5968 0.5471 0.9236 -0.0416 0.1167 -0.0064 232 LEU A CD1
52181613 C CD2 . LEU A 208 ? 0.5117 0.4940 0.8858 -0.0486 0.0820 0.0146 232 LEU A CD2
52191614 N N . TYR A 209 ? 0.7087 0.6125 0.8399 -0.0731 0.1114 -0.0295 233 TYR A N
52201615 C CA . TYR A 209 ? 0.6672 0.5511 0.7623 -0.0851 0.1385 -0.0355 233 TYR A CA
52211616 C C . TYR A 209 ? 0.7722 0.6384 0.8200 -0.0919 0.1520 -0.0488 233 TYR A C
52221617 O O . TYR A 209 ? 0.7814 0.6287 0.8201 -0.0996 0.1860 -0.0580 233 TYR A O
52231618 C CB . TYR A 209 ? 0.7470 0.6267 0.8062 -0.0916 0.1236 -0.0292 233 TYR A CB
52241619 C CG . TYR A 209 ? 0.6632 0.5224 0.6846 -0.1060 0.1505 -0.0322 233 TYR A CG
52251620 C CD1 . TYR A 209 ? 0.7352 0.5781 0.6941 -0.1171 0.1560 -0.0400 233 TYR A CD1
52261621 C CD2 . TYR A 209 ? 0.7238 0.5804 0.7702 -0.1111 0.1704 -0.0265 233 TYR A CD2
52271622 C CE1 . TYR A 209 ? 0.9048 0.7266 0.8212 -0.1334 0.1800 -0.0424 233 TYR A CE1
52281623 C CE2 . TYR A 209 ? 1.0065 0.8422 1.0133 -0.1259 0.1973 -0.0291 233 TYR A CE2
52291624 C CZ . TYR A 209 ? 1.0355 0.8525 0.9742 -0.1373 0.2017 -0.0372 233 TYR A CZ
52301625 O OH . TYR A 209 ? 1.1383 0.9322 1.0297 -0.1551 0.2273 -0.0394 233 TYR A OH
52311626 N N . ASP A 210 ? 0.8316 0.7027 0.8480 -0.0907 0.1267 -0.0503 234 ASP A N
52321627 C CA . ASP A 210 ? 0.6979 0.5549 0.6699 -0.1001 0.1347 -0.0620 234 ASP A CA
52331628 C C . ASP A 210 ? 0.7356 0.5807 0.7347 -0.0976 0.1616 -0.0715 234 ASP A C
52341629 O O . ASP A 210 ? 0.8420 0.6615 0.8080 -0.1101 0.1891 -0.0845 234 ASP A O
52351630 C CB . ASP A 210 ? 0.6796 0.5518 0.6324 -0.0962 0.1018 -0.0591 234 ASP A CB
52361631 C CG . ASP A 210 ? 0.8211 0.6824 0.7256 -0.1097 0.1050 -0.0690 234 ASP A CG
52371632 O OD1 . ASP A 210 ? 1.0263 0.8758 0.8815 -0.1256 0.1101 -0.0712 234 ASP A OD1
52381633 O OD2 . ASP A 210 ? 0.8665 0.7310 0.7805 -0.1062 0.1008 -0.0735 234 ASP A OD2
52391634 N N . MET A 211 ? 0.6201 0.4809 0.6787 -0.0822 0.1549 -0.0644 235 MET A N
52401635 C CA . MET A 211 ? 0.7087 0.5593 0.8020 -0.0764 0.1788 -0.0694 235 MET A CA
52411636 C C . MET A 211 ? 0.7927 0.6245 0.9026 -0.0797 0.2215 -0.0750 235 MET A C
52421637 O O . MET A 211 ? 0.8440 0.6468 0.9331 -0.0865 0.2534 -0.0892 235 MET A O
52431638 C CB . MET A 211 ? 0.8308 0.7060 0.9884 -0.0597 0.1594 -0.0553 235 MET A CB
52441639 C CG . MET A 211 ? 0.5741 0.4593 0.7194 -0.0556 0.1296 -0.0531 235 MET A CG
52451640 S SD . MET A 211 ? 0.6574 0.5700 0.8730 -0.0399 0.1064 -0.0341 235 MET A SD
52461641 C CE . MET A 211 ? 0.7949 0.7173 0.9749 -0.0395 0.0705 -0.0332 235 MET A CE
52471642 N N . VAL A 212 ? 0.7709 0.6169 0.9176 -0.0762 0.2249 -0.0645 236 VAL A N
52481643 C CA . VAL A 212 ? 0.7167 0.5493 0.8909 -0.0774 0.2684 -0.0678 236 VAL A CA
52491644 C C . VAL A 212 ? 0.8186 0.6224 0.9245 -0.0966 0.2933 -0.0808 236 VAL A C
52501645 O O . VAL A 212 ? 0.9837 0.7696 1.0996 -0.1004 0.3356 -0.0870 236 VAL A O
52511646 C CB . VAL A 212 ? 0.7617 0.6229 1.0063 -0.0688 0.2648 -0.0502 236 VAL A CB
52521647 C CG1 . VAL A 212 ? 0.7465 0.6335 1.0677 -0.0514 0.2501 -0.0360 236 VAL A CG1
52531648 C CG2 . VAL A 212 ? 0.8599 0.7349 1.0799 -0.0755 0.2327 -0.0420 236 VAL A CG2
52541649 N N . CYS A 213 ? 0.8417 0.6406 0.8787 -0.1093 0.2690 -0.0840 237 CYS A N
52551650 C CA . CYS A 213 ? 0.7982 0.5742 0.7677 -0.1295 0.2842 -0.0909 237 CYS A CA
52561651 C C . CYS A 213 ? 0.9098 0.6641 0.8006 -0.1470 0.2787 -0.1038 237 CYS A C
52571652 O O . CYS A 213 ? 1.0946 0.8255 0.9228 -0.1675 0.2942 -0.1106 237 CYS A O
52581653 C CB . CYS A 213 ? 0.7873 0.5813 0.7498 -0.1311 0.2573 -0.0757 237 CYS A CB
52591654 S SG . CYS A 213 ? 1.0243 0.8326 1.0550 -0.1240 0.2746 -0.0629 237 CYS A SG
52601655 N N . GLY A 214 ? 0.9408 0.7031 0.8313 -0.1420 0.2562 -0.1062 238 GLY A N
52611656 C CA . GLY A 214 ? 0.9373 0.6841 0.7588 -0.1604 0.2472 -0.1166 238 GLY A CA
52621657 C C . GLY A 214 ? 0.8912 0.6561 0.6698 -0.1687 0.2095 -0.1053 238 GLY A C
52631658 O O . GLY A 214 ? 1.0805 0.8435 0.8126 -0.1823 0.1933 -0.1093 238 GLY A O
52641659 N N . ASP A 215 ? 0.9408 0.7233 0.7365 -0.1610 0.1948 -0.0902 239 ASP A N
52651660 C CA . ASP A 215 ? 1.0971 0.8942 0.8572 -0.1663 0.1621 -0.0770 239 ASP A CA
52661661 C C . ASP A 215 ? 0.9315 0.7534 0.7410 -0.1461 0.1396 -0.0611 239 ASP A C
52671662 O O . ASP A 215 ? 0.9088 0.7349 0.7714 -0.1338 0.1508 -0.0598 239 ASP A O
52681663 C CB . ASP A 215 ? 1.1176 0.8928 0.8153 -0.1892 0.1758 -0.0766 239 ASP A CB
52691664 C CG . ASP A 215 ? 1.3753 1.1639 1.0286 -0.1982 0.1413 -0.0619 239 ASP A CG
52701665 O OD1 . ASP A 215 ? 1.5673 1.3754 1.2208 -0.1942 0.1141 -0.0588 239 ASP A OD1
52711666 O OD2 . ASP A 215 ? 1.6171 1.3972 1.2370 -0.2092 0.1421 -0.0517 239 ASP A OD2
52721667 N N . ILE A 216 ? 0.7202 0.5581 0.5127 -0.1435 0.1076 -0.0486 240 ILE A N
52731668 C CA . ILE A 216 ? 0.7345 0.5894 0.5624 -0.1265 0.0857 -0.0351 240 ILE A CA
52741669 C C . ILE A 216 ? 0.8728 0.7165 0.6965 -0.1312 0.0950 -0.0259 240 ILE A C
52751670 O O . ILE A 216 ? 1.0438 0.8722 0.8204 -0.1479 0.1051 -0.0238 240 ILE A O
52761671 C CB . ILE A 216 ? 0.7430 0.6164 0.5560 -0.1206 0.0530 -0.0258 240 ILE A CB
52771672 C CG1 . ILE A 216 ? 0.8450 0.7139 0.6003 -0.1384 0.0471 -0.0197 240 ILE A CG1
52781673 C CG2 . ILE A 216 ? 0.7206 0.6077 0.5508 -0.1134 0.0444 -0.0336 240 ILE A CG2
52791674 C CD1 . ILE A 216 ? 0.9773 0.8591 0.7252 -0.1314 0.0208 -0.0003 240 ILE A CD1
52801675 N N . PRO A 217 ? 0.7706 0.6201 0.6397 -0.1193 0.0918 -0.0197 241 PRO A N
52811676 C CA . PRO A 217 ? 0.8696 0.7067 0.7388 -0.1261 0.1051 -0.0118 241 PRO A CA
52821677 C C . PRO A 217 ? 0.8289 0.6592 0.6574 -0.1311 0.0887 0.0029 241 PRO A C
52831678 O O . PRO A 217 ? 0.8279 0.6420 0.6311 -0.1443 0.1041 0.0086 241 PRO A O
52841679 C CB . PRO A 217 ? 0.7513 0.5994 0.6817 -0.1136 0.0996 -0.0085 241 PRO A CB
52851680 C CG . PRO A 217 ? 0.6865 0.5505 0.6321 -0.0997 0.0734 -0.0100 241 PRO A CG
52861681 C CD . PRO A 217 ? 0.6737 0.5399 0.5928 -0.1025 0.0758 -0.0195 241 PRO A CD
52871682 N N . PHE A 218 ? 0.9928 0.8346 0.8156 -0.1206 0.0596 0.0105 242 PHE A N
52881683 C CA . PHE A 218 ? 0.9228 0.7601 0.7174 -0.1209 0.0424 0.0280 242 PHE A CA
52891684 C C . PHE A 218 ? 1.0160 0.8671 0.7807 -0.1209 0.0224 0.0330 242 PHE A C
52901685 O O . PHE A 218 ? 1.0198 0.8882 0.8035 -0.1096 0.0099 0.0271 242 PHE A O
52911686 C CB . PHE A 218 ? 0.8633 0.7005 0.6904 -0.1045 0.0263 0.0366 242 PHE A CB
52921687 C CG . PHE A 218 ? 0.9321 0.7644 0.8015 -0.1026 0.0377 0.0305 242 PHE A CG
52931688 C CD1 . PHE A 218 ? 0.8919 0.7097 0.7628 -0.1147 0.0577 0.0341 242 PHE A CD1
52941689 C CD2 . PHE A 218 ? 0.7692 0.6127 0.6770 -0.0902 0.0274 0.0228 242 PHE A CD2
52951690 C CE1 . PHE A 218 ? 0.7347 0.5532 0.6511 -0.1143 0.0661 0.0309 242 PHE A CE1
52961691 C CE2 . PHE A 218 ? 0.7995 0.6422 0.7476 -0.0909 0.0335 0.0198 242 PHE A CE2
52971692 C CZ . PHE A 218 ? 0.8667 0.6987 0.8222 -0.1028 0.0523 0.0243 242 PHE A CZ
52981693 N N . GLU A 219 ? 1.2057 1.0511 0.9250 -0.1342 0.0173 0.0466 243 GLU A N
52991694 C CA . GLU A 219 ? 1.3701 1.2333 1.0642 -0.1362 -0.0054 0.0565 243 GLU A CA
53001695 C C . GLU A 219 ? 1.3724 1.2421 1.0701 -0.1238 -0.0290 0.0814 243 GLU A C
53011696 O O . GLU A 219 ? 1.4485 1.3408 1.1461 -0.1178 -0.0503 0.0915 243 GLU A O
53021697 C CB . GLU A 219 ? 1.4253 1.2806 1.0606 -0.1642 0.0022 0.0551 243 GLU A CB
53031698 C CG . GLU A 219 ? 1.5323 1.4004 1.1553 -0.1731 0.0000 0.0404 243 GLU A CG
53041699 C CD . GLU A 219 ? 1.7731 1.6726 1.4061 -0.1639 -0.0313 0.0533 243 GLU A CD
53051700 O OE1 . GLU A 219 ? 1.7222 1.6355 1.3643 -0.1641 -0.0339 0.0409 243 GLU A OE1
53061701 O OE2 . GLU A 219 ? 1.8160 1.7262 1.4489 -0.1569 -0.0520 0.0771 243 GLU A OE2
53071702 N N . HIS A 220 ? 1.2669 1.1175 0.9711 -0.1193 -0.0249 0.0923 244 HIS A N
53081703 C CA . HIS A 220 ? 1.2748 1.1252 0.9857 -0.1054 -0.0440 0.1166 244 HIS A CA
53091704 C C . HIS A 220 ? 1.1341 0.9725 0.8888 -0.0849 -0.0417 0.1122 244 HIS A C
53101705 O O . HIS A 220 ? 1.0108 0.8398 0.7857 -0.0863 -0.0262 0.0946 244 HIS A O
53111706 C CB . HIS A 220 ? 1.2578 1.0898 0.9294 -0.1209 -0.0430 0.1376 244 HIS A CB
53121707 C CG . HIS A 220 ? 1.3980 1.2375 1.0164 -0.1457 -0.0467 0.1430 244 HIS A CG
53131708 N ND1 . HIS A 220 ? 1.5138 1.3786 1.1185 -0.1467 -0.0728 0.1603 244 HIS A ND1
53141709 C CD2 . HIS A 220 ? 1.3125 1.1364 0.8860 -0.1724 -0.0271 0.1331 244 HIS A CD2
53151710 C CE1 . HIS A 220 ? 1.5431 1.4070 1.0929 -0.1754 -0.0720 0.1607 244 HIS A CE1
53161711 N NE2 . HIS A 220 ? 1.4945 1.3310 1.0216 -0.1912 -0.0428 0.1430 244 HIS A NE2
53171712 N N . ASP A 221 ? 1.2298 1.0678 0.9994 -0.0665 -0.0573 0.1292 245 ASP A N
53181713 C CA . ASP A 221 ? 1.0753 0.8935 0.8773 -0.0499 -0.0544 0.1252 245 ASP A CA
53191714 C C . ASP A 221 ? 0.8726 0.6607 0.6702 -0.0616 -0.0396 0.1256 245 ASP A C
53201715 O O . ASP A 221 ? 0.8905 0.6659 0.7129 -0.0595 -0.0313 0.1114 245 ASP A O
53211716 C CB . ASP A 221 ? 0.9368 0.7530 0.7519 -0.0284 -0.0691 0.1449 245 ASP A CB
53221717 C CG . ASP A 221 ? 1.0896 0.9384 0.9187 -0.0150 -0.0817 0.1447 245 ASP A CG
53231718 O OD1 . ASP A 221 ? 1.1986 1.0659 1.0313 -0.0199 -0.0788 0.1251 245 ASP A OD1
53241719 O OD2 . ASP A 221 ? 1.2051 1.0612 1.0450 0.0011 -0.0935 0.1655 245 ASP A OD2
53251720 N N . GLU A 222 ? 1.0199 0.7975 0.7853 -0.0762 -0.0366 0.1428 246 GLU A N
53261721 C CA . GLU A 222 ? 1.0061 0.7546 0.7674 -0.0876 -0.0218 0.1468 246 GLU A CA
53271722 C C . GLU A 222 ? 0.9834 0.7330 0.7584 -0.1007 -0.0008 0.1240 246 GLU A C
53281723 O O . GLU A 222 ? 0.9029 0.6361 0.7024 -0.1021 0.0083 0.1190 246 GLU A O
53291724 C CB . GLU A 222 ? 1.0642 0.8030 0.7817 -0.1031 -0.0222 0.1705 246 GLU A CB
53301725 C CG . GLU A 222 ? 1.5123 1.2171 1.2277 -0.1059 -0.0163 0.1874 246 GLU A CG
53311726 C CD . GLU A 222 ? 1.7275 1.4174 1.4329 -0.1284 0.0090 0.1790 246 GLU A CD
53321727 O OE1 . GLU A 222 ? 1.6791 1.3542 1.4162 -0.1274 0.0194 0.1698 246 GLU A OE1
53331728 O OE2 . GLU A 222 ? 1.6884 1.3806 1.3534 -0.1485 0.0192 0.1824 246 GLU A OE2
53341729 N N . GLU A 223 ? 1.0182 0.7870 0.7808 -0.1104 0.0070 0.1107 247 GLU A N
53351730 C CA . GLU A 223 ? 0.9980 0.7697 0.7814 -0.1194 0.0284 0.0907 247 GLU A CA
53361731 C C . GLU A 223 ? 0.9325 0.7130 0.7640 -0.1049 0.0225 0.0765 247 GLU A C
53371732 O O . GLU A 223 ? 1.0581 0.8366 0.9199 -0.1100 0.0356 0.0676 247 GLU A O
53381733 C CB . GLU A 223 ? 1.0559 0.8409 0.8142 -0.1315 0.0397 0.0790 247 GLU A CB
53391734 C CG . GLU A 223 ? 1.2551 1.0345 0.9552 -0.1472 0.0375 0.0928 247 GLU A CG
53401735 C CD . GLU A 223 ? 1.4010 1.1897 1.0714 -0.1610 0.0467 0.0784 247 GLU A CD
53411736 O OE1 . GLU A 223 ? 1.3056 1.1141 0.9879 -0.1518 0.0333 0.0700 247 GLU A OE1
53421737 O OE2 . GLU A 223 ? 1.4416 1.2149 1.0739 -0.1823 0.0688 0.0750 247 GLU A OE2
53431738 N N . ILE A 224 ? 0.8786 0.6698 0.7177 -0.0882 0.0029 0.0756 248 ILE A N
53441739 C CA . ILE A 224 ? 0.8873 0.6837 0.7633 -0.0765 -0.0039 0.0626 248 ILE A CA
53451740 C C . ILE A 224 ? 0.8405 0.6123 0.7331 -0.0745 -0.0062 0.0672 248 ILE A C
53461741 O O . ILE A 224 ? 0.8175 0.5874 0.7385 -0.0799 -0.0016 0.0581 248 ILE A O
53471742 C CB . ILE A 224 ? 0.8721 0.6844 0.7476 -0.0602 -0.0208 0.0604 248 ILE A CB
53481743 C CG1 . ILE A 224 ? 0.9058 0.7413 0.7652 -0.0658 -0.0189 0.0550 248 ILE A CG1
53491744 C CG2 . ILE A 224 ? 0.8485 0.6620 0.7538 -0.0505 -0.0271 0.0472 248 ILE A CG2
53501745 C CD1 . ILE A 224 ? 0.9589 0.8138 0.8193 -0.0524 -0.0344 0.0545 248 ILE A CD1
53511746 N N . ILE A 225 ? 0.8159 0.5684 0.6925 -0.0672 -0.0142 0.0825 249 ILE A N
53521747 C CA . ILE A 225 ? 0.9146 0.6357 0.8005 -0.0673 -0.0144 0.0880 249 ILE A CA
53531748 C C . ILE A 225 ? 0.7644 0.4778 0.6609 -0.0871 0.0013 0.0870 249 ILE A C
53541749 O O . ILE A 225 ? 0.7644 0.4646 0.6846 -0.0925 0.0015 0.0812 249 ILE A O
53551750 C CB . ILE A 225 ? 0.8665 0.5653 0.7312 -0.0584 -0.0205 0.1096 249 ILE A CB
53561751 C CG1 . ILE A 225 ? 0.9593 0.6735 0.8193 -0.0384 -0.0341 0.1145 249 ILE A CG1
53571752 C CG2 . ILE A 225 ? 0.9854 0.6454 0.8594 -0.0577 -0.0196 0.1130 249 ILE A CG2
53581753 C CD1 . ILE A 225 ? 1.0190 0.7311 0.8565 -0.0341 -0.0407 0.1412 249 ILE A CD1
53591754 N N . ARG A 226 ? 0.8384 0.5602 0.7173 -0.0998 0.0152 0.0925 250 ARG A N
53601755 C CA . ARG A 226 ? 0.9114 0.6279 0.8035 -0.1182 0.0346 0.0922 250 ARG A CA
53611756 C C . ARG A 226 ? 0.8395 0.5782 0.7730 -0.1214 0.0408 0.0752 250 ARG A C
53621757 O O . ARG A 226 ? 0.9256 0.6615 0.8902 -0.1322 0.0487 0.0745 250 ARG A O
53631758 C CB . ARG A 226 ? 0.8509 0.5673 0.7080 -0.1317 0.0516 0.1010 250 ARG A CB
53641759 C CG . ARG A 226 ? 0.8291 0.5316 0.6939 -0.1499 0.0729 0.1068 250 ARG A CG
53651760 C CD . ARG A 226 ? 0.9046 0.5960 0.7220 -0.1644 0.0881 0.1197 250 ARG A CD
53661761 N NE . ARG A 226 ? 1.0550 0.7382 0.8835 -0.1831 0.1153 0.1217 250 ARG A NE
53671762 C CZ . ARG A 226 ? 1.1971 0.8878 1.0148 -0.1968 0.1432 0.1148 250 ARG A CZ
53681763 N NH1 . ARG A 226 ? 0.9449 0.6483 0.7375 -0.1956 0.1470 0.1040 250 ARG A NH1
53691764 N NH2 . ARG A 226 ? 1.1740 0.8572 1.0059 -0.2129 0.1699 0.1185 250 ARG A NH2
53701765 N N . GLY A 227 ? 0.7869 0.5492 0.7242 -0.1129 0.0367 0.0636 251 GLY A N
53711766 C CA . GLY A 227 ? 0.9109 0.6947 0.8895 -0.1137 0.0401 0.0505 251 GLY A CA
53721767 C C . GLY A 227 ? 0.9407 0.7343 0.9424 -0.1272 0.0661 0.0491 251 GLY A C
53731768 O O . GLY A 227 ? 1.0007 0.8134 1.0471 -0.1275 0.0691 0.0424 251 GLY A O
53741769 N N . GLN A 228 ? 0.8722 0.6535 0.8460 -0.1384 0.0859 0.0565 252 GLN A N
53751770 C CA . GLN A 228 ? 0.8776 0.6664 0.8699 -0.1505 0.1169 0.0537 252 GLN A CA
53761771 C C . GLN A 228 ? 0.9074 0.7076 0.8847 -0.1476 0.1297 0.0416 252 GLN A C
53771772 O O . GLN A 228 ? 0.7709 0.5639 0.6983 -0.1466 0.1234 0.0412 252 GLN A O
53781773 C CB . GLN A 228 ? 0.7519 0.5189 0.7148 -0.1661 0.1355 0.0659 252 GLN A CB
53791774 C CG . GLN A 228 ? 0.9524 0.7260 0.9548 -0.1791 0.1660 0.0664 252 GLN A CG
53801775 C CD . GLN A 228 ? 1.2088 0.9593 1.1895 -0.1951 0.1795 0.0811 252 GLN A CD
53811776 O OE1 . GLN A 228 ? 1.0802 0.8114 1.0424 -0.1948 0.1594 0.0924 252 GLN A OE1
53821777 N NE2 . GLN A 228 ? 1.2439 0.9939 1.2275 -0.2090 0.2159 0.0813 252 GLN A NE2
53831778 N N . VAL A 229 ? 1.0132 0.8310 1.0360 -0.1466 0.1468 0.0331 253 VAL A N
53841779 C CA . VAL A 229 ? 0.9683 0.7949 0.9867 -0.1413 0.1571 0.0201 253 VAL A CA
53851780 C C . VAL A 229 ? 0.9990 0.8198 1.0205 -0.1523 0.1992 0.0151 253 VAL A C
53861781 O O . VAL A 229 ? 1.0298 0.8610 1.1050 -0.1546 0.2179 0.0184 253 VAL A O
53871782 C CB . VAL A 229 ? 0.9489 0.7990 1.0201 -0.1278 0.1413 0.0150 253 VAL A CB
53881783 C CG1 . VAL A 229 ? 0.8864 0.7447 0.9761 -0.1245 0.1648 0.0041 253 VAL A CG1
53891784 C CG2 . VAL A 229 ? 0.9892 0.8405 1.0375 -0.1171 0.1068 0.0143 253 VAL A CG2
53901785 N N . PHE A 230 ? 1.0681 0.8720 1.0323 -0.1603 0.2148 0.0075 254 PHE A N
53911786 C CA . PHE A 230 ? 1.1642 0.9547 1.1179 -0.1722 0.2590 -0.0007 254 PHE A CA
53921787 C C . PHE A 230 ? 1.1356 0.9261 1.0895 -0.1669 0.2728 -0.0175 254 PHE A C
53931788 O O . PHE A 230 ? 1.1537 0.9434 1.0733 -0.1637 0.2505 -0.0229 254 PHE A O
53941789 C CB . PHE A 230 ? 1.1419 0.9051 1.0187 -0.1915 0.2700 0.0033 254 PHE A CB
53951790 C CG . PHE A 230 ? 1.3865 1.1444 1.2655 -0.1984 0.2654 0.0206 254 PHE A CG
53961791 C CD1 . PHE A 230 ? 1.4223 1.1951 1.3707 -0.1947 0.2730 0.0268 254 PHE A CD1
53971792 C CD2 . PHE A 230 ? 1.4750 1.2141 1.2897 -0.2094 0.2514 0.0326 254 PHE A CD2
53981793 C CE1 . PHE A 230 ? 1.3985 1.1639 1.3488 -0.2032 0.2693 0.0424 254 PHE A CE1
53991794 C CE2 . PHE A 230 ? 1.4730 1.2033 1.2898 -0.2158 0.2482 0.0495 254 PHE A CE2
54001795 C CZ . PHE A 230 ? 1.3973 1.1392 1.2808 -0.2132 0.2579 0.0534 254 PHE A CZ
54011796 N N . PHE A 231 ? 1.1676 0.9593 1.1644 -0.1656 0.3105 -0.0248 255 PHE A N
54021797 C CA . PHE A 231 ? 1.1573 0.9457 1.1647 -0.1587 0.3281 -0.0401 255 PHE A CA
54031798 C C . PHE A 231 ? 1.2070 0.9602 1.1531 -0.1760 0.3704 -0.0552 255 PHE A C
54041799 O O . PHE A 231 ? 1.0395 0.7794 0.9799 -0.1874 0.4052 -0.0543 255 PHE A O
54051800 C CB . PHE A 231 ? 0.7637 0.5767 0.8664 -0.1427 0.3413 -0.0366 255 PHE A CB
54061801 C CG . PHE A 231 ? 0.8622 0.7070 1.0169 -0.1291 0.2978 -0.0235 255 PHE A CG
54071802 C CD1 . PHE A 231 ? 0.7274 0.5876 0.9126 -0.1316 0.2819 -0.0084 255 PHE A CD1
54081803 C CD2 . PHE A 231 ? 0.7726 0.6282 0.9378 -0.1164 0.2723 -0.0268 255 PHE A CD2
54091804 C CE1 . PHE A 231 ? 0.6835 0.5676 0.9074 -0.1225 0.2422 0.0015 255 PHE A CE1
54101805 C CE2 . PHE A 231 ? 0.8412 0.7222 1.0449 -0.1064 0.2331 -0.0158 255 PHE A CE2
54111806 C CZ . PHE A 231 ? 0.6916 0.5858 0.9228 -0.1101 0.2180 -0.0025 255 PHE A CZ
54121807 N N . ARG A 232 ? 1.3076 1.0442 1.2032 -0.1805 0.3668 -0.0692 256 ARG A N
54131808 C CA . ARG A 232 ? 1.2532 0.9514 1.0815 -0.2000 0.4047 -0.0870 256 ARG A CA
54141809 C C . ARG A 232 ? 1.3202 1.0057 1.1881 -0.1916 0.4471 -0.1033 256 ARG A C
54151810 O O . ARG A 232 ? 1.3237 0.9723 1.1473 -0.2070 0.4920 -0.1199 256 ARG A O
54161811 C CB . ARG A 232 ? 1.4545 1.1404 1.2026 -0.2134 0.3755 -0.0926 256 ARG A CB
54171812 C CG . ARG A 232 ? 1.4961 1.2054 1.2763 -0.1961 0.3394 -0.0921 256 ARG A CG
54181813 C CD . ARG A 232 ? 1.6460 1.3584 1.3632 -0.2066 0.2991 -0.0876 256 ARG A CD
54191814 N NE . ARG A 232 ? 1.7114 1.4560 1.4609 -0.1911 0.2557 -0.0686 256 ARG A NE
54201815 C CZ . ARG A 232 ? 1.7564 1.5101 1.4662 -0.1956 0.2194 -0.0580 256 ARG A CZ
54211816 N NH1 . ARG A 232 ? 1.7943 1.5325 1.4314 -0.2168 0.2159 -0.0618 256 ARG A NH1
54221817 N NH2 . ARG A 232 ? 1.5900 1.3683 1.3341 -0.1792 0.1863 -0.0425 256 ARG A NH2
54231818 N N . GLN A 233 ? 1.0486 0.7610 0.9966 -0.1682 0.4347 -0.0984 257 GLN A N
54241819 C CA . GLN A 233 ? 1.2275 0.9315 1.2276 -0.1558 0.4724 -0.1089 257 GLN A CA
54251820 C C . GLN A 233 ? 1.0622 0.7975 1.1652 -0.1380 0.4861 -0.0932 257 GLN A C
54261821 O O . GLN A 233 ? 1.0017 0.7697 1.1408 -0.1333 0.4545 -0.0747 257 GLN A O
54271822 C CB . GLN A 233 ? 1.0870 0.7964 1.0980 -0.1439 0.4469 -0.1134 257 GLN A CB
54281823 C CG . GLN A 233 ? 1.1623 0.8312 1.0893 -0.1616 0.4587 -0.1352 257 GLN A CG
54291824 C CD . GLN A 233 ? 1.4336 1.0705 1.3811 -0.1569 0.5093 -0.1526 257 GLN A CD
54301825 O OE1 . GLN A 233 ? 1.5538 1.2059 1.5896 -0.1354 0.5294 -0.1450 257 GLN A OE1
54311826 N NE2 . GLN A 233 ? 1.5848 1.1762 1.4515 -0.1779 0.5306 -0.1751 257 GLN A NE2
54321827 N N . ARG A 234 ? 0.8784 0.6023 1.0295 -0.1291 0.5351 -0.1005 258 ARG A N
54331828 C CA . ARG A 234 ? 0.8460 0.6056 1.1087 -0.1100 0.5470 -0.0831 258 ARG A CA
54341829 C C . ARG A 234 ? 0.7760 0.5746 1.0990 -0.0914 0.4967 -0.0670 258 ARG A C
54351830 O O . ARG A 234 ? 1.0275 0.8189 1.3563 -0.0811 0.4912 -0.0731 258 ARG A O
54361831 C CB . ARG A 234 ? 0.9450 0.6809 1.2458 -0.0998 0.6024 -0.0932 258 ARG A CB
54371832 C CG . ARG A 234 ? 0.9325 0.7051 1.3551 -0.0729 0.6018 -0.0735 258 ARG A CG
54381833 C CD . ARG A 234 ? 0.8587 0.6768 1.3495 -0.0702 0.5879 -0.0498 258 ARG A CD
54391834 N NE . ARG A 234 ? 0.9007 0.7660 1.5001 -0.0489 0.5645 -0.0261 258 ARG A NE
54401835 C CZ . ARG A 234 ? 0.8565 0.7572 1.5379 -0.0403 0.5608 -0.0047 258 ARG A CZ
54411836 N NH1 . ARG A 234 ? 0.7926 0.6893 1.4656 -0.0500 0.5812 -0.0041 258 ARG A NH1
54421837 N NH2 . ARG A 234 ? 0.9644 0.9060 1.7363 -0.0230 0.5340 0.0180 258 ARG A NH2
54431838 N N . VAL A 235 ? 0.7795 0.6160 1.1413 -0.0894 0.4598 -0.0471 259 VAL A N
54441839 C CA . VAL A 235 ? 0.9167 0.7881 1.3229 -0.0765 0.4085 -0.0319 259 VAL A CA
54451840 C C . VAL A 235 ? 0.8133 0.7269 1.3179 -0.0688 0.4043 -0.0091 259 VAL A C
54461841 O O . VAL A 235 ? 0.7482 0.6708 1.2546 -0.0800 0.4048 -0.0016 259 VAL A O
54471842 C CB . VAL A 235 ? 0.8359 0.7075 1.1745 -0.0861 0.3587 -0.0319 259 VAL A CB
54481843 C CG1 . VAL A 235 ? 0.6172 0.5213 0.9988 -0.0742 0.3103 -0.0177 259 VAL A CG1
54491844 C CG2 . VAL A 235 ? 0.8310 0.6669 1.0781 -0.0954 0.3607 -0.0515 259 VAL A CG2
54501845 N N . SER A 236 ? 0.7762 0.7160 1.3630 -0.0511 0.3994 0.0036 260 SER A N
54511846 C CA . SER A 236 ? 0.6208 0.6062 1.3112 -0.0442 0.3934 0.0286 260 SER A CA
54521847 C C . SER A 236 ? 0.7479 0.7554 1.4317 -0.0580 0.3534 0.0404 260 SER A C
54531848 O O . SER A 236 ? 0.7493 0.7496 1.3735 -0.0643 0.3119 0.0362 260 SER A O
54541849 C CB . SER A 236 ? 0.7409 0.7539 1.5027 -0.0258 0.3707 0.0444 260 SER A CB
54551850 O OG . SER A 236 ? 0.6427 0.6770 1.3932 -0.0297 0.3106 0.0547 260 SER A OG
54561851 N N . SEP01 A 237 ? 0.8826 0.9152 1.6292 -0.0630 0.3691 0.0551 261 SEP01 A N
54571852 C CA . SEP01 A 237 ? 0.7960 0.8482 1.5457 -0.0783 0.3364 0.0674 261 SEP01 A CA
54581853 C CB . SEP01 A 237 ? 0.8664 0.9535 1.7101 -0.0814 0.3605 0.0866 261 SEP01 A CB
54591854 O OG . SEP01 A 237 ? 1.2058 1.2648 2.0225 -0.0812 0.4126 0.0741 261 SEP01 A OG
54601855 C C . SEP01 A 237 ? 0.7882 0.8612 1.5428 -0.0773 0.2753 0.0774 261 SEP01 A C
54611856 O O . SEP01 A 237 ? 0.9110 0.9756 1.6147 -0.0896 0.2418 0.0754 261 SEP01 A O
54621857 P P . SEP01 A 237 ? 1.4934 1.5533 2.3692 -0.0576 0.4496 0.0758 261 SEP01 A P
54631858 O O1P . SEP01 A 237 ? 1.2685 1.3785 2.2512 -0.0480 0.4294 0.1049 261 SEP01 A O1P
54641859 O O2P . SEP01 A 237 ? 1.1865 1.2302 2.0545 -0.0414 0.4512 0.0662 261 SEP01 A O2P
54651860 O O3P . SEP01 A 237 ? 1.1265 1.1466 1.9576 -0.0615 0.5071 0.0584 261 SEP01 A O3P
54661861 N N . GLU A 238 ? 0.6719 0.7682 1.4844 -0.0624 0.2631 0.0882 262 GLU A N
54671862 C CA . GLU A 238 ? 0.5256 0.6396 1.3397 -0.0620 0.2078 0.0978 262 GLU A CA
54681863 C C . GLU A 238 ? 0.5739 0.6531 1.2895 -0.0620 0.1868 0.0780 262 GLU A C
54691864 O O . GLU A 238 ? 0.6197 0.6984 1.2984 -0.0705 0.1458 0.0782 262 GLU A O
54701865 C CB . GLU A 238 ? 0.4903 0.6358 1.3891 -0.0458 0.2033 0.1163 262 GLU A CB
54711866 C CG . GLU A 238 ? 0.5089 0.7017 1.5185 -0.0467 0.2097 0.1432 262 GLU A CG
54721867 C CD . GLU A 238 ? 0.7458 0.9475 1.8187 -0.0225 0.2292 0.1555 262 GLU A CD
54731868 O OE1 . GLU A 238 ? 0.8343 1.0161 1.8908 -0.0094 0.2427 0.1457 262 GLU A OE1
54741869 O OE2 . GLU A 238 ? 0.7341 0.9588 1.8703 -0.0171 0.2315 0.1754 262 GLU A OE2
54751870 N N . CYS A 239 ? 0.6238 0.6733 1.2979 -0.0533 0.2159 0.0607 263 CYS A N
54761871 C CA . CYS A 239 ? 0.6965 0.7164 1.2805 -0.0549 0.1977 0.0432 263 CYS A CA
54771872 C C . CYS A 239 ? 0.6572 0.6577 1.1724 -0.0696 0.1899 0.0345 263 CYS A C
54781873 O O . CYS A 239 ? 0.6105 0.6026 1.0735 -0.0727 0.1564 0.0300 263 CYS A O
54791874 C CB . CYS A 239 ? 0.6068 0.5977 1.1594 -0.0471 0.2321 0.0265 263 CYS A CB
54801875 S SG . CYS A 239 ? 0.5392 0.5026 0.9958 -0.0489 0.2071 0.0087 263 CYS A SG
54811876 N N . GLN A 240 ? 0.6548 0.6470 1.1701 -0.0784 0.2222 0.0331 264 GLN A N
54821877 C CA . GLN A 240 ? 0.6458 0.6202 1.1028 -0.0926 0.2144 0.0294 264 GLN A CA
54831878 C C . GLN A 240 ? 0.6756 0.6674 1.1492 -0.0989 0.1723 0.0417 264 GLN A C
54841879 O O . GLN A 240 ? 0.6874 0.6616 1.1026 -0.1044 0.1486 0.0371 264 GLN A O
54851880 C CB . GLN A 240 ? 0.7448 0.7097 1.2070 -0.1023 0.2575 0.0291 264 GLN A CB
54861881 C CG . GLN A 240 ? 0.7274 0.6619 1.1440 -0.1021 0.2999 0.0122 264 GLN A CG
54871882 C CD . GLN A 240 ? 0.8069 0.7226 1.1973 -0.1167 0.3372 0.0097 264 GLN A CD
54881883 O OE1 . GLN A 240 ? 0.9102 0.8217 1.2737 -0.1289 0.3229 0.0162 264 GLN A OE1
54891884 N NE2 . GLN A 240 ? 0.9005 0.8007 1.2946 -0.1163 0.3870 0.0001 264 GLN A NE2
54901885 N N . HIS A 241 ? 0.6888 0.7143 1.2421 -0.0988 0.1623 0.0580 265 HIS A N
54911886 C CA . HIS A 241 ? 0.7513 0.7904 1.3164 -0.1088 0.1212 0.0685 265 HIS A CA
54921887 C C . HIS A 241 ? 0.6476 0.6794 1.1708 -0.1034 0.0828 0.0626 265 HIS A C
54931888 O O . HIS A 241 ? 0.7477 0.7644 1.2273 -0.1114 0.0566 0.0593 265 HIS A O
54941889 C CB . HIS A 241 ? 0.6912 0.7720 1.3520 -0.1124 0.1150 0.0893 265 HIS A CB
54951890 C CG . HIS A 241 ? 0.8890 0.9818 1.5577 -0.1269 0.0705 0.0991 265 HIS A CG
54961891 N ND1 . HIS A 241 ? 0.8964 1.0144 1.5996 -0.1263 0.0350 0.1104 265 HIS A ND1
54971892 C CD2 . HIS A 241 ? 0.9008 0.9790 1.5409 -0.1443 0.0560 0.0986 265 HIS A CD2
54981893 C CE1 . HIS A 241 ? 0.8660 0.9839 1.5588 -0.1444 0.0007 0.1149 265 HIS A CE1
54991894 N NE2 . HIS A 241 ? 1.0044 1.0971 1.6604 -0.1549 0.0136 0.1073 265 HIS A NE2
55001895 N N . LEU A 242 ? 0.6321 0.6727 1.1694 -0.0899 0.0810 0.0617 266 LEU A N
55011896 C CA . LEU A 242 ? 0.6410 0.6743 1.1364 -0.0851 0.0485 0.0559 266 LEU A CA
55021897 C C . LEU A 242 ? 0.5234 0.5237 0.9343 -0.0857 0.0474 0.0395 266 LEU A C
55031898 O O . LEU A 242 ? 0.5205 0.5111 0.8940 -0.0890 0.0190 0.0367 266 LEU A O
55041899 C CB . LEU A 242 ? 0.6076 0.6504 1.1261 -0.0707 0.0534 0.0570 266 LEU A CB
55051900 C CG . LEU A 242 ? 0.5676 0.6135 1.0644 -0.0682 0.0152 0.0581 266 LEU A CG
55061901 C CD1 . LEU A 242 ? 0.5456 0.6021 1.0486 -0.0818 -0.0212 0.0674 266 LEU A CD1
55071902 C CD2 . LEU A 242 ? 0.5884 0.6504 1.1277 -0.0561 0.0153 0.0671 266 LEU A CD2
55081903 N N . ILE A 243 ? 0.5457 0.5281 0.9260 -0.0831 0.0789 0.0295 267 ILE A N
55091904 C CA . ILE A 243 ? 0.6297 0.5854 0.9339 -0.0840 0.0764 0.0176 267 ILE A CA
55101905 C C . ILE A 243 ? 0.6959 0.6395 0.9760 -0.0939 0.0637 0.0210 267 ILE A C
55111906 O O . ILE A 243 ? 0.6482 0.5795 0.8872 -0.0925 0.0404 0.0177 267 ILE A O
55121907 C CB . ILE A 243 ? 0.6509 0.5899 0.9261 -0.0843 0.1121 0.0078 267 ILE A CB
55131908 C CG1 . ILE A 243 ? 0.5622 0.5068 0.8590 -0.0746 0.1250 0.0030 267 ILE A CG1
55141909 C CG2 . ILE A 243 ? 0.6453 0.5616 0.8448 -0.0876 0.1055 -0.0003 267 ILE A CG2
55151910 C CD1 . ILE A 243 ? 0.5349 0.4560 0.7848 -0.0770 0.1536 -0.0110 267 ILE A CD1
55161911 N N . ARG A 244 ? 0.6004 0.5460 0.9080 -0.1038 0.0808 0.0281 268 ARG A N
55171912 C CA . ARG A 244 ? 0.7271 0.6569 1.0124 -0.1146 0.0720 0.0323 268 ARG A CA
55181913 C C . ARG A 244 ? 0.6763 0.6104 0.9743 -0.1186 0.0368 0.0368 268 ARG A C
55191914 O O . ARG A 244 ? 0.6626 0.5750 0.9283 -0.1248 0.0246 0.0369 268 ARG A O
55201915 C CB . ARG A 244 ? 0.5425 0.4758 0.8601 -0.1259 0.1001 0.0400 268 ARG A CB
55211916 C CG . ARG A 244 ? 0.5557 0.4705 0.8341 -0.1276 0.1348 0.0340 268 ARG A CG
55221917 C CD . ARG A 244 ? 0.5971 0.5086 0.8935 -0.1414 0.1610 0.0421 268 ARG A CD
55231918 N NE . ARG A 244 ? 0.8886 0.7789 1.1383 -0.1458 0.1947 0.0358 268 ARG A NE
55241919 C CZ . ARG A 244 ? 0.8899 0.7839 1.1590 -0.1454 0.2326 0.0309 268 ARG A CZ
55251920 N NH1 . ARG A 244 ? 0.7733 0.6944 1.1157 -0.1377 0.2426 0.0336 268 ARG A NH1
55261921 N NH2 . ARG A 244 ? 0.6864 0.5550 0.8994 -0.1533 0.2616 0.0238 268 ARG A NH2
55271922 N N . TRP A 245 ? 0.5191 0.4777 0.8608 -0.1161 0.0208 0.0410 269 TRP A N
55281923 C CA . TRP A 245 ? 0.5256 0.4860 0.8698 -0.1225 -0.0142 0.0437 269 TRP A CA
55291924 C C . TRP A 245 ? 0.6817 0.6241 0.9695 -0.1128 -0.0322 0.0326 269 TRP A C
55301925 O O . TRP A 245 ? 0.6518 0.5714 0.9030 -0.1170 -0.0487 0.0283 269 TRP A O
55311926 C CB . TRP A 245 ? 0.5465 0.5423 0.9579 -0.1250 -0.0258 0.0555 269 TRP A CB
55321927 C CG . TRP A 245 ? 0.5410 0.5425 0.9633 -0.1393 -0.0612 0.0617 269 TRP A CG
55331928 C CD1 . TRP A 245 ? 0.5334 0.5091 0.9194 -0.1527 -0.0780 0.0572 269 TRP A CD1
55341929 C CD2 . TRP A 245 ? 0.5706 0.6032 1.0413 -0.1437 -0.0845 0.0743 269 TRP A CD2
55351930 N NE1 . TRP A 245 ? 0.7062 0.6929 1.1098 -0.1676 -0.1100 0.0636 269 TRP A NE1
55361931 C CE2 . TRP A 245 ? 0.5802 0.6042 1.0359 -0.1628 -0.1165 0.0756 269 TRP A CE2
55371932 C CE3 . TRP A 245 ? 0.5020 0.5670 1.0266 -0.1338 -0.0817 0.0856 269 TRP A CE3
55381933 C CZ2 . TRP A 245 ? 0.6376 0.6867 1.1266 -0.1749 -0.1483 0.0884 269 TRP A CZ2
55391934 C CZ3 . TRP A 245 ? 0.5962 0.6882 1.1600 -0.1428 -0.1132 0.1009 269 TRP A CZ3
55401935 C CH2 . TRP A 245 ? 0.5528 0.6380 1.0969 -0.1644 -0.1477 0.1025 269 TRP A CH2
55411936 N N . CYS A 246 ? 0.6356 0.5865 0.9172 -0.0997 -0.0269 0.0278 270 CYS A N
55421937 C CA . CYS A 246 ? 0.7005 0.6376 0.9312 -0.0900 -0.0393 0.0179 270 CYS A CA
55431938 C C . CYS A 246 ? 0.6038 0.5144 0.7825 -0.0878 -0.0328 0.0121 270 CYS A C
55441939 O O . CYS A 246 ? 0.6329 0.5285 0.7742 -0.0826 -0.0471 0.0066 270 CYS A O
55451940 C CB . CYS A 246 ? 0.4338 0.3831 0.6674 -0.0785 -0.0290 0.0144 270 CYS A CB
55461941 S SG . CYS A 246 ? 0.7837 0.7618 1.0735 -0.0766 -0.0414 0.0239 270 CYS A SG
55471942 N N . LEU A 247 ? 0.7479 0.6522 0.9242 -0.0915 -0.0103 0.0145 271 LEU A N
55481943 C CA . LEU A 247 ? 0.6528 0.5336 0.7821 -0.0904 -0.0047 0.0135 271 LEU A CA
55491944 C C . LEU A 247 ? 0.5786 0.4403 0.7065 -0.1004 -0.0092 0.0194 271 LEU A C
55501945 O O . LEU A 247 ? 0.7206 0.5633 0.8194 -0.1019 0.0002 0.0232 271 LEU A O
55511946 C CB . LEU A 247 ? 0.5857 0.4664 0.7015 -0.0914 0.0218 0.0131 271 LEU A CB
55521947 C CG . LEU A 247 ? 0.5833 0.4746 0.6880 -0.0832 0.0266 0.0053 271 LEU A CG
55531948 C CD1 . LEU A 247 ? 0.5543 0.4377 0.6307 -0.0881 0.0515 0.0028 271 LEU A CD1
55541949 C CD2 . LEU A 247 ? 0.5494 0.4390 0.6241 -0.0732 0.0047 0.0014 271 LEU A CD2
55551950 N N . ALA A 248 ? 0.6499 0.5153 0.8075 -0.1091 -0.0242 0.0216 272 ALA A N
55561951 C CA . ALA A 248 ? 0.6989 0.5417 0.8524 -0.1210 -0.0300 0.0257 272 ALA A CA
55571952 C C . ALA A 248 ? 0.6854 0.4955 0.7877 -0.1127 -0.0375 0.0218 272 ALA A C
55581953 O O . ALA A 248 ? 0.7537 0.5617 0.8334 -0.1007 -0.0486 0.0146 272 ALA A O
55591954 C CB . ALA A 248 ? 0.5524 0.4036 0.7389 -0.1341 -0.0505 0.0271 272 ALA A CB
55601955 N N . LEU A 249 ? 0.7464 0.5311 0.8330 -0.1184 -0.0296 0.0282 273 LEU A N
55611956 C CA . LEU A 249 ? 0.7334 0.4862 0.7775 -0.1081 -0.0340 0.0282 273 LEU A CA
55621957 C C . LEU A 249 ? 0.7731 0.5048 0.8064 -0.1073 -0.0522 0.0192 273 LEU A C
55631958 O O . LEU A 249 ? 0.8485 0.5668 0.8535 -0.0921 -0.0569 0.0144 273 LEU A O
55641959 C CB . LEU A 249 ? 0.8243 0.5519 0.8572 -0.1160 -0.0222 0.0397 273 LEU A CB
55651960 C CG . LEU A 249 ? 0.8993 0.6375 0.9205 -0.1147 -0.0036 0.0484 273 LEU A CG
55661961 C CD1 . LEU A 249 ? 0.7480 0.4561 0.7488 -0.1214 0.0052 0.0621 273 LEU A CD1
55671962 C CD2 . LEU A 249 ? 0.6408 0.3910 0.6361 -0.0978 -0.0067 0.0455 273 LEU A CD2
55681963 N N . ARG A 250 ? 0.7796 0.5081 0.8347 -0.1250 -0.0620 0.0171 274 ARG A N
55691964 C CA . ARG A 250 ? 0.8416 0.5462 0.8799 -0.1295 -0.0793 0.0066 274 ARG A CA
55701965 C C . ARG A 250 ? 0.8351 0.5675 0.8810 -0.1259 -0.0923 -0.0009 274 ARG A C
55711966 O O . ARG A 250 ? 0.9230 0.6903 1.0071 -0.1341 -0.0957 0.0040 274 ARG A O
55721967 C CB . ARG A 250 ? 0.8264 0.5145 0.8805 -0.1548 -0.0870 0.0083 274 ARG A CB
55731968 C CG . ARG A 250 ? 1.0579 0.7008 1.0904 -0.1591 -0.0781 0.0121 274 ARG A CG
55741969 C CD . ARG A 250 ? 1.2171 0.8246 1.2406 -0.1814 -0.0917 0.0048 274 ARG A CD
55751970 N NE . ARG A 250 ? 1.1456 0.7741 1.2112 -0.2080 -0.0971 0.0130 274 ARG A NE
55761971 C CZ . ARG A 250 ? 1.3032 0.9184 1.3734 -0.2344 -0.1147 0.0085 274 ARG A CZ
55771972 N NH1 . ARG A 250 ? 1.4341 1.0096 1.4627 -0.2392 -0.1273 -0.0066 274 ARG A NH1
55781973 N NH2 . ARG A 250 ? 1.3764 1.0188 1.4938 -0.2579 -0.1192 0.0195 274 ARG A NH2
55791974 N N . PRO A 251 ? 0.8546 0.5732 0.8679 -0.1132 -0.0982 -0.0110 275 PRO A N
55801975 C CA . PRO A 251 ? 0.8413 0.5846 0.8588 -0.1117 -0.1108 -0.0168 275 PRO A CA
55811976 C C . PRO A 251 ? 0.7405 0.4913 0.7777 -0.1348 -0.1302 -0.0168 275 PRO A C
55821977 O O . PRO A 251 ? 0.6789 0.4637 0.7411 -0.1370 -0.1399 -0.0130 275 PRO A O
55831978 C CB . PRO A 251 ? 0.7396 0.4563 0.7136 -0.0973 -0.1108 -0.0281 275 PRO A CB
55841979 C CG . PRO A 251 ? 0.6544 0.3505 0.6138 -0.0826 -0.0948 -0.0236 275 PRO A CG
55851980 C CD . PRO A 251 ? 0.6726 0.3551 0.6474 -0.0978 -0.0911 -0.0155 275 PRO A CD
55861981 N N . SER A 252 ? 0.7694 0.4887 0.7965 -0.1534 -0.1374 -0.0195 276 SER A N
55871982 C CA . SER A 252 ? 0.7207 0.4481 0.7653 -0.1799 -0.1598 -0.0179 276 SER A CA
55881983 C C . SER A 252 ? 0.7889 0.5635 0.8973 -0.1885 -0.1607 -0.0014 276 SER A C
55891984 O O . SER A 252 ? 0.8677 0.6722 1.0059 -0.2013 -0.1798 0.0054 276 SER A O
55901985 C CB . SER A 252 ? 0.9991 0.6793 1.0179 -0.2008 -0.1654 -0.0247 276 SER A CB
55911986 O OG . SER A 252 ? 0.9439 0.6145 0.9801 -0.2022 -0.1496 -0.0164 276 SER A OG
55921987 N N . ASP A 253 ? 0.6903 0.4724 0.8213 -0.1814 -0.1392 0.0065 277 ASP A N
55931988 C CA . ASP A 253 ? 0.7207 0.5454 0.9133 -0.1869 -0.1325 0.0212 277 ASP A CA
55941989 C C . ASP A 253 ? 0.6280 0.4898 0.8432 -0.1692 -0.1262 0.0244 277 ASP A C
55951990 O O . ASP A 253 ? 0.6856 0.5833 0.9560 -0.1715 -0.1194 0.0363 277 ASP A O
55961991 C CB . ASP A 253 ? 0.7098 0.5250 0.9109 -0.1868 -0.1081 0.0274 277 ASP A CB
55971992 C CG . ASP A 253 ? 0.9299 0.7124 1.1222 -0.2084 -0.1138 0.0280 277 ASP A CG
55981993 O OD1 . ASP A 253 ? 1.0884 0.8651 1.2825 -0.2287 -0.1373 0.0258 277 ASP A OD1
55991994 O OD2 . ASP A 253 ? 0.8911 0.6514 1.0713 -0.2069 -0.0954 0.0312 277 ASP A OD2
56001995 N N . ARG A 254 ? 0.6439 0.4970 0.8207 -0.1519 -0.1268 0.0146 278 ARG A N
56011996 C CA . ARG A 254 ? 0.6881 0.5704 0.8802 -0.1361 -0.1205 0.0164 278 ARG A CA
56021997 C C . ARG A 254 ? 0.7437 0.6524 0.9644 -0.1440 -0.1432 0.0227 278 ARG A C
56031998 O O . ARG A 254 ? 0.6660 0.5627 0.8695 -0.1589 -0.1670 0.0204 278 ARG A O
56041999 C CB . ARG A 254 ? 0.6003 0.4651 0.7423 -0.1173 -0.1145 0.0052 278 ARG A CB
56052000 C CG . ARG A 254 ? 0.7426 0.6063 0.8762 -0.1042 -0.0898 0.0055 278 ARG A CG
56062001 C CD . ARG A 254 ? 0.7432 0.5902 0.8298 -0.0882 -0.0874 -0.0028 278 ARG A CD
56072002 N NE . ARG A 254 ? 0.5783 0.3996 0.6400 -0.0853 -0.0770 -0.0016 278 ARG A NE
56082003 C CZ . ARG A 254 ? 0.6645 0.4661 0.6899 -0.0728 -0.0766 -0.0055 278 ARG A CZ
56092004 N NH1 . ARG A 254 ? 0.5880 0.3929 0.5961 -0.0624 -0.0838 -0.0126 278 ARG A NH1
56102005 N NH2 . ARG A 254 ? 0.6417 0.4205 0.6505 -0.0704 -0.0682 -0.0003 278 ARG A NH2
56112006 N N . PRO A 255 ? 0.6744 0.6166 0.9367 -0.1353 -0.1362 0.0314 279 PRO A N
56122007 C CA . PRO A 255 ? 0.6958 0.6661 0.9930 -0.1421 -0.1586 0.0426 279 PRO A CA
56132008 C C . PRO A 255 ? 0.7468 0.7079 1.0006 -0.1360 -0.1741 0.0350 279 PRO A C
56142009 O O . PRO A 255 ? 0.7037 0.6488 0.9171 -0.1205 -0.1612 0.0232 279 PRO A O
56152010 C CB . PRO A 255 ? 0.6580 0.6611 1.0142 -0.1304 -0.1384 0.0540 279 PRO A CB
56162011 C CG . PRO A 255 ? 0.6530 0.6386 0.9772 -0.1142 -0.1088 0.0419 279 PRO A CG
56172012 C CD . PRO A 255 ? 0.7180 0.6712 0.9971 -0.1202 -0.1066 0.0323 279 PRO A CD
56182013 N N . THR A 256 ? 0.7326 0.7057 0.9957 -0.1503 -0.2030 0.0436 280 THR A N
56192014 C CA . THR A 256 ? 0.7908 0.7616 1.0212 -0.1458 -0.2171 0.0406 280 THR A CA
56202015 C C . THR A 256 ? 0.6857 0.6852 0.9549 -0.1286 -0.2062 0.0509 280 THR A C
56212016 O O . THR A 256 ? 0.6131 0.6346 0.9374 -0.1220 -0.1893 0.0606 280 THR A O
56222017 C CB . THR A 256 ? 0.6694 0.6431 0.8933 -0.1696 -0.2529 0.0486 280 THR A CB
56232018 O OG1 . THR A 256 ? 0.7208 0.7352 1.0177 -0.1787 -0.2663 0.0723 280 THR A OG1
56242019 C CG2 . THR A 256 ? 0.5765 0.5150 0.7578 -0.1893 -0.2621 0.0361 280 THR A CG2
56252020 N N . PHE A 257 ? 0.6782 0.6746 0.9170 -0.1219 -0.2135 0.0481 281 PHE A N
56262021 C CA . PHE A 257 ? 0.6056 0.6246 0.8787 -0.1074 -0.2049 0.0583 281 PHE A CA
56272022 C C . PHE A 257 ? 0.5460 0.5994 0.8880 -0.1147 -0.2214 0.0833 281 PHE A C
56282023 O O . PHE A 257 ? 0.5881 0.6621 0.9841 -0.1019 -0.2047 0.0942 281 PHE A O
56292024 C CB . PHE A 257 ? 0.5878 0.5955 0.8130 -0.1013 -0.2106 0.0516 281 PHE A CB
56302025 C CG . PHE A 257 ? 0.7004 0.6799 0.8662 -0.0930 -0.1950 0.0302 281 PHE A CG
56312026 C CD1 . PHE A 257 ? 0.8742 0.8495 1.0422 -0.0799 -0.1678 0.0217 281 PHE A CD1
56322027 C CD2 . PHE A 257 ? 1.0247 0.9824 1.1331 -0.0988 -0.2069 0.0197 281 PHE A CD2
56332028 C CE1 . PHE A 257 ? 0.8359 0.7903 0.9560 -0.0721 -0.1561 0.0063 281 PHE A CE1
56342029 C CE2 . PHE A 257 ? 0.9879 0.9231 1.0509 -0.0887 -0.1908 0.0027 281 PHE A CE2
56352030 C CZ . PHE A 257 ? 0.8091 0.7451 0.8811 -0.0750 -0.1671 -0.0024 281 PHE A CZ
56362031 N N . GLU A 258 ? 0.7161 0.7757 1.0582 -0.1359 -0.2540 0.0934 282 GLU A N
56372032 C CA . GLU A 258 ? 0.7074 0.8055 1.1238 -0.1446 -0.2724 0.1210 282 GLU A CA
56382033 C C . GLU A 258 ? 0.6795 0.7953 1.1591 -0.1417 -0.2511 0.1269 282 GLU A C
56392034 O O . GLU A 258 ? 0.5800 0.7273 1.1339 -0.1318 -0.2412 0.1459 282 GLU A O
56402035 C CB . GLU A 258 ? 0.6919 0.7925 1.0904 -0.1733 -0.3143 0.1304 282 GLU A CB
56412036 C CG . GLU A 258 ? 0.9351 1.0741 1.4090 -0.1842 -0.3292 0.1578 282 GLU A CG
56422037 C CD . GLU A 258 ? 1.2106 1.3374 1.6478 -0.2104 -0.3529 0.1580 282 GLU A CD
56432038 O OE1 . GLU A 258 ? 1.2524 1.3630 1.6321 -0.2227 -0.3750 0.1574 282 GLU A OE1
56442039 O OE2 . GLU A 258 ? 1.1036 1.2361 1.5690 -0.2198 -0.3477 0.1586 282 GLU A OE2
56452040 N N . GLU A 259 ? 0.6592 0.7531 1.1108 -0.1498 -0.2413 0.1112 283 GLU A N
56462041 C CA . GLU A 259 ? 0.6205 0.7286 1.1262 -0.1497 -0.2197 0.1164 283 GLU A CA
56472042 C C . GLU A 259 ? 0.5330 0.6410 1.0576 -0.1255 -0.1785 0.1106 283 GLU A C
56482043 O O . GLU A 259 ? 0.5984 0.7287 1.1876 -0.1212 -0.1579 0.1218 283 GLU A O
56492044 C CB . GLU A 259 ? 0.6001 0.6793 1.0643 -0.1649 -0.2192 0.1014 283 GLU A CB
56502045 C CG . GLU A 259 ? 0.5466 0.6376 1.0315 -0.1940 -0.2512 0.1138 283 GLU A CG
56512046 C CD . GLU A 259 ? 0.8336 0.8831 1.2575 -0.2105 -0.2550 0.0954 283 GLU A CD
56522047 O OE1 . GLU A 259 ? 0.8865 0.9378 1.3159 -0.2381 -0.2816 0.1020 283 GLU A OE1
56532048 O OE2 . GLU A 259 ? 0.5401 0.5548 0.9118 -0.1966 -0.2321 0.0754 283 GLU A OE2
56542049 N N . ILE A 260 ? 0.5543 0.6369 1.0229 -0.1111 -0.1649 0.0932 284 ILE A N
56552050 C CA . ILE A 260 ? 0.4964 0.5774 0.9778 -0.0915 -0.1290 0.0878 284 ILE A CA
56562051 C C . ILE A 260 ? 0.6099 0.7188 1.1553 -0.0814 -0.1270 0.1066 284 ILE A C
56572052 O O . ILE A 260 ? 0.6408 0.7624 1.2404 -0.0719 -0.0986 0.1131 284 ILE A O
56582053 C CB . ILE A 260 ? 0.5941 0.6451 1.0027 -0.0816 -0.1195 0.0670 284 ILE A CB
56592054 C CG1 . ILE A 260 ? 0.5254 0.5498 0.8838 -0.0861 -0.1111 0.0509 284 ILE A CG1
56602055 C CG2 . ILE A 260 ? 0.4315 0.4823 0.8522 -0.0652 -0.0900 0.0636 284 ILE A CG2
56612056 C CD1 . ILE A 260 ? 0.4715 0.4713 0.7624 -0.0778 -0.1082 0.0342 284 ILE A CD1
56622057 N N . GLN A 261 ? 0.5563 0.6730 1.0959 -0.0831 -0.1555 0.1165 285 GLN A N
56632058 C CA . GLN A 261 ? 0.4746 0.6131 1.0693 -0.0714 -0.1545 0.1357 285 GLN A CA
56642059 C C . GLN A 261 ? 0.4958 0.6741 1.1817 -0.0760 -0.1641 0.1641 285 GLN A C
56652060 O O . GLN A 261 ? 0.5153 0.7132 1.2652 -0.0619 -0.1527 0.1818 285 GLN A O
56662061 C CB . GLN A 261 ? 0.5783 0.7114 1.1330 -0.0737 -0.1835 0.1392 285 GLN A CB
56672062 C CG . GLN A 261 ? 0.4280 0.5310 0.9184 -0.0626 -0.1661 0.1174 285 GLN A CG
56682063 C CD . GLN A 261 ? 0.6310 0.7285 1.0808 -0.0662 -0.1922 0.1210 285 GLN A CD
56692064 O OE1 . GLN A 261 ? 0.6363 0.7348 1.0595 -0.0824 -0.2238 0.1252 285 GLN A OE1
56702065 N NE2 . GLN A 261 ? 0.6496 0.7384 1.0904 -0.0531 -0.1780 0.1186 285 GLN A NE2
56712066 N N . ASN A 262 ? 0.5542 0.7446 1.2504 -0.0954 -0.1840 0.1696 286 ASN A N
56722067 C CA . ASN A 262 ? 0.5129 0.7463 1.2991 -0.1034 -0.1963 0.1983 286 ASN A CA
56732068 C C . ASN A 262 ? 0.4277 0.6692 1.2614 -0.1002 -0.1605 0.1961 286 ASN A C
56742069 O O . ASN A 262 ? 0.5366 0.8071 1.4291 -0.1086 -0.1676 0.2157 286 ASN A O
56752070 C CB . ASN A 262 ? 0.4337 0.6725 1.1944 -0.1302 -0.2414 0.2066 286 ASN A CB
56762071 C CG . ASN A 262 ? 0.7356 0.9815 1.4859 -0.1316 -0.2727 0.2262 286 ASN A CG
56772072 O OD1 . ASN A 262 ? 0.9368 1.2008 1.7394 -0.1153 -0.2651 0.2466 286 ASN A OD1
56782073 N ND2 . ASN A 262 ? 0.8416 1.0687 1.5206 -0.1518 -0.3053 0.2197 286 ASN A ND2
56792074 N N . HIS A 263 ? 0.5221 0.7325 1.3169 -0.0877 -0.1205 0.1718 287 HIS A N
56802075 C CA . HIS A 263 ? 0.5804 0.7854 1.3931 -0.0852 -0.0809 0.1630 287 HIS A CA
56812076 C C . HIS A 263 ? 0.5018 0.7247 1.3913 -0.0656 -0.0428 0.1744 287 HIS A C
56822077 O O . HIS A 263 ? 0.5954 0.8136 1.4901 -0.0492 -0.0356 0.1761 287 HIS A O
56832078 C CB . HIS A 263 ? 0.4789 0.6385 1.2011 -0.0827 -0.0606 0.1322 287 HIS A CB
56842079 C CG . HIS A 263 ? 0.5242 0.6735 1.2504 -0.0835 -0.0224 0.1230 287 HIS A CG
56852080 N ND1 . HIS A 263 ? 0.6314 0.7790 1.3881 -0.0692 0.0220 0.1204 287 HIS A ND1
56862081 C CD2 . HIS A 263 ? 0.5423 0.6796 1.2429 -0.0981 -0.0209 0.1162 287 HIS A CD2
56872082 C CE1 . HIS A 263 ? 0.6072 0.7433 1.3539 -0.0759 0.0489 0.1123 287 HIS A CE1
56882083 N NE2 . HIS A 263 ? 0.6322 0.7628 1.3469 -0.0930 0.0229 0.1108 287 HIS A NE2
56892084 N N . PRO A 264 ? 0.6521 0.8937 1.6026 -0.0672 -0.0160 0.1824 288 PRO A N
56902085 C CA . PRO A 264 ? 0.5991 0.8593 1.6329 -0.0478 0.0230 0.1954 288 PRO A CA
56912086 C C . PRO A 264 ? 0.6536 0.8756 1.6467 -0.0288 0.0635 0.1739 288 PRO A C
56922087 O O . PRO A 264 ? 0.7098 0.9393 1.7562 -0.0104 0.0818 0.1848 288 PRO A O
56932088 C CB . PRO A 264 ? 0.4578 0.7267 1.5240 -0.0545 0.0487 0.1980 288 PRO A CB
56942089 C CG . PRO A 264 ? 0.5464 0.8255 1.5898 -0.0794 0.0058 0.2028 288 PRO A CG
56952090 C CD . PRO A 264 ? 0.6080 0.8592 1.5660 -0.0880 -0.0232 0.1848 288 PRO A CD
56962091 N N . TRP A 265 ? 0.7059 0.8862 1.6070 -0.0335 0.0777 0.1447 289 TRP A N
56972092 C CA . TRP A 265 ? 0.5631 0.7066 1.4193 -0.0201 0.1123 0.1239 289 TRP A CA
56982093 C C . TRP A 265 ? 0.6027 0.7385 1.4353 -0.0113 0.0889 0.1246 289 TRP A C
56992094 O O . TRP A 265 ? 0.6071 0.7201 1.4299 0.0016 0.1167 0.1149 289 TRP A O
57002095 C CB . TRP A 265 ? 0.5458 0.6509 1.3088 -0.0298 0.1266 0.0963 289 TRP A CB
57012096 C CG . TRP A 265 ? 0.4799 0.5488 1.1974 -0.0207 0.1621 0.0756 289 TRP A CG
57022097 C CD1 . TRP A 265 ? 0.7265 0.7798 1.4628 -0.0143 0.2136 0.0678 289 TRP A CD1
57032098 C CD2 . TRP A 265 ? 0.6848 0.7273 1.3304 -0.0190 0.1498 0.0600 289 TRP A CD2
57042099 N NE1 . TRP A 265 ? 0.6735 0.6893 1.3487 -0.0109 0.2325 0.0471 289 TRP A NE1
57052100 C CE2 . TRP A 265 ? 0.7949 0.8062 1.4169 -0.0137 0.1929 0.0430 289 TRP A CE2
57062101 C CE3 . TRP A 265 ? 0.5724 0.6140 1.1708 -0.0226 0.1082 0.0583 289 TRP A CE3
57072102 C CZ2 . TRP A 265 ? 0.8103 0.7926 1.3655 -0.0135 0.1922 0.0258 289 TRP A CZ2
57082103 C CZ3 . TRP A 265 ? 0.6299 0.6453 1.1667 -0.0200 0.1101 0.0421 289 TRP A CZ3
57092104 C CH2 . TRP A 265 ? 0.7416 0.7291 1.2583 -0.0164 0.1501 0.0267 289 TRP A CH2
57102105 N N . MET A 266 ? 0.6334 0.7847 1.4532 -0.0199 0.0400 0.1352 290 MET A N
57112106 C CA . MET A 266 ? 0.5371 0.6812 1.3290 -0.0141 0.0159 0.1368 290 MET A CA
57122107 C C . MET A 266 ? 0.6640 0.8376 1.5398 -0.0025 0.0068 0.1661 290 MET A C
57132108 O O . MET A 266 ? 0.7600 0.9331 1.6202 -0.0001 -0.0198 0.1739 290 MET A O
57142109 C CB . MET A 266 ? 0.5210 0.6632 1.2523 -0.0298 -0.0295 0.1332 290 MET A CB
57152110 C CG . MET A 266 ? 0.5311 0.6377 1.1704 -0.0346 -0.0224 0.1048 290 MET A CG
57162111 S SD . MET A 266 ? 0.6573 0.7364 1.2548 -0.0208 -0.0038 0.0904 290 MET A SD
57172112 C CE . MET A 266 ? 0.5233 0.5975 1.0562 -0.0290 -0.0481 0.0874 290 MET A CE
57182113 N N . GLN A 267 ? 0.6260 0.8262 1.5921 0.0048 0.0284 0.1844 291 GLN A N
57192114 C CA . GLN A 267 ? 0.8231 1.0564 1.8820 0.0175 0.0198 0.2174 291 GLN A CA
57202115 C C . GLN A 267 ? 0.7772 0.9859 1.8567 0.0405 0.0630 0.2126 291 GLN A C
57212116 O O . GLN A 267 ? 0.8293 1.0035 1.8757 0.0453 0.1087 0.1867 291 GLN A O
57222117 C CB . GLN A 267 ? 0.6963 0.9554 1.8164 0.0135 0.0209 0.2383 291 GLN A CB
57232118 C CG . GLN A 267 ? 0.8057 1.0921 1.9271 -0.0043 -0.0351 0.2611 291 GLN A CG
57242119 C CD . GLN A 267 ? 0.9429 1.2547 2.1281 -0.0067 -0.0340 0.2847 291 GLN A CD
57252120 O OE1 . GLN A 267 ? 0.9142 1.2488 2.1096 -0.0206 -0.0757 0.3068 291 GLN A OE1
57262121 N NE2 . GLN A 267 ? 0.9187 1.2253 2.1441 0.0055 0.0146 0.2796 291 GLN A NE2
57272122 N N . ASP A 268 ? 0.6551 0.8673 1.7634 0.0503 0.0470 0.2356 292 ASP A N
57282123 C CA . ASP A 268 ? 0.7396 0.9226 1.8646 0.0699 0.0848 0.2337 292 ASP A CA
57292124 C C . ASP A 268 ? 0.7145 0.8577 1.7679 0.0733 0.1045 0.2012 292 ASP A C
57302125 O O . ASP A 268 ? 0.5479 0.6553 1.5927 0.0836 0.1537 0.1821 292 ASP A O
57312126 C CB . ASP A 268 ? 0.7211 0.8949 1.8967 0.0797 0.1349 0.2349 292 ASP A CB
57322127 C CG . ASP A 268 ? 0.8781 1.0886 2.1100 0.0726 0.1170 0.2611 292 ASP A CG
57332128 O OD1 . ASP A 268 ? 0.7694 1.0061 2.0310 0.0688 0.0766 0.2914 292 ASP A OD1
57342129 O OD2 . ASP A 268 ? 0.8103 1.0226 2.0527 0.0692 0.1426 0.2517 292 ASP A OD2
57352130 N N . VAL A 269 ? 0.7600 0.8962 1.7327 0.0582 0.0650 0.1912 293 VAL A N
57362131 C CA . VAL A 269 ? 0.6943 0.7865 1.5761 0.0555 0.0743 0.1627 293 VAL A CA
57372132 C C . VAL A 269 ? 0.7247 0.8010 1.6299 0.0706 0.0826 0.1738 293 VAL A C
57382133 O O . VAL A 269 ? 0.7262 0.8271 1.6759 0.0753 0.0511 0.2040 293 VAL A O
57392134 C CB . VAL A 269 ? 0.6953 0.7887 1.4967 0.0376 0.0306 0.1533 293 VAL A CB
57402135 C CG1 . VAL A 269 ? 0.7718 0.9023 1.6076 0.0319 -0.0189 0.1836 293 VAL A CG1
57412136 C CG2 . VAL A 269 ? 0.5644 0.6229 1.2905 0.0367 0.0327 0.1339 293 VAL A CG2
57422137 N N . LEU A 270 ? 0.7591 0.7921 1.6328 0.0766 0.1246 0.1504 294 LEU A N
57432138 C CA . LEU A 270 ? 0.7625 0.7724 1.6483 0.0889 0.1340 0.1577 294 LEU A CA
57442139 C C . LEU A 270 ? 0.7068 0.7112 1.5240 0.0778 0.0942 0.1558 294 LEU A C
57452140 O O . LEU A 270 ? 0.7564 0.7585 1.4983 0.0618 0.0757 0.1364 294 LEU A O
57462141 C CB . LEU A 270 ? 0.8089 0.7676 1.6685 0.0938 0.1896 0.1297 294 LEU A CB
57472142 C CG . LEU A 270 ? 0.7518 0.6971 1.6277 0.0960 0.2390 0.1126 294 LEU A CG
57482143 C CD1 . LEU A 270 ? 0.8936 0.7810 1.6958 0.0892 0.2786 0.0773 294 LEU A CD1
57492144 C CD2 . LEU A 270 ? 0.6398 0.6018 1.6188 0.1138 0.2642 0.1377 294 LEU A CD2
57502145 N N . LEU A 271 ? 0.7941 0.7957 1.6398 0.0874 0.0833 0.1772 295 LEU A N
57512146 C CA . LEU A 271 ? 0.8116 0.8000 1.5910 0.0778 0.0561 0.1734 295 LEU A CA
57522147 C C . LEU A 271 ? 0.7120 0.6543 1.4174 0.0710 0.0874 0.1374 295 LEU A C
57532148 O O . LEU A 271 ? 0.7789 0.6937 1.4919 0.0761 0.1319 0.1198 295 LEU A O
57542149 C CB . LEU A 271 ? 0.9327 0.9255 1.7626 0.0895 0.0409 0.2069 295 LEU A CB
57552150 C CG . LEU A 271 ? 0.8659 0.9080 1.7547 0.0900 -0.0033 0.2460 295 LEU A CG
57562151 C CD1 . LEU A 271 ? 0.8672 0.9113 1.7864 0.0970 -0.0231 0.2789 295 LEU A CD1
57572152 C CD2 . LEU A 271 ? 0.6995 0.7644 1.5276 0.0687 -0.0449 0.2388 295 LEU A CD2
57582153 N N . PRO A 272 ? 0.7919 0.7257 1.4231 0.0576 0.0650 0.1257 296 PRO A N
57592154 C CA . PRO A 272 ? 0.7237 0.6191 1.2852 0.0479 0.0899 0.0936 296 PRO A CA
57602155 C C . PRO A 272 ? 0.7780 0.6319 1.3561 0.0560 0.1271 0.0896 296 PRO A C
57612156 O O . PRO A 272 ? 0.8627 0.6817 1.4006 0.0486 0.1606 0.0615 296 PRO A O
57622157 C CB . PRO A 272 ? 0.7380 0.6416 1.2366 0.0348 0.0540 0.0916 296 PRO A CB
57632158 C CG . PRO A 272 ? 0.6594 0.6026 1.1715 0.0327 0.0167 0.1080 296 PRO A CG
57642159 C CD . PRO A 272 ? 0.7930 0.7553 1.3932 0.0469 0.0169 0.1366 296 PRO A CD
57652160 N N . GLN A 273 ? 0.8115 0.6654 1.4448 0.0695 0.1220 0.1172 297 GLN A N
57662161 C CA . GLN A 273 ? 0.9299 0.7388 1.5822 0.0784 0.1599 0.1143 297 GLN A CA
57672162 C C . GLN A 273 ? 0.9816 0.7719 1.6809 0.0906 0.2084 0.1050 297 GLN A C
57682163 O O . GLN A 273 ? 0.7912 0.5333 1.4605 0.0866 0.2508 0.0785 297 GLN A O
57692164 C CB . GLN A 273 ? 1.0499 0.8649 1.7563 0.0918 0.1411 0.1510 297 GLN A CB
57702165 C CG . GLN A 273 ? 1.1660 1.0345 1.9358 0.1007 0.1028 0.1880 297 GLN A CG
57712166 C CD . GLN A 273 ? 1.0958 0.9971 1.8120 0.0836 0.0516 0.1923 297 GLN A CD
57722167 O OE1 . GLN A 273 ? 0.8171 0.7304 1.4840 0.0706 0.0437 0.1702 297 GLN A OE1
57732168 N NE2 . GLN A 273 ? 1.0831 0.9965 1.8082 0.0837 0.0182 0.2215 297 GLN A NE2
57742169 N N . GLU A 274 ? 0.8663 0.6939 1.6386 0.1038 0.2036 0.1266 298 GLU A N
57752170 C CA . GLU A 274 ? 0.9487 0.7674 1.7648 0.1134 0.2498 0.1183 298 GLU A CA
57762171 C C . GLU A 274 ? 0.9990 0.7914 1.7450 0.0978 0.2763 0.0789 298 GLU A C
57772172 O O . GLU A 274 ? 1.0005 0.7564 1.7375 0.0974 0.3253 0.0578 298 GLU A O
57782173 C CB . GLU A 274 ? 0.8939 0.7696 1.7888 0.1222 0.2318 0.1480 298 GLU A CB
57792174 C CG . GLU A 274 ? 0.8859 0.8008 1.8320 0.1282 0.1890 0.1888 298 GLU A CG
57802175 C CD . GLU A 274 ? 0.8574 0.8244 1.8794 0.1317 0.1751 0.2172 298 GLU A CD
57812176 O OE1 . GLU A 274 ? 0.9708 0.9684 1.9898 0.1242 0.1490 0.2184 298 GLU A OE1
57822177 O OE2 . GLU A 274 ? 0.9257 0.9017 2.0101 0.1405 0.1902 0.2387 298 GLU A OE2
57832178 N N . THR A 275 ? 0.8629 0.6791 1.5469 0.0798 0.2418 0.0685 299 THR A N
57842179 C CA . THR A 275 ? 0.8972 0.6949 1.5118 0.0628 0.2615 0.0351 299 THR A CA
57852180 C C . THR A 275 ? 0.9975 0.7441 1.5378 0.0486 0.2829 0.0068 299 THR A C
57862181 O O . THR A 275 ? 1.0059 0.7199 1.5033 0.0375 0.3181 -0.0205 299 THR A O
57872182 C CB . THR A 275 ? 0.8297 0.6655 1.4037 0.0496 0.2193 0.0344 299 THR A CB
57882183 O OG1 . THR A 275 ? 1.0182 0.8449 1.5537 0.0384 0.2411 0.0114 299 THR A OG1
57892184 C CG2 . THR A 275 ? 0.9059 0.7396 1.4094 0.0356 0.1869 0.0268 299 THR A CG2
57902185 N N . ALA A 276 ? 1.0018 0.7394 1.5259 0.0468 0.2633 0.0137 300 ALA A N
57912186 C CA . ALA A 276 ? 1.0269 0.7152 1.4873 0.0318 0.2841 -0.0112 300 ALA A CA
57922187 C C . ALA A 276 ? 1.2071 0.8434 1.6957 0.0405 0.3396 -0.0210 300 ALA A C
57932188 O O . ALA A 276 ? 1.1986 0.7887 1.6282 0.0239 0.3721 -0.0516 300 ALA A O
57942189 C CB . ALA A 276 ? 0.7657 0.4578 1.2089 0.0280 0.2516 0.0011 300 ALA A CB
57952190 N N . GLU A 277 ? 1.1808 0.8281 1.7557 0.0646 0.3495 0.0053 301 GLU A N
57962191 C CA . GLU A 277 ? 1.1430 0.7643 1.7356 0.0693 0.3964 -0.0010 301 GLU A CA
57972192 C C . GLU A 277 ? 1.1758 0.7911 1.7613 0.0645 0.4344 -0.0197 301 GLU A C
57982193 O O . GLU A 277 ? 1.0273 0.6008 1.5684 0.0520 0.4749 -0.0444 301 GLU A O
57992194 C CB . GLU A 277 ? 1.1159 0.7632 1.7999 0.0927 0.3926 0.0355 301 GLU A CB
58002195 C CG . GLU A 277 ? 1.2246 0.8750 1.9150 0.0969 0.3580 0.0566 301 GLU A CG
58012196 C CD . GLU A 277 ? 1.2268 0.9251 2.0071 0.1172 0.3320 0.0999 301 GLU A CD
58022197 O OE1 . GLU A 277 ? 1.2154 0.9172 2.0063 0.1213 0.3056 0.1214 301 GLU A OE1
58032198 O OE2 . GLU A 277 ? 1.3110 1.0438 2.1496 0.1265 0.3372 0.1133 301 GLU A OE2
58042199 N N . ILE A 278 ? 1.0821 0.7374 1.7081 0.0722 0.4216 -0.0075 302 ILE A N
58052200 C CA . ILE A 278 ? 1.1344 0.7860 1.7621 0.0683 0.4588 -0.0207 302 ILE A CA
58062201 C C . ILE A 278 ? 1.0791 0.6997 1.6088 0.0434 0.4688 -0.0569 302 ILE A C
58072202 O O . ILE A 278 ? 1.1540 0.7494 1.6539 0.0323 0.5087 -0.0758 302 ILE A O
58082203 C CB . ILE A 278 ? 0.9792 0.6858 1.6870 0.0833 0.4417 0.0065 302 ILE A CB
58092204 C CG1 . ILE A 278 ? 0.9355 0.6715 1.7387 0.1035 0.4358 0.0434 302 ILE A CG1
58102205 C CG2 . ILE A 278 ? 0.8093 0.5116 1.5125 0.0766 0.4775 -0.0074 302 ILE A CG2
58112206 C CD1 . ILE A 278 ? 0.6970 0.4933 1.5645 0.1141 0.3871 0.0774 302 ILE A CD1
58122207 N N . HIS A 279 ? 1.1540 0.7735 1.6289 0.0316 0.4333 -0.0661 303 HIS A N
58132208 C CA . HIS A 279 ? 1.1545 0.7563 1.5378 0.0054 0.4353 -0.0952 303 HIS A CA
58142209 C C . HIS A 279 ? 1.2390 0.8115 1.5375 -0.0181 0.4223 -0.1145 303 HIS A C
58152210 O O . HIS A 279 ? 1.5321 1.0650 1.7580 -0.0409 0.4472 -0.1428 303 HIS A O
58162211 C CB . HIS A 279 ? 1.0332 0.6912 1.4136 0.0025 0.3928 -0.0830 303 HIS A CB
58172212 C CG . HIS A 279 ? 0.9994 0.6835 1.4461 0.0169 0.4084 -0.0699 303 HIS A CG
58182213 N ND1 . HIS A 279 ? 0.9696 0.6306 1.3983 0.0097 0.4513 -0.0879 303 HIS A ND1
58192214 C CD2 . HIS A 279 ? 0.8794 0.6112 1.4094 0.0358 0.3866 -0.0399 303 HIS A CD2
58202215 C CE1 . HIS A 279 ? 0.9634 0.6584 1.4660 0.0248 0.4569 -0.0693 303 HIS A CE1
58212216 N NE2 . HIS A 279 ? 0.9069 0.6462 1.4728 0.0402 0.4167 -0.0398 303 HIS A NE2
58222217 N N . LEU A 280 ? 1.0752 0.6677 1.3783 -0.0157 0.3830 -0.0994 304 LEU A N
58232218 C CA . LEU A 280 ? 1.1898 0.7646 1.4164 -0.0394 0.3658 -0.1149 304 LEU A CA
58242219 C C . LEU A 280 ? 1.3695 0.8881 1.5885 -0.0430 0.3956 -0.1254 304 LEU A C
58252220 O O . LEU A 280 ? 1.3505 0.8610 1.5274 -0.0584 0.3757 -0.1296 304 LEU A O
58262221 C CB . LEU A 280 ? 1.0736 0.6988 1.3010 -0.0379 0.3097 -0.0951 304 LEU A CB
58272222 C CG . LEU A 280 ? 0.9008 0.5796 1.1639 -0.0257 0.2819 -0.0770 304 LEU A CG
58282223 C CD1 . LEU A 280 ? 0.9534 0.6741 1.2243 -0.0215 0.2323 -0.0565 304 LEU A CD1
58292224 C CD2 . LEU A 280 ? 0.9046 0.5890 1.1164 -0.0413 0.2842 -0.0938 304 LEU A CD2
58302225 N N . HIS A 281 ? 1.5435 1.0443 1.7990 -0.0306 0.4359 -0.1243 305 HIS A N
58312226 C CA . HIS A 281 ? 1.4869 0.9498 1.7302 -0.0349 0.4628 -0.1310 305 HIS A CA
58322227 C C . HIS A 281 ? 1.5510 1.0147 1.8152 -0.0279 0.4368 -0.1141 305 HIS A C
58332228 O O . HIS A 281 ? 1.4552 0.9514 1.7842 -0.0063 0.4111 -0.0858 305 HIS A O
58342229 C CB . HIS A 281 ? 1.5666 0.9909 1.7120 -0.0690 0.4801 -0.1634 305 HIS A CB
58352230 C CG . HIS A 281 ? 1.8875 1.2688 2.0134 -0.0770 0.5076 -0.1724 305 HIS A CG
58362231 N ND1 . HIS A 281 ? 1.8909 1.2505 2.0581 -0.0632 0.5508 -0.1692 305 HIS A ND1
58372232 C CD2 . HIS A 281 ? 1.8986 1.2541 1.9697 -0.0982 0.4984 -0.1838 305 HIS A CD2
58382233 C CE1 . HIS A 281 ? 1.8991 1.2180 2.0353 -0.0749 0.5681 -0.1795 305 HIS A CE1
58392234 N NE2 . HIS A 281 ? 1.9895 1.3056 2.0671 -0.0965 0.5363 -0.1885 305 HIS A NE2
58402235 C C10 . I4M B . ? 0.5525 0.6551 0.4722 -0.0936 -0.0669 -0.0259 401 I4M A C10
58412236 C C13 . I4M B . ? 0.8969 0.9095 0.7960 -0.1385 -0.0298 -0.0526 401 I4M A C13
58422237 C C15 . I4M B . ? 1.0255 0.9408 0.8358 -0.1909 0.0164 -0.0954 401 I4M A C15
58432238 C C17 . I4M B . ? 0.6395 0.6917 0.5275 -0.1306 -0.0483 -0.0455 401 I4M A C17
58442239 C C20 . I4M B . ? 0.7120 0.7837 0.5809 -0.1536 -0.0565 -0.0437 401 I4M A C20
58452240 C C21 . I4M B . ? 0.9439 0.9885 0.7797 -0.1756 -0.0487 -0.0547 401 I4M A C21
58462241 C C22 . I4M B . ? 0.7178 0.7043 0.6262 -0.1390 -0.0192 -0.0541 401 I4M A C22
58472242 C C24 . I4M B . ? 0.5773 0.6212 0.5067 -0.1053 -0.0445 -0.0361 401 I4M A C24
58482243 C C26 . I4M B . ? 0.7921 0.8325 0.7055 -0.1204 -0.0417 -0.0429 401 I4M A C26
58492244 C C07 . I4M B . ? 0.9066 0.8963 0.6729 -0.2056 -0.0301 -0.0737 401 I4M A C07
58502245 C C08 . I4M B . ? 0.6027 0.7181 0.5361 -0.0730 -0.0710 -0.0194 401 I4M A C08
58512246 C C09 . I4M B . ? 0.6599 0.7559 0.6007 -0.0681 -0.0637 -0.0231 401 I4M A C09
58522247 C C11 . I4M B . ? 0.4964 0.4893 0.4251 -0.1232 -0.0244 -0.0440 401 I4M A C11
58532248 C C12 . I4M B . ? 0.5674 0.5880 0.5030 -0.1081 -0.0370 -0.0361 401 I4M A C12
58542249 C C14 . I4M B . ? 0.9186 0.8502 0.7677 -0.1796 0.0075 -0.0836 401 I4M A C14
58552250 C C16 . I4M B . ? 0.8036 0.7312 0.6893 -0.1573 0.0096 -0.0751 401 I4M A C16
58562251 C C18 . I4M B . ? 0.8474 0.7963 0.6338 -0.2060 -0.0049 -0.0889 401 I4M A C18
58572252 C C19 . I4M B . ? 1.1260 1.1351 0.9588 -0.1658 -0.0328 -0.0637 401 I4M A C19
58582253 C C23 . I4M B . ? 0.5946 0.6767 0.5284 -0.0854 -0.0586 -0.0282 401 I4M A C23
58592254 C C25 . I4M B . ? 0.6567 0.7413 0.5786 -0.0980 -0.0592 -0.0311 401 I4M A C25
58602255 N N04 . I4M B . ? 0.6096 0.7202 0.5513 -0.0613 -0.0685 -0.0196 401 I4M A N04
58612256 N N05 . I4M B . ? 0.7226 0.7870 0.6310 -0.1175 -0.0513 -0.0390 401 I4M A N05
58622257 N N06 . I4M B . ? 1.1402 1.1155 0.9382 -0.1882 -0.0179 -0.0775 401 I4M A N06
58632258 O O01 . I4M B . ? 0.7859 0.7193 0.6337 -0.1696 0.0080 -0.0841 401 I4M A O01
58642259 O O02 . I4M B . ? 0.8289 0.7811 0.7248 -0.1551 -0.0034 -0.0646 401 I4M A O02
58652260 O O03 . I4M B . ? 0.5580 0.6228 0.4943 -0.0901 -0.0529 -0.0296 401 I4M A O03
58662261 O O . HOH C . ? 0.8702 0.8979 0.6320 -0.0902 -0.0553 0.0345 501 HOH A O
58672262 O O . HOH C . ? 0.8968 1.1158 0.8615 -0.3722 -0.0127 0.0476 502 HOH A O
58682263 O O . HOH C . ? 0.9863 0.6305 0.8371 -0.1958 0.1175 0.1430 503 HOH A O
58692264 O O . HOH C . ? 0.7496 1.1017 0.7841 0.0546 0.2545 0.0239 504 HOH A O
58702265 O O . HOH C . ? 0.8124 0.4518 0.9751 -0.0688 0.4396 -0.1443 505 HOH A O
58712266 O O . HOH C . ? 0.9211 0.7522 0.6898 -0.1591 0.1099 -0.0915 506 HOH A O
58722268 O O . HOH C . ? 0.8790 0.6929 0.7026 -0.3063 0.0444 -0.0808 508 HOH A O
58732269 O O . HOH C . ? 0.4997 0.5676 1.0962 -0.1978 -0.0796 0.1076 509 HOH A O
58742270 O O . HOH C . ? 0.6373 0.5900 1.0485 -0.2099 -0.1051 0.0703 510 HOH A O
58752271 O O . HOH C . ? 0.9477 1.0756 0.7218 -0.1914 -0.1135 -0.0006 511 HOH A O
58762273 O O . HOH C . ? 0.6737 0.6107 0.9793 -0.2127 -0.2027 0.0498 513 HOH A O
58772274 O O . HOH C . ? 1.0085 0.7051 0.7855 -0.2361 0.3949 -0.0291 514 HOH A O
58782275 O O . HOH C . ? 1.0469 0.8650 0.7399 0.0758 0.0940 -0.1175 515 HOH A O
58792276 O O . HOH C . ? 0.4855 0.6643 1.1999 -0.2170 -0.2050 0.1601 516 HOH A O
5880#
5881loop_
5882_pdbx_poly_seq_scheme.asym_id
5883_pdbx_poly_seq_scheme.entity_id
5884_pdbx_poly_seq_scheme.seq_id
5885_pdbx_poly_seq_scheme.mon_id
5886_pdbx_poly_seq_scheme.ndb_seq_num
5887_pdbx_poly_seq_scheme.pdb_seq_num
5888_pdbx_poly_seq_scheme.auth_seq_num
5889_pdbx_poly_seq_scheme.pdb_mon_id
5890_pdbx_poly_seq_scheme.auth_mon_id
5891_pdbx_poly_seq_scheme.pdb_strand_id
5892_pdbx_poly_seq_scheme.pdb_ins_code
5893_pdbx_poly_seq_scheme.hetero
5894A 1 1 GLY 1 25 ? ? ? A . n
5895A 1 2 PRO 2 26 ? ? ? A . n
5896A 1 3 HIS 3 27 ? ? ? A . n
5897A 1 4 MET 4 28 ? ? ? A . n
5898A 1 5 LYS 5 29 ? ? ? A . n
5899A 1 6 GLU 6 30 ? ? ? A . n
5900A 1 7 LYS 7 31 ? ? ? A . n
5901A 1 8 GLU 8 32 32 GLU GLU A . n
5902A 1 9 PRO 9 33 33 PRO PRO A . n
5903A 1 10 LEU 10 34 34 LEU LEU A . n
5904A 1 11 GLU 11 35 35 GLU GLU A . n
5905A 1 12 SER 12 36 36 SER SER A . n
5906A 1 13 GLN 13 37 37 GLN GLN A . n
5907A 1 14 TYR 14 38 38 TYR TYR A . n
5908A 1 15 GLN 15 39 39 GLN GLN A . n
5909A 1 16 VAL 16 40 40 VAL VAL A . n
5910A 1 17 GLY 17 41 41 GLY GLY A . n
5911A 1 18 PRO 18 42 42 PRO PRO A . n
5912A 1 19 LEU 19 43 43 LEU LEU A . n
5913A 1 20 LEU 20 44 44 LEU LEU A . n
5914A 1 21 GLY 21 45 45 GLY GLY A . n
5915A 1 22 SER 22 46 46 SER SER A . n
5916A 1 23 GLY 23 47 47 GLY GLY A . n
5917A 1 24 GLY 24 48 48 GLY GLY A . n
5918A 1 25 PHE 25 49 49 PHE PHE A . n
5919A 1 26 GLY 26 50 50 GLY GLY A . n
5920A 1 27 SER 27 51 51 SER SER A . n
5921A 1 28 VAL 28 52 52 VAL VAL A . n
5922A 1 29 TYR 29 53 53 TYR TYR A . n
5923A 1 30 SER 30 54 54 SER SER A . n
5924A 1 31 GLY 31 55 55 GLY GLY A . n
5925A 1 32 ILE 32 56 56 ILE ILE A . n
5926A 1 33 ARG 33 57 57 ARG ARG A . n
5927A 1 34 VAL 34 58 58 VAL VAL A . n
5928A 1 35 SER 35 59 59 SER SER A . n
5929A 1 36 ASP 36 60 60 ASP ASP A . n
5930A 1 37 ASN 37 61 61 ASN ASN A . n
5931A 1 38 LEU 38 62 62 LEU LEU A . n
5932A 1 39 PRO 39 63 63 PRO PRO A . n
5933A 1 40 VAL 40 64 64 VAL VAL A . n
5934A 1 41 ALA 41 65 65 ALA ALA A . n
5935A 1 42 ILE 42 66 66 ILE ILE A . n
5936A 1 43 LYS 43 67 67 LYS LYS A . n
5937A 1 44 HIS 44 68 68 HIS HIS A . n
5938A 1 45 VAL 45 69 69 VAL VAL A . n
5939A 1 46 GLU 46 70 70 GLU GLU A . n
5940A 1 47 LYS 47 71 71 LYS LYS A . n
5941A 1 48 ASP 48 72 72 ASP ASP A . n
5942A 1 49 ARG 49 73 73 ARG ARG A . n
5943A 1 50 ILE 50 74 74 ILE ILE A . n
5944A 1 51 SER 51 75 75 SER SER A . n
5945A 1 52 ASP 52 76 76 ASP ASP A . n
5946A 1 53 TRP 53 77 77 TRP TRP A . n
5947A 1 54 GLY 54 78 78 GLY GLY A . n
5948A 1 55 GLU 55 79 79 GLU GLU A . n
5949A 1 56 LEU 56 80 80 LEU LEU A . n
5950A 1 57 PRO 57 81 81 PRO PRO A . n
5951A 1 58 ASN 58 82 82 ASN ASN A . n
5952A 1 59 GLY 59 83 83 GLY GLY A . n
5953A 1 60 THR 60 84 84 THR THR A . n
5954A 1 61 ARG 61 85 85 ARG ARG A . n
5955A 1 62 VAL 62 86 86 VAL VAL A . n
5956A 1 63 PRO 63 87 87 PRO PRO A . n
5957A 1 64 MET 64 88 88 MET MET A . n
5958A 1 65 GLU 65 89 89 GLU GLU A . n
5959A 1 66 VAL 66 90 90 VAL VAL A . n
5960A 1 67 VAL 67 91 91 VAL VAL A . n
5961A 1 68 LEU 68 92 92 LEU LEU A . n
5962A 1 69 LEU 69 93 93 LEU LEU A . n
5963A 1 70 LYS 70 94 94 LYS LYS A . n
5964A 1 71 LYS 71 95 95 LYS LYS A . n
5965A 1 72 VAL 72 96 96 VAL VAL A . n
5966A 1 73 SER 73 97 97 SER SER A . n
5967A 1 74 SER 74 98 98 SER SER A . n
5968A 1 75 GLY 75 99 99 GLY GLY A . n
5969A 1 76 PHE 76 100 100 PHE PHE A . n
5970A 1 77 SER 77 101 101 SER SER A . n
5971A 1 78 GLY 78 102 102 GLY GLY A . n
5972A 1 79 VAL 79 103 103 VAL VAL A . n
5973A 1 80 ILE 80 104 104 ILE ILE A . n
5974A 1 81 ARG 81 105 105 ARG ARG A . n
5975A 1 82 LEU 82 106 106 LEU LEU A . n
5976A 1 83 LEU 83 107 107 LEU LEU A . n
5977A 1 84 ASP 84 108 108 ASP ASP A . n
5978A 1 85 TRP 85 109 109 TRP TRP A . n
5979A 1 86 PHE 86 110 110 PHE PHE A . n
5980A 1 87 GLU 87 111 111 GLU GLU A . n
5981A 1 88 ARG 88 112 112 ARG ARG A . n
5982A 1 89 PRO 89 113 113 PRO PRO A . n
5983A 1 90 ASP 90 114 114 ASP ASP A . n
5984A 1 91 SER 91 115 115 SER SER A . n
5985A 1 92 PHE 92 116 116 PHE PHE A . n
5986A 1 93 VAL 93 117 117 VAL VAL A . n
5987A 1 94 LEU 94 118 118 LEU LEU A . n
5988A 1 95 ILE 95 119 119 ILE ILE A . n
5989A 1 96 LEU 96 120 120 LEU LEU A . n
5990A 1 97 GLU 97 121 121 GLU GLU A . n
5991A 1 98 ARG 98 122 122 ARG ARG A . n
5992A 1 99 PRO 99 123 123 PRO PRO A . n
5993A 1 100 GLU 100 124 124 GLU GLU A . n
5994A 1 101 PRO 101 125 125 PRO PRO A . n
5995A 1 102 VAL 102 126 126 VAL VAL A . n
5996A 1 103 GLN 103 127 127 GLN GLN A . n
5997A 1 104 ASP 104 128 128 ASP ASP A . n
5998A 1 105 LEU 105 129 129 LEU LEU A . n
5999A 1 106 PHE 106 130 130 PHE PHE A . n
6000A 1 107 ASP 107 131 131 ASP ASP A . n
6001A 1 108 PHE 108 132 132 PHE PHE A . n
6002A 1 109 ILE 109 133 133 ILE ILE A . n
6003A 1 110 THR 110 134 134 THR THR A . n
6004A 1 111 GLU 111 135 135 GLU GLU A . n
6005A 1 112 ARG 112 136 136 ARG ARG A . n
6006A 1 113 GLY 113 137 137 GLY GLY A . n
6007A 1 114 ALA 114 138 138 ALA ALA A . n
6008A 1 115 LEU 115 139 139 LEU LEU A . n
6009A 1 116 GLN 116 140 140 GLN GLN A . n
6010A 1 117 GLU 117 141 141 GLU GLU A . n
6011A 1 118 GLU 118 142 142 GLU GLU A . n
6012A 1 119 LEU 119 143 143 LEU LEU A . n
6013A 1 120 ALA 120 144 144 ALA ALA A . n
6014A 1 121 ARG 121 145 145 ARG ARG A . n
6015A 1 122 SER 122 146 146 SER SER A . n
6016A 1 123 PHE 123 147 147 PHE PHE A . n
6017A 1 124 PHE 124 148 148 PHE PHE A . n
6018A 1 125 TRP 125 149 149 TRP TRP A . n
6019A 1 126 GLN 126 150 150 GLN GLN A . n
6020A 1 127 VAL 127 151 151 VAL VAL A . n
6021A 1 128 LEU 128 152 152 LEU LEU A . n
6022A 1 129 GLU 129 153 153 GLU GLU A . n
6023A 1 130 ALA 130 154 154 ALA ALA A . n
6024A 1 131 VAL 131 155 155 VAL VAL A . n
6025A 1 132 ARG 132 156 156 ARG ARG A . n
6026A 1 133 HIS 133 157 157 HIS HIS A . n
6027A 1 134 CYS 134 158 158 CYS CYS A . n
6028A 1 135 HIS 135 159 159 HIS HIS A . n
6029A 1 136 ASN 136 160 160 ASN ASN A . n
6030A 1 137 CYS 137 161 161 CYS CYS A . n
6031A 1 138 GLY 138 162 162 GLY GLY A . n
6032A 1 139 VAL 139 163 163 VAL VAL A . n
6033A 1 140 LEU 140 164 164 LEU LEU A . n
6034A 1 141 HIS 141 165 165 HIS HIS A . n
6035A 1 142 ARG 142 166 166 ARG ARG A . n
6036A 1 143 ASP 143 167 167 ASP ASP A . n
6037A 1 144 ILE 144 168 168 ILE ILE A . n
6038A 1 145 LYS 145 169 169 LYS LYS A . n
6039A 1 146 ASP 146 170 170 ASP ASP A . n
6040A 1 147 GLU 147 171 171 GLU GLU A . n
6041A 1 148 ASN 148 172 172 ASN ASN A . n
6042A 1 149 ILE 149 173 173 ILE ILE A . n
6043A 1 150 LEU 150 174 174 LEU LEU A . n
6044A 1 151 ILE 151 175 175 ILE ILE A . n
6045A 1 152 ASP 152 176 176 ASP ASP A . n
6046A 1 153 LEU 153 177 177 LEU LEU A . n
6047A 1 154 ASN 154 178 178 ASN ASN A . n
6048A 1 155 ARG 155 179 179 ARG ARG A . n
6049A 1 156 GLY 156 180 180 GLY GLY A . n
6050A 1 157 GLU 157 181 181 GLU GLU A . n
6051A 1 158 LEU 158 182 182 LEU LEU A . n
6052A 1 159 LYS 159 183 183 LYS LYS A . n
6053A 1 160 LEU 160 184 184 LEU LEU A . n
6054A 1 161 ILE 161 185 185 ILE ILE A . n
6055A 1 162 ASP 162 186 186 ASP ASP A . n
6056A 1 163 PHE 163 187 187 PHE PHE A . n
6057A 1 164 GLY 164 188 188 GLY GLY A . n
6058A 1 165 SER 165 189 189 SER SER A . n
6059A 1 166 GLY 166 190 190 GLY GLY A . n
6060A 1 167 ALA 167 191 191 ALA ALA A . n
6061A 1 168 LEU 168 192 192 LEU LEU A . n
6062A 1 169 LEU 169 193 193 LEU LEU A . n
6063A 1 170 LYS 170 194 194 LYS LYS A . n
6064A 1 171 ASP 171 195 195 ASP ASP A . n
6065A 1 172 THR 172 196 196 THR THR A . n
6066A 1 173 VAL 173 197 197 VAL VAL A . n
6067A 1 174 TYR 174 198 198 TYR TYR A . n
6068A 1 175 THR 175 199 199 THR THR A . n
6069A 1 176 ASP 176 200 200 ASP ASP A . n
6070A 1 177 PHE 177 201 201 PHE PHE A . n
6071A 1 178 ASP 178 202 202 ASP ASP A . n
6072A 1 179 GLY 179 203 203 GLY GLY A . n
6073A 1 180 THR 180 204 204 THR THR A . n
6074A 1 181 ARG 181 205 205 ARG ARG A . n
6075A 1 182 VAL 182 206 206 VAL VAL A . n
6076A 1 183 TYR 183 207 207 TYR TYR A . n
6077A 1 184 SER 184 208 208 SER SER A . n
6078A 1 185 PRO 185 209 209 PRO PRO A . n
6079A 1 186 PRO 186 210 210 PRO PRO A . n
6080A 1 187 GLU 187 211 211 GLU GLU A . n
6081A 1 188 TRP 188 212 212 TRP TRP A . n
6082A 1 189 ILE 189 213 213 ILE ILE A . n
6083A 1 190 ARG 190 214 214 ARG ARG A . n
6084A 1 191 TYR 191 215 215 TYR TYR A . n
6085A 1 192 HIS 192 216 216 HIS HIS A . n
6086A 1 193 ARG 193 217 217 ARG ARG A . n
6087A 1 194 TYR 194 218 218 TYR TYR A . n
6088A 1 195 HIS 195 219 219 HIS HIS A . n
6089A 1 196 GLY 196 220 220 GLY GLY A . n
6090A 1 197 ARG 197 221 221 ARG ARG A . n
6091A 1 198 SER 198 222 222 SER SER A . n
6092A 1 199 ALA 199 223 223 ALA ALA A . n
6093A 1 200 ALA 200 224 224 ALA ALA A . n
6094A 1 201 VAL 201 225 225 VAL VAL A . n
6095A 1 202 TRP 202 226 226 TRP TRP A . n
6096A 1 203 SER 203 227 227 SER SER A . n
6097A 1 204 LEU 204 228 228 LEU LEU A . n
6098A 1 205 GLY 205 229 229 GLY GLY A . n
6099A 1 206 ILE 206 230 230 ILE ILE A . n
6100A 1 207 LEU 207 231 231 LEU LEU A . n
6101A 1 208 LEU 208 232 232 LEU LEU A . n
6102A 1 209 TYR 209 233 233 TYR TYR A . n
6103A 1 210 ASP 210 234 234 ASP ASP A . n
6104A 1 211 MET 211 235 235 MET MET A . n
6105A 1 212 VAL 212 236 236 VAL VAL A . n
6106A 1 213 CYS 213 237 237 CYS CYS A . n
6107A 1 214 GLY 214 238 238 GLY GLY A . n
6108A 1 215 ASP 215 239 239 ASP ASP A . n
6109A 1 216 ILE 216 240 240 ILE ILE A . n
6110A 1 217 PRO 217 241 241 PRO PRO A . n
6111A 1 218 PHE 218 242 242 PHE PHE A . n
6112A 1 219 GLU 219 243 243 GLU GLU A . n
6113A 1 220 HIS 220 244 244 HIS HIS A . n
6114A 1 221 ASP 221 245 245 ASP ASP A . n
6115A 1 222 GLU 222 246 246 GLU GLU A . n
6116A 1 223 GLU 223 247 247 GLU GLU A . n
6117A 1 224 ILE 224 248 248 ILE ILE A . n
6118A 1 225 ILE 225 249 249 ILE ILE A . n
6119A 1 226 ARG 226 250 250 ARG ARG A . n
6120A 1 227 GLY 227 251 251 GLY GLY A . n
6121A 1 228 GLN 228 252 252 GLN GLN A . n
6122A 1 229 VAL 229 253 253 VAL VAL A . n
6123A 1 230 PHE 230 254 254 PHE PHE A . n
6124A 1 231 PHE 231 255 255 PHE PHE A . n
6125A 1 232 ARG 232 256 256 ARG ARG A . n
6126A 1 233 GLN 233 257 257 GLN GLN A . n
6127A 1 234 ARG 234 258 258 ARG ARG A . n
6128A 1 235 VAL 235 259 259 VAL VAL A . n
6129A 1 236 SER 236 260 260 SER SER A . n
6130A 1 237 SEP01 237 261 261 SEP01 SEP01 A . n
6131A 1 238 GLU 238 262 262 GLU GLU A . n
6132A 1 239 CYS 239 263 263 CYS CYS A . n
6133A 1 240 GLN 240 264 264 GLN GLN A . n
6134A 1 241 HIS 241 265 265 HIS HIS A . n
6135A 1 242 LEU 242 266 266 LEU LEU A . n
6136A 1 243 ILE 243 267 267 ILE ILE A . n
6137A 1 244 ARG 244 268 268 ARG ARG A . n
6138A 1 245 TRP 245 269 269 TRP TRP A . n
6139A 1 246 CYS 246 270 270 CYS CYS A . n
6140A 1 247 LEU 247 271 271 LEU LEU A . n
6141A 1 248 ALA 248 272 272 ALA ALA A . n
6142A 1 249 LEU 249 273 273 LEU LEU A . n
6143A 1 250 ARG 250 274 274 ARG ARG A . n
6144A 1 251 PRO 251 275 275 PRO PRO A . n
6145A 1 252 SER 252 276 276 SER SER A . n
6146A 1 253 ASP 253 277 277 ASP ASP A . n
6147A 1 254 ARG 254 278 278 ARG ARG A . n
6148A 1 255 PRO 255 279 279 PRO PRO A . n
6149A 1 256 THR 256 280 280 THR THR A . n
6150A 1 257 PHE 257 281 281 PHE PHE A . n
6151A 1 258 GLU 258 282 282 GLU GLU A . n
6152A 1 259 GLU 259 283 283 GLU GLU A . n
6153A 1 260 ILE 260 284 284 ILE ILE A . n
6154A 1 261 GLN 261 285 285 GLN GLN A . n
6155A 1 262 ASN 262 286 286 ASN ASN A . n
6156A 1 263 HIS 263 287 287 HIS HIS A . n
6157A 1 264 PRO 264 288 288 PRO PRO A . n
6158A 1 265 TRP 265 289 289 TRP TRP A . n
6159A 1 266 MET 266 290 290 MET MET A . n
6160A 1 267 GLN 267 291 291 GLN GLN A . n
6161A 1 268 ASP 268 292 292 ASP ASP A . n
6162A 1 269 VAL 269 293 293 VAL VAL A . n
6163A 1 270 LEU 270 294 294 LEU LEU A . n
6164A 1 271 LEU 271 295 295 LEU LEU A . n
6165A 1 272 PRO 272 296 296 PRO PRO A . n
6166A 1 273 GLN 273 297 297 GLN GLN A . n
6167A 1 274 GLU 274 298 298 GLU GLU A . n
6168A 1 275 THR 275 299 299 THR THR A . n
6169A 1 276 ALA 276 300 300 ALA ALA A . n
6170A 1 277 GLU 277 301 301 GLU GLU A . n
6171A 1 278 ILE 278 302 302 ILE ILE A . n
6172A 1 279 HIS 279 303 303 HIS HIS A . n
6173A 1 280 LEU 280 304 304 LEU LEU A . n
6174A 1 281 HIS 281 305 305 HIS HIS A . n
6175A 1 282 SER 282 306 ? ? ? A . n
6176A 1 283 LEU 283 307 ? ? ? A . n
6177A 1 284 SER 284 308 ? ? ? A . n
6178A 1 285 PRO 285 309 ? ? ? A . n
6179A 1 286 GLY 286 310 ? ? ? A . n
6180A 1 287 PRO 287 311 ? ? ? A . n
6181A 1 288 SER 288 312 ? ? ? A . n
6182A 1 289 LYS 289 313 ? ? ? A . n
6183#
6184_pdbx_contact_author.id 5
6185_pdbx_contact_author.email huangniu@nibs.ac.cn
6186_pdbx_contact_author.name_first Niu
6187_pdbx_contact_author.name_last Huang
6188_pdbx_contact_author.name_mi ?
6189_pdbx_contact_author.role 'principal investigator/group leader'
6190_pdbx_contact_author.identifier_ORCID 0000-0002-6912-033X
6191#
6192loop_
6193_pdbx_nonpoly_scheme.asym_id
6194_pdbx_nonpoly_scheme.entity_id
6195_pdbx_nonpoly_scheme.mon_id
6196_pdbx_nonpoly_scheme.ndb_seq_num
6197_pdbx_nonpoly_scheme.pdb_seq_num
6198_pdbx_nonpoly_scheme.auth_seq_num
6199_pdbx_nonpoly_scheme.pdb_mon_id
6200_pdbx_nonpoly_scheme.auth_mon_id
6201_pdbx_nonpoly_scheme.pdb_strand_id
6202_pdbx_nonpoly_scheme.pdb_ins_code
6203B 2 I4M 1 401 401 I4M LIG A .
6204C 3 HOH 1 501 4 HOH HOH A .
6205C 3 HOH 2 502 18 HOH HOH A .
6206C 3 HOH 3 503 15 HOH HOH A .
6207C 3 HOH 4 504 3 HOH HOH A .
6208C 3 HOH 5 505 7 HOH HOH A .
6209C 3 HOH 6 506 20 HOH HOH A .
6210C 3 HOH 7 507 24 HOH HOH A .
6211C 3 HOH 8 508 1 HOH HOH A .
6212C 3 HOH 9 509 21 HOH HOH A .
6213C 3 HOH 10 510 22 HOH HOH A .
6214C 3 HOH 11 511 2 HOH HOH A .
6215C 3 HOH 12 512 23 HOH HOH A .
6216C 3 HOH 13 513 19 HOH HOH A .
6217C 3 HOH 14 514 16 HOH HOH A .
6218C 3 HOH 15 515 14 HOH HOH A .
6219C 3 HOH 16 516 12 HOH HOH A .
6220#
6221_pdbx_struct_mod_residue.id 1
6222_pdbx_struct_mod_residue.label_asym_id A
6223_pdbx_struct_mod_residue.label_comp_id SEP01
6224_pdbx_struct_mod_residue.label_seq_id 237
6225_pdbx_struct_mod_residue.auth_asym_id A
6226_pdbx_struct_mod_residue.auth_comp_id SEP01
6227_pdbx_struct_mod_residue.auth_seq_id 261
6228_pdbx_struct_mod_residue.PDB_ins_code ?
6229_pdbx_struct_mod_residue.parent_comp_id SER
6230_pdbx_struct_mod_residue.details 'modified residue'
6231#
6232_pdbx_struct_assembly.id 1
6233_pdbx_struct_assembly.details author_defined_assembly
6234_pdbx_struct_assembly.method_details ?
6235_pdbx_struct_assembly.oligomeric_details monomeric
6236_pdbx_struct_assembly.oligomeric_count 1
6237#
6238_pdbx_struct_assembly_gen.assembly_id 1
6239_pdbx_struct_assembly_gen.oper_expression 1
6240_pdbx_struct_assembly_gen.asym_id_list A,B,C
6241#
6242loop_
6243_pdbx_struct_assembly_prop.biol_id
6244_pdbx_struct_assembly_prop.type
6245_pdbx_struct_assembly_prop.value
6246_pdbx_struct_assembly_prop.details
62471 'ABSA (A^2)' 0 ?
62481 MORE 0 ?
62491 'SSA (A^2)' 12820 ?
6250#
6251_pdbx_struct_oper_list.id 1
6252_pdbx_struct_oper_list.type 'identity operation'
6253_pdbx_struct_oper_list.name 1_555
6254_pdbx_struct_oper_list.symmetry_operation x,y,z
6255_pdbx_struct_oper_list.matrix[1][1] 1.0000000000
6256_pdbx_struct_oper_list.matrix[1][2] 0.0000000000
6257_pdbx_struct_oper_list.matrix[1][3] 0.0000000000
6258_pdbx_struct_oper_list.vector[1] 0.0000000000
6259_pdbx_struct_oper_list.matrix[2][1] 0.0000000000
6260_pdbx_struct_oper_list.matrix[2][2] 1.0000000000
6261_pdbx_struct_oper_list.matrix[2][3] 0.0000000000
6262_pdbx_struct_oper_list.vector[2] 0.0000000000
6263_pdbx_struct_oper_list.matrix[3][1] 0.0000000000
6264_pdbx_struct_oper_list.matrix[3][2] 0.0000000000
6265_pdbx_struct_oper_list.matrix[3][3] 1.0000000000
6266_pdbx_struct_oper_list.vector[3] 0.0000000000
6267#
6268_pdbx_audit_revision_history.ordinal 1
6269_pdbx_audit_revision_history.data_content_type 'Structure model'
6270_pdbx_audit_revision_history.major_revision 1
6271_pdbx_audit_revision_history.minor_revision 0
6272_pdbx_audit_revision_history.revision_date 2022-07-13
6273#
6274_pdbx_audit_revision_details.ordinal 1
6275_pdbx_audit_revision_details.revision_ordinal 1
6276_pdbx_audit_revision_details.data_content_type 'Structure model'
6277_pdbx_audit_revision_details.provider repository
6278_pdbx_audit_revision_details.type 'Initial release'
6279_pdbx_audit_revision_details.description ?
6280_pdbx_audit_revision_details.details ?
6281#
6282_pdbx_refine_tls.id 1
6283_pdbx_refine_tls.pdbx_refine_id 'X-RAY DIFFRACTION'
6284_pdbx_refine_tls.details ?
6285_pdbx_refine_tls.method refined
6286_pdbx_refine_tls.origin_x 66.3593
6287_pdbx_refine_tls.origin_y 27.0983
6288_pdbx_refine_tls.origin_z 0.8465
6289_pdbx_refine_tls.T[1][1] 0.3705
6290_pdbx_refine_tls.T[1][1]_esd ?
6291_pdbx_refine_tls.T[1][2] -0.0310
6292_pdbx_refine_tls.T[1][2]_esd ?
6293_pdbx_refine_tls.T[1][3] -0.0579
6294_pdbx_refine_tls.T[1][3]_esd ?
6295_pdbx_refine_tls.T[2][2] 0.3544
6296_pdbx_refine_tls.T[2][2]_esd ?
6297_pdbx_refine_tls.T[2][3] -0.0308
6298_pdbx_refine_tls.T[2][3]_esd ?
6299_pdbx_refine_tls.T[3][3] 0.3765
6300_pdbx_refine_tls.T[3][3]_esd ?
6301_pdbx_refine_tls.L[1][1] 2.6870
6302_pdbx_refine_tls.L[1][1]_esd ?
6303_pdbx_refine_tls.L[1][2] 1.5997
6304_pdbx_refine_tls.L[1][2]_esd ?
6305_pdbx_refine_tls.L[1][3] -0.9230
6306_pdbx_refine_tls.L[1][3]_esd ?
6307_pdbx_refine_tls.L[2][2] 4.1310
6308_pdbx_refine_tls.L[2][2]_esd ?
6309_pdbx_refine_tls.L[2][3] -1.3502
6310_pdbx_refine_tls.L[2][3]_esd ?
6311_pdbx_refine_tls.L[3][3] 2.8114
6312_pdbx_refine_tls.L[3][3]_esd ?
6313_pdbx_refine_tls.S[1][1] 0.1618
6314_pdbx_refine_tls.S[1][1]_esd ?
6315_pdbx_refine_tls.S[1][2] -0.0298
6316_pdbx_refine_tls.S[1][2]_esd ?
6317_pdbx_refine_tls.S[1][3] 0.1592
6318_pdbx_refine_tls.S[1][3]_esd ?
6319_pdbx_refine_tls.S[2][1] 0.1095
6320_pdbx_refine_tls.S[2][1]_esd ?
6321_pdbx_refine_tls.S[2][2] -0.0349
6322_pdbx_refine_tls.S[2][2]_esd ?
6323_pdbx_refine_tls.S[2][3] 0.5086
6324_pdbx_refine_tls.S[2][3]_esd ?
6325_pdbx_refine_tls.S[3][1] -0.0000
6326_pdbx_refine_tls.S[3][1]_esd ?
6327_pdbx_refine_tls.S[3][2] 0.1903
6328_pdbx_refine_tls.S[3][2]_esd ?
6329_pdbx_refine_tls.S[3][3] -0.1015
6330_pdbx_refine_tls.S[3][3]_esd ?
6331#
6332_pdbx_refine_tls_group.id 1
6333_pdbx_refine_tls_group.pdbx_refine_id 'X-RAY DIFFRACTION'
6334_pdbx_refine_tls_group.refine_tls_id 1
6335_pdbx_refine_tls_group.beg_label_asym_id ?
6336_pdbx_refine_tls_group.beg_label_seq_id ?
6337_pdbx_refine_tls_group.beg_auth_asym_id ?
6338_pdbx_refine_tls_group.beg_auth_seq_id ?
6339_pdbx_refine_tls_group.beg_PDB_ins_code ?
6340_pdbx_refine_tls_group.end_label_asym_id ?
6341_pdbx_refine_tls_group.end_label_seq_id ?
6342_pdbx_refine_tls_group.end_auth_asym_id ?
6343_pdbx_refine_tls_group.end_auth_seq_id ?
6344_pdbx_refine_tls_group.end_PDB_ins_code ?
6345_pdbx_refine_tls_group.selection ?
6346_pdbx_refine_tls_group.selection_details all
6347#
6348_phasing.method MR
6349#
6350loop_
6351_software.citation_id
6352_software.classification
6353_software.compiler_name
6354_software.compiler_version
6355_software.contact_author
6356_software.contact_author_email
6357_software.date
6358_software.description
6359_software.dependencies
6360_software.hardware
6361_software.language
6362_software.location
6363_software.mods
6364_software.name
6365_software.os
6366_software.os_version
6367_software.type
6368_software.version
6369_software.pdbx_ordinal
6370? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.19.2 1
6371? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? 0.7.7 2
6372? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? 2.8.3 3
6373? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.27 4
6374? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS ? ? ? 'Feb 5, 2021' 5
6375#
6376_pdbx_entry_details.entry_id PDB_00017XSV
6377_pdbx_entry_details.has_ligand_of_interest Y
6378_pdbx_entry_details.compound_details ?
6379_pdbx_entry_details.source_details ?
6380_pdbx_entry_details.nonpolymer_details ?
6381_pdbx_entry_details.sequence_details ?
6382#
6383loop_
6384_pdbx_validate_torsion.id
6385_pdbx_validate_torsion.PDB_model_num
6386_pdbx_validate_torsion.auth_comp_id
6387_pdbx_validate_torsion.auth_asym_id
6388_pdbx_validate_torsion.auth_seq_id
6389_pdbx_validate_torsion.PDB_ins_code
6390_pdbx_validate_torsion.label_alt_id
6391_pdbx_validate_torsion.phi
6392_pdbx_validate_torsion.psi
63931 1 ARG A 166 ? ? 69.45 -9.52
63942 1 ASP A 186 ? ? 54.46 80.40
6395#
6396loop_
6397_pdbx_unobs_or_zero_occ_atoms.id
6398_pdbx_unobs_or_zero_occ_atoms.PDB_model_num
6399_pdbx_unobs_or_zero_occ_atoms.polymer_flag
6400_pdbx_unobs_or_zero_occ_atoms.occupancy_flag
6401_pdbx_unobs_or_zero_occ_atoms.auth_asym_id
6402_pdbx_unobs_or_zero_occ_atoms.auth_comp_id
6403_pdbx_unobs_or_zero_occ_atoms.auth_seq_id
6404_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code
6405_pdbx_unobs_or_zero_occ_atoms.auth_atom_id
6406_pdbx_unobs_or_zero_occ_atoms.label_alt_id
6407_pdbx_unobs_or_zero_occ_atoms.label_asym_id
6408_pdbx_unobs_or_zero_occ_atoms.label_comp_id
6409_pdbx_unobs_or_zero_occ_atoms.label_seq_id
6410_pdbx_unobs_or_zero_occ_atoms.label_atom_id
64111 1 Y 1 A GLU 32 ? CG ? A GLU 8 CG
64122 1 Y 1 A GLU 32 ? CD ? A GLU 8 CD
64133 1 Y 1 A GLU 32 ? OE1 ? A GLU 8 OE1
64144 1 Y 1 A GLU 32 ? OE2 ? A GLU 8 OE2
64155 1 Y 1 A ARG 156 ? CG ? A ARG 132 CG
64166 1 Y 1 A ARG 156 ? CD ? A ARG 132 CD
64177 1 Y 1 A ARG 156 ? NE ? A ARG 132 NE
64188 1 Y 1 A ARG 156 ? CZ ? A ARG 132 CZ
64199 1 Y 1 A ARG 156 ? NH1 ? A ARG 132 NH1
642010 1 Y 1 A ARG 156 ? NH2 ? A ARG 132 NH2
6421#
6422loop_
6423_pdbx_unobs_or_zero_occ_residues.id
6424_pdbx_unobs_or_zero_occ_residues.PDB_model_num
6425_pdbx_unobs_or_zero_occ_residues.polymer_flag
6426_pdbx_unobs_or_zero_occ_residues.occupancy_flag
6427_pdbx_unobs_or_zero_occ_residues.auth_asym_id
6428_pdbx_unobs_or_zero_occ_residues.auth_comp_id
6429_pdbx_unobs_or_zero_occ_residues.auth_seq_id
6430_pdbx_unobs_or_zero_occ_residues.PDB_ins_code
6431_pdbx_unobs_or_zero_occ_residues.label_asym_id
6432_pdbx_unobs_or_zero_occ_residues.label_comp_id
6433_pdbx_unobs_or_zero_occ_residues.label_seq_id
64341 1 Y 1 A GLY 25 ? A GLY 1
64352 1 Y 1 A PRO 26 ? A PRO 2
64363 1 Y 1 A HIS 27 ? A HIS 3
64374 1 Y 1 A MET 28 ? A MET 4
64385 1 Y 1 A LYS 29 ? A LYS 5
64396 1 Y 1 A GLU 30 ? A GLU 6
64407 1 Y 1 A LYS 31 ? A LYS 7
64418 1 Y 1 A SER 306 ? A SER 282
64429 1 Y 1 A LEU 307 ? A LEU 283
644310 1 Y 1 A SER 308 ? A SER 284
644411 1 Y 1 A PRO 309 ? A PRO 285
644512 1 Y 1 A GLY 310 ? A GLY 286
644613 1 Y 1 A PRO 311 ? A PRO 287
644714 1 Y 1 A SER 312 ? A SER 288
644815 1 Y 1 A LYS 313 ? A LYS 289
6449#
6450_pdbx_audit_support.funding_organization 'Beijing Municipal Science & Technology Commission'
6451_pdbx_audit_support.country China
6452_pdbx_audit_support.grant_number Z201100005320012
6453_pdbx_audit_support.ordinal 1
6454#
6455_pdbx_entity_instance_feature.ordinal 1
6456_pdbx_entity_instance_feature.comp_id I4M
6457_pdbx_entity_instance_feature.asym_id ?
6458_pdbx_entity_instance_feature.seq_num ?
6459_pdbx_entity_instance_feature.auth_comp_id I4M
6460_pdbx_entity_instance_feature.auth_asym_id ?
6461_pdbx_entity_instance_feature.auth_seq_num ?
6462_pdbx_entity_instance_feature.feature_type 'SUBJECT OF INVESTIGATION'
6463_pdbx_entity_instance_feature.details ?
6464#
6465loop_
6466_pdbx_entity_nonpoly.entity_id
6467_pdbx_entity_nonpoly.name
6468_pdbx_entity_nonpoly.comp_id
64692 '8-Methyl-2,5,20-trioxa-8,13,17-triazatetracyclo[11.10.2.014,19.021,25]pentacosa-1(24),14(19),15,17,21(25),22-hexaene' I4M
64703 water HOH
6471#
6472_pdbx_struct_assembly_auth_evidence.id 1
6473_pdbx_struct_assembly_auth_evidence.assembly_id 1
6474_pdbx_struct_assembly_auth_evidence.experimental_support 'gel filtration'
6475_pdbx_struct_assembly_auth_evidence.details ?
6476#