Ticket #1547: 3q46_assembly.cif

data_3Q46
#
_coordinate_server_result.query_type      assembly 
_coordinate_server_result.datetime_utc    '2018-12-16 16:23:27' 
_coordinate_server_result.is_empty        no 
_coordinate_server_result.has_error       no 
_coordinate_server_result.api_version     1.4.8 
_coordinate_server_result.core_version    3.2.1 
#
loop_
_coordinate_server_query_params.name
_coordinate_server_query_params.value
id 1 
atomSitesOnly 0 
modelId . 
format mmCIF 
encoding cif 
lowPrecisionCoords false 
#
_entry.id    3Q46 
#
loop_
_entity.id
_entity.type
_entity.src_method
_entity.pdbx_description
_entity.formula_weight
_entity.pdbx_number_of_molecules
_entity.details
_entity.pdbx_mutation
_entity.pdbx_fragment
_entity.pdbx_ec
1 polymer man Tt-IPPase ? ? . ? ? ? 
2 non-polymer syn 'PHOSPHATE ION' ? ? . ? ? ? 
3 non-polymer syn 'MAGNESIUM ION' ? ? . ? ? ? 
4 non-polymer syn '4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID' ? ? . ? ? ? 
5 non-polymer syn 'CHLORIDE ION' ? ? . ? ? ? 
6 water nat water ? ? . ? ? ? 
#
_exptl.entry_id    3Q46 
_exptl.method      'X-ray diffraction' 
#
_cell.entry_id            3Q46 
_cell.length_a            99.253 
_cell.length_b            99.253 
_cell.length_c            98.557 
_cell.angle_alpha         90 
_cell.angle_beta          90 
_cell.angle_gamma         120 
_cell.Z_PDB               18 
_cell.pdbx_unique_axis    ? 
#
_symmetry.entry_id                          3Q46 
_symmetry.space_group_name_H-M              'H 3 2' 
_symmetry.pdbx_full_space_group_name_H-M    ? 
_symmetry.cell_setting                      ? 
_symmetry.Int_Tables_number                 155 
_symmetry.space_group_name_Hall             ? 
#
loop_
_struct_conf.conf_type_id
_struct_conf.id
_struct_conf.pdbx_PDB_helix_id
_struct_conf.beg_label_comp_id
_struct_conf.beg_label_asym_id
_struct_conf.beg_label_seq_id
_struct_conf.pdbx_beg_PDB_ins_code
_struct_conf.end_label_comp_id
_struct_conf.end_label_asym_id
_struct_conf.end_label_seq_id
_struct_conf.pdbx_end_PDB_ins_code
_struct_conf.beg_auth_comp_id
_struct_conf.beg_auth_asym_id
_struct_conf.beg_auth_seq_id
_struct_conf.end_auth_comp_id
_struct_conf.end_auth_asym_id
_struct_conf.end_auth_seq_id
_struct_conf.pdbx_PDB_helix_class
_struct_conf.details
_struct_conf.pdbx_PDB_helix_length
HELX_P HELX_P1 1 ASP A 113 . ASN A 117 . ASP A 113 ASN A 117 5 ? 5 
HELX_P HELX_P2 2 ASP A 121 . VAL A 125 . ASP A 121 VAL A 125 5 ? 5 
HELX_P HELX_P3 3 PRO A 126 . TYR A 140 . PRO A 126 TYR A 140 1 ? 15 
HELX_P HELX_P4 4 LYS A 141 . GLY A 145 . LYS A 141 GLY A 145 5 ? 5 
HELX_P HELX_P5 5 ALA A 156 . GLU A 177 . ALA A 156 GLU A 177 1 ? 22 
HELX_P HELX_P6 6 ASP A-2 113 . ASN A-2 117 . ASP A-2 113 ASN A-2 117 5 ? 5 
HELX_P HELX_P7 7 ASP A-2 121 . VAL A-2 125 . ASP A-2 121 VAL A-2 125 5 ? 5 
HELX_P HELX_P8 8 PRO A-2 126 . TYR A-2 140 . PRO A-2 126 TYR A-2 140 1 ? 15 
HELX_P HELX_P9 9 LYS A-2 141 . GLY A-2 145 . LYS A-2 141 GLY A-2 145 5 ? 5 
HELX_P HELX_P10 10 ALA A-2 156 . GLU A-2 177 . ALA A-2 156 GLU A-2 177 1 ? 22 
HELX_P HELX_P11 11 ASP A-3 113 . ASN A-3 117 . ASP A-3 113 ASN A-3 117 5 ? 5 
HELX_P HELX_P12 12 ASP A-3 121 . VAL A-3 125 . ASP A-3 121 VAL A-3 125 5 ? 5 
HELX_P HELX_P13 13 PRO A-3 126 . TYR A-3 140 . PRO A-3 126 TYR A-3 140 1 ? 15 
HELX_P HELX_P14 14 LYS A-3 141 . GLY A-3 145 . LYS A-3 141 GLY A-3 145 5 ? 5 
HELX_P HELX_P15 15 ALA A-3 156 . GLU A-3 177 . ALA A-3 156 GLU A-3 177 1 ? 22 
HELX_P HELX_P16 16 ASP A-4 113 . ASN A-4 117 . ASP A-4 113 ASN A-4 117 5 ? 5 
HELX_P HELX_P17 17 ASP A-4 121 . VAL A-4 125 . ASP A-4 121 VAL A-4 125 5 ? 5 
HELX_P HELX_P18 18 PRO A-4 126 . TYR A-4 140 . PRO A-4 126 TYR A-4 140 1 ? 15 
HELX_P HELX_P19 19 LYS A-4 141 . GLY A-4 145 . LYS A-4 141 GLY A-4 145 5 ? 5 
HELX_P HELX_P20 20 ALA A-4 156 . GLU A-4 177 . ALA A-4 156 GLU A-4 177 1 ? 22 
HELX_P HELX_P21 21 ASP A-5 113 . ASN A-5 117 . ASP A-5 113 ASN A-5 117 5 ? 5 
HELX_P HELX_P22 22 ASP A-5 121 . VAL A-5 125 . ASP A-5 121 VAL A-5 125 5 ? 5 
HELX_P HELX_P23 23 PRO A-5 126 . TYR A-5 140 . PRO A-5 126 TYR A-5 140 1 ? 15 
HELX_P HELX_P24 24 LYS A-5 141 . GLY A-5 145 . LYS A-5 141 GLY A-5 145 5 ? 5 
HELX_P HELX_P25 25 ALA A-5 156 . GLU A-5 177 . ALA A-5 156 GLU A-5 177 1 ? 22 
HELX_P HELX_P26 26 ASP A-6 113 . ASN A-6 117 . ASP A-6 113 ASN A-6 117 5 ? 5 
HELX_P HELX_P27 27 ASP A-6 121 . VAL A-6 125 . ASP A-6 121 VAL A-6 125 5 ? 5 
HELX_P HELX_P28 28 PRO A-6 126 . TYR A-6 140 . PRO A-6 126 TYR A-6 140 1 ? 15 
HELX_P HELX_P29 29 LYS A-6 141 . GLY A-6 145 . LYS A-6 141 GLY A-6 145 5 ? 5 
HELX_P HELX_P30 30 ALA A-6 156 . GLU A-6 177 . ALA A-6 156 GLU A-6 177 1 ? 22 
#
loop_
_struct_sheet_range.sheet_id
_struct_sheet_range.id
_struct_sheet_range.beg_label_comp_id
_struct_sheet_range.beg_label_asym_id
_struct_sheet_range.beg_label_seq_id
_struct_sheet_range.pdbx_beg_PDB_ins_code
_struct_sheet_range.end_label_comp_id
_struct_sheet_range.end_label_asym_id
_struct_sheet_range.end_label_seq_id
_struct_sheet_range.pdbx_end_PDB_ins_code
_struct_sheet_range.symmetry
_struct_sheet_range.beg_auth_comp_id
_struct_sheet_range.beg_auth_asym_id
_struct_sheet_range.beg_auth_seq_id
_struct_sheet_range.end_auth_comp_id
_struct_sheet_range.end_auth_asym_id
_struct_sheet_range.end_auth_seq_id
A 3 VAL A 17 . ILE A 23 . ? VAL A 17 ILE A 23 
B 1 ASN A 29 . LEU A 33 . ? ASN A 29 LEU A 33 
B 2 LEU A 40 . VAL A 45 . ? LEU A 40 VAL A 45 
A 4 ASP A 55 . ILE A 58 . ? ASP A 55 ILE A 58 
A 5 ASP A 71 . VAL A 74 . ? ASP A 71 VAL A 74 
A 7 ILE A 85 . ASP A 98 . ? ILE A 85 ASP A 98 
A 6 LYS A 105 . PRO A 110 . ? LYS A 105 PRO A 110 
A 8 THR A 148 . ASN A 155 . ? THR A 148 ASN A 155 
A 3 VAL A-2 17 . ILE A-2 23 . ? VAL A-2 17 ILE A-2 23 
B 1 ASN A-2 29 . LEU A-2 33 . ? ASN A-2 29 LEU A-2 33 
B 2 LEU A-2 40 . VAL A-2 45 . ? LEU A-2 40 VAL A-2 45 
A 4 ASP A-2 55 . ILE A-2 58 . ? ASP A-2 55 ILE A-2 58 
A 5 ASP A-2 71 . VAL A-2 74 . ? ASP A-2 71 VAL A-2 74 
A 7 ILE A-2 85 . ASP A-2 98 . ? ILE A-2 85 ASP A-2 98 
A 6 LYS A-2 105 . PRO A-2 110 . ? LYS A-2 105 PRO A-2 110 
A 8 THR A-2 148 . ASN A-2 155 . ? THR A-2 148 ASN A-2 155 
A 3 VAL A-3 17 . ILE A-3 23 . ? VAL A-3 17 ILE A-3 23 
B 1 ASN A-3 29 . LEU A-3 33 . ? ASN A-3 29 LEU A-3 33 
B 2 LEU A-3 40 . VAL A-3 45 . ? LEU A-3 40 VAL A-3 45 
A 4 ASP A-3 55 . ILE A-3 58 . ? ASP A-3 55 ILE A-3 58 
A 5 ASP A-3 71 . VAL A-3 74 . ? ASP A-3 71 VAL A-3 74 
A 7 ILE A-3 85 . ASP A-3 98 . ? ILE A-3 85 ASP A-3 98 
A 6 LYS A-3 105 . PRO A-3 110 . ? LYS A-3 105 PRO A-3 110 
A 8 THR A-3 148 . ASN A-3 155 . ? THR A-3 148 ASN A-3 155 
A 3 VAL A-4 17 . ILE A-4 23 . ? VAL A-4 17 ILE A-4 23 
B 1 ASN A-4 29 . LEU A-4 33 . ? ASN A-4 29 LEU A-4 33 
B 2 LEU A-4 40 . VAL A-4 45 . ? LEU A-4 40 VAL A-4 45 
A 4 ASP A-4 55 . ILE A-4 58 . ? ASP A-4 55 ILE A-4 58 
A 5 ASP A-4 71 . VAL A-4 74 . ? ASP A-4 71 VAL A-4 74 
A 7 ILE A-4 85 . ASP A-4 98 . ? ILE A-4 85 ASP A-4 98 
A 6 LYS A-4 105 . PRO A-4 110 . ? LYS A-4 105 PRO A-4 110 
A 8 THR A-4 148 . ASN A-4 155 . ? THR A-4 148 ASN A-4 155 
A 3 VAL A-5 17 . ILE A-5 23 . ? VAL A-5 17 ILE A-5 23 
B 1 ASN A-5 29 . LEU A-5 33 . ? ASN A-5 29 LEU A-5 33 
B 2 LEU A-5 40 . VAL A-5 45 . ? LEU A-5 40 VAL A-5 45 
A 4 ASP A-5 55 . ILE A-5 58 . ? ASP A-5 55 ILE A-5 58 
A 5 ASP A-5 71 . VAL A-5 74 . ? ASP A-5 71 VAL A-5 74 
A 7 ILE A-5 85 . ASP A-5 98 . ? ILE A-5 85 ASP A-5 98 
A 6 LYS A-5 105 . PRO A-5 110 . ? LYS A-5 105 PRO A-5 110 
A 8 THR A-5 148 . ASN A-5 155 . ? THR A-5 148 ASN A-5 155 
A 3 VAL A-6 17 . ILE A-6 23 . ? VAL A-6 17 ILE A-6 23 
B 1 ASN A-6 29 . LEU A-6 33 . ? ASN A-6 29 LEU A-6 33 
B 2 LEU A-6 40 . VAL A-6 45 . ? LEU A-6 40 VAL A-6 45 
A 4 ASP A-6 55 . ILE A-6 58 . ? ASP A-6 55 ILE A-6 58 
A 5 ASP A-6 71 . VAL A-6 74 . ? ASP A-6 71 VAL A-6 74 
A 7 ILE A-6 85 . ASP A-6 98 . ? ILE A-6 85 ASP A-6 98 
A 6 LYS A-6 105 . PRO A-6 110 . ? LYS A-6 105 PRO A-6 110 
A 8 THR A-6 148 . ASN A-6 155 . ? THR A-6 148 ASN A-6 155 
#
_entity_poly.entity_id                       1 
_entity_poly.type                            polypeptide(L) 
_entity_poly.nstd_linkage                    no 
_entity_poly.nstd_monomer                    no 
_entity_poly.pdbx_seq_one_letter_code        
;MNPFHELEPGPEVPEVVYALIEIPKGSRNKYELDKATGLLKLDRVLYSPFFYPVDYGIIPQTWYDDGDPFDIMVIMREPV
YPLTIIEARPIGIMKMEDSGDKDWKVLAVPVEDPYFNDWKDISDVPKAFLDEIAHFFQRYKELQGKTTKIEGWGNAEEAK
REILRAIEMYKEKFGKEE
; 

_entity_poly.pdbx_seq_one_letter_code_can    
;MNPFHELEPGPEVPEVVYALIEIPKGSRNKYELDKATGLLKLDRVLYSPFFYPVDYGIIPQTWYDDGDPFDIMVIMREPV
YPLTIIEARPIGIMKMEDSGDKDWKVLAVPVEDPYFNDWKDISDVPKAFLDEIAHFFQRYKELQGKTTKIEGWGNAEEAK
REILRAIEMYKEKFGKEE
; 

_entity_poly.pdbx_strand_id                  A,A-2,A-3,A-4,A-5,A-6 
#
loop_
_struct_asym.id
_struct_asym.pdbx_blank_PDB_chainid_flag
_struct_asym.pdbx_modified
_struct_asym.entity_id
_struct_asym.details
A N Y 1 'Might not contain all original atoms depending on the query used' 
A-2 N Y 1 'Added by the Coordinate Server' 
A-3 N Y 1 'Added by the Coordinate Server' 
A-4 N Y 1 'Added by the Coordinate Server' 
A-5 N Y 1 'Added by the Coordinate Server' 
A-6 N Y 1 'Added by the Coordinate Server' 
B N Y 2 'Might not contain all original atoms depending on the query used' 
B-2 N Y 2 'Added by the Coordinate Server' 
B-3 N Y 2 'Added by the Coordinate Server' 
B-4 N Y 2 'Added by the Coordinate Server' 
B-5 N Y 2 'Added by the Coordinate Server' 
B-6 N Y 2 'Added by the Coordinate Server' 
C N Y 3 'Might not contain all original atoms depending on the query used' 
D N Y 3 'Might not contain all original atoms depending on the query used' 
E N Y 3 'Might not contain all original atoms depending on the query used' 
F N Y 3 'Might not contain all original atoms depending on the query used' 
C-2 N Y 3 'Added by the Coordinate Server' 
D-2 N Y 3 'Added by the Coordinate Server' 
E-2 N Y 3 'Added by the Coordinate Server' 
F-2 N Y 3 'Added by the Coordinate Server' 
C-3 N Y 3 'Added by the Coordinate Server' 
D-3 N Y 3 'Added by the Coordinate Server' 
E-3 N Y 3 'Added by the Coordinate Server' 
F-3 N Y 3 'Added by the Coordinate Server' 
C-4 N Y 3 'Added by the Coordinate Server' 
D-4 N Y 3 'Added by the Coordinate Server' 
E-4 N Y 3 'Added by the Coordinate Server' 
F-4 N Y 3 'Added by the Coordinate Server' 
C-5 N Y 3 'Added by the Coordinate Server' 
D-5 N Y 3 'Added by the Coordinate Server' 
E-5 N Y 3 'Added by the Coordinate Server' 
F-5 N Y 3 'Added by the Coordinate Server' 
C-6 N Y 3 'Added by the Coordinate Server' 
D-6 N Y 3 'Added by the Coordinate Server' 
E-6 N Y 3 'Added by the Coordinate Server' 
F-6 N Y 3 'Added by the Coordinate Server' 
G N Y 4 'Might not contain all original atoms depending on the query used' 
G-2 N Y 4 'Added by the Coordinate Server' 
G-3 N Y 4 'Added by the Coordinate Server' 
G-4 N Y 4 'Added by the Coordinate Server' 
G-5 N Y 4 'Added by the Coordinate Server' 
G-6 N Y 4 'Added by the Coordinate Server' 
H N Y 5 'Might not contain all original atoms depending on the query used' 
H-2 N Y 5 'Added by the Coordinate Server' 
H-3 N Y 5 'Added by the Coordinate Server' 
H-4 N Y 5 'Added by the Coordinate Server' 
H-5 N Y 5 'Added by the Coordinate Server' 
H-6 N Y 5 'Added by the Coordinate Server' 
I N Y 6 'Might not contain all original atoms depending on the query used' 
I-2 N Y 6 'Added by the Coordinate Server' 
I-3 N Y 6 'Added by the Coordinate Server' 
I-4 N Y 6 'Added by the Coordinate Server' 
I-5 N Y 6 'Added by the Coordinate Server' 
I-6 N Y 6 'Added by the Coordinate Server' 
#
loop_
_struct_conn.id
_struct_conn.conn_type_id
_struct_conn.pdbx_PDB_id
_struct_conn.ptnr1_label_asym_id
_struct_conn.ptnr1_label_comp_id
_struct_conn.ptnr1_label_seq_id
_struct_conn.ptnr1_label_atom_id
_struct_conn.pdbx_ptnr1_label_alt_id
_struct_conn.pdbx_ptnr1_PDB_ins_code
_struct_conn.pdbx_ptnr1_standard_comp_id
_struct_conn.ptnr1_symmetry
_struct_conn.ptnr2_label_asym_id
_struct_conn.ptnr2_label_comp_id
_struct_conn.ptnr2_label_seq_id
_struct_conn.ptnr2_label_atom_id
_struct_conn.pdbx_ptnr2_label_alt_id
_struct_conn.pdbx_ptnr2_PDB_ins_code
_struct_conn.ptnr1_auth_asym_id
_struct_conn.ptnr1_auth_comp_id
_struct_conn.ptnr1_auth_seq_id
_struct_conn.ptnr2_auth_asym_id
_struct_conn.ptnr2_auth_comp_id
_struct_conn.ptnr2_auth_seq_id
_struct_conn.ptnr2_symmetry
_struct_conn.pdbx_ptnr3_label_asym_id
_struct_conn.pdbx_ptnr3_label_comp_id
_struct_conn.pdbx_ptnr3_label_seq_id
_struct_conn.pdbx_ptnr3_label_alt_id
_struct_conn.pdbx_ptnr3_label_atom_id
_struct_conn.pdbx_ptnr3_PDB_ins_code
_struct_conn.details
_struct_conn.pdbx_dist_value
_struct_conn.pdbx_value_order
metalc1 metalc ? B PO4 . O3 ? ? ? 1_555 F MG . MG ? ? A PO4 301 A MG 308 1_555 ? ? ? ? ? ? ? 2.015 ? 
metalc2 metalc ? A ASP 98 OD2 ? ? ? 1_555 E MG . MG ? ? A ASP 98 A MG 307 1_555 ? ? ? ? ? ? ? 2.017 ? 
metalc3 metalc ? A ASP 71 OD2 ? ? ? 1_555 C MG . MG ? ? A ASP 71 A MG 305 1_555 ? ? ? ? ? ? ? 2.024 ? 
metalc4 metalc ? A ASP 103 OD2 ? ? ? 1_555 E MG . MG ? ? A ASP 103 A MG 307 1_555 ? ? ? ? ? ? ? 2.026 ? 
metalc5 metalc ? C MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 305 A HOH 465 1_555 ? ? ? ? ? ? ? 2.041 ? 
metalc6 metalc ? F MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 308 A HOH 455 1_555 ? ? ? ? ? ? ? 2.045 ? 
metalc7 metalc ? B PO4 . O2 ? ? ? 1_555 E MG . MG ? ? A PO4 301 A MG 307 1_555 ? ? ? ? ? ? ? 2.051 ? 
metalc8 metalc ? D MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 306 A HOH 454 1_555 ? ? ? ? ? ? ? 2.054 ? 
metalc9 metalc ? F MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 308 A HOH 232 1_555 ? ? ? ? ? ? ? 2.055 ? 
metalc10 metalc ? F MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 308 A HOH 458 1_555 ? ? ? ? ? ? ? 2.057 ? 
metalc11 metalc ? C MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 305 A HOH 184 1_555 ? ? ? ? ? ? ? 2.059 ? 
metalc12 metalc ? A GLU 32 OE1 ? ? ? 1_555 F MG . MG ? ? A GLU 32 A MG 308 1_555 ? ? ? ? ? ? ? 2.076 ? 
metalc13 metalc ? A ASP 103 OD1 ? ? ? 1_555 D MG . MG ? ? A ASP 103 A MG 306 1_555 ? ? ? ? ? ? ? 2.077 ? 
metalc14 metalc ? A ASP 71 OD1 ? ? ? 1_555 D MG . MG ? ? A ASP 71 A MG 306 1_555 ? ? ? ? ? ? ? 2.085 ? 
metalc15 metalc ? A ASP 66 OD2 ? ? ? 1_555 D MG . MG ? ? A ASP 66 A MG 306 1_555 ? ? ? ? ? ? ? 2.088 ? 
metalc16 metalc ? C MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 305 A HOH 185 1_555 ? ? ? ? ? ? ? 2.092 ? 
metalc17 metalc ? E MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 307 A HOH 218 1_555 ? ? ? ? ? ? ? 2.098 ? 
metalc18 metalc ? F MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 308 A HOH 457 1_555 ? ? ? ? ? ? ? 2.100 ? 
metalc19 metalc ? E MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 307 A HOH 211 1_555 ? ? ? ? ? ? ? 2.108 ? 
metalc20 metalc ? E MG . MG ? ? ? 1_555 I HOH . O ? ? A MG 307 A HOH 213 1_555 ? ? ? ? ? ? ? 2.112 ? 
metalc21 metalc ? B PO4 . O4 ? ? ? 1_555 C MG . MG ? ? A PO4 301 A MG 305 1_555 ? ? ? ? ? ? ? 2.119 ? 
metalc22 metalc ? B PO4 . O2 ? ? ? 1_555 D MG . MG ? ? A PO4 301 A MG 306 1_555 ? ? ? ? ? ? ? 2.174 ? 
metalc23 metalc ? B PO4 . O4 ? ? ? 1_555 D MG . MG ? ? A PO4 301 A MG 306 1_555 ? ? ? ? ? ? ? 2.177 ? 
metalc24 metalc ? B PO4 . O1 ? ? ? 1_555 C MG . MG ? ? A PO4 301 A MG 305 1_555 ? ? ? ? ? ? ? 2.194 ? 
#
_struct_conn_type.id           metalc 
_struct_conn_type.criteria     ? 
_struct_conn_type.reference    ? 
#
loop_
_chem_comp_bond.comp_id
_chem_comp_bond.pdbx_stereo_config
_chem_comp_bond.pdbx_ordinal
_chem_comp_bond.pdbx_aromatic_flag
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.value_order
ALA N 1 N N CA SING 
ALA N 2 N N H SING 
ALA N 3 N N H2 SING 
ALA N 4 N CA C SING 
ALA N 5 N CA CB SING 
ALA N 6 N CA HA SING 
ALA N 7 N C O DOUB 
ALA N 8 N C OXT SING 
ALA N 9 N CB HB1 SING 
ALA N 10 N CB HB2 SING 
ALA N 11 N CB HB3 SING 
ALA N 12 N OXT HXT SING 
ARG N 1 N N CA SING 
ARG N 2 N N H SING 
ARG N 3 N N H2 SING 
ARG N 4 N CA C SING 
ARG N 5 N CA CB SING 
ARG N 6 N CA HA SING 
ARG N 7 N C O DOUB 
ARG N 8 N C OXT SING 
ARG N 9 N CB CG SING 
ARG N 10 N CB HB2 SING 
ARG N 11 N CB HB3 SING 
ARG N 12 N CG CD SING 
ARG N 13 N CG HG2 SING 
ARG N 14 N CG HG3 SING 
ARG N 15 N CD NE SING 
ARG N 16 N CD HD2 SING 
ARG N 17 N CD HD3 SING 
ARG N 18 N NE CZ SING 
ARG N 19 N NE HE SING 
ARG N 20 N CZ NH1 SING 
ARG N 21 N CZ NH2 DOUB 
ARG N 22 N NH1 HH11 SING 
ARG N 23 N NH1 HH12 SING 
ARG N 24 N NH2 HH21 SING 
ARG N 25 N NH2 HH22 SING 
ARG N 26 N OXT HXT SING 
ASN N 1 N N CA SING 
ASN N 2 N N H SING 
ASN N 3 N N H2 SING 
ASN N 4 N CA C SING 
ASN N 5 N CA CB SING 
ASN N 6 N CA HA SING 
ASN N 7 N C O DOUB 
ASN N 8 N C OXT SING 
ASN N 9 N CB CG SING 
ASN N 10 N CB HB2 SING 
ASN N 11 N CB HB3 SING 
ASN N 12 N CG OD1 DOUB 
ASN N 13 N CG ND2 SING 
ASN N 14 N ND2 HD21 SING 
ASN N 15 N ND2 HD22 SING 
ASN N 16 N OXT HXT SING 
ASP N 1 N N CA SING 
ASP N 2 N N H SING 
ASP N 3 N N H2 SING 
ASP N 4 N CA C SING 
ASP N 5 N CA CB SING 
ASP N 6 N CA HA SING 
ASP N 7 N C O DOUB 
ASP N 8 N C OXT SING 
ASP N 9 N CB CG SING 
ASP N 10 N CB HB2 SING 
ASP N 11 N CB HB3 SING 
ASP N 12 N CG OD1 DOUB 
ASP N 13 N CG OD2 SING 
ASP N 14 N OD2 HD2 SING 
ASP N 15 N OXT HXT SING 
EPE N 1 N N1 C2 SING 
EPE N 2 N N1 C6 SING 
EPE N 3 N N1 C9 SING 
EPE N 4 N C2 C3 SING 
EPE N 5 N C2 H21 SING 
EPE N 6 N C2 H22 SING 
EPE N 7 N C3 N4 SING 
EPE N 8 N C3 H31 SING 
EPE N 9 N C3 H32 SING 
EPE N 10 N N4 C5 SING 
EPE N 11 N N4 C7 SING 
EPE N 12 N C5 C6 SING 
EPE N 13 N C5 H51 SING 
EPE N 14 N C5 H52 SING 
EPE N 15 N C6 H61 SING 
EPE N 16 N C6 H62 SING 
EPE N 17 N C7 C8 SING 
EPE N 18 N C7 H71 SING 
EPE N 19 N C7 H72 SING 
EPE N 20 N C8 O8 SING 
EPE N 21 N C8 H81 SING 
EPE N 22 N C8 H82 SING 
EPE N 23 N O8 HO8 SING 
EPE N 24 N C9 C10 SING 
EPE N 25 N C9 H91 SING 
EPE N 26 N C9 H92 SING 
EPE N 27 N C10 S SING 
EPE N 28 N C10 H101 SING 
EPE N 29 N C10 H102 SING 
EPE N 30 N S O1S DOUB 
EPE N 31 N S O2S DOUB 
EPE N 32 N S O3S SING 
EPE N 33 N O3S HOS3 SING 
GLN N 1 N N CA SING 
GLN N 2 N N H SING 
GLN N 3 N N H2 SING 
GLN N 4 N CA C SING 
GLN N 5 N CA CB SING 
GLN N 6 N CA HA SING 
GLN N 7 N C O DOUB 
GLN N 8 N C OXT SING 
GLN N 9 N CB CG SING 
GLN N 10 N CB HB2 SING 
GLN N 11 N CB HB3 SING 
GLN N 12 N CG CD SING 
GLN N 13 N CG HG2 SING 
GLN N 14 N CG HG3 SING 
GLN N 15 N CD OE1 DOUB 
GLN N 16 N CD NE2 SING 
GLN N 17 N NE2 HE21 SING 
GLN N 18 N NE2 HE22 SING 
GLN N 19 N OXT HXT SING 
GLU N 1 N N CA SING 
GLU N 2 N N H SING 
GLU N 3 N N H2 SING 
GLU N 4 N CA C SING 
GLU N 5 N CA CB SING 
GLU N 6 N CA HA SING 
GLU N 7 N C O DOUB 
GLU N 8 N C OXT SING 
GLU N 9 N CB CG SING 
GLU N 10 N CB HB2 SING 
GLU N 11 N CB HB3 SING 
GLU N 12 N CG CD SING 
GLU N 13 N CG HG2 SING 
GLU N 14 N CG HG3 SING 
GLU N 15 N CD OE1 DOUB 
GLU N 16 N CD OE2 SING 
GLU N 17 N OE2 HE2 SING 
GLU N 18 N OXT HXT SING 
GLY N 1 N N CA SING 
GLY N 2 N N H SING 
GLY N 3 N N H2 SING 
GLY N 4 N CA C SING 
GLY N 5 N CA HA2 SING 
GLY N 6 N CA HA3 SING 
GLY N 7 N C O DOUB 
GLY N 8 N C OXT SING 
GLY N 9 N OXT HXT SING 
HIS N 1 N N CA SING 
HIS N 2 N N H SING 
HIS N 3 N N H2 SING 
HIS N 4 N CA C SING 
HIS N 5 N CA CB SING 
HIS N 6 N CA HA SING 
HIS N 7 N C O DOUB 
HIS N 8 N C OXT SING 
HIS N 9 N CB CG SING 
HIS N 10 N CB HB2 SING 
HIS N 11 N CB HB3 SING 
HIS N 12 Y CG ND1 SING 
HIS N 13 Y CG CD2 DOUB 
HIS N 14 Y ND1 CE1 DOUB 
HIS N 15 N ND1 HD1 SING 
HIS N 16 Y CD2 NE2 SING 
HIS N 17 N CD2 HD2 SING 
HIS N 18 Y CE1 NE2 SING 
HIS N 19 N CE1 HE1 SING 
HIS N 20 N NE2 HE2 SING 
HIS N 21 N OXT HXT SING 
HOH N 1 N O H1 SING 
HOH N 2 N O H2 SING 
ILE N 1 N N CA SING 
ILE N 2 N N H SING 
ILE N 3 N N H2 SING 
ILE N 4 N CA C SING 
ILE N 5 N CA CB SING 
ILE N 6 N CA HA SING 
ILE N 7 N C O DOUB 
ILE N 8 N C OXT SING 
ILE N 9 N CB CG1 SING 
ILE N 10 N CB CG2 SING 
ILE N 11 N CB HB SING 
ILE N 12 N CG1 CD1 SING 
ILE N 13 N CG1 HG12 SING 
ILE N 14 N CG1 HG13 SING 
ILE N 15 N CG2 HG21 SING 
ILE N 16 N CG2 HG22 SING 
ILE N 17 N CG2 HG23 SING 
ILE N 18 N CD1 HD11 SING 
ILE N 19 N CD1 HD12 SING 
ILE N 20 N CD1 HD13 SING 
ILE N 21 N OXT HXT SING 
LEU N 1 N N CA SING 
LEU N 2 N N H SING 
LEU N 3 N N H2 SING 
LEU N 4 N CA C SING 
LEU N 5 N CA CB SING 
LEU N 6 N CA HA SING 
LEU N 7 N C O DOUB 
LEU N 8 N C OXT SING 
LEU N 9 N CB CG SING 
LEU N 10 N CB HB2 SING 
LEU N 11 N CB HB3 SING 
LEU N 12 N CG CD1 SING 
LEU N 13 N CG CD2 SING 
LEU N 14 N CG HG SING 
LEU N 15 N CD1 HD11 SING 
LEU N 16 N CD1 HD12 SING 
LEU N 17 N CD1 HD13 SING 
LEU N 18 N CD2 HD21 SING 
LEU N 19 N CD2 HD22 SING 
LEU N 20 N CD2 HD23 SING 
LEU N 21 N OXT HXT SING 
LYS N 1 N N CA SING 
LYS N 2 N N H SING 
LYS N 3 N N H2 SING 
LYS N 4 N CA C SING 
LYS N 5 N CA CB SING 
LYS N 6 N CA HA SING 
LYS N 7 N C O DOUB 
LYS N 8 N C OXT SING 
LYS N 9 N CB CG SING 
LYS N 10 N CB HB2 SING 
LYS N 11 N CB HB3 SING 
LYS N 12 N CG CD SING 
LYS N 13 N CG HG2 SING 
LYS N 14 N CG HG3 SING 
LYS N 15 N CD CE SING 
LYS N 16 N CD HD2 SING 
LYS N 17 N CD HD3 SING 
LYS N 18 N CE NZ SING 
LYS N 19 N CE HE2 SING 
LYS N 20 N CE HE3 SING 
LYS N 21 N NZ HZ1 SING 
LYS N 22 N NZ HZ2 SING 
LYS N 23 N NZ HZ3 SING 
LYS N 24 N OXT HXT SING 
MET N 1 N N CA SING 
MET N 2 N N H SING 
MET N 3 N N H2 SING 
MET N 4 N CA C SING 
MET N 5 N CA CB SING 
MET N 6 N CA HA SING 
MET N 7 N C O DOUB 
MET N 8 N C OXT SING 
MET N 9 N CB CG SING 
MET N 10 N CB HB2 SING 
MET N 11 N CB HB3 SING 
MET N 12 N CG SD SING 
MET N 13 N CG HG2 SING 
MET N 14 N CG HG3 SING 
MET N 15 N SD CE SING 
MET N 16 N CE HE1 SING 
MET N 17 N CE HE2 SING 
MET N 18 N CE HE3 SING 
MET N 19 N OXT HXT SING 
PHE N 1 N N CA SING 
PHE N 2 N N H SING 
PHE N 3 N N H2 SING 
PHE N 4 N CA C SING 
PHE N 5 N CA CB SING 
PHE N 6 N CA HA SING 
PHE N 7 N C O DOUB 
PHE N 8 N C OXT SING 
PHE N 9 N CB CG SING 
PHE N 10 N CB HB2 SING 
PHE N 11 N CB HB3 SING 
PHE N 12 Y CG CD1 DOUB 
PHE N 13 Y CG CD2 SING 
PHE N 14 Y CD1 CE1 SING 
PHE N 15 N CD1 HD1 SING 
PHE N 16 Y CD2 CE2 DOUB 
PHE N 17 N CD2 HD2 SING 
PHE N 18 Y CE1 CZ DOUB 
PHE N 19 N CE1 HE1 SING 
PHE N 20 Y CE2 CZ SING 
PHE N 21 N CE2 HE2 SING 
PHE N 22 N CZ HZ SING 
PHE N 23 N OXT HXT SING 
PO4 N 1 N P O1 DOUB 
PO4 N 2 N P O2 SING 
PO4 N 3 N P O3 SING 
PO4 N 4 N P O4 SING 
PRO N 1 N N CA SING 
PRO N 2 N N CD SING 
PRO N 3 N N H SING 
PRO N 4 N CA C SING 
PRO N 5 N CA CB SING 
PRO N 6 N CA HA SING 
PRO N 7 N C O DOUB 
PRO N 8 N C OXT SING 
PRO N 9 N CB CG SING 
PRO N 10 N CB HB2 SING 
PRO N 11 N CB HB3 SING 
PRO N 12 N CG CD SING 
PRO N 13 N CG HG2 SING 
PRO N 14 N CG HG3 SING 
PRO N 15 N CD HD2 SING 
PRO N 16 N CD HD3 SING 
PRO N 17 N OXT HXT SING 
SER N 1 N N CA SING 
SER N 2 N N H SING 
SER N 3 N N H2 SING 
SER N 4 N CA C SING 
SER N 5 N CA CB SING 
SER N 6 N CA HA SING 
SER N 7 N C O DOUB 
SER N 8 N C OXT SING 
SER N 9 N CB OG SING 
SER N 10 N CB HB2 SING 
SER N 11 N CB HB3 SING 
SER N 12 N OG HG SING 
SER N 13 N OXT HXT SING 
THR N 1 N N CA SING 
THR N 2 N N H SING 
THR N 3 N N H2 SING 
THR N 4 N CA C SING 
THR N 5 N CA CB SING 
THR N 6 N CA HA SING 
THR N 7 N C O DOUB 
THR N 8 N C OXT SING 
THR N 9 N CB OG1 SING 
THR N 10 N CB CG2 SING 
THR N 11 N CB HB SING 
THR N 12 N OG1 HG1 SING 
THR N 13 N CG2 HG21 SING 
THR N 14 N CG2 HG22 SING 
THR N 15 N CG2 HG23 SING 
THR N 16 N OXT HXT SING 
TRP N 1 N N CA SING 
TRP N 2 N N H SING 
TRP N 3 N N H2 SING 
TRP N 4 N CA C SING 
TRP N 5 N CA CB SING 
TRP N 6 N CA HA SING 
TRP N 7 N C O DOUB 
TRP N 8 N C OXT SING 
TRP N 9 N CB CG SING 
TRP N 10 N CB HB2 SING 
TRP N 11 N CB HB3 SING 
TRP N 12 Y CG CD1 DOUB 
TRP N 13 Y CG CD2 SING 
TRP N 14 Y CD1 NE1 SING 
TRP N 15 N CD1 HD1 SING 
TRP N 16 Y CD2 CE2 DOUB 
TRP N 17 Y CD2 CE3 SING 
TRP N 18 Y NE1 CE2 SING 
TRP N 19 N NE1 HE1 SING 
TRP N 20 Y CE2 CZ2 SING 
TRP N 21 Y CE3 CZ3 DOUB 
TRP N 22 N CE3 HE3 SING 
TRP N 23 Y CZ2 CH2 DOUB 
TRP N 24 N CZ2 HZ2 SING 
TRP N 25 Y CZ3 CH2 SING 
TRP N 26 N CZ3 HZ3 SING 
TRP N 27 N CH2 HH2 SING 
TRP N 28 N OXT HXT SING 
TYR N 1 N N CA SING 
TYR N 2 N N H SING 
TYR N 3 N N H2 SING 
TYR N 4 N CA C SING 
TYR N 5 N CA CB SING 
TYR N 6 N CA HA SING 
TYR N 7 N C O DOUB 
TYR N 8 N C OXT SING 
TYR N 9 N CB CG SING 
TYR N 10 N CB HB2 SING 
TYR N 11 N CB HB3 SING 
TYR N 12 Y CG CD1 DOUB 
TYR N 13 Y CG CD2 SING 
TYR N 14 Y CD1 CE1 SING 
TYR N 15 N CD1 HD1 SING 
TYR N 16 Y CD2 CE2 DOUB 
TYR N 17 N CD2 HD2 SING 
TYR N 18 Y CE1 CZ DOUB 
TYR N 19 N CE1 HE1 SING 
TYR N 20 Y CE2 CZ SING 
TYR N 21 N CE2 HE2 SING 
TYR N 22 N CZ OH SING 
TYR N 23 N OH HH SING 
TYR N 24 N OXT HXT SING 
VAL N 1 N N CA SING 
VAL N 2 N N H SING 
VAL N 3 N N H2 SING 
VAL N 4 N CA C SING 
VAL N 5 N CA CB SING 
VAL N 6 N CA HA SING 
VAL N 7 N C O DOUB 
VAL N 8 N C OXT SING 
VAL N 9 N CB CG1 SING 
VAL N 10 N CB CG2 SING 
VAL N 11 N CB HB SING 
VAL N 12 N CG1 HG11 SING 
VAL N 13 N CG1 HG12 SING 
VAL N 14 N CG1 HG13 SING 
VAL N 15 N CG2 HG21 SING 
VAL N 16 N CG2 HG22 SING 
VAL N 17 N CG2 HG23 SING 
VAL N 18 N OXT HXT SING 
#
_atom_sites.entry_id                     3Q46 
_atom_sites.fract_transf_matrix[1][1]    0.010075 
_atom_sites.fract_transf_matrix[1][2]    0.005817 
_atom_sites.fract_transf_matrix[1][3]    0 
_atom_sites.fract_transf_vector[1]       0 
_atom_sites.fract_transf_matrix[2][1]    0 
_atom_sites.fract_transf_matrix[2][2]    0.011634 
_atom_sites.fract_transf_matrix[2][3]    0 
_atom_sites.fract_transf_vector[2]       0 
_atom_sites.fract_transf_matrix[3][1]    0 
_atom_sites.fract_transf_matrix[3][2]    0 
_atom_sites.fract_transf_matrix[3][3]    0.010146 
_atom_sites.fract_transf_vector[3]       0 
#
loop_
_pdbx_nonpoly_scheme.asym_id
_pdbx_nonpoly_scheme.entity_id
_pdbx_nonpoly_scheme.mon_id
_pdbx_nonpoly_scheme.ndb_seq_num
_pdbx_nonpoly_scheme.pdb_seq_num
_pdbx_nonpoly_scheme.auth_seq_num
_pdbx_nonpoly_scheme.pdb_mon_id
_pdbx_nonpoly_scheme.auth_mon_id
_pdbx_nonpoly_scheme.pdb_strand_id
_pdbx_nonpoly_scheme.pdb_ins_code
B 2 PO4 1 301 301 PO4 PO4 A . 
C 3 MG 1 305 305 MG MG A . 
D 3 MG 1 306 306 MG MG A . 
E 3 MG 1 307 307 MG MG A . 
F 3 MG 1 308 308 MG MG A . 
G 4 EPE 1 309 309 EPE EPE A . 
H 5 CL 1 310 310 CL CL A . 
I 6 HOH 1 179 179 HOH HOH A . 
I 6 HOH 2 180 180 HOH HOH A . 
I 6 HOH 3 181 181 HOH HOH A . 
I 6 HOH 4 182 182 HOH HOH A . 
I 6 HOH 5 183 183 HOH HOH A . 
I 6 HOH 6 184 184 HOH HOH A . 
I 6 HOH 7 185 185 HOH HOH A . 
I 6 HOH 8 186 186 HOH HOH A . 
I 6 HOH 9 187 187 HOH HOH A . 
I 6 HOH 10 188 188 HOH HOH A . 
I 6 HOH 11 189 189 HOH HOH A . 
I 6 HOH 12 190 190 HOH HOH A . 
I 6 HOH 13 191 191 HOH HOH A . 
I 6 HOH 14 192 192 HOH HOH A . 
I 6 HOH 15 193 193 HOH HOH A . 
I 6 HOH 16 194 194 HOH HOH A . 
I 6 HOH 17 195 195 HOH HOH A . 
I 6 HOH 18 196 196 HOH HOH A . 
I 6 HOH 19 197 197 HOH HOH A . 
I 6 HOH 20 198 198 HOH HOH A . 
I 6 HOH 21 199 199 HOH HOH A . 
I 6 HOH 22 200 200 HOH HOH A . 
I 6 HOH 23 201 201 HOH HOH A . 
I 6 HOH 24 202 202 HOH HOH A . 
I 6 HOH 25 203 203 HOH HOH A . 
I 6 HOH 26 204 204 HOH HOH A . 
I 6 HOH 27 205 205 HOH HOH A . 
I 6 HOH 28 206 206 HOH HOH A . 
I 6 HOH 29 207 207 HOH HOH A . 
I 6 HOH 30 208 208 HOH HOH A . 
I 6 HOH 31 209 209 HOH HOH A . 
I 6 HOH 32 210 210 HOH HOH A . 
I 6 HOH 33 211 211 HOH HOH A . 
I 6 HOH 34 212 212 HOH HOH A . 
I 6 HOH 35 213 213 HOH HOH A . 
I 6 HOH 36 214 214 HOH HOH A . 
I 6 HOH 37 215 215 HOH HOH A . 
I 6 HOH 38 216 216 HOH HOH A . 
I 6 HOH 39 217 217 HOH HOH A . 
I 6 HOH 40 218 218 HOH HOH A . 
I 6 HOH 41 219 219 HOH HOH A . 
I 6 HOH 42 220 220 HOH HOH A . 
I 6 HOH 43 221 221 HOH HOH A . 
I 6 HOH 44 222 222 HOH HOH A . 
I 6 HOH 45 223 223 HOH HOH A . 
I 6 HOH 46 224 224 HOH HOH A . 
I 6 HOH 47 225 225 HOH HOH A . 
I 6 HOH 48 226 226 HOH HOH A . 
I 6 HOH 49 227 227 HOH HOH A . 
I 6 HOH 50 228 228 HOH HOH A . 
I 6 HOH 51 229 229 HOH HOH A . 
I 6 HOH 52 230 230 HOH HOH A . 
I 6 HOH 53 231 231 HOH HOH A . 
I 6 HOH 54 232 232 HOH HOH A . 
I 6 HOH 55 233 233 HOH HOH A . 
I 6 HOH 56 234 234 HOH HOH A . 
I 6 HOH 57 235 235 HOH HOH A . 
I 6 HOH 58 236 236 HOH HOH A . 
I 6 HOH 59 237 237 HOH HOH A . 
I 6 HOH 60 238 238 HOH HOH A . 
I 6 HOH 61 239 239 HOH HOH A . 
I 6 HOH 62 240 240 HOH HOH A . 
I 6 HOH 63 241 241 HOH HOH A . 
I 6 HOH 64 242 242 HOH HOH A . 
I 6 HOH 65 243 243 HOH HOH A . 
I 6 HOH 66 244 244 HOH HOH A . 
I 6 HOH 67 245 245 HOH HOH A . 
I 6 HOH 68 246 246 HOH HOH A . 
I 6 HOH 69 247 247 HOH HOH A . 
I 6 HOH 70 248 248 HOH HOH A . 
I 6 HOH 71 249 249 HOH HOH A . 
I 6 HOH 72 250 250 HOH HOH A . 
I 6 HOH 73 251 251 HOH HOH A . 
I 6 HOH 74 252 252 HOH HOH A . 
I 6 HOH 75 253 253 HOH HOH A . 
I 6 HOH 76 254 254 HOH HOH A . 
I 6 HOH 77 255 255 HOH HOH A . 
I 6 HOH 78 256 256 HOH HOH A . 
I 6 HOH 79 257 257 HOH HOH A . 
I 6 HOH 80 258 258 HOH HOH A . 
I 6 HOH 81 259 259 HOH HOH A . 
I 6 HOH 82 260 260 HOH HOH A . 
I 6 HOH 83 261 261 HOH HOH A . 
I 6 HOH 84 262 262 HOH HOH A . 
I 6 HOH 85 263 263 HOH HOH A . 
I 6 HOH 86 264 264 HOH HOH A . 
I 6 HOH 87 265 265 HOH HOH A . 
I 6 HOH 88 266 266 HOH HOH A . 
I 6 HOH 89 267 267 HOH HOH A . 
I 6 HOH 90 268 268 HOH HOH A . 
I 6 HOH 91 269 269 HOH HOH A . 
I 6 HOH 92 270 270 HOH HOH A . 
I 6 HOH 93 271 271 HOH HOH A . 
I 6 HOH 94 272 272 HOH HOH A . 
I 6 HOH 95 273 273 HOH HOH A . 
I 6 HOH 96 274 274 HOH HOH A . 
I 6 HOH 97 275 275 HOH HOH A . 
I 6 HOH 98 276 276 HOH HOH A . 
I 6 HOH 99 277 277 HOH HOH A . 
I 6 HOH 100 278 278 HOH HOH A . 
I 6 HOH 101 279 279 HOH HOH A . 
I 6 HOH 102 280 280 HOH HOH A . 
I 6 HOH 103 281 281 HOH HOH A . 
I 6 HOH 104 282 282 HOH HOH A . 
I 6 HOH 105 283 283 HOH HOH A . 
I 6 HOH 106 284 284 HOH HOH A . 
I 6 HOH 107 285 285 HOH HOH A . 
I 6 HOH 108 286 286 HOH HOH A . 
I 6 HOH 109 287 287 HOH HOH A . 
I 6 HOH 110 288 288 HOH HOH A . 
I 6 HOH 111 289 289 HOH HOH A . 
I 6 HOH 112 290 290 HOH HOH A . 
I 6 HOH 113 291 291 HOH HOH A . 
I 6 HOH 114 292 292 HOH HOH A . 
I 6 HOH 115 293 293 HOH HOH A . 
I 6 HOH 116 294 294 HOH HOH A . 
I 6 HOH 117 295 295 HOH HOH A . 
I 6 HOH 118 296 296 HOH HOH A . 
I 6 HOH 119 297 297 HOH HOH A . 
I 6 HOH 120 298 298 HOH HOH A . 
I 6 HOH 121 299 299 HOH HOH A . 
I 6 HOH 122 300 300 HOH HOH A . 
I 6 HOH 123 302 302 HOH HOH A . 
I 6 HOH 124 303 303 HOH HOH A . 
I 6 HOH 125 304 304 HOH HOH A . 
I 6 HOH 126 311 311 HOH HOH A . 
I 6 HOH 127 312 312 HOH HOH A . 
I 6 HOH 128 313 313 HOH HOH A . 
I 6 HOH 129 314 314 HOH HOH A . 
I 6 HOH 130 315 315 HOH HOH A . 
I 6 HOH 131 316 316 HOH HOH A . 
I 6 HOH 132 317 317 HOH HOH A . 
I 6 HOH 133 318 318 HOH HOH A . 
I 6 HOH 134 319 319 HOH HOH A . 
I 6 HOH 135 320 320 HOH HOH A . 
I 6 HOH 136 321 321 HOH HOH A . 
I 6 HOH 137 322 322 HOH HOH A . 
I 6 HOH 138 323 323 HOH HOH A . 
I 6 HOH 139 324 324 HOH HOH A . 
I 6 HOH 140 325 325 HOH HOH A . 
I 6 HOH 141 326 326 HOH HOH A . 
I 6 HOH 142 327 327 HOH HOH A . 
I 6 HOH 143 328 328 HOH HOH A . 
I 6 HOH 144 329 329 HOH HOH A . 
I 6 HOH 145 330 330 HOH HOH A . 
I 6 HOH 146 331 331 HOH HOH A . 
I 6 HOH 147 332 332 HOH HOH A . 
I 6 HOH 148 333 333 HOH HOH A . 
I 6 HOH 149 334 334 HOH HOH A . 
I 6 HOH 150 335 335 HOH HOH A . 
I 6 HOH 151 336 336 HOH HOH A . 
I 6 HOH 152 337 337 HOH HOH A . 
I 6 HOH 153 338 338 HOH HOH A . 
I 6 HOH 154 339 339 HOH HOH A . 
I 6 HOH 155 340 340 HOH HOH A . 
I 6 HOH 156 341 341 HOH HOH A . 
I 6 HOH 157 342 342 HOH HOH A . 
I 6 HOH 158 343 343 HOH HOH A . 
I 6 HOH 159 344 344 HOH HOH A . 
I 6 HOH 160 345 345 HOH HOH A . 
I 6 HOH 161 346 346 HOH HOH A . 
I 6 HOH 162 347 347 HOH HOH A . 
I 6 HOH 163 348 348 HOH HOH A . 
I 6 HOH 164 349 349 HOH HOH A . 
I 6 HOH 165 350 350 HOH HOH A . 
I 6 HOH 166 351 351 HOH HOH A . 
I 6 HOH 167 352 352 HOH HOH A . 
I 6 HOH 168 353 353 HOH HOH A . 
I 6 HOH 169 354 354 HOH HOH A . 
I 6 HOH 170 355 355 HOH HOH A . 
I 6 HOH 171 356 356 HOH HOH A . 
I 6 HOH 172 357 357 HOH HOH A . 
I 6 HOH 173 358 358 HOH HOH A . 
I 6 HOH 174 359 359 HOH HOH A . 
I 6 HOH 175 360 360 HOH HOH A . 
I 6 HOH 176 361 361 HOH HOH A . 
I 6 HOH 177 362 362 HOH HOH A . 
I 6 HOH 178 363 363 HOH HOH A . 
I 6 HOH 179 364 364 HOH HOH A . 
I 6 HOH 180 365 365 HOH HOH A . 
I 6 HOH 181 366 366 HOH HOH A . 
I 6 HOH 182 367 367 HOH HOH A . 
I 6 HOH 183 368 368 HOH HOH A . 
I 6 HOH 184 369 369 HOH HOH A . 
I 6 HOH 185 370 370 HOH HOH A . 
I 6 HOH 186 371 371 HOH HOH A . 
I 6 HOH 187 372 372 HOH HOH A . 
I 6 HOH 188 373 373 HOH HOH A . 
I 6 HOH 189 374 374 HOH HOH A . 
I 6 HOH 190 375 375 HOH HOH A . 
I 6 HOH 191 376 376 HOH HOH A . 
I 6 HOH 192 377 377 HOH HOH A . 
I 6 HOH 193 378 378 HOH HOH A . 
I 6 HOH 194 379 379 HOH HOH A . 
I 6 HOH 195 380 380 HOH HOH A . 
I 6 HOH 196 381 381 HOH HOH A . 
I 6 HOH 197 382 382 HOH HOH A . 
I 6 HOH 198 383 383 HOH HOH A . 
I 6 HOH 199 384 384 HOH HOH A . 
I 6 HOH 200 385 385 HOH HOH A . 
I 6 HOH 201 386 386 HOH HOH A . 
I 6 HOH 202 387 387 HOH HOH A . 
I 6 HOH 203 388 388 HOH HOH A . 
I 6 HOH 204 389 389 HOH HOH A . 
I 6 HOH 205 390 390 HOH HOH A . 
I 6 HOH 206 391 391 HOH HOH A . 
I 6 HOH 207 392 392 HOH HOH A . 
I 6 HOH 208 393 393 HOH HOH A . 
I 6 HOH 209 394 394 HOH HOH A . 
I 6 HOH 210 395 395 HOH HOH A . 
I 6 HOH 211 396 396 HOH HOH A . 
I 6 HOH 212 397 397 HOH HOH A . 
I 6 HOH 213 398 398 HOH HOH A . 
I 6 HOH 214 399 399 HOH HOH A . 
I 6 HOH 215 400 400 HOH HOH A . 
I 6 HOH 216 401 401 HOH HOH A . 
I 6 HOH 217 402 402 HOH HOH A . 
I 6 HOH 218 403 403 HOH HOH A . 
I 6 HOH 219 404 404 HOH HOH A . 
I 6 HOH 220 405 405 HOH HOH A . 
I 6 HOH 221 406 406 HOH HOH A . 
I 6 HOH 222 407 407 HOH HOH A . 
I 6 HOH 223 408 408 HOH HOH A . 
I 6 HOH 224 409 409 HOH HOH A . 
I 6 HOH 225 410 410 HOH HOH A . 
I 6 HOH 226 411 411 HOH HOH A . 
I 6 HOH 227 412 412 HOH HOH A . 
I 6 HOH 228 413 413 HOH HOH A . 
I 6 HOH 229 414 414 HOH HOH A . 
I 6 HOH 230 415 415 HOH HOH A . 
I 6 HOH 231 416 416 HOH HOH A . 
I 6 HOH 232 417 417 HOH HOH A . 
I 6 HOH 233 418 418 HOH HOH A . 
I 6 HOH 234 419 419 HOH HOH A . 
I 6 HOH 235 420 420 HOH HOH A . 
I 6 HOH 236 421 421 HOH HOH A . 
I 6 HOH 237 422 422 HOH HOH A . 
I 6 HOH 238 423 423 HOH HOH A . 
I 6 HOH 239 424 424 HOH HOH A . 
I 6 HOH 240 425 425 HOH HOH A . 
I 6 HOH 241 426 426 HOH HOH A . 
I 6 HOH 242 427 427 HOH HOH A . 
I 6 HOH 243 428 428 HOH HOH A . 
I 6 HOH 244 429 429 HOH HOH A . 
I 6 HOH 245 430 430 HOH HOH A . 
I 6 HOH 246 431 431 HOH HOH A . 
I 6 HOH 247 432 432 HOH HOH A . 
I 6 HOH 248 433 433 HOH HOH A . 
I 6 HOH 249 434 434 HOH HOH A . 
I 6 HOH 250 435 435 HOH HOH A . 
I 6 HOH 251 436 436 HOH HOH A . 
I 6 HOH 252 437 437 HOH HOH A . 
I 6 HOH 253 438 438 HOH HOH A . 
I 6 HOH 254 439 439 HOH HOH A . 
I 6 HOH 255 440 440 HOH HOH A . 
I 6 HOH 256 441 441 HOH HOH A . 
I 6 HOH 257 442 442 HOH HOH A . 
I 6 HOH 258 443 443 HOH HOH A . 
I 6 HOH 259 444 444 HOH HOH A . 
I 6 HOH 260 445 445 HOH HOH A . 
I 6 HOH 261 446 446 HOH HOH A . 
I 6 HOH 262 447 447 HOH HOH A . 
I 6 HOH 263 448 448 HOH HOH A . 
I 6 HOH 264 449 449 HOH HOH A . 
I 6 HOH 265 450 450 HOH HOH A . 
I 6 HOH 266 451 451 HOH HOH A . 
I 6 HOH 267 452 452 HOH HOH A . 
I 6 HOH 268 453 453 HOH HOH A . 
I 6 HOH 269 454 454 HOH HOH A . 
I 6 HOH 270 455 455 HOH HOH A . 
I 6 HOH 271 456 456 HOH HOH A . 
I 6 HOH 272 457 457 HOH HOH A . 
I 6 HOH 273 458 458 HOH HOH A . 
I 6 HOH 274 459 459 HOH HOH A . 
I 6 HOH 275 460 460 HOH HOH A . 
I 6 HOH 276 461 461 HOH HOH A . 
I 6 HOH 277 462 462 HOH HOH A . 
I 6 HOH 278 463 463 HOH HOH A . 
I 6 HOH 279 464 464 HOH HOH A . 
I 6 HOH 280 465 465 HOH HOH A . 
I 6 HOH 281 466 466 HOH HOH A . 
I 6 HOH 282 467 467 HOH HOH A . 
I 6 HOH 283 468 468 HOH HOH A . 
I 6 HOH 284 469 469 HOH HOH A . 
I 6 HOH 285 470 470 HOH HOH A . 
I 6 HOH 286 471 471 HOH HOH A . 
I 6 HOH 287 472 472 HOH HOH A . 
I 6 HOH 288 473 473 HOH HOH A . 
I 6 HOH 289 474 474 HOH HOH A . 
I 6 HOH 290 475 475 HOH HOH A . 
I 6 HOH 291 476 476 HOH HOH A . 
I 6 HOH 292 477 477 HOH HOH A . 
I 6 HOH 293 478 478 HOH HOH A . 
I 6 HOH 294 479 479 HOH HOH A . 
I 6 HOH 295 480 480 HOH HOH A . 
#
loop_
_atom_site.group_PDB
_atom_site.id
_atom_site.type_symbol
_atom_site.label_atom_id
_atom_site.label_alt_id
_atom_site.label_comp_id
_atom_site.label_asym_id
_atom_site.label_entity_id
_atom_site.label_seq_id
_atom_site.pdbx_PDB_ins_code
_atom_site.Cartn_x
_atom_site.Cartn_y
_atom_site.Cartn_z
_atom_site.occupancy
_atom_site.B_iso_or_equiv
_atom_site.pdbx_formal_charge
_atom_site.auth_atom_id
_atom_site.auth_comp_id
_atom_site.auth_asym_id
_atom_site.auth_seq_id
_atom_site.pdbx_PDB_model_num
ATOM 1 N N A MET A 1 1 . 45.668 29.73 13.387 0.36 40.14 ? N MET A 1 1 
ATOM 2 N N B MET A 1 1 . 45.212 29.935 13.468 0.25 40.26 ? N MET A 1 1 
ATOM 3 C CA A MET A 1 1 . 44.624 28.91 13.97 0.36 35.49 ? CA MET A 1 1 
ATOM 4 C CA B MET A 1 1 . 44.342 28.906 14.015 0.25 35.98 ? CA MET A 1 1 
ATOM 5 C CA C MET A 1 1 . 44.972 26.815 15.416 0.28 34.51 ? CA MET A 1 1 
ATOM 6 C CA D MET A 1 1 . 44.858 26.818 15.468 0.11 34.38 ? CA MET A 1 1 
ATOM 7 C C A MET A 1 1 . 44.236 27.835 12.99 0.36 32.17 ? C MET A 1 1 
ATOM 8 C C B MET A 1 1 . 44.36 27.706 13.09 0.25 32.13 ? C MET A 1 1 
ATOM 9 C C C MET A 1 1 . 44.481 26.096 14.178 0.28 32.62 ? C MET A 1 1 
ATOM 10 C C D MET A 1 1 . 44.464 26.112 14.179 0.11 32.43 ? C MET A 1 1 
ATOM 11 O O A MET A 1 1 . 44.153 28.102 11.848 0.36 29.44 ? O MET A 1 1 
ATOM 12 O O B MET A 1 1 . 44.243 27.907 11.916 0.25 29.37 ? O MET A 1 1 
ATOM 13 O O C MET A 1 1 . 43.713 26.658 13.384 0.28 31.69 ? O MET A 1 1 
ATOM 14 O O D MET A 1 1 . 43.74 26.67 13.353 0.11 31.49 ? O MET A 1 1 
ATOM 15 C CB A MET A 1 1 . 43.405 29.768 14.248 0.36 34.98 ? CB MET A 1 1 
ATOM 16 C CB B MET A 1 1 . 42.905 29.435 14.099 0.25 35.51 ? CB MET A 1 1 
ATOM 17 C CB C MET A 1 1 . 45.262 25.783 16.495 0.28 34.42 ? CB MET A 1 1 
ATOM 18 C CB D MET A 1 1 . 43.977 26.304 16.607 0.11 34.16 ? CB MET A 1 1 
ATOM 19 C CG A MET A 1 1 . 43.775 31.08 14.924 0.36 34.12 ? CG MET A 1 1 
ATOM 20 C CG B MET A 1 1 . 42.755 30.644 15.005 0.25 35.7 ? CG MET A 1 1 
ATOM 21 C CG C MET A 1 1 . 45.609 26.387 17.829 0.28 33.1 ? CG MET A 1 1 
ATOM 22 C CG D MET A 1 1 . 42.715 27.114 16.819 0.11 32.87 ? CG MET A 1 1 
ATOM 23 S SD A MET A 1 1 . 42.316 31.731 15.737 0.36 36.19 ? SD MET A 1 1 
ATOM 24 S SD B MET A 1 1 . 41.054 31.23 15.103 0.25 35.99 ? SD MET A 1 1 
ATOM 25 S SD C MET A 1 1 . 44.887 25.431 19.162 0.28 33.31 ? SD MET A 1 1 
ATOM 26 S SD D MET A 1 1 . 41.194 26.277 16.313 0.11 31.06 ? SD MET A 1 1 
ATOM 27 C CE A MET A 1 1 . 41.669 30.259 16.5 0.36 35.71 ? CE MET A 1 1 
ATOM 28 C CE B MET A 1 1 . 41.127 32.335 16.502 0.25 37.61 ? CE MET A 1 1 
ATOM 29 C CE C MET A 1 1 . 44.222 26.691 20.209 0.28 34.8 ? CE MET A 1 1 
ATOM 30 C CE D MET A 1 1 . 40.701 25.481 17.832 0.11 34.52 ? CE MET A 1 1 
ATOM 31 N N A ASN A 1 2 . 43.957 26.631 13.515 0.36 33.6 ? N ASN A 2 1 
ATOM 32 N N B ASN A 1 2 . 44.5 26.484 13.649 0.25 32.8 ? N ASN A 2 1 
ATOM 33 N N C ASN A 1 2 . 44.934 24.867 14.004 0.28 32.44 ? N ASN A 2 1 
ATOM 34 N N D ASN A 1 2 . 44.95 24.889 14.012 0.11 31.64 ? N ASN A 2 1 
ATOM 35 C CA A ASN A 1 2 . 43.638 25.443 12.71 0.36 34.36 ? CA ASN A 2 1 
ATOM 36 C CA B ASN A 1 2 . 44.336 25.211 12.9 0.25 33.95 ? CA ASN A 2 1 
ATOM 37 C CA C ASN A 1 2 . 44.414 24.007 12.924 0.28 33.7 ? CA ASN A 2 1 
ATOM 38 C CA D ASN A 1 2 . 44.52 24.011 12.914 0.11 33.1 ? CA ASN A 2 1 
ATOM 39 C C A ASN A 1 2 . 42.359 25.662 11.942 0.36 26.62 ? C ASN A 2 1 
ATOM 40 C C B ASN A 1 2 . 42.991 25.125 12.24 0.25 25.14 ? C ASN A 2 1 
ATOM 41 C C C ASN A 1 2 . 43.098 24.525 12.315 0.28 24.9 ? C ASN A 2 1 
ATOM 42 C C D ASN A 1 2 . 43.146 24.37 12.319 0.11 25.36 ? C ASN A 2 1 
ATOM 43 O O A ASN A 1 2 . 41.304 25.963 12.513 0.36 28.36 ? O ASN A 2 1 
ATOM 44 O O B ASN A 1 2 . 42.009 24.995 12.945 0.25 23.83 ? O ASN A 2 1 
ATOM 45 O O C ASN A 1 2 . 42.111 24.615 13.025 0.28 24.62 ? O ASN A 2 1 
ATOM 46 O O D ASN A 1 2 . 42.167 24.452 13.05 0.11 23.05 ? O ASN A 2 1 
ATOM 47 C CB A ASN A 1 2 . 43.541 24.219 13.621 0.36 44.1 ? CB ASN A 2 1 
ATOM 48 C CB B ASN A 1 2 . 44.474 24.003 13.831 0.25 43.76 ? CB ASN A 2 1 
ATOM 49 C CB C ASN A 1 2 . 44.22 22.569 13.435 0.28 43.96 ? CB ASN A 2 1 
ATOM 50 C CB D ASN A 1 2 . 44.506 22.557 13.401 0.11 43.6 ? CB ASN A 2 1 
ATOM 51 C CG A ASN A 1 2 . 43.52 22.89 12.855 0.36 49.12 ? CG ASN A 2 1 
ATOM 52 C CG B ASN A 1 2 . 43.945 22.694 13.206 0.25 48.37 ? CG ASN A 2 1 
ATOM 53 C CG C ASN A 1 2 . 44.032 21.566 12.314 0.28 48.56 ? CG ASN A 2 1 
ATOM 54 C CG D ASN A 1 2 . 44.141 21.568 12.309 0.11 48.28 ? CG ASN A 2 1 
ATOM 55 O OD1 A ASN A 1 2 . 42.607 22.602 12.108 0.36 42.33 ? OD1 ASN A 2 1 
ATOM 56 O OD1 B ASN A 1 2 . 42.805 22.613 12.703 0.25 42.07 ? OD1 ASN A 2 1 
ATOM 57 O OD1 C ASN A 1 2 . 43.416 21.855 11.298 0.28 40.84 ? OD1 ASN A 2 1 
ATOM 58 O OD1 D ASN A 1 2 . 43.46 21.901 11.343 0.11 40.32 ? OD1 ASN A 2 1 
ATOM 59 N ND2 A ASN A 1 2 . 44.531 22.079 13.067 0.36 59.17 ? ND2 ASN A 2 1 
ATOM 60 N ND2 B ASN A 1 2 . 44.767 21.671 13.234 0.25 59.12 ? ND2 ASN A 2 1 
ATOM 61 N ND2 C ASN A 1 2 . 44.559 20.364 12.509 0.28 59.36 ? ND2 ASN A 2 1 
ATOM 62 N ND2 D ASN A 1 2 . 44.584 20.327 12.473 0.11 59.28 ? ND2 ASN A 2 1 
ATOM 63 N N A PRO A 1 3 . 42.424 25.489 10.619 0.36 21.88 ? N PRO A 3 1 
ATOM 64 N N B PRO A 1 3 . 42.983 25.138 10.913 0.25 19.02 ? N PRO A 3 1 
ATOM 65 N N C PRO A 1 3 . 43.125 24.874 11.03 0.28 19.35 ? N PRO A 3 1 
ATOM 66 C CA A PRO A 1 3 . 41.236 25.869 9.836 0.36 22.47 ? CA PRO A 3 1 
ATOM 67 C CA B PRO A 1 3 . 41.767 25.493 10.192 0.25 18.02 ? CA PRO A 3 1 
ATOM 68 C CA C PRO A 1 3 . 41.938 25.441 10.388 0.28 19.53 ? CA PRO A 3 1 
ATOM 69 C C A PRO A 1 3 . 40.211 24.75 9.778 0.36 20.39 ? C PRO A 3 1 
ATOM 70 C C B PRO A 1 3 . 40.588 24.607 10.479 0.25 11.06 ? C PRO A 3 1 
ATOM 71 C C C PRO A 1 3 . 40.68 24.607 10.548 0.28 14.57 ? C PRO A 3 1 
ATOM 72 O O A PRO A 1 3 . 39.255 24.895 9.091 0.36 22.55 ? O PRO A 3 1 
ATOM 73 O O B PRO A 1 3 . 39.503 25.078 10.631 0.25 10.59 ? O PRO A 3 1 
ATOM 74 O O C PRO A 1 3 . 39.558 25.096 10.657 0.28 14.5 ? O PRO A 3 1 
ATOM 75 C CB A PRO A 1 3 . 41.802 26.054 8.457 0.36 23.61 ? CB PRO A 3 1 
ATOM 76 C CB B PRO A 1 3 . 42.223 25.395 8.709 0.25 21.61 ? CB PRO A 3 1 
ATOM 77 C CB C PRO A 1 3 . 42.369 25.502 8.894 0.28 22.9 ? CB PRO A 3 1 
ATOM 78 C CG A PRO A 1 3 . 43.069 25.202 8.454 0.36 23.1 ? CG PRO A 3 1 
ATOM 79 C CG B PRO A 1 3 . 43.665 25.384 8.725 0.25 22.53 ? CG PRO A 3 1 
ATOM 80 C CG C PRO A 1 3 . 43.84 25.463 8.902 0.28 23.91 ? CG PRO A 3 1 
ATOM 81 C CD A PRO A 1 3 . 43.647 25.314 9.774 0.36 21.97 ? CD PRO A 3 1 
ATOM 82 C CD B PRO A 1 3 . 44.128 24.867 10.007 0.25 17.71 ? CD PRO A 3 1 
ATOM 83 C CD C PRO A 1 3 . 44.254 24.688 10.08 0.28 20.95 ? CD PRO A 3 1 
ATOM 84 N N A PHE A 1 4 . 40.474 23.672 10.513 0.36 17.27 ? N PHE A 4 1 
ATOM 85 N N B PHE A 1 4 . 40.812 23.31 10.45 0.25 9.76 ? N PHE A 4 1 
ATOM 86 N N C PHE A 1 4 . 40.864 23.304 10.485 0.28 10.24 ? N PHE A 4 1 
ATOM 87 C CA A PHE A 1 4 . 39.514 22.573 10.621 0.36 13.99 ? CA PHE A 4 1 
ATOM 88 C CA B PHE A 1 4 . 39.73 22.363 10.607 0.25 9.85 ? CA PHE A 4 1 
ATOM 89 C CA C PHE A 1 4 . 39.73 22.374 10.609 0.28 10.21 ? CA PHE A 4 1 
ATOM 90 C C A PHE A 1 4 . 38.88 22.54 12.032 0.36 12.25 ? C PHE A 4 1 
ATOM 91 C C B PHE A 1 4 . 38.967 22.571 11.95 0.25 9.54 ? C PHE A 4 1 
ATOM 92 C C C PHE A 1 4 . 38.956 22.535 11.962 0.28 10.14 ? C PHE A 4 1 
ATOM 93 O O A PHE A 1 4 . 37.685 22.285 12.201 0.36 18.17 ? O PHE A 4 1 
ATOM 94 O O B PHE A 1 4 . 37.753 22.555 11.986 0.25 6.57 ? O PHE A 4 1 
ATOM 95 O O C PHE A 1 4 . 37.714 22.441 12.01 0.28 8.76 ? O PHE A 4 1 
ATOM 96 C CB A PHE A 1 4 . 40.264 21.292 10.348 0.36 15.15 ? CB PHE A 4 1 
ATOM 97 C CB B PHE A 1 4 . 40.36 21.01 10.459 0.25 11.01 ? CB PHE A 4 1 
ATOM 98 C CB C PHE A 1 4 . 40.301 21.002 10.377 0.28 11.46 ? CB PHE A 4 1 
ATOM 99 C CG A PHE A 1 4 . 39.538 20.043 10.816 0.36 14.46 ? CG PHE A 4 1 
ATOM 100 C CG B PHE A 1 4 . 39.474 19.86 10.893 0.25 10.49 ? CG PHE A 4 1 
ATOM 101 C CG C PHE A 1 4 . 39.428 19.852 10.881 0.28 11.5 ? CG PHE A 4 1 
ATOM 102 C CD1 A PHE A 1 4 . 38.222 19.782 10.425 0.36 15 ? CD1 PHE A 4 1 
ATOM 103 C CD1 B PHE A 1 4 . 39.976 18.885 11.773 0.25 13.65 ? CD1 PHE A 4 1 
ATOM 104 C CD1 C PHE A 1 4 . 38.075 19.771 10.607 0.28 13.71 ? CD1 PHE A 4 1 
ATOM 105 C CD2 A PHE A 1 4 . 40.182 19.156 11.699 0.36 17.16 ? CD2 PHE A 4 1 
ATOM 106 C CD2 B PHE A 1 4 . 38.152 19.783 10.527 0.25 8.78 ? CD2 PHE A 4 1 
ATOM 107 C CD2 C PHE A 1 4 . 39.992 18.868 11.712 0.28 11.9 ? CD2 PHE A 4 1 
ATOM 108 C CE1 A PHE A 1 4 . 37.559 18.622 10.873 0.36 16.5 ? CE1 PHE A 4 1 
ATOM 109 C CE1 B PHE A 1 4 . 39.201 17.819 12.199 0.25 13.74 ? CE1 PHE A 4 1 
ATOM 110 C CE1 C PHE A 1 4 . 37.315 18.694 11.088 0.28 13.78 ? CE1 PHE A 4 1 
ATOM 111 C CE2 A PHE A 1 4 . 39.541 18.012 12.154 0.36 18.34 ? CE2 PHE A 4 1 
ATOM 112 C CE2 B PHE A 1 4 . 37.339 18.722 10.974 0.25 9.68 ? CE2 PHE A 4 1 
ATOM 113 C CE2 C PHE A 1 4 . 39.268 17.802 12.169 0.28 12.79 ? CE2 PHE A 4 1 
ATOM 114 C CZ A PHE A 1 4 . 38.212 17.751 11.739 0.36 16.8 ? CZ PHE A 4 1 
ATOM 115 C CZ B PHE A 1 4 . 37.887 17.773 11.823 0.25 11.74 ? CZ PHE A 4 1 
ATOM 116 C CZ C PHE A 1 4 . 37.924 17.753 11.88 0.28 12.79 ? CZ PHE A 4 1 
ATOM 117 N N . HIS A 1 5 . 39.722 22.755 13.04 0.88 10.61 ? N HIS A 5 1 
ATOM 118 C CA . HIS A 1 5 . 39.155 22.898 14.388 0.88 10.48 ? CA HIS A 5 1 
ATOM 119 C C . HIS A 1 5 . 38.798 24.326 14.732 0.88 11.8 ? C HIS A 5 1 
ATOM 120 O O . HIS A 1 5 . 37.894 24.558 15.526 0.88 14.12 ? O HIS A 5 1 
ATOM 121 C CB . HIS A 1 5 . 40.143 22.336 15.436 0.88 11.97 ? CB HIS A 5 1 
ATOM 122 C CG . HIS A 1 5 . 40.347 20.867 15.301 0.88 12.95 ? CG HIS A 5 1 
ATOM 123 N ND1 . HIS A 1 5 . 39.312 19.978 15.492 0.88 13.88 ? ND1 HIS A 5 1 
ATOM 124 C CD2 . HIS A 1 5 . 41.491 20.134 15.075 0.88 13.3 ? CD2 HIS A 5 1 
ATOM 125 C CE1 . HIS A 1 5 . 39.818 18.759 15.386 0.88 13.77 ? CE1 HIS A 5 1 
ATOM 126 N NE2 . HIS A 1 5 . 41.132 18.806 15.095 0.88 15.05 ? NE2 HIS A 5 1 
ATOM 127 N N A GLU A 1 6 . 39.464 25.303 14.188 0.62 11.43 ? N GLU A 6 1 
ATOM 128 N N B GLU A 1 6 . 39.519 25.288 14.169 0.38 12.39 ? N GLU A 6 1 
ATOM 129 C CA A GLU A 1 6 . 39.266 26.604 14.721 0.62 15.19 ? CA GLU A 6 1 
ATOM 130 C CA B GLU A 1 6 . 39.361 26.698 14.515 0.38 15.6 ? CA GLU A 6 1 
ATOM 131 C C A GLU A 1 6 . 38.391 27.499 13.897 0.62 13.6 ? C GLU A 6 1 
ATOM 132 C C B GLU A 1 6 . 38.226 27.379 13.785 0.38 15.58 ? C GLU A 6 1 
ATOM 133 O O A GLU A 1 6 . 37.906 28.323 14.57 0.62 18.14 ? O GLU A 6 1 
ATOM 134 O O B GLU A 1 6 . 37.579 28.233 14.366 0.38 18.6 ? O GLU A 6 1 
ATOM 135 C CB A GLU A 1 6 . 40.679 27.196 14.998 0.62 18.67 ? CB GLU A 6 1 
ATOM 136 C CB B GLU A 1 6 . 40.717 27.427 14.176 0.38 18.73 ? CB GLU A 6 1 
ATOM 137 N N A LEU A 1 7 . 38.126 27.233 12.618 0.62 13.54 ? N LEU A 7 1 
ATOM 138 N N B LEU A 1 7 . 37.985 27.003 12.558 0.38 16.64 ? N LEU A 7 1 
ATOM 139 C CA A LEU A 1 7 . 37.036 27.861 11.884 0.62 13.63 ? CA LEU A 7 1 
ATOM 140 C CA B LEU A 1 7 . 36.937 27.67 11.828 0.38 20.47 ? CA LEU A 7 1 
ATOM 141 C C A LEU A 1 7 . 35.681 27.26 12.232 0.62 12.89 ? C LEU A 7 1 
ATOM 142 C C B LEU A 1 7 . 35.599 27.088 12.297 0.38 15.58 ? C LEU A 7 1 
ATOM 143 O O A LEU A 1 7 . 35.563 26.131 12.213 0.62 11.25 ? O LEU A 7 1 
ATOM 144 O O B LEU A 1 7 . 35.58 25.949 12.659 0.38 13.67 ? O LEU A 7 1 
ATOM 145 C CB A LEU A 1 7 . 37.257 27.735 10.423 0.62 18.62 ? CB LEU A 7 1 
ATOM 146 C CB B LEU A 1 7 . 37.144 27.393 10.351 0.38 32.14 ? CB LEU A 7 1 
ATOM 147 C CG A LEU A 1 7 . 38.308 28.537 9.723 0.62 39.31 ? CG LEU A 7 1 
ATOM 148 C CG B LEU A 1 7 . 37.298 28.511 9.321 0.38 47.02 ? CG LEU A 7 1 
ATOM 149 C CD1 A LEU A 1 7 . 38.485 28.037 8.304 0.62 46.43 ? CD1 LEU A 7 1 
ATOM 150 C CD1 B LEU A 1 7 . 37.626 29.859 9.954 0.38 52.14 ? CD1 LEU A 7 1 
ATOM 151 C CD2 A LEU A 1 7 . 37.88 30.016 9.724 0.62 52.8 ? CD2 LEU A 7 1 
ATOM 152 C CD2 B LEU A 1 7 . 38.327 28.127 8.268 0.38 56.97 ? CD2 LEU A 7 1 
ATOM 153 N N A GLU A 1 8 . 34.625 28.063 12.38 0.62 13.39 ? N GLU A 8 1 
ATOM 154 N N B GLU A 1 8 . 34.518 27.885 12.166 0.38 17.54 ? N GLU A 8 1 
ATOM 155 C CA A GLU A 1 8 . 33.249 27.522 12.471 0.62 14.22 ? CA GLU A 8 1 
ATOM 156 C CA B GLU A 1 8 . 33.167 27.475 12.589 0.38 17.23 ? CA GLU A 8 1 
ATOM 157 C C A GLU A 1 8 . 32.793 26.848 11.155 0.62 8.36 ? C GLU A 8 1 
ATOM 158 C C B GLU A 1 8 . 32.505 27.098 11.267 0.38 14.86 ? C GLU A 8 1 
ATOM 159 O O A GLU A 1 8 . 33.363 27.127 10.107 0.62 7.86 ? O GLU A 8 1 
ATOM 160 O O B GLU A 1 8 . 32.749 27.763 10.36 0.38 20.08 ? O GLU A 8 1 
ATOM 161 C CB A GLU A 1 8 . 32.256 28.63 12.839 0.62 18.66 ? CB GLU A 8 1 
ATOM 162 C CB B GLU A 1 8 . 32.423 28.649 13.253 0.38 22.1 ? CB GLU A 8 1 
ATOM 163 C CG A GLU A 1 8 . 32.437 29.206 14.231 0.62 22.7 ? CG GLU A 8 1 
ATOM 164 C CG B GLU A 1 8 . 32.192 29.851 12.394 0.38 26.07 ? CG GLU A 8 1 
ATOM 165 C CD A GLU A 1 8 . 32.401 28.143 15.306 0.62 24.7 ? CD GLU A 8 1 
ATOM 166 C CD B GLU A 1 8 . 30.953 30.628 12.836 0.38 28.27 ? CD GLU A 8 1 
ATOM 167 O OE1 A GLU A 1 8 . 33.359 28.081 16.105 0.62 25.67 ? OE1 GLU A 8 1 
ATOM 168 O OE1 B GLU A 1 8 . 30.253 30.175 13.782 0.38 29.43 ? OE1 GLU A 8 1 
ATOM 169 O OE2 A GLU A 1 8 . 31.421 27.373 15.353 0.62 26.17 ? OE2 GLU A 8 1 
ATOM 170 O OE2 B GLU A 1 8 . 30.662 31.72 12.285 0.38 29.5 ? OE2 GLU A 8 1 
ATOM 171 N N . PRO A 1 9 . 31.722 26.041 11.19 1 10.23 ? N PRO A 9 1 
ATOM 172 C CA . PRO A 1 9 . 31.273 25.478 9.883 1 9.19 ? CA PRO A 9 1 
ATOM 173 C C . PRO A 1 9 . 30.846 26.543 8.919 1 8.97 ? C PRO A 9 1 
ATOM 174 O O . PRO A 1 9 . 30.889 26.279 7.694 1 9.65 ? O PRO A 9 1 
ATOM 175 C CB . PRO A 1 9 . 30.198 24.494 10.287 1 10.04 ? CB PRO A 9 1 
ATOM 176 C CG . PRO A 1 9 . 30.477 24.109 11.693 1 11.28 ? CG PRO A 9 1 
ATOM 177 C CD . PRO A 1 9 . 31.016 25.404 12.311 1 12.21 ? CD PRO A 9 1 
ATOM 178 N N . GLY A 1 10 . 30.347 27.685 9.349 1 8.68 ? N GLY A 10 1 
ATOM 179 C CA . GLY A 1 10 . 29.866 28.646 8.425 1 9.71 ? CA GLY A 10 1 
ATOM 180 C C . GLY A 1 10 . 29.338 29.869 9.178 1 9.57 ? C GLY A 10 1 
ATOM 181 O O . GLY A 1 10 . 29.105 29.839 10.388 1 11.97 ? O GLY A 10 1 
ATOM 182 N N . PRO A 1 11 . 29.049 30.943 8.438 1 10.16 ? N PRO A 11 1 
ATOM 183 C CA . PRO A 1 11 . 28.47 32.144 9.026 1 12.01 ? CA PRO A 11 1 
ATOM 184 C C . PRO A 1 11 . 26.986 32.081 9.153 1 11.05 ? C PRO A 11 1 
ATOM 185 O O . PRO A 1 11 . 26.41 32.862 9.956 1 14.23 ? O PRO A 11 1 
ATOM 186 C CB . PRO A 1 11 . 28.942 33.234 8.082 1 12.83 ? CB PRO A 11 1 
ATOM 187 C CG . PRO A 1 11 . 28.931 32.543 6.753 1 12.81 ? CG PRO A 11 1 
ATOM 188 C CD . PRO A 1 11 . 29.521 31.16 7.04 1 11 ? CD PRO A 11 1 
ATOM 189 N N . GLU A 1 12 . 26.305 31.246 8.369 1 10.84 ? N GLU A 12 1 
ATOM 190 C CA . GLU A 1 12 . 24.814 31.153 8.459 1 11.83 ? CA GLU A 12 1 
ATOM 191 C C . GLU A 1 12 . 24.413 29.685 8.144 1 9.88 ? C GLU A 12 1 
ATOM 192 O O . GLU A 1 12 . 23.748 29.4 7.162 1 10.77 ? O GLU A 12 1 
ATOM 193 C CB . GLU A 1 12 . 24.121 32.061 7.476 1 13.11 ? CB GLU A 12 1 
ATOM 194 C CG . GLU A 1 12 . 24.389 33.437 7.491 1 21.98 ? CG GLU A 12 1 
ATOM 195 C CD . GLU A 1 12 . 23.623 34.22 6.402 1 25.94 ? CD GLU A 12 1 
ATOM 196 O OE1 . GLU A 1 12 . 22.387 33.903 6.085 1 27.73 ? OE1 GLU A 12 1 
ATOM 197 O OE2 . GLU A 1 12 . 24.293 35.065 5.835 1 31.25 ? OE2 GLU A 12 1 
ATOM 198 N N . VAL A 1 13 . 24.872 28.779 8.994 1 9.87 ? N VAL A 13 1 
ATOM 199 C CA . VAL A 1 13 . 24.691 27.374 8.734 1 9.74 ? CA VAL A 13 1 
ATOM 200 C C . VAL A 1 13 . 23.24 27.031 8.733 1 9.69 ? C VAL A 13 1 
ATOM 201 O O . VAL A 1 13 . 22.504 27.467 9.645 1 10.53 ? O VAL A 13 1 
ATOM 202 C CB . VAL A 1 13 . 25.444 26.591 9.814 1 11.11 ? CB VAL A 13 1 
ATOM 203 C CG1 . VAL A 1 13 . 25.088 25.103 9.824 1 13.51 ? CG1 VAL A 13 1 
ATOM 204 C CG2 . VAL A 1 13 . 26.992 26.756 9.694 1 13.73 ? CG2 VAL A 13 1 
ATOM 205 N N . PRO A 1 14 . 22.76 26.179 7.814 1 9.3 ? N PRO A 14 1 
ATOM 206 C CA . PRO A 1 14 . 23.453 25.502 6.724 1 9.51 ? CA PRO A 14 1 
ATOM 207 C C . PRO A 1 14 . 23.299 26.227 5.383 1 9.02 ? C PRO A 14 1 
ATOM 208 O O . PRO A 1 14 . 23.769 25.677 4.373 1 10.43 ? O PRO A 14 1 
ATOM 209 C CB . PRO A 1 14 . 22.8 24.138 6.704 1 9.81 ? CB PRO A 14 1 
ATOM 210 C CG . PRO A 1 14 . 21.342 24.465 6.983 1 10.63 ? CG PRO A 14 1 
ATOM 211 C CD . PRO A 1 14 . 21.415 25.596 8.048 1 9.98 ? CD PRO A 14 1 
ATOM 212 N N . GLU A 1 15 . 22.64 27.388 5.358 1 9.93 ? N GLU A 15 1 
ATOM 213 C CA . GLU A 1 15 . 22.464 28.095 4.073 1 12.14 ? CA GLU A 15 1 
ATOM 214 C C . GLU A 1 15 . 23.716 28.701 3.519 1 10.18 ? C GLU A 15 1 
ATOM 215 O O . GLU A 1 15 . 23.828 28.813 2.271 1 10.58 ? O GLU A 15 1 
ATOM 216 C CB . GLU A 1 15 . 21.41 29.209 4.214 1 14.92 ? CB GLU A 15 1 
ATOM 217 C CG . GLU A 1 15 . 19.974 28.667 4.514 1 19.13 ? CG GLU A 15 1 
ATOM 218 C CD . GLU A 1 15 . 19.826 28.466 5.926 1 16.96 ? CD GLU A 15 1 
ATOM 219 O OE1 . GLU A 1 15 . 18.991 27.661 6.21 1 21.22 ? OE1 GLU A 15 1 
ATOM 220 O OE2 . GLU A 1 15 . 20.551 29.09 6.666 1 20.35 ? OE2 GLU A 15 1 
ATOM 221 N N . VAL A 1 16 . 24.66 29.107 4.362 1 9.52 ? N VAL A 16 1 
ATOM 222 C CA . VAL A 1 16 . 25.968 29.613 3.96 1 9.2 ? CA VAL A 16 1 
ATOM 223 C C . VAL A 1 16 . 26.971 28.943 4.847 1 8.11 ? C VAL A 16 1 
ATOM 224 O O . VAL A 1 16 . 26.865 29.059 6.092 1 10.13 ? O VAL A 16 1 
ATOM 225 C CB . VAL A 1 16 . 26.106 31.124 4.037 1 11.17 ? CB VAL A 16 1 
ATOM 226 C CG1 . VAL A 1 16 . 27.466 31.515 3.545 1 12.09 ? CG1 VAL A 16 1 
ATOM 227 C CG2 . VAL A 1 16 . 24.981 31.833 3.221 1 13.96 ? CG2 VAL A 16 1 
ATOM 228 N N . VAL A 1 17 . 27.906 28.256 4.273 1 6.81 ? N VAL A 17 1 
ATOM 229 C CA . VAL A 1 17 . 28.961 27.58 4.975 1 6.7 ? CA VAL A 17 1 
ATOM 230 C C . VAL A 1 17 . 30.303 28.146 4.558 1 6.82 ? C VAL A 17 1 
ATOM 231 O O . VAL A 1 17 . 30.441 28.788 3.505 1 7.92 ? O VAL A 17 1 
ATOM 232 C CB . VAL A 1 17 . 28.919 26.058 4.759 1 7.7 ? CB VAL A 17 1 
ATOM 233 C CG1 . VAL A 1 17 . 27.607 25.493 5.346 1 9.56 ? CG1 VAL A 17 1 
ATOM 234 C CG2 . VAL A 1 17 . 29.166 25.636 3.351 1 8.28 ? CG2 VAL A 17 1 
ATOM 235 N N . TYR A 1 18 . 31.34 27.842 5.334 1 7.2 ? N TYR A 18 1 
ATOM 236 C CA . TYR A 1 18 . 32.726 28.009 4.884 1 7.62 ? CA TYR A 18 1 
ATOM 237 C C . TYR A 1 18 . 33.198 26.757 4.196 1 7.56 ? C TYR A 18 1 
ATOM 238 O O . TYR A 1 18 . 33.057 25.621 4.723 1 9.26 ? O TYR A 18 1 
ATOM 239 C CB . TYR A 1 18 . 33.66 28.332 6.035 1 8.7 ? CB TYR A 18 1 
ATOM 240 C CG . TYR A 1 18 . 33.417 29.611 6.668 1 9.74 ? CG TYR A 18 1 
ATOM 241 C CD1 . TYR A 1 18 . 33.24 29.695 8.063 1 12.56 ? CD1 TYR A 18 1 
ATOM 242 C CD2 . TYR A 1 18 . 33.293 30.788 5.993 1 10.23 ? CD2 TYR A 18 1 
ATOM 243 C CE1 . TYR A 1 18 . 32.915 30.922 8.733 1 15.07 ? CE1 TYR A 18 1 
ATOM 244 C CE2 . TYR A 1 18 . 33.131 32.017 6.623 1 13.52 ? CE2 TYR A 18 1 
ATOM 245 C CZ . TYR A 1 18 . 32.925 32.083 7.97 1 14.9 ? CZ TYR A 18 1 
ATOM 246 O OH . TYR A 1 18 . 32.64 33.256 8.601 1 19.53 ? OH TYR A 18 1 
ATOM 247 N N . ALA A 1 19 . 33.771 26.929 3.046 1 6.71 ? N ALA A 19 1 
ATOM 248 C CA . ALA A 1 19 . 34.541 25.887 2.385 1 6.98 ? CA ALA A 19 1 
ATOM 249 C C . ALA A 1 19 . 36.006 26.22 2.555 1 6.79 ? C ALA A 19 1 
ATOM 250 O O . ALA A 1 19 . 36.447 27.304 2.14 1 9.69 ? O ALA A 19 1 
ATOM 251 C CB . ALA A 1 19 . 34.192 25.798 0.936 1 7.22 ? CB ALA A 19 1 
ATOM 252 N N . LEU A 1 20 . 36.764 25.328 3.113 1 5.56 ? N LEU A 20 1 
ATOM 253 C CA . LEU A 1 20 . 38.239 25.434 3.19 1 5.58 ? CA LEU A 20 1 
ATOM 254 C C . LEU A 1 20 . 38.745 24.589 2.038 1 5.22 ? C LEU A 20 1 
ATOM 255 O O . LEU A 1 20 . 38.652 23.344 2.073 1 5.58 ? O LEU A 20 1 
ATOM 256 C CB . LEU A 1 20 . 38.721 24.977 4.521 1 6.33 ? CB LEU A 20 1 
ATOM 257 C CG . LEU A 1 20 . 40.244 25.104 4.701 1 8.44 ? CG LEU A 20 1 
ATOM 258 C CD1 . LEU A 1 20 . 40.68 26.558 4.728 1 9.53 ? CD1 LEU A 20 1 
ATOM 259 C CD2 . LEU A 1 20 . 40.64 24.388 5.98 1 15.85 ? CD2 LEU A 20 1 
ATOM 260 N N . ILE A 1 21 . 39.255 25.232 0.994 1 5.48 ? N ILE A 21 1 
ATOM 261 C CA . ILE A 1 21 . 39.681 24.509 -0.203 1 5.2 ? CA ILE A 21 1 
ATOM 262 C C . ILE A 1 21 . 40.997 23.844 0.013 1 5.21 ? C ILE A 21 1 
ATOM 263 O O . ILE A 1 21 . 41.946 24.436 0.543 1 7.29 ? O ILE A 21 1 
ATOM 264 C CB . ILE A 1 21 . 39.681 25.457 -1.429 1 5.8 ? CB ILE A 21 1 
ATOM 265 C CG1 . ILE A 1 21 . 38.28 26.022 -1.657 1 6.59 ? CG1 ILE A 21 1 
ATOM 266 C CG2 . ILE A 1 21 . 40.25 24.769 -2.647 1 6.11 ? CG2 ILE A 21 1 
ATOM 267 C CD1 . ILE A 1 21 . 37.155 24.997 -1.756 1 7.65 ? CD1 ILE A 21 1 
ATOM 268 N N . GLU A 1 22 . 41.08 22.589 -0.391 1 5.02 ? N GLU A 22 1 
ATOM 269 C CA . GLU A 1 22 . 42.322 21.798 -0.422 1 5.03 ? CA GLU A 22 1 
ATOM 270 C C . GLU A 1 22 . 42.909 21.694 -1.826 1 5.04 ? C GLU A 22 1 
ATOM 271 O O . GLU A 1 22 . 44.12 21.687 -1.979 1 5.87 ? O GLU A 22 1 
ATOM 272 C CB . GLU A 1 22 . 42.052 20.398 0.156 1 5.37 ? CB GLU A 22 1 
ATOM 273 C CG . GLU A 1 22 . 41.679 20.395 1.63 1 5.95 ? CG GLU A 22 1 
ATOM 274 C CD . GLU A 1 22 . 41.03 19.122 2.089 1 5.27 ? CD GLU A 22 1 
ATOM 275 O OE1 . GLU A 1 22 . 40.132 18.614 1.368 1 5.65 ? OE1 GLU A 22 1 
ATOM 276 O OE2 . GLU A 1 22 . 41.379 18.641 3.206 1 6.15 ? OE2 GLU A 22 1 
ATOM 277 N N . ILE A 1 23 . 42.044 21.532 -2.821 1 4.85 ? N ILE A 23 1 
ATOM 278 C CA . ILE A 1 23 . 42.441 21.207 -4.179 1 4.97 ? CA ILE A 23 1 
ATOM 279 C C . ILE A 1 23 . 41.836 22.227 -5.136 1 4.87 ? C ILE A 23 1 
ATOM 280 O O . ILE A 1 23 . 40.617 22.255 -5.337 1 5.92 ? O ILE A 23 1 
ATOM 281 C CB . ILE A 1 23 . 42.019 19.818 -4.637 1 5.14 ? CB ILE A 23 1 
ATOM 282 C CG1 . ILE A 1 23 . 42.348 18.759 -3.594 1 6.35 ? CG1 ILE A 23 1 
ATOM 283 C CG2 . ILE A 1 23 . 42.649 19.503 -5.984 1 6.16 ? CG2 ILE A 23 1 
ATOM 284 C CD1 . ILE A 1 23 . 41.871 17.357 -3.991 1 6.53 ? CD1 ILE A 23 1 
ATOM 285 N N . PRO A 1 24 . 42.638 23.05 -5.792 1 5.11 ? N PRO A 24 1 
ATOM 286 C CA . PRO A 1 24 . 42.095 23.947 -6.837 1 5.7 ? CA PRO A 24 1 
ATOM 287 C C . PRO A 1 24 . 41.596 23.126 -8.026 1 5.52 ? C PRO A 24 1 
ATOM 288 O O . PRO A 1 24 . 42.22 22.154 -8.432 1 5.71 ? O PRO A 24 1 
ATOM 289 C CB . PRO A 1 24 . 43.294 24.816 -7.221 1 6.68 ? CB PRO A 24 1 
ATOM 290 C CG . PRO A 1 24 . 44.253 24.71 -6.014 1 7.48 ? CG PRO A 24 1 
ATOM 291 C CD . PRO A 1 24 . 44.096 23.272 -5.567 1 6.62 ? CD PRO A 24 1 
ATOM 292 N N . LYS A 1 25 . 40.507 23.583 -8.647 1 5.89 ? N LYS A 25 1 
ATOM 293 C CA A LYS A 1 25 . 40.073 22.941 -9.861 0.44 5.63 ? CA LYS A 25 1 
ATOM 294 C CA B LYS A 1 25 . 40.065 23.023 -9.941 0.56 5.33 ? CA LYS A 25 1 
ATOM 295 C C . LYS A 1 25 . 41.259 22.937 -10.864 1 5.44 ? C LYS A 25 1 
ATOM 296 O O . LYS A 1 25 . 42.014 23.898 -10.983 1 5.97 ? O LYS A 25 1 
ATOM 297 C CB A LYS A 1 25 . 38.896 23.745 -10.442 0.44 7.25 ? CB LYS A 25 1 
ATOM 298 C CB B LYS A 1 25 . 38.972 23.905 -10.622 0.56 7.17 ? CB LYS A 25 1 
ATOM 299 C CG A LYS A 1 25 . 38.356 23.247 -11.793 0.44 8.32 ? CG LYS A 25 1 
ATOM 300 C CG B LYS A 1 25 . 38.668 23.59 -12.03 0.56 6.78 ? CG LYS A 25 1 
ATOM 301 C CD A LYS A 1 25 . 38.955 23.978 -12.985 0.44 10.38 ? CD LYS A 25 1 
ATOM 302 C CD B LYS A 1 25 . 37.616 24.485 -12.562 0.56 7.51 ? CD LYS A 25 1 
ATOM 303 C CE A LYS A 1 25 . 38.244 23.726 -14.276 0.44 15.53 ? CE LYS A 25 1 
ATOM 304 C CE B LYS A 1 25 . 38.042 25.941 -12.672 0.56 10.42 ? CE LYS A 25 1 
ATOM 305 N NZ A LYS A 1 25 . 38.927 24.528 -15.349 0.44 27.79 ? NZ LYS A 25 1 
ATOM 306 N NZ B LYS A 1 25 . 37.127 26.894 -13.448 0.56 9.27 ? NZ LYS A 25 1 
ATOM 307 N N . GLY A 1 26 . 41.363 21.811 -11.574 1 5.55 ? N GLY A 26 1 
ATOM 308 C CA . GLY A 1 26 . 42.403 21.621 -12.552 1 5.49 ? CA GLY A 26 1 
ATOM 309 C C . GLY A 1 26 . 43.595 20.83 -12.051 1 5.73 ? C GLY A 26 1 
ATOM 310 O O . GLY A 1 26 . 44.471 20.5 -12.829 1 7.67 ? O GLY A 26 1 
ATOM 311 N N . SER A 1 27 . 43.63 20.502 -10.762 1 5.42 ? N SER A 27 1 
ATOM 312 C CA A SER A 1 27 . 44.741 19.759 -10.16 0.74 5.55 ? CA SER A 27 1 
ATOM 313 C CA B SER A 1 27 . 44.736 19.77 -10.226 0.26 4.82 ? CA SER A 27 1 
ATOM 314 C C . SER A 1 27 . 44.532 18.242 -10.332 1 4.77 ? C SER A 27 1 
ATOM 315 O O . SER A 1 27 . 43.431 17.755 -10.146 1 5.65 ? O SER A 27 1 
ATOM 316 C CB A SER A 1 27 . 44.787 19.997 -8.658 0.74 6.56 ? CB SER A 27 1 
ATOM 317 C CB B SER A 1 27 . 44.926 20.181 -8.744 0.26 5.87 ? CB SER A 27 1 
ATOM 318 O OG A SER A 1 27 . 44.861 21.431 -8.408 0.74 6.87 ? OG SER A 27 1 
ATOM 319 O OG B SER A 1 27 . 45.865 19.381 -8.1 0.26 7.98 ? OG SER A 27 1 
ATOM 320 N N . ARG A 1 28 . 45.625 17.554 -10.574 1 5.09 ? N ARG A 28 1 
ATOM 321 C CA . ARG A 1 28 . 45.722 16.111 -10.48 1 5.37 ? CA ARG A 28 1 
ATOM 322 C C . ARG A 1 28 . 46.269 15.641 -9.142 1 5.59 ? C ARG A 28 1 
ATOM 323 O O . ARG A 1 28 . 46.122 14.468 -8.755 1 6.91 ? O ARG A 28 1 
ATOM 324 C CB . ARG A 1 28 . 46.56 15.584 -11.627 1 6.42 ? CB ARG A 28 1 
ATOM 325 C CG . ARG A 1 28 . 46.741 14.076 -11.652 1 6.95 ? CG ARG A 28 1 
ATOM 326 C CD . ARG A 1 28 . 47.567 13.639 -12.821 1 7.78 ? CD ARG A 28 1 
ATOM 327 N NE . ARG A 1 28 . 47.854 12.216 -12.737 1 6.37 ? NE ARG A 28 1 
ATOM 328 C CZ . ARG A 1 28 . 48.308 11.498 -13.741 1 5.64 ? CZ ARG A 28 1 
ATOM 329 N NH1 . ARG A 1 28 . 48.776 12.096 -14.836 1 7.13 ? NH1 ARG A 28 1 
ATOM 330 N NH2 . ARG A 1 28 . 48.293 10.178 -13.659 1 5.92 ? NH2 ARG A 28 1 
ATOM 331 N N . ASN A 1 29 . 46.936 16.51 -8.402 1 5.68 ? N ASN A 29 1 
ATOM 332 C CA . ASN A 1 29 . 47.419 16.198 -7.055 1 6.22 ? CA ASN A 29 1 
ATOM 333 C C . ASN A 1 29 . 46.247 16.27 -6.065 1 5.91 ? C ASN A 29 1 
ATOM 334 O O . ASN A 1 29 . 45.554 17.265 -5.983 1 7.08 ? O ASN A 29 1 
ATOM 335 C CB . ASN A 1 29 . 48.508 17.148 -6.641 1 5.89 ? CB ASN A 29 1 
ATOM 336 C CG . ASN A 1 29 . 49.806 16.973 -7.402 1 6.16 ? CG ASN A 29 1 
ATOM 337 O OD1 . ASN A 1 29 . 50.052 15.919 -8.018 1 7.04 ? OD1 ASN A 29 1 
ATOM 338 N ND2 . ASN A 1 29 . 50.662 17.953 -7.288 1 6.83 ? ND2 ASN A 29 1 
ATOM 339 N N A LYS A 1 30 . 46.069 15.176 -5.321 0.73 5.89 ? N LYS A 30 1 
ATOM 340 N N B LYS A 1 30 . 46.025 15.151 -5.38 0.27 5.78 ? N LYS A 30 1 
ATOM 341 C CA A LYS A 1 30 . 45.029 15.1 -4.298 0.73 5.88 ? CA LYS A 30 1 
ATOM 342 C CA B LYS A 1 30 . 45.038 15.084 -4.306 0.27 5.82 ? CA LYS A 30 1 
ATOM 343 C C A LYS A 1 30 . 45.58 15.555 -2.952 0.73 5.33 ? C LYS A 30 1 
ATOM 344 C C B LYS A 1 30 . 45.627 15.556 -2.978 0.27 5.44 ? C LYS A 30 1 
ATOM 345 O O A LYS A 1 30 . 46.188 14.781 -2.217 0.73 8.13 ? O LYS A 30 1 
ATOM 346 O O B LYS A 1 30 . 46.013 14.739 -2.141 0.27 8.04 ? O LYS A 30 1 
ATOM 347 C CB A LYS A 1 30 . 44.459 13.678 -4.205 0.73 7.06 ? CB LYS A 30 1 
ATOM 348 C CB B LYS A 1 30 . 44.505 13.656 -4.158 0.27 7.08 ? CB LYS A 30 1 
ATOM 349 C CG A LYS A 1 30 . 43.905 13.273 -2.828 0.73 10.97 ? CG LYS A 30 1 
ATOM 350 C CG B LYS A 1 30 . 43.004 13.571 -3.945 0.27 9.72 ? CG LYS A 30 1 
ATOM 351 C CD A LYS A 1 30 . 42.661 14.065 -2.449 0.73 5.69 ? CD LYS A 30 1 
ATOM 352 C CD B LYS A 1 30 . 42.601 14.071 -2.57 0.27 8.17 ? CD LYS A 30 1 
ATOM 353 C CE A LYS A 1 30 . 41.725 13.275 -1.532 0.73 10.85 ? CE LYS A 30 1 
ATOM 354 C CE B LYS A 1 30 . 41.124 13.816 -2.314 0.27 9.73 ? CE LYS A 30 1 
ATOM 355 N NZ A LYS A 1 30 . 40.619 14.11 -0.983 0.73 7.38 ? NZ LYS A 30 1 
ATOM 356 N NZ B LYS A 1 30 . 40.699 14.267 -0.96 0.27 7.75 ? NZ LYS A 30 1 
ATOM 357 N N . TYR A 1 31 . 45.499 16.853 -2.712 1 5.95 ? N TYR A 31 1 
ATOM 358 C CA . TYR A 1 31 . 45.907 17.443 -1.435 1 6.3 ? CA TYR A 31 1 
ATOM 359 C C . TYR A 1 31 . 44.822 17.239 -0.401 1 6.04 ? C TYR A 31 1 
ATOM 360 O O . TYR A 1 31 . 43.649 17.278 -0.736 1 6.73 ? O TYR A 31 1 
ATOM 361 C CB . TYR A 1 31 . 46.114 18.928 -1.601 1 6.66 ? CB TYR A 31 1 
ATOM 362 C CG . TYR A 1 31 . 47.074 19.323 -2.698 1 6.12 ? CG TYR A 31 1 
ATOM 363 C CD1 . TYR A 1 31 . 46.651 20.01 -3.818 1 6.39 ? CD1 TYR A 31 1 
ATOM 364 C CD2 . TYR A 1 31 . 48.434 19.039 -2.596 1 7.17 ? CD2 TYR A 31 1 
ATOM 365 C CE1 . TYR A 1 31 . 47.494 20.373 -4.825 1 6.75 ? CE1 TYR A 31 1 
ATOM 366 C CE2 . TYR A 1 31 . 49.299 19.406 -3.6 1 7.68 ? CE2 TYR A 31 1 
ATOM 367 C CZ . TYR A 1 31 . 48.816 20.072 -4.714 1 7.11 ? CZ TYR A 31 1 
ATOM 368 O OH . TYR A 1 31 . 49.726 20.393 -5.704 1 8.29 ? OH TYR A 31 1 
ATOM 369 N N . GLU A 1 32 . 45.229 17.097 0.852 1 6.11 ? N GLU A 32 1 
ATOM 370 C CA . GLU A 1 32 . 44.322 17.076 1.977 1 6.34 ? CA GLU A 32 1 
ATOM 371 C C . GLU A 1 32 . 44.945 17.878 3.104 1 7 ? C GLU A 32 1 
ATOM 372 O O . GLU A 1 32 . 46.143 17.899 3.279 1 8.98 ? O GLU A 32 1 
ATOM 373 C CB . GLU A 1 32 . 44.041 15.672 2.504 1 7.23 ? CB GLU A 32 1 
ATOM 374 C CG . GLU A 1 32 . 43.252 14.812 1.507 1 7.38 ? CG GLU A 32 1 
ATOM 375 C CD . GLU A 1 32 . 42.882 13.437 2.018 1 7.62 ? CD GLU A 32 1 
ATOM 376 O OE1 . GLU A 1 32 . 41.851 12.902 1.535 1 9.9 ? OE1 GLU A 32 1 
ATOM 377 O OE2 . GLU A 1 32 . 43.593 12.867 2.886 1 9.21 ? OE2 GLU A 32 1 
ATOM 378 N N A LEU A 1 33 . 44.048 18.411 3.945 0.13 8.75 ? N LEU A 33 1 
ATOM 379 N N B LEU A 1 33 . 44.097 18.511 3.922 0.87 7.07 ? N LEU A 33 1 
ATOM 380 C CA A LEU A 1 33 . 44.419 19.035 5.216 0.13 13.4 ? CA LEU A 33 1 
ATOM 381 C CA B LEU A 1 33 . 44.591 19.093 5.155 0.87 8.33 ? CA LEU A 33 1 
ATOM 382 C C A LEU A 1 33 . 44.783 17.992 6.275 0.13 13.71 ? C LEU A 33 1 
ATOM 383 C C B LEU A 1 33 . 45.099 17.98 6.041 0.87 11.32 ? C LEU A 33 1 
ATOM 384 O O A LEU A 1 33 . 43.927 17.329 6.861 0.13 11.04 ? O LEU A 33 1 
ATOM 385 O O B LEU A 1 33 . 44.491 16.891 6.215 0.87 12.93 ? O LEU A 33 1 
ATOM 386 C CB A LEU A 1 33 . 43.243 19.896 5.702 0.13 18 ? CB LEU A 33 1 
ATOM 387 C CB B LEU A 1 33 . 43.394 19.88 5.819 0.87 9.47 ? CB LEU A 33 1 
ATOM 388 C CG A LEU A 1 33 . 43.196 20.424 7.138 0.13 24.71 ? CG LEU A 33 1 
ATOM 389 C CG B LEU A 1 33 . 43.813 20.616 7.099 0.87 11.47 ? CG LEU A 33 1 
ATOM 390 C CD1 A LEU A 1 33 . 42.063 21.435 7.251 0.13 26.72 ? CD1 LEU A 33 1 
ATOM 391 C CD1 B LEU A 1 33 . 44.622 21.874 6.641 0.87 15.16 ? CD1 LEU A 33 1 
ATOM 392 C CD2 A LEU A 1 33 . 42.997 19.305 8.155 0.13 29.05 ? CD2 LEU A 33 1 
ATOM 393 C CD2 B LEU A 1 33 . 42.657 21.254 7.694 0.87 16.24 ? CD2 LEU A 33 1 
ATOM 394 N N A ASP A 1 34 . 46.072 17.878 6.56 0.13 18.46 ? N ASP A 34 1 
ATOM 395 N N B ASP A 1 34 . 46.285 18.245 6.622 0.87 13.67 ? N ASP A 34 1 
ATOM 396 C CA A ASP A 1 34 . 46.503 16.962 7.609 0.13 23.8 ? CA ASP A 34 1 
ATOM 397 C CA B ASP A 1 34 . 46.82 17.321 7.643 0.87 16.96 ? CA ASP A 34 1 
ATOM 398 C C A ASP A 1 34 . 45.776 17.312 8.908 0.13 25.77 ? C ASP A 34 1 
ATOM 399 C C B ASP A 1 34 . 46.062 17.581 8.943 0.87 21.25 ? C ASP A 34 1 
ATOM 400 O O A ASP A 1 34 . 45.689 18.467 9.281 0.13 24.05 ? O ASP A 34 1 
ATOM 401 O O B ASP A 1 34 . 46.257 18.601 9.443 0.87 25.41 ? O ASP A 34 1 
ATOM 402 C CB A ASP A 1 34 . 48.015 17.067 7.793 0.13 26.59 ? CB ASP A 34 1 
ATOM 403 C CB B ASP A 1 34 . 48.388 17.55 7.74 0.87 18.99 ? CB ASP A 34 1 
ATOM 404 C CG A ASP A 1 34 . 48.569 15.986 8.697 0.13 25.83 ? CG ASP A 34 1 
ATOM 405 C CG B ASP A 1 34 . 49.043 16.679 8.807 0.87 25.66 ? CG ASP A 34 1 
ATOM 406 O OD1 A ASP A 1 34 . 48.295 16.029 9.919 0.13 24.87 ? OD1 ASP A 34 1 
ATOM 407 O OD1 B ASP A 1 34 . 49.775 17.267 9.621 0.87 27.67 ? OD1 ASP A 34 1 
ATOM 408 O OD2 A ASP A 1 34 . 49.288 15.097 8.197 0.13 25.29 ? OD2 ASP A 34 1 
ATOM 409 O OD2 B ASP A 1 34 . 48.768 15.475 8.833 0.87 30.06 ? OD2 ASP A 34 1 
ATOM 410 N N A LYS A 1 35 . 45.242 16.304 9.591 0.13 31.19 ? N LYS A 35 1 
ATOM 411 N N B LYS A 1 35 . 45.348 16.589 9.477 0.87 23.84 ? N LYS A 35 1 
ATOM 412 C CA A LYS A 1 35 . 44.551 16.534 10.85 0.13 38.08 ? CA LYS A 35 1 
ATOM 413 C CA B LYS A 1 35 . 44.54 16.739 10.661 0.87 32.14 ? CA LYS A 35 1 
ATOM 414 C C A LYS A 1 35 . 45.555 16.869 11.958 0.13 35.69 ? C LYS A 35 1 
ATOM 415 C C B LYS A 1 35 . 45.511 17.05 11.874 0.87 32.28 ? C LYS A 35 1 
ATOM 416 O O A LYS A 1 35 . 45.283 17.696 12.822 0.13 33.54 ? O LYS A 35 1 
ATOM 417 O O B LYS A 1 35 . 45.258 17.947 12.613 0.87 32.37 ? O LYS A 35 1 
ATOM 418 C CB A LYS A 1 35 . 43.727 15.305 11.235 0.13 48.24 ? CB LYS A 35 1 
ATOM 419 C CB B LYS A 1 35 . 43.763 15.467 10.977 0.87 45.29 ? CB LYS A 35 1 
ATOM 420 C CG A LYS A 1 35 . 42.258 15.391 10.853 0.13 56.16 ? CG LYS A 35 1 
ATOM 421 C CG B LYS A 1 35 . 42.337 15.442 10.462 0.87 54.48 ? CG LYS A 35 1 
ATOM 422 C CD A LYS A 1 35 . 41.782 14.14 10.129 0.13 62.07 ? CD LYS A 35 1 
ATOM 423 C CD B LYS A 1 35 . 41.894 14.012 10.263 0.87 60.05 ? CD LYS A 35 1 
ATOM 424 C CE A LYS A 1 35 . 42.304 12.873 10.777 0.13 67.75 ? CE LYS A 35 1 
ATOM 425 C CE B LYS A 1 35 . 42.708 13.412 9.146 0.87 66.06 ? CE LYS A 35 1 
ATOM 426 N NZ A LYS A 1 35 . 41.635 11.662 10.229 0.13 72.93 ? NZ LYS A 35 1 
ATOM 427 N NZ B LYS A 1 35 . 42.437 12.003 9 0.87 71.33 ? NZ LYS A 35 1 
ATOM 428 N N A ALA A 1 36 . 46.719 16.227 11.909 0.13 38.02 ? N ALA A 36 1 
ATOM 429 N N B ALA A 1 36 . 46.66 16.371 11.944 0.87 35.81 ? N ALA A 36 1 
ATOM 430 C CA A ALA A 1 36 . 47.76 16.413 12.923 0.13 41.53 ? CA ALA A 36 1 
ATOM 431 C CA B ALA A 1 36 . 47.574 16.549 13.112 0.87 41.15 ? CA ALA A 36 1 
ATOM 432 C C A ALA A 1 36 . 48.121 17.875 13.109 0.13 38.04 ? C ALA A 36 1 
ATOM 433 C C B ALA A 1 36 . 48.09 17.937 13.158 0.87 37.73 ? C ALA A 36 1 
ATOM 434 O O A ALA A 1 36 . 48.049 18.413 14.211 0.13 36.07 ? O ALA A 36 1 
ATOM 435 O O B ALA A 1 36 . 48.211 18.505 14.257 0.87 36.23 ? O ALA A 36 1 
ATOM 436 C CB A ALA A 1 36 . 49.012 15.613 12.54 0.13 48.73 ? CB ALA A 36 1 
ATOM 437 C CB B ALA A 1 36 . 48.75 15.536 13.036 0.87 48.66 ? CB ALA A 36 1 
ATOM 438 N N . THR A 1 37 . 48.523 18.496 12.01 1 39.66 ? N THR A 37 1 
ATOM 439 C CA . THR A 1 37 . 49.111 19.819 12.011 1 34.01 ? CA THR A 37 1 
ATOM 440 C C . THR A 1 37 . 48.444 20.988 11.435 1 30.32 ? C THR A 37 1 
ATOM 441 O O . THR A 1 37 . 48.983 22.084 11.537 1 29.69 ? O THR A 37 1 
ATOM 442 C CB . THR A 1 37 . 50.42 19.861 11.23 1 33.29 ? CB THR A 37 1 
ATOM 443 O OG1 . THR A 1 37 . 50.17 19.803 9.807 1 28.71 ? OG1 THR A 37 1 
ATOM 444 C CG2 . THR A 1 37 . 51.406 18.736 11.711 1 37.3 ? CG2 THR A 37 1 
ATOM 445 N N . GLY A 1 38 . 47.461 20.835 10.545 1 27.54 ? N GLY A 38 1 
ATOM 446 C CA . GLY A 1 38 . 46.981 22.059 9.902 1 30.59 ? CA GLY A 38 1 
ATOM 447 C C . GLY A 1 38 . 47.568 22.376 8.518 1 24.91 ? C GLY A 38 1 
ATOM 448 O O . GLY A 1 38 . 47.117 23.282 7.785 1 28.51 ? O GLY A 38 1 
ATOM 449 N N . LEU A 1 39 . 48.632 21.662 8.141 1 18.54 ? N LEU A 39 1 
ATOM 450 C CA . LEU A 1 39 . 49.342 21.974 6.871 1 15.79 ? CA LEU A 39 1 
ATOM 451 C C . LEU A 1 39 . 48.688 21.227 5.716 1 12.44 ? C LEU A 39 1 
ATOM 452 O O . LEU A 1 39 . 48.034 20.167 5.945 1 15.33 ? O LEU A 39 1 
ATOM 453 C CB . LEU A 1 39 . 50.747 21.55 6.968 1 18.53 ? CB LEU A 39 1 
ATOM 454 C CG . LEU A 1 39 . 51.614 22.372 7.949 1 48.12 ? CG LEU A 39 1 
ATOM 455 C CD1 . LEU A 1 39 . 52.933 21.627 8.218 1 64.95 ? CD1 LEU A 39 1 
ATOM 456 C CD2 . LEU A 1 39 . 51.853 23.731 7.416 1 67.63 ? CD2 LEU A 39 1 
ATOM 457 N N . LEU A 1 40 . 48.869 21.673 4.507 1 10.69 ? N LEU A 40 1 
ATOM 458 C CA . LEU A 1 40 . 48.485 20.902 3.322 1 8.78 ? CA LEU A 40 1 
ATOM 459 C C . LEU A 1 40 . 49.443 19.719 3.151 1 7.17 ? C LEU A 40 1 
ATOM 460 O O . LEU A 1 40 . 50.639 19.882 3.255 1 6.72 ? O LEU A 40 1 
ATOM 461 C CB . LEU A 1 40 . 48.494 21.793 2.084 1 9.06 ? CB LEU A 40 1 
ATOM 462 C CG . LEU A 1 40 . 47.672 21.297 0.901 1 9.95 ? CG LEU A 40 1 
ATOM 463 C CD1 . LEU A 1 40 . 46.154 21.43 1.225 1 9.81 ? CD1 LEU A 40 1 
ATOM 464 C CD2 . LEU A 1 40 . 48.048 22.001 -0.376 1 10.28 ? CD2 LEU A 40 1 
ATOM 465 N N . LYS A 1 41 . 48.887 18.572 2.785 1 7.49 ? N LYS A 41 1 
ATOM 466 C CA . LYS A 1 41 . 49.662 17.363 2.543 1 7.14 ? CA LYS A 41 1 
ATOM 467 C C . LYS A 1 41 . 49.23 16.774 1.2 1 6.45 ? C LYS A 41 1 
ATOM 468 O O . LYS A 1 41 . 48.048 16.799 0.823 1 8.05 ? O LYS A 41 1 
ATOM 469 C CB . LYS A 1 41 . 49.477 16.39 3.631 1 9.51 ? CB LYS A 41 1 
ATOM 470 C CG . LYS A 1 41 . 50.289 15.136 3.546 1 15.34 ? CG LYS A 41 1 
ATOM 471 C CD . LYS A 1 41 . 50.181 14.362 4.872 1 48.26 ? CD LYS A 41 1 
ATOM 472 C CE . LYS A 1 41 . 50.868 12.983 4.79 1 80.95 ? CE LYS A 41 1 
ATOM 473 N NZ . LYS A 1 41 . 50.883 12.321 6.119 1 108.74 ? NZ LYS A 41 1 
ATOM 474 N N . LEU A 1 42 . 50.178 16.205 0.454 1 6.14 ? N LEU A 42 1 
ATOM 475 C CA . LEU A 1 42 . 49.855 15.403 -0.696 1 6.13 ? CA LEU A 42 1 
ATOM 476 C C . LEU A 1 42 . 49.347 14.054 -0.218 1 6.32 ? C LEU A 42 1 
ATOM 477 O O . LEU A 1 42 . 50.118 13.254 0.319 1 8.31 ? O LEU A 42 1 
ATOM 478 C CB . LEU A 1 42 . 51.097 15.226 -1.576 1 6.73 ? CB LEU A 42 1 
ATOM 479 C CG . LEU A 1 42 . 50.865 14.459 -2.839 1 7.26 ? CG LEU A 42 1 
ATOM 480 C CD1 . LEU A 1 42 . 50.032 15.277 -3.874 1 8.59 ? CD1 LEU A 42 1 
ATOM 481 C CD2 . LEU A 1 42 . 52.195 14.029 -3.462 1 8.3 ? CD2 LEU A 42 1 
ATOM 482 N N . ASP A 1 43 . 48.073 13.771 -0.396 0.91 5.74 ? N ASP A 43 1 
ATOM 483 C CA . ASP A 1 43 . 47.534 12.427 -0.08 0.91 6.25 ? CA ASP A 43 1 
ATOM 484 C C . ASP A 1 43 . 47.961 11.439 -1.138 0.91 7.16 ? C ASP A 43 1 
ATOM 485 O O . ASP A 1 43 . 48.557 10.385 -0.833 0.91 9.66 ? O ASP A 43 1 
ATOM 486 C CB . ASP A 1 43 . 46.005 12.489 -0.021 0.91 8.57 ? CB ASP A 43 1 
ATOM 487 C CG . ASP A 1 43 . 45.318 11.118 0.079 0.91 13.17 ? CG ASP A 43 1 
ATOM 488 O OD1 . ASP A 1 43 . 45.821 10.379 0.969 0.91 19.08 ? OD1 ASP A 43 1 
ATOM 489 O OD2 . ASP A 1 43 . 44.265 10.857 -0.537 0.91 13.49 ? OD2 ASP A 43 1 
ATOM 490 N N A ARG A 1 44 . 47.731 11.769 -2.432 0.88 7.5 ? N ARG A 44 1 
ATOM 491 N N B ARG A 1 44 . 48.007 11.988 -2.334 0.12 10.17 ? N ARG A 44 1 
ATOM 492 C CA A ARG A 1 44 . 48.367 10.951 -3.531 0.88 9.02 ? CA ARG A 44 1 
ATOM 493 C CA B ARG A 1 44 . 47.988 11.221 -3.559 0.12 10.27 ? CA ARG A 44 1 
ATOM 494 C C A ARG A 1 44 . 48.166 11.796 -4.78 0.88 6.96 ? C ARG A 44 1 
ATOM 495 C C B ARG A 1 44 . 48.798 11.948 -4.69 0.12 8.97 ? C ARG A 44 1 
ATOM 496 O O A ARG A 1 44 . 47.639 12.882 -4.785 0.88 7.94 ? O ARG A 44 1 
ATOM 497 O O B ARG A 1 44 . 49.524 12.89 -4.434 0.12 11 ? O ARG A 44 1 
ATOM 498 C CB A ARG A 1 44 . 47.71 9.572 -3.756 0.88 10.81 ? CB ARG A 44 1 
ATOM 499 C CB B ARG A 1 44 . 46.544 11.252 -3.932 0.12 12.35 ? CB ARG A 44 1 
ATOM 500 C CG A ARG A 1 44 . 46.237 9.962 -4.028 0.88 16.06 ? CG ARG A 44 1 
ATOM 501 C CG B ARG A 1 44 . 45.762 9.944 -3.815 0.12 15.56 ? CG ARG A 44 1 
ATOM 502 C CD A ARG A 1 44 . 45.416 8.84 -3.813 0.88 19.5 ? CD ARG A 44 1 
ATOM 503 C CD B ARG A 1 44 . 45.557 9.465 -2.4 0.12 17.61 ? CD ARG A 44 1 
ATOM 504 N NE A ARG A 1 44 . 44.13 8.857 -4.561 0.88 17.14 ? NE ARG A 44 1 
ATOM 505 N NE B ARG A 1 44 . 46.034 8.096 -2.249 0.12 17.66 ? NE ARG A 44 1 
ATOM 506 C CZ A ARG A 1 44 . 42.97 9.326 -4.122 0.88 12.3 ? CZ ARG A 44 1 
ATOM 507 C CZ B ARG A 1 44 . 45.781 7.307 -1.209 0.12 14.5 ? CZ ARG A 44 1 
ATOM 508 N NH1 A ARG A 1 44 . 42.88 10.101 -3.067 0.88 14.44 ? NH1 ARG A 44 1 
ATOM 509 N NH1 B ARG A 1 44 . 45.049 7.733 -0.193 0.12 14.11 ? NH1 ARG A 44 1 
ATOM 510 N NH2 A ARG A 1 44 . 41.949 9.144 -4.98 0.88 13.08 ? NH2 ARG A 44 1 
ATOM 511 N NH2 B ARG A 1 44 . 46.265 6.08 -1.204 0.12 14.3 ? NH2 ARG A 44 1 
ATOM 512 N N . VAL A 1 45 . 48.865 11.294 -5.834 1 7.95 ? N VAL A 45 1 
ATOM 513 C CA . VAL A 1 45 . 48.689 11.769 -7.191 1 6.98 ? CA VAL A 45 1 
ATOM 514 C C . VAL A 1 45 . 47.651 10.861 -7.865 1 5.99 ? C VAL A 45 1 
ATOM 515 O O . VAL A 1 45 . 47.775 9.654 -7.791 1 6.51 ? O VAL A 45 1 
ATOM 516 C CB . VAL A 1 45 . 50.018 11.75 -7.96 1 8.01 ? CB VAL A 45 1 
ATOM 517 C CG1 . VAL A 1 45 . 49.858 12.197 -9.391 1 8.04 ? CG1 VAL A 45 1 
ATOM 518 C CG2 . VAL A 1 45 . 51.062 12.651 -7.228 1 8.74 ? CG2 VAL A 45 1 
ATOM 519 N N . LEU A 1 46 . 46.623 11.428 -8.515 1 5.69 ? N LEU A 46 1 
ATOM 520 C CA . LEU A 1 46 . 45.658 10.561 -9.16 1 5.49 ? CA LEU A 46 1 
ATOM 521 C C . LEU A 1 46 . 46.367 9.662 -10.156 1 5.41 ? C LEU A 46 1 
ATOM 522 O O . LEU A 1 46 . 47.281 10.087 -10.884 1 5.8 ? O LEU A 46 1 
ATOM 523 C CB . LEU A 1 46 . 44.542 11.315 -9.845 1 6.35 ? CB LEU A 46 1 
ATOM 524 C CG . LEU A 1 46 . 43.693 12.217 -8.963 1 6.78 ? CG LEU A 46 1 
ATOM 525 C CD1 . LEU A 1 46 . 42.574 12.847 -9.819 1 7.51 ? CD1 LEU A 46 1 
ATOM 526 C CD2 . LEU A 1 46 . 43.084 11.47 -7.79 1 7.52 ? CD2 LEU A 46 1 
ATOM 527 N N A TYR A 1 47 . 45.854 8.459 -10.31 0.58 5.39 ? N TYR A 47 1 
ATOM 528 N N B TYR A 1 47 . 46.026 8.386 -10.203 0.42 6.2 ? N TYR A 47 1 
ATOM 529 C CA A TYR A 1 47 . 46.545 7.445 -11.04 0.58 5.76 ? CA TYR A 47 1 
ATOM 530 C CA B TYR A 1 47 . 46.694 7.396 -11.139 0.42 6.19 ? CA TYR A 47 1 
ATOM 531 C C A TYR A 1 47 . 46.218 7.536 -12.502 0.58 5.11 ? C TYR A 47 1 
ATOM 532 C C B TYR A 1 47 . 46.418 7.702 -12.636 0.42 5.23 ? C TYR A 47 1 
ATOM 533 O O A TYR A 1 47 . 46.839 6.86 -13.32 0.58 5.35 ? O TYR A 47 1 
ATOM 534 O O B TYR A 1 47 . 47.098 7.204 -13.512 0.42 5.77 ? O TYR A 47 1 
ATOM 535 C CB A TYR A 1 47 . 46.214 6.018 -10.531 0.58 5.3 ? CB TYR A 47 1 
ATOM 536 C CB B TYR A 1 47 . 46.186 5.939 -10.875 0.42 6.51 ? CB TYR A 47 1 
ATOM 537 C CG A TYR A 1 47 . 46.859 5.571 -9.261 0.58 5.44 ? CG TYR A 47 1 
ATOM 538 C CG B TYR A 1 47 . 46.835 5.241 -9.689 0.42 6.61 ? CG TYR A 47 1 
ATOM 539 C CD1 A TYR A 1 47 . 47.127 4.226 -9.092 0.58 5.84 ? CD1 TYR A 47 1 
ATOM 540 C CD1 B TYR A 1 47 . 47.217 3.96 -9.773 0.42 7.13 ? CD1 TYR A 47 1 
ATOM 541 C CD2 A TYR A 1 47 . 47.206 6.468 -8.226 0.58 6.24 ? CD2 TYR A 47 1 
ATOM 542 C CD2 B TYR A 1 47 . 47.214 5.944 -8.577 0.42 8.83 ? CD2 TYR A 47 1 
ATOM 543 C CE1 A TYR A 1 47 . 47.733 3.766 -7.973 0.58 6.41 ? CE1 TYR A 47 1 
ATOM 544 C CE1 B TYR A 1 47 . 47.903 3.307 -8.729 0.42 10.16 ? CE1 TYR A 47 1 
ATOM 545 C CE2 A TYR A 1 47 . 47.778 5.985 -7.07 0.58 7.02 ? CE2 TYR A 47 1 
ATOM 546 C CE2 B TYR A 1 47 . 47.906 5.291 -7.438 0.42 9.94 ? CE2 TYR A 47 1 
ATOM 547 C CZ A TYR A 1 47 . 48.07 4.639 -6.97 0.58 7.68 ? CZ TYR A 47 1 
ATOM 548 C CZ B TYR A 1 47 . 48.231 3.977 -7.573 0.42 9.86 ? CZ TYR A 47 1 
ATOM 549 O OH A TYR A 1 47 . 48.679 4.112 -5.857 0.58 10.27 ? OH TYR A 47 1 
ATOM 550 O OH B TYR A 1 47 . 48.916 3.293 -6.596 0.42 14.03 ? OH TYR A 47 1 
ATOM 551 N N . SER A 1 48 . 45.307 8.401 -12.88 1 5.85 ? N SER A 48 1 
ATOM 552 C CA . SER A 1 48 . 44.825 8.656 -14.237 1 5.71 ? CA SER A 48 1 
ATOM 553 C C . SER A 1 48 . 44.987 10.137 -14.54 1 5.4 ? C SER A 48 1 
ATOM 554 O O . SER A 1 48 . 44.999 10.957 -13.611 1 5.44 ? O SER A 48 1 
ATOM 555 C CB . SER A 1 48 . 43.37 8.25 -14.328 1 6.22 ? CB SER A 48 1 
ATOM 556 O OG . SER A 1 48 . 43.257 6.884 -14.027 1 6.9 ? OG SER A 48 1 
ATOM 557 N N . PRO A 1 49 . 45.021 10.526 -15.828 1 5.28 ? N PRO A 49 1 
ATOM 558 C CA . PRO A 1 49 . 45.2 11.94 -16.205 1 5.38 ? CA PRO A 49 1 
ATOM 559 C C . PRO A 1 49 . 43.863 12.663 -16.187 1 4.94 ? C PRO A 49 1 
ATOM 560 O O . PRO A 1 49 . 43.28 13.051 -17.196 1 5.7 ? O PRO A 49 1 
ATOM 561 C CB . PRO A 1 49 . 45.792 11.845 -17.603 1 5.93 ? CB PRO A 49 1 
ATOM 562 C CG . PRO A 1 49 . 45.185 10.59 -18.157 1 6.3 ? CG PRO A 49 1 
ATOM 563 C CD . PRO A 1 49 . 45.077 9.649 -17.003 1 6.46 ? CD PRO A 49 1 
ATOM 564 N N . PHE A 1 50 . 43.336 12.77 -14.966 1 5.13 ? N PHE A 50 1 
ATOM 565 C CA . PHE A 1 50 . 42.1 13.407 -14.643 1 5.13 ? CA PHE A 50 1 
ATOM 566 C C . PHE A 1 50 . 42.393 14.583 -13.717 1 5.39 ? C PHE A 50 1 
ATOM 567 O O . PHE A 1 50 . 43.419 14.571 -13.012 0.89 5.68 ? O PHE A 50 1 
ATOM 568 C CB . PHE A 1 50 . 41.13 12.432 -13.956 1 5.97 ? CB PHE A 50 1 
ATOM 569 C CG . PHE A 1 50 . 40.829 11.124 -14.692 1 5.75 ? CG PHE A 50 1 
ATOM 570 C CD1 . PHE A 1 50 . 40.176 10.15 -13.985 1 6.42 ? CD1 PHE A 50 1 
ATOM 571 C CD2 . PHE A 1 50 . 41.118 10.894 -16.024 1 5.44 ? CD2 PHE A 50 1 
ATOM 572 C CE1 . PHE A 1 50 . 39.819 8.956 -14.604 1 6.95 ? CE1 PHE A 50 1 
ATOM 573 C CE2 . PHE A 1 50 . 40.784 9.685 -16.629 0.94 5.48 ? CE2 PHE A 50 1 
ATOM 574 C CZ . PHE A 1 50 . 40.114 8.705 -15.898 1 6.74 ? CZ PHE A 50 1 
ATOM 575 N N . PHE A 1 51 . 41.517 15.572 -13.708 1 5.53 ? N PHE A 51 1 
ATOM 576 C CA . PHE A 1 51 . 41.688 16.701 -12.863 1 5.8 ? CA PHE A 51 1 
ATOM 577 C C . PHE A 1 51 . 40.419 17.002 -12.091 1 4.96 ? C PHE A 51 1 
ATOM 578 O O . PHE A 1 51 . 39.319 16.765 -12.547 1 5.55 ? O PHE A 51 1 
ATOM 579 C CB . PHE A 1 51 . 42.156 17.975 -13.62 1 7.14 ? CB PHE A 51 1 
ATOM 580 C CG . PHE A 1 51 . 41.151 18.488 -14.686 1 7.22 ? CG PHE A 51 1 
ATOM 581 C CD1 . PHE A 1 51 . 40.131 19.334 -14.315 1 7.41 ? CD1 PHE A 51 1 
ATOM 582 C CD2 . PHE A 1 51 . 41.206 18.082 -16.013 1 9.04 ? CD2 PHE A 51 1 
ATOM 583 C CE1 . PHE A 1 51 . 39.237 19.85 -15.257 1 8.62 ? CE1 PHE A 51 1 
ATOM 584 C CE2 . PHE A 1 51 . 40.31 18.578 -16.947 1 9.33 ? CE2 PHE A 51 1 
ATOM 585 C CZ . PHE A 1 51 . 39.343 19.46 -16.554 1 9.81 ? CZ PHE A 51 1 
ATOM 586 N N . TYR A 1 52 . 40.59 17.545 -10.882 1 5.42 ? N TYR A 52 1 
ATOM 587 C CA . TYR A 1 52 . 39.42 17.898 -10.099 1 5.74 ? CA TYR A 52 1 
ATOM 588 C C . TYR A 1 52 . 38.597 18.921 -10.849 1 5.22 ? C TYR A 52 1 
ATOM 589 O O . TYR A 1 52 . 39.123 19.981 -11.229 1 5.96 ? O TYR A 52 1 
ATOM 590 C CB . TYR A 1 52 . 39.801 18.387 -8.691 1 5.87 ? CB TYR A 52 1 
ATOM 591 C CG . TYR A 1 52 . 40.011 17.233 -7.761 1 5.84 ? CG TYR A 52 1 
ATOM 592 C CD1 . TYR A 1 52 . 41.173 16.495 -7.759 1 6.03 ? CD1 TYR A 52 1 
ATOM 593 C CD2 . TYR A 1 52 . 38.982 16.822 -6.889 1 7.15 ? CD2 TYR A 52 1 
ATOM 594 C CE1 . TYR A 1 52 . 41.279 15.324 -6.987 1 7.03 ? CE1 TYR A 52 1 
ATOM 595 C CE2 . TYR A 1 52 . 39.078 15.699 -6.122 1 7.62 ? CE2 TYR A 52 1 
ATOM 596 C CZ . TYR A 1 52 . 40.211 14.957 -6.188 1 7.93 ? CZ TYR A 52 1 
ATOM 597 O OH . TYR A 1 52 . 40.365 13.774 -5.461 1 9.99 ? OH TYR A 52 1 
ATOM 598 N N . PRO A 1 53 . 37.295 18.694 -11.016 1 5.53 ? N PRO A 53 1 
ATOM 599 C CA . PRO A 1 53 . 36.483 19.584 -11.868 1 5.57 ? CA PRO A 53 1 
ATOM 600 C C . PRO A 1 53 . 35.956 20.806 -11.127 1 5.35 ? C PRO A 53 1 
ATOM 601 O O . PRO A 1 53 . 35.268 21.643 -11.76 1 6.68 ? O PRO A 53 1 
ATOM 602 C CB . PRO A 1 53 . 35.357 18.68 -12.348 1 6.23 ? CB PRO A 53 1 
ATOM 603 C CG . PRO A 1 53 . 35.199 17.668 -11.228 1 6.11 ? CG PRO A 53 1 
ATOM 604 C CD . PRO A 1 53 . 36.611 17.387 -10.781 1 6.01 ? CD PRO A 53 1 
ATOM 605 N N . VAL A 1 54 . 36.183 20.871 -9.844 1 5.39 ? N VAL A 54 1 
ATOM 606 C CA . VAL A 1 54 . 35.684 21.837 -8.877 1 5.44 ? CA VAL A 54 1 
ATOM 607 C C . VAL A 1 54 . 36.806 22.183 -7.942 1 5.39 ? C VAL A 54 1 
ATOM 608 O O . VAL A 1 54 . 37.765 21.406 -7.81 1 6.44 ? O VAL A 54 1 
ATOM 609 C CB . VAL A 1 54 . 34.507 21.203 -8.071 1 6.82 ? CB VAL A 54 1 
ATOM 610 C CG1 . VAL A 1 54 . 33.291 21.018 -8.975 1 9.09 ? CG1 VAL A 54 1 
ATOM 611 C CG2 . VAL A 1 54 . 34.936 19.918 -7.392 1 8.42 ? CG2 VAL A 54 1 
ATOM 612 N N . ASP A 1 55 . 36.71 23.312 -7.251 1 5.29 ? N ASP A 55 1 
ATOM 613 C CA A ASP A 1 55 . 37.559 23.582 -6.101 0.78 4.96 ? CA ASP A 55 1 
ATOM 614 C CA B ASP A 1 55 . 37.58 23.549 -6.142 0.22 6.41 ? CA ASP A 55 1 
ATOM 615 C C . ASP A 1 55 . 37.049 22.675 -4.984 1 5.12 ? C ASP A 55 1 
ATOM 616 O O . ASP A 1 55 . 35.839 22.667 -4.676 1 8.66 ? O ASP A 55 1 
ATOM 617 C CB A ASP A 1 55 . 37.529 25.041 -5.7 0.78 5.2 ? CB ASP A 55 1 
ATOM 618 C CB B ASP A 1 55 . 37.61 25.042 -5.881 0.22 9.13 ? CB ASP A 55 1 
ATOM 619 C CG A ASP A 1 55 . 38.386 25.951 -6.599 0.78 4.81 ? CG ASP A 55 1 
ATOM 620 C CG B ASP A 1 55 . 38.272 25.792 -7.007 0.22 11.3 ? CG ASP A 55 1 
ATOM 621 O OD1 A ASP A 1 55 . 38.622 25.577 -7.803 0.78 5.48 ? OD1 ASP A 55 1 
ATOM 622 O OD1 B ASP A 1 55 . 39.486 25.954 -6.978 0.22 10.07 ? OD1 ASP A 55 1 
ATOM 623 O OD2 A ASP A 1 55 . 38.72 27.029 -6.12 0.78 7 ? OD2 ASP A 55 1 
ATOM 624 O OD2 B ASP A 1 55 . 37.596 26.17 -7.968 0.22 12.83 ? OD2 ASP A 55 1 
ATOM 625 N N . TYR A 1 56 . 37.899 21.897 -4.398 1 4.78 ? N TYR A 56 1 
ATOM 626 C CA . TYR A 1 56 . 37.51 20.758 -3.572 1 4.68 ? CA TYR A 56 1 
ATOM 627 C C . TYR A 1 56 . 38.087 20.913 -2.182 1 4.31 ? C TYR A 56 1 
ATOM 628 O O . TYR A 1 56 . 39.283 21.2 -2.031 1 4.97 ? O TYR A 56 1 
ATOM 629 C CB . TYR A 1 56 . 38.01 19.469 -4.241 1 4.94 ? CB TYR A 56 1 
ATOM 630 C CG . TYR A 1 56 . 37.571 18.218 -3.601 1 4.86 ? CG TYR A 56 1 
ATOM 631 C CD1 . TYR A 1 56 . 36.43 17.549 -4.015 1 5.72 ? CD1 TYR A 56 1 
ATOM 632 C CD2 . TYR A 1 56 . 38.262 17.656 -2.519 1 5.33 ? CD2 TYR A 56 1 
ATOM 633 C CE1 . TYR A 1 56 . 35.992 16.384 -3.364 1 6.02 ? CE1 TYR A 56 1 
ATOM 634 C CE2 . TYR A 1 56 . 37.852 16.507 -1.88 1 5.41 ? CE2 TYR A 56 1 
ATOM 635 C CZ . TYR A 1 56 . 36.681 15.878 -2.302 1 5.07 ? CZ TYR A 56 1 
ATOM 636 O OH . TYR A 1 56 . 36.203 14.764 -1.676 1 5.73 ? OH TYR A 56 1 
ATOM 637 N N . GLY A 1 57 . 37.282 20.702 -1.144 1 4.69 ? N GLY A 57 1 
ATOM 638 C CA . GLY A 1 57 . 37.83 20.801 0.206 1 5.09 ? CA GLY A 57 1 
ATOM 639 C C . GLY A 1 57 . 36.868 20.297 1.247 1 4.53 ? C GLY A 57 1 
ATOM 640 O O . GLY A 1 57 . 36.187 19.282 1.036 1 4.87 ? O GLY A 57 1 
ATOM 641 N N . ILE A 1 58 . 36.842 20.983 2.375 1 4.98 ? N ILE A 58 1 
ATOM 642 C CA . ILE A 1 58 . 36.102 20.564 3.566 1 5.03 ? CA ILE A 58 1 
ATOM 643 C C . ILE A 1 58 . 35.281 21.696 4.108 1 5.26 ? C ILE A 58 1 
ATOM 644 O O . ILE A 1 58 . 35.568 22.89 3.913 1 5.72 ? O ILE A 58 1 
ATOM 645 C CB . ILE A 1 58 . 37.042 20.045 4.674 1 5.51 ? CB ILE A 58 1 
ATOM 646 C CG1 . ILE A 1 58 . 37.961 21.104 5.245 1 7.51 ? CG1 ILE A 58 1 
ATOM 647 C CG2 . ILE A 1 58 . 37.794 18.838 4.162 1 6.69 ? CG2 ILE A 58 1 
ATOM 648 C CD1 . ILE A 1 58 . 38.705 20.668 6.479 1 10.43 ? CD1 ILE A 58 1 
ATOM 649 N N . ILE A 1 59 . 34.272 21.321 4.897 1 5.62 ? N ILE A 59 1 
ATOM 650 C CA . ILE A 1 59 . 33.591 22.255 5.791 1 5.55 ? CA ILE A 59 1 
ATOM 651 C C . ILE A 1 59 . 34.272 22.123 7.139 1 5.5 ? C ILE A 59 1 
ATOM 652 O O . ILE A 1 59 . 34.389 21.011 7.683 1 6.11 ? O ILE A 59 1 
ATOM 653 C CB . ILE A 1 59 . 32.099 22.005 5.865 1 5.91 ? CB ILE A 59 1 
ATOM 654 C CG1 . ILE A 1 59 . 31.462 22.116 4.461 1 6.79 ? CG1 ILE A 59 1 
ATOM 655 C CG2 . ILE A 1 59 . 31.469 22.99 6.868 1 6.66 ? CG2 ILE A 59 1 
ATOM 656 C CD1 . ILE A 1 59 . 30.006 21.774 4.422 1 7.69 ? CD1 ILE A 59 1 
ATOM 657 N N . PRO A 1 60 . 34.767 23.214 7.737 1 6.35 ? N PRO A 60 1 
ATOM 658 C CA . PRO A 1 60 . 35.418 23.079 9.058 1 7.24 ? CA PRO A 60 1 
ATOM 659 C C . PRO A 1 60 . 34.44 22.575 10.113 1 6.6 ? C PRO A 60 1 
ATOM 660 O O . PRO A 1 60 . 33.231 22.746 10.015 1 6.97 ? O PRO A 60 1 
ATOM 661 C CB . PRO A 1 60 . 35.869 24.529 9.391 1 9.61 ? CB PRO A 60 1 
ATOM 662 C CG . PRO A 1 60 . 35.898 25.226 8.033 1 10.49 ? CG PRO A 60 1 
ATOM 663 C CD . PRO A 1 60 . 34.791 24.602 7.256 1 7.12 ? CD PRO A 60 1 
ATOM 664 N N . GLN A 1 61 . 35.012 21.946 11.157 1 6.87 ? N GLN A 61 1 
ATOM 665 C CA A GLN A 1 61 . 34.195 21.46 12.291 0.64 7.58 ? CA GLN A 61 1 
ATOM 666 C CA B GLN A 1 61 . 34.178 21.549 12.294 0.36 7.2 ? CA GLN A 61 1 
ATOM 667 C C . GLN A 1 61 . 33.066 20.587 11.822 1 7 ? C GLN A 61 1 
ATOM 668 O O . GLN A 1 61 . 31.948 20.619 12.323 1 7.54 ? O GLN A 61 1 
ATOM 669 C CB A GLN A 1 61 . 33.764 22.578 13.227 0.64 7.99 ? CB GLN A 61 1 
ATOM 670 C CB B GLN A 1 61 . 33.649 22.757 13.103 0.36 8.22 ? CB GLN A 61 1 
ATOM 671 C CG A GLN A 1 61 . 34.972 23.221 13.931 0.64 9.71 ? CG GLN A 61 1 
ATOM 672 C CG B GLN A 1 61 . 34.752 23.351 13.965 0.36 7.81 ? CG GLN A 61 1 
ATOM 673 C CD A GLN A 1 61 . 34.522 24.151 15.001 0.64 11.76 ? CD GLN A 61 1 
ATOM 674 C CD B GLN A 1 61 . 34.238 24.354 14.946 0.36 10.2 ? CD GLN A 61 1 
ATOM 675 O OE1 A GLN A 1 61 . 33.764 23.746 15.9 0.64 14.59 ? OE1 GLN A 61 1 
ATOM 676 O OE1 B GLN A 1 61 . 33.043 24.428 15.166 0.36 11 ? OE1 GLN A 61 1 
ATOM 677 N NE2 A GLN A 1 61 . 34.83 25.437 14.89 0.64 13.79 ? NE2 GLN A 61 1 
ATOM 678 N NE2 B GLN A 1 61 . 35.103 25.139 15.525 0.36 10.17 ? NE2 GLN A 61 1 
ATOM 679 N N . THR A 1 62 . 33.396 19.702 10.879 1 6.69 ? N THR A 62 1 
ATOM 680 C CA . THR A 1 62 . 32.534 18.613 10.453 1 6.47 ? CA THR A 62 1 
ATOM 681 C C . THR A 1 62 . 33.336 17.321 10.517 1 6.75 ? C THR A 62 1 
ATOM 682 O O . THR A 1 62 . 34.556 17.294 10.53 1 7.05 ? O THR A 62 1 
ATOM 683 C CB . THR A 1 62 . 31.965 18.806 9.04 1 6.69 ? CB THR A 62 1 
ATOM 684 O OG1 . THR A 1 62 . 33 18.721 8.073 1 6.43 ? OG1 THR A 62 1 
ATOM 685 C CG2 . THR A 1 62 . 31.143 20.05 8.932 1 7.11 ? CG2 THR A 62 1 
ATOM 686 N N . TRP A 1 63 . 32.574 16.205 10.498 1 7.15 ? N TRP A 63 1 
ATOM 687 C CA . TRP A 1 63 . 33.148 14.869 10.41 1 6.75 ? CA TRP A 63 1 
ATOM 688 C C . TRP A 1 63 . 32.223 14.024 9.589 1 6.5 ? C TRP A 63 1 
ATOM 689 O O . TRP A 1 63 . 31.085 14.388 9.347 1 7.85 ? O TRP A 63 1 
ATOM 690 C CB . TRP A 1 63 . 33.406 14.298 11.809 1 8.04 ? CB TRP A 63 1 
ATOM 691 C CG . TRP A 1 63 . 34.356 13.165 11.864 1 8.78 ? CG TRP A 63 1 
ATOM 692 C CD1 . TRP A 1 63 . 34.104 11.842 12.184 1 10.6 ? CD1 TRP A 63 1 
ATOM 693 C CD2 . TRP A 1 63 . 35.77 13.243 11.621 1 9.48 ? CD2 TRP A 63 1 
ATOM 694 N NE1 . TRP A 1 63 . 35.276 11.118 12.114 1 11.67 ? NE1 TRP A 63 1 
ATOM 695 C CE2 . TRP A 1 63 . 36.309 11.955 11.814 1 10.29 ? CE2 TRP A 63 1 
ATOM 696 C CE3 . TRP A 1 63 . 36.619 14.286 11.272 1 10.16 ? CE3 TRP A 63 1 
ATOM 697 C CZ2 . TRP A 1 63 . 37.675 11.703 11.704 1 12.8 ? CZ2 TRP A 63 1 
ATOM 698 C CZ3 . TRP A 1 63 . 37.94 14.051 11.185 1 11.15 ? CZ3 TRP A 63 1 
ATOM 699 C CH2 . TRP A 1 63 . 38.488 12.74 11.418 1 12.69 ? CH2 TRP A 63 1 
ATOM 700 N N . TYR A 1 64 . 32.696 12.888 9.141 1 6.79 ? N TYR A 64 1 
ATOM 701 C CA . TYR A 1 64 . 31.908 12.095 8.187 1 7.2 ? CA TYR A 64 1 
ATOM 702 C C . TYR A 1 64 . 32.326 10.642 8.233 1 6.84 ? C TYR A 64 1 
ATOM 703 O O . TYR A 1 64 . 33.321 10.259 8.874 1 7.99 ? O TYR A 64 1 
ATOM 704 C CB . TYR A 1 64 . 32.015 12.68 6.766 1 6.65 ? CB TYR A 64 1 
ATOM 705 C CG . TYR A 1 64 . 30.755 12.457 5.996 1 6.51 ? CG TYR A 64 1 
ATOM 706 C CD1 . TYR A 1 64 . 29.576 13.08 6.371 1 7.3 ? CD1 TYR A 64 1 
ATOM 707 C CD2 . TYR A 1 64 . 30.677 11.599 4.893 1 6.84 ? CD2 TYR A 64 1 
ATOM 708 C CE1 . TYR A 1 64 . 28.391 12.892 5.692 1 7.15 ? CE1 TYR A 64 1 
ATOM 709 C CE2 . TYR A 1 64 . 29.512 11.367 4.257 1 6.98 ? CE2 TYR A 64 1 
ATOM 710 C CZ . TYR A 1 64 . 28.37 12.055 4.609 1 7.13 ? CZ TYR A 64 1 
ATOM 711 O OH . TYR A 1 64 . 27.221 11.856 3.88 1 7.61 ? OH TYR A 64 1 
ATOM 712 N N . ASP A 1 65 . 31.574 9.819 7.523 1 7.16 ? N ASP A 65 1 
ATOM 713 C CA . ASP A 1 65 . 31.673 8.362 7.627 1 7.38 ? CA ASP A 65 1 
ATOM 714 C C . ASP A 1 65 . 32.987 7.806 7.148 1 7.67 ? C ASP A 65 1 
ATOM 715 O O . ASP A 1 65 . 33.322 6.68 7.509 1 9.41 ? O ASP A 65 1 
ATOM 716 C CB . ASP A 1 65 . 30.566 7.692 6.815 1 8.1 ? CB ASP A 65 1 
ATOM 717 C CG . ASP A 1 65 . 29.18 8.107 7.276 1 9.92 ? CG ASP A 65 1 
ATOM 718 O OD1 . ASP A 1 65 . 28.839 9.279 7.234 1 11.41 ? OD1 ASP A 65 1 
ATOM 719 O OD2 . ASP A 1 65 . 28.414 7.235 7.657 1 18.8 ? OD2 ASP A 65 1 
ATOM 720 N N . ASP A 1 66 . 33.714 8.535 6.291 1 7.9 ? N ASP A 66 1 
ATOM 721 C CA . ASP A 1 66 . 35.024 8.102 5.833 1 7.53 ? CA ASP A 66 1 
ATOM 722 C C . ASP A 1 66 . 36.134 8.53 6.758 1 8.33 ? C ASP A 66 1 
ATOM 723 O O . ASP A 1 66 . 37.32 8.376 6.408 1 9.85 ? O ASP A 66 1 
ATOM 724 C CB . ASP A 1 66 . 35.286 8.543 4.4 1 7.95 ? CB ASP A 66 1 
ATOM 725 C CG . ASP A 1 66 . 35.358 10.058 4.221 1 6.05 ? CG ASP A 66 1 
ATOM 726 O OD1 . ASP A 1 66 . 34.874 10.783 5.101 1 7.24 ? OD1 ASP A 66 1 
ATOM 727 O OD2 . ASP A 1 66 . 35.879 10.47 3.139 1 5.76 ? OD2 ASP A 66 1 
ATOM 728 N N . GLY A 1 67 . 35.814 8.974 7.963 1 8.42 ? N GLY A 67 1 
ATOM 729 C CA . GLY A 1 67 . 36.874 9.26 8.91 1 9.79 ? CA GLY A 67 1 
ATOM 730 C C . GLY A 1 67 . 37.656 10.507 8.596 1 8.76 ? C GLY A 67 1 
ATOM 731 O O . GLY A 1 67 . 38.888 10.542 8.753 1 10.3 ? O GLY A 67 1 
ATOM 732 N N . ASP A 1 68 . 36.964 11.536 8.126 1 7.79 ? N ASP A 68 1 
ATOM 733 C CA . ASP A 1 68 . 37.586 12.8 7.772 1 7.88 ? CA ASP A 68 1 
ATOM 734 C C . ASP A 1 68 . 36.459 13.837 7.71 1 6.69 ? C ASP A 68 1 
ATOM 735 O O . ASP A 1 68 . 35.28 13.496 7.762 1 7.12 ? O ASP A 68 1 
ATOM 736 C CB . ASP A 1 68 . 38.404 12.688 6.468 1 8.23 ? CB ASP A 68 1 
ATOM 737 C CG . ASP A 1 68 . 39.907 12.615 6.727 1 9.4 ? CG ASP A 68 1 
ATOM 738 O OD1 . ASP A 1 68 . 40.431 13.27 7.644 1 10.77 ? OD1 ASP A 68 1 
ATOM 739 O OD2 . ASP A 1 68 . 40.564 11.885 5.923 1 11.24 ? OD2 ASP A 68 1 
ATOM 740 N N . PRO A 1 69 . 36.828 15.125 7.561 1 6.47 ? N PRO A 69 1 
ATOM 741 C CA . PRO A 1 69 . 35.811 16.155 7.471 1 6.24 ? CA PRO A 69 1 
ATOM 742 C C . PRO A 1 69 . 34.903 15.956 6.265 1 5.4 ? C PRO A 69 1 
ATOM 743 O O . PRO A 1 69 . 35.292 15.37 5.238 1 5.71 ? O PRO A 69 1 
ATOM 744 C CB . PRO A 1 69 . 36.624 17.427 7.381 1 7.11 ? CB PRO A 69 1 
ATOM 745 C CG . PRO A 1 69 . 37.947 17.094 8.036 1 8.02 ? CG PRO A 69 1 
ATOM 746 C CD . PRO A 1 69 . 38.197 15.676 7.613 1 7.55 ? CD PRO A 69 1 
ATOM 747 N N . PHE A 1 70 . 33.722 16.517 6.331 1 5.78 ? N PHE A 70 1 
ATOM 748 C CA . PHE A 1 70 . 32.725 16.448 5.253 1 5.49 ? CA PHE A 70 1 
ATOM 749 C C . PHE A 1 70 . 33.219 17.255 4.063 1 5.09 ? C PHE A 70 1 
ATOM 750 O O . PHE A 1 70 . 33.703 18.38 4.171 1 5.57 ? O PHE A 70 1 
ATOM 751 C CB . PHE A 1 70 . 31.414 16.969 5.831 1 6.16 ? CB PHE A 70 1 
ATOM 752 C CG . PHE A 1 70 . 30.199 16.853 4.945 1 5.66 ? CG PHE A 70 1 
ATOM 753 C CD1 . PHE A 1 70 . 29.23 17.855 4.968 1 6.83 ? CD1 PHE A 70 1 
ATOM 754 C CD2 . PHE A 1 70 . 29.901 15.719 4.205 1 6.46 ? CD2 PHE A 70 1 
ATOM 755 C CE1 . PHE A 1 70 . 28.057 17.724 4.257 1 7.3 ? CE1 PHE A 70 1 
ATOM 756 C CE2 . PHE A 1 70 . 28.757 15.617 3.461 1 6.67 ? CE2 PHE A 70 1 
ATOM 757 C CZ . PHE A 1 70 . 27.821 16.611 3.484 1 6.7 ? CZ PHE A 70 1 
ATOM 758 N N . ASP A 1 71 . 33.054 16.649 2.885 1 4.86 ? N ASP A 71 1 
ATOM 759 C CA . ASP A 1 71 . 33.584 17.163 1.646 0.93 4.19 ? CA ASP A 71 1 
ATOM 760 C C . ASP A 1 71 . 32.638 18.17 0.972 1 4.9 ? C ASP A 71 1 
ATOM 761 O O . ASP A 1 71 . 31.424 17.977 0.933 1 5.03 ? O ASP A 71 1 
ATOM 762 C CB . ASP A 1 71 . 33.857 16.015 0.666 1 5.03 ? CB ASP A 71 1 
ATOM 763 C CG . ASP A 1 71 . 34.877 15.041 1.181 1 4.56 ? CG ASP A 71 1 
ATOM 764 O OD1 . ASP A 1 71 . 34.722 13.798 0.938 1 4.86 ? OD1 ASP A 71 1 
ATOM 765 O OD2 . ASP A 1 71 . 35.848 15.499 1.814 1 4.97 ? OD2 ASP A 71 1 
ATOM 766 N N . ILE A 1 72 . 33.247 19.211 0.41 1 4.9 ? N ILE A 72 1 
ATOM 767 C CA . ILE A 1 72 . 32.524 20.234 -0.33 1 4.73 ? CA ILE A 72 1 
ATOM 768 C C . ILE A 1 72 . 33.249 20.557 -1.604 1 4.8 ? C ILE A 72 1 
ATOM 769 O O . ILE A 1 72 . 34.486 20.609 -1.669 1 5.94 ? O ILE A 72 1 
ATOM 770 C CB . ILE A 1 72 . 32.28 21.471 0.566 1 5.17 ? CB ILE A 72 1 
ATOM 771 C CG1 . ILE A 1 72 . 31.424 22.529 -0.161 1 5.54 ? CG1 ILE A 72 1 
ATOM 772 C CG2 . ILE A 1 72 . 33.555 22.062 1.102 1 5.7 ? CG2 ILE A 72 1 
ATOM 773 C CD1 . ILE A 1 72 . 30.75 23.522 0.796 1 6.31 ? CD1 ILE A 72 1 
ATOM 774 N N . MET A 1 73 . 32.461 20.813 -2.619 1 4.76 ? N MET A 73 1 
ATOM 775 C CA . MET A 1 73 . 32.868 21.143 -3.988 1 4.99 ? CA MET A 73 1 
ATOM 776 C C . MET A 1 73 . 32.322 22.514 -4.313 1 5.58 ? C MET A 73 1 
ATOM 777 O O . MET A 1 73 . 31.101 22.695 -4.282 1 7 ? O MET A 73 1 
ATOM 778 C CB . MET A 1 73 . 32.274 20.102 -4.946 1 5.68 ? CB MET A 73 1 
ATOM 779 C CG . MET A 1 73 . 32.623 18.661 -4.574 1 6.07 ? CG MET A 73 1 
ATOM 780 S SD . MET A 1 73 . 32.087 17.421 -5.77 1 7.52 ? SD MET A 73 1 
ATOM 781 C CE . MET A 1 73 . 30.289 17.581 -5.637 1 8.16 ? CE MET A 73 1 
ATOM 782 N N . VAL A 1 74 . 33.193 23.481 -4.584 1 5.26 ? N VAL A 74 1 
ATOM 783 C CA . VAL A 1 74 . 32.812 24.848 -4.878 1 5.11 ? CA VAL A 74 1 
ATOM 784 C C . VAL A 1 74 . 33.119 25.131 -6.345 1 5.59 ? C VAL A 74 1 
ATOM 785 O O . VAL A 1 74 . 34.224 24.898 -6.826 1 6.29 ? O VAL A 74 1 
ATOM 786 C CB . VAL A 1 74 . 33.477 25.851 -3.978 1 5.78 ? CB VAL A 74 1 
ATOM 787 C CG1 . VAL A 1 74 . 32.943 27.248 -4.296 1 6.92 ? CG1 VAL A 74 1 
ATOM 788 C CG2 . VAL A 1 74 . 33.238 25.517 -2.515 1 6.87 ? CG2 VAL A 74 1 
ATOM 789 N N . ILE A 1 75 . 32.121 25.659 -7.049 1 5.95 ? N ILE A 75 1 
ATOM 790 C CA A ILE A 1 75 . 32.272 26.034 -8.408 0.24 6.15 ? CA ILE A 75 1 
ATOM 791 C CA B ILE A 1 75 . 32.326 26.032 -8.459 0.76 6.32 ? CA ILE A 75 1 
ATOM 792 C C . ILE A 1 75 . 32.918 27.454 -8.514 1 6.47 ? C ILE A 75 1 
ATOM 793 O O . ILE A 1 75 . 32.247 28.426 -8.295 0.9 7.34 ? O ILE A 75 1 
ATOM 794 C CB A ILE A 1 75 . 30.935 25.946 -9.118 0.24 9.65 ? CB ILE A 75 1 
ATOM 795 C CB B ILE A 1 75 . 31.008 25.975 -9.235 0.76 6.06 ? CB ILE A 75 1 
ATOM 796 C CG1 A ILE A 1 75 . 30.301 24.581 -8.784 0.24 8.58 ? CG1 ILE A 75 1 
ATOM 797 C CG1 B ILE A 1 75 . 30.276 24.641 -9.054 0.76 8.44 ? CG1 ILE A 75 1 
ATOM 798 C CG2 A ILE A 1 75 . 31.104 26.12 -10.647 0.24 14.17 ? CG2 ILE A 75 1 
ATOM 799 C CG2 B ILE A 1 75 . 31.301 26.236 -10.706 0.76 7.07 ? CG2 ILE A 75 1 
ATOM 800 C CD1 A ILE A 1 75 . 31.205 23.422 -9.092 0.24 8.05 ? CD1 ILE A 75 1 
ATOM 801 C CD1 B ILE A 1 75 . 28.853 24.619 -9.654 0.76 9.61 ? CD1 ILE A 75 1 
ATOM 802 N N . MET A 1 76 . 34.242 27.506 -8.755 1 7.14 ? N MET A 76 1 
ATOM 803 C CA . MET A 1 76 . 35.005 28.753 -8.893 1 7.1 ? CA MET A 76 1 
ATOM 804 C C . MET A 1 76 . 35.438 28.938 -10.369 1 7.57 ? C MET A 76 1 
ATOM 805 O O . MET A 1 76 . 36.05 28.035 -10.923 1 9.76 ? O MET A 76 1 
ATOM 806 C CB . MET A 1 76 . 36.231 28.83 -7.995 0.81 5.65 ? CB MET A 76 1 
ATOM 807 C CG . MET A 1 76 . 35.916 28.984 -6.523 1 8.44 ? CG MET A 76 1 
ATOM 808 S SD . MET A 1 76 . 35.152 30.62 -6.155 1 9.77 ? SD MET A 76 1 
ATOM 809 C CE . MET A 1 76 . 36.518 31.71 -6.486 1 9.5 ? CE MET A 76 1 
ATOM 810 N N . ARG A 1 77 . 35.207 30.103 -10.923 1 6.49 ? N ARG A 77 1 
ATOM 811 C CA . ARG A 1 77 . 35.69 30.431 -12.247 1 6.33 ? CA ARG A 77 1 
ATOM 812 C C . ARG A 1 77 . 37.211 30.504 -12.284 1 7.01 ? C ARG A 77 1 
ATOM 813 O O . ARG A 1 77 . 37.846 29.829 -13.108 1 10.91 ? O ARG A 77 1 
ATOM 814 C CB . ARG A 1 77 . 35.03 31.722 -12.772 1 7.12 ? CB ARG A 77 1 
ATOM 815 C CG . ARG A 1 77 . 33.524 31.558 -12.94 1 7.08 ? CG ARG A 77 1 
ATOM 816 C CD . ARG A 1 77 . 32.922 32.729 -13.678 1 7.8 ? CD ARG A 77 1 
ATOM 817 N NE . ARG A 1 77 . 32.884 33.938 -12.859 1 7.04 ? NE ARG A 77 1 
ATOM 818 C CZ . ARG A 1 77 . 32.768 35.174 -13.358 1 7.27 ? CZ ARG A 77 1 
ATOM 819 N NH1 . ARG A 1 77 . 32.905 35.417 -14.663 1 7.82 ? NH1 ARG A 77 1 
ATOM 820 N NH2 . ARG A 1 77 . 32.579 36.184 -12.519 1 7.52 ? NH2 ARG A 77 1 
ATOM 821 N N . GLU A 1 78 . 37.819 31.289 -11.417 1 6.55 ? N GLU A 78 1 
ATOM 822 C CA . GLU A 1 78 . 39.241 31.289 -11.204 1 6.08 ? CA GLU A 78 1 
ATOM 823 C C . GLU A 1 78 . 39.495 30.421 -9.953 1 6.01 ? C GLU A 78 1 
ATOM 824 O O . GLU A 1 78 . 38.982 30.787 -8.883 1 6.71 ? O GLU A 78 1 
ATOM 825 C CB . GLU A 1 78 . 39.766 32.722 -10.954 1 6.87 ? CB GLU A 78 1 
ATOM 826 C CG . GLU A 1 78 . 41.248 32.78 -10.685 1 7.07 ? CG GLU A 78 1 
ATOM 827 C CD . GLU A 1 78 . 41.737 34.241 -10.529 1 7.94 ? CD GLU A 78 1 
ATOM 828 O OE1 . GLU A 1 78 . 41.679 34.98 -11.497 1 8.79 ? OE1 GLU A 78 1 
ATOM 829 O OE2 . GLU A 1 78 . 42.118 34.649 -9.416 1 8.75 ? OE2 GLU A 78 1 
ATOM 830 N N . PRO A 1 79 . 40.207 29.333 -10.067 1 6.29 ? N PRO A 79 1 
ATOM 831 C CA . PRO A 1 79 . 40.425 28.491 -8.866 1 7.4 ? CA PRO A 79 1 
ATOM 832 C C . PRO A 1 79 . 41.163 29.271 -7.788 1 6.54 ? C PRO A 79 1 
ATOM 833 O O . PRO A 1 79 . 41.969 30.14 -8.063 1 7.98 ? O PRO A 79 1 
ATOM 834 C CB . PRO A 1 79 . 41.288 27.348 -9.408 1 9.58 ? CB PRO A 79 1 
ATOM 835 C CG . PRO A 1 79 . 40.928 27.317 -10.891 1 11.99 ? CG PRO A 79 1 
ATOM 836 C CD . PRO A 1 79 . 40.795 28.755 -11.27 1 9.34 ? CD PRO A 79 1 
ATOM 837 N N . VAL A 1 80 . 40.862 28.901 -6.551 1 6.9 ? N VAL A 80 1 
ATOM 838 C CA . VAL A 1 80 . 41.575 29.46 -5.431 1 6.39 ? CA VAL A 80 1 
ATOM 839 C C . VAL A 1 80 . 42.802 28.671 -5.088 1 6.41 ? C VAL A 80 1 
ATOM 840 O O . VAL A 1 80 . 42.948 27.543 -5.441 1 12.34 ? O VAL A 80 1 
ATOM 841 C CB . VAL A 1 80 . 40.689 29.705 -4.185 1 7.07 ? CB VAL A 80 1 
ATOM 842 C CG1 . VAL A 1 80 . 39.469 30.555 -4.532 1 7.7 ? CG1 VAL A 80 1 
ATOM 843 C CG2 . VAL A 1 80 . 40.27 28.402 -3.478 1 7.07 ? CG2 VAL A 80 1 
ATOM 844 N N . TYR A 1 81 . 43.644 29.214 -4.254 1 6.87 ? N TYR A 81 1 
ATOM 845 C CA . TYR A 1 81 . 44.809 28.557 -3.729 1 6.61 ? CA TYR A 81 1 
ATOM 846 C C . TYR A 1 81 . 44.417 27.6 -2.609 1 6.29 ? C TYR A 81 1 
ATOM 847 O O . TYR A 1 81 . 43.441 27.879 -1.853 1 7.29 ? O TYR A 81 1 
ATOM 848 C CB . TYR A 1 81 . 45.854 29.581 -3.232 1 6.91 ? CB TYR A 81 1 
ATOM 849 C CG . TYR A 1 81 . 46.457 30.343 -4.345 1 6.95 ? CG TYR A 81 1 
ATOM 850 C CD1 . TYR A 1 81 . 45.851 31.481 -4.886 1 7.61 ? CD1 TYR A 81 1 
ATOM 851 C CD2 . TYR A 1 81 . 47.633 29.906 -4.949 1 6.69 ? CD2 TYR A 81 1 
ATOM 852 C CE1 . TYR A 1 81 . 46.386 32.111 -5.975 1 8.61 ? CE1 TYR A 81 1 
ATOM 853 C CE2 . TYR A 1 81 . 48.176 30.55 -6.047 1 7.91 ? CE2 TYR A 81 1 
ATOM 854 C CZ . TYR A 1 81 . 47.513 31.664 -6.578 1 7.85 ? CZ TYR A 81 1 
ATOM 855 O OH . TYR A 1 81 . 48.063 32.281 -7.663 1 9.9 ? OH TYR A 81 1 
ATOM 856 N N . PRO A 1 82 . 45.157 26.529 -2.345 1 6.6 ? N PRO A 82 1 
ATOM 857 C CA . PRO A 1 82 . 44.835 25.699 -1.189 1 6.49 ? CA PRO A 82 1 
ATOM 858 C C . PRO A 1 82 . 44.872 26.502 0.094 1 6.38 ? C PRO A 82 1 
ATOM 859 O O . PRO A 1 82 . 45.677 27.426 0.266 1 7.21 ? O PRO A 82 1 
ATOM 860 C CB . PRO A 1 82 . 45.946 24.644 -1.195 1 8.01 ? CB PRO A 82 1 
ATOM 861 C CG . PRO A 1 82 . 46.446 24.613 -2.622 1 8.51 ? CG PRO A 82 1 
ATOM 862 C CD . PRO A 1 82 . 46.338 26.064 -3.089 1 7.51 ? CD PRO A 82 1 
ATOM 863 N N . LEU A 1 83 . 43.991 26.096 1.012 1 6.31 ? N LEU A 83 1 
ATOM 864 C CA . LEU A 1 83 . 43.798 26.674 2.322 1 6.74 ? CA LEU A 83 1 
ATOM 865 C C . LEU A 1 83 . 43.123 28.024 2.3 1 6.65 ? C LEU A 83 1 
ATOM 866 O O . LEU A 1 83 . 43.135 28.742 3.298 1 8.57 ? O LEU A 83 1 
ATOM 867 C CB . LEU A 1 83 . 45.079 26.684 3.18 1 9.23 ? CB LEU A 83 1 
ATOM 868 C CG . LEU A 1 83 . 45.797 25.36 3.26 1 13.43 ? CG LEU A 83 1 
ATOM 869 C CD1 . LEU A 1 83 . 47.059 25.541 4.183 1 19.69 ? CD1 LEU A 83 1 
ATOM 870 C CD2 . LEU A 1 83 . 44.917 24.291 3.751 1 16.76 ? CD2 LEU A 83 1 
ATOM 871 N N . THR A 1 84 . 42.427 28.341 1.194 1 6.22 ? N THR A 84 1 
ATOM 872 C CA . THR A 1 84 . 41.611 29.548 1.112 1 5.97 ? CA THR A 84 1 
ATOM 873 C C . THR A 1 84 . 40.192 29.218 1.627 1 5.51 ? C THR A 84 1 
ATOM 874 O O . THR A 1 84 . 39.6 28.195 1.244 1 6.08 ? O THR A 84 1 
ATOM 875 C CB . THR A 1 84 . 41.536 30.045 -0.313 1 6.72 ? CB THR A 84 1 
ATOM 876 O OG1 . THR A 1 84 . 42.84 30.282 -0.82 1 7.84 ? OG1 THR A 84 1 
ATOM 877 C CG2 . THR A 1 84 . 40.759 31.348 -0.392 1 8.07 ? CG2 THR A 84 1 
ATOM 878 N N . ILE A 1 85 . 39.637 30.139 2.403 1 5.46 ? N ILE A 85 1 
ATOM 879 C CA . ILE A 1 85 . 38.255 30.087 2.852 1 5.41 ? CA ILE A 85 1 
ATOM 880 C C . ILE A 1 85 . 37.348 30.741 1.837 1 5.24 ? C ILE A 85 1 
ATOM 881 O O . ILE A 1 85 . 37.595 31.874 1.424 1 6.35 ? O ILE A 85 1 
ATOM 882 C CB . ILE A 1 85 . 38.11 30.848 4.176 1 7.14 ? CB ILE A 85 1 
ATOM 883 C CG1 . ILE A 1 85 . 39.019 30.335 5.271 1 8.97 ? CG1 ILE A 85 1 
ATOM 884 C CG2 . ILE A 1 85 . 36.648 30.897 4.597 1 8.84 ? CG2 ILE A 85 1 
ATOM 885 C CD1 . ILE A 1 85 . 39.234 31.424 6.37 1 12.02 ? CD1 ILE A 85 1 
ATOM 886 N N . ILE A 1 86 . 36.281 30.061 1.463 1 5.24 ? N ILE A 86 1 
ATOM 887 C CA . ILE A 1 86 . 35.265 30.609 0.576 1 5.71 ? CA ILE A 86 1 
ATOM 888 C C . ILE A 1 86 . 33.916 30.556 1.311 1 5.48 ? C ILE A 86 1 
ATOM 889 O O . ILE A 1 86 . 33.523 29.471 1.756 1 6.91 ? O ILE A 86 1 
ATOM 890 C CB . ILE A 1 86 . 35.144 29.844 -0.754 1 5.78 ? CB ILE A 86 1 
ATOM 891 C CG1 . ILE A 1 86 . 36.482 29.774 -1.488 1 6.45 ? CG1 ILE A 86 1 
ATOM 892 C CG2 . ILE A 1 86 . 34.032 30.435 -1.635 1 6.8 ? CG2 ILE A 86 1 
ATOM 893 C CD1 . ILE A 1 86 . 36.431 28.947 -2.744 1 6.96 ? CD1 ILE A 86 1 
ATOM 894 N N . GLU A 1 87 . 33.176 31.643 1.386 1 5.35 ? N GLU A 87 1 
ATOM 895 C CA B GLU A 1 87 . 31.787 31.625 1.813 0.52 5.91 ? CA GLU A 87 1 
ATOM 896 C CA C GLU A 1 87 . 31.796 31.57 1.828 0.16 4.53 ? CA GLU A 87 1 
ATOM 897 C CA D GLU A 1 87 . 31.798 31.623 1.831 0.32 6.15 ? CA GLU A 87 1 
ATOM 898 C C . GLU A 1 87 . 30.945 31.04 0.68 1 5.44 ? C GLU A 87 1 
ATOM 899 O O . GLU A 1 87 . 30.931 31.599 -0.421 1 6.38 ? O GLU A 87 1 
ATOM 900 C CB B GLU A 1 87 . 31.317 33.045 2.104 0.52 6.91 ? CB GLU A 87 1 
ATOM 901 C CB C GLU A 1 87 . 31.268 32.897 2.369 0.16 6 ? CB GLU A 87 1 
ATOM 902 C CB D GLU A 1 87 . 31.355 33.047 2.206 0.32 6.84 ? CB GLU A 87 1 
ATOM 903 C CG B GLU A 1 87 . 31.995 33.617 3.243 0.52 8.71 ? CG GLU A 87 1 
ATOM 904 C CG C GLU A 1 87 . 31.973 33.36 3.625 0.16 8.87 ? CG GLU A 87 1 
ATOM 905 C CG D GLU A 1 87 . 30.036 33.087 2.892 0.32 6.84 ? CG GLU A 87 1 
ATOM 906 C CD B GLU A 1 87 . 32.174 35.2 3.152 0.52 13.19 ? CD GLU A 87 1 
ATOM 907 C CD C GLU A 1 87 . 31.5 34.73 4.086 0.16 11.76 ? CD GLU A 87 1 
ATOM 908 C CD D GLU A 1 87 . 29.601 34.505 3.337 0.32 10.09 ? CD GLU A 87 1 
ATOM 909 O OE1 B GLU A 1 87 . 32.45 36.005 2.058 0.52 13.17 ? OE1 GLU A 87 1 
ATOM 910 O OE1 C GLU A 1 87 . 30.53 35.266 3.509 0.16 14.6 ? OE1 GLU A 87 1 
ATOM 911 O OE1 D GLU A 1 87 . 28.511 34.761 3.818 0.32 9.99 ? OE1 GLU A 87 1 
ATOM 912 O OE2 B GLU A 1 87 . 32.249 35.774 4.28 0.52 17.98 ? OE2 GLU A 87 1 
ATOM 913 O OE2 C GLU A 1 87 . 32.167 35.282 5.008 0.16 12.42 ? OE2 GLU A 87 1 
ATOM 914 O OE2 D GLU A 1 87 . 30.392 35.46 3.232 0.32 16.66 ? OE2 GLU A 87 1 
ATOM 915 N N . ALA A 1 88 . 30.277 29.938 0.958 1 5.58 ? N ALA A 88 1 
ATOM 916 C CA . ALA A 1 88 . 29.677 29.1 -0.099 1 6.66 ? CA ALA A 88 1 
ATOM 917 C C . ALA A 1 88 . 28.217 28.802 0.234 1 6.11 ? C ALA A 88 1 
ATOM 918 O O . ALA A 1 88 . 27.851 28.526 1.365 1 6.89 ? O ALA A 88 1 
ATOM 919 C CB . ALA A 1 88 . 30.466 27.822 -0.221 1 8.29 ? CB ALA A 88 1 
ATOM 920 N N . ARG A 1 89 . 27.402 28.843 -0.826 1 5.79 ? N ARG A 89 1 
ATOM 921 C CA . ARG A 1 89 . 25.991 28.508 -0.776 1 5.79 ? CA ARG A 89 1 
ATOM 922 C C . ARG A 1 89 . 25.787 27.097 -1.322 1 5.55 ? C ARG A 89 1 
ATOM 923 O O . ARG A 1 89 . 25.987 26.855 -2.507 1 5.94 ? O ARG A 89 1 
ATOM 924 C CB . ARG A 1 89 . 25.169 29.511 -1.653 1 6.92 ? CB ARG A 89 1 
ATOM 925 C CG . ARG A 1 89 . 23.756 29.11 -1.864 1 8.75 ? CG ARG A 89 1 
ATOM 926 C CD . ARG A 1 89 . 22.894 30.198 -2.513 1 10.31 ? CD ARG A 89 1 
ATOM 927 N NE . ARG A 1 89 . 23.344 30.602 -3.903 1 9.21 ? NE ARG A 89 1 
ATOM 928 C CZ . ARG A 1 89 . 24.04 31.722 -4.145 1 8.44 ? CZ ARG A 89 1 
ATOM 929 N NH1 . ARG A 1 89 . 24.321 32.042 -5.373 1 9.12 ? NH1 ARG A 89 1 
ATOM 930 N NH2 . ARG A 1 89 . 24.468 32.497 -3.14 1 10.1 ? NH2 ARG A 89 1 
ATOM 931 N N . PRO A 1 90 . 25.377 26.156 -0.46 1 5.88 ? N PRO A 90 1 
ATOM 932 C CA . PRO A 1 90 . 25.044 24.797 -0.935 1 6.06 ? CA PRO A 90 1 
ATOM 933 C C . PRO A 1 90 . 23.868 24.859 -1.912 1 6.19 ? C PRO A 90 1 
ATOM 934 O O . PRO A 1 90 . 22.857 25.488 -1.601 1 7.13 ? O PRO A 90 1 
ATOM 935 C CB . PRO A 1 90 . 24.667 24.057 0.356 1 6.57 ? CB PRO A 90 1 
ATOM 936 C CG . PRO A 1 90 . 25.429 24.79 1.435 1 7.36 ? CG PRO A 90 1 
ATOM 937 C CD . PRO A 1 90 . 25.308 26.241 1.01 1 7.96 ? CD PRO A 90 1 
ATOM 938 N N . ILE A 1 91 . 24.019 24.14 -3.041 1 5.57 ? N ILE A 91 1 
ATOM 939 C CA . ILE A 1 91 . 22.949 24.026 -4.028 1 6.35 ? CA ILE A 91 1 
ATOM 940 C C . ILE A 1 91 . 22.564 22.6 -4.303 1 6.38 ? C ILE A 91 1 
ATOM 941 O O . ILE A 1 91 . 21.573 22.377 -5.005 1 8.22 ? O ILE A 91 1 
ATOM 942 C CB . ILE A 1 91 . 23.28 24.791 -5.337 1 6.85 ? CB ILE A 91 1 
ATOM 943 C CG1 . ILE A 1 91 . 24.467 24.183 -6.078 1 7.48 ? CG1 ILE A 91 1 
ATOM 944 C CG2 . ILE A 1 91 . 23.436 26.266 -5.022 1 7.64 ? CG2 ILE A 91 1 
ATOM 945 C CD1 . ILE A 1 91 . 24.676 24.732 -7.452 1 8.92 ? CD1 ILE A 91 1 
ATOM 946 N N . GLY A 1 92 . 23.292 21.596 -3.787 1 6.35 ? N GLY A 92 1 
ATOM 947 C CA . GLY A 1 92 . 22.966 20.221 -4.064 1 6.45 ? CA GLY A 92 1 
ATOM 948 C C . GLY A 1 92 . 24.024 19.347 -3.429 1 5.48 ? C GLY A 92 1 
ATOM 949 O O . GLY A 1 92 . 24.923 19.832 -2.733 1 5.73 ? O GLY A 92 1 
ATOM 950 N N . ILE A 1 93 . 23.917 18.047 -3.666 1 6.02 ? N ILE A 93 1 
ATOM 951 C CA . ILE A 1 93 . 24.822 17.091 -3.021 1 5.79 ? CA ILE A 93 1 
ATOM 952 C C . ILE A 1 93 . 25.001 15.881 -3.918 1 5.52 ? C ILE A 93 1 
ATOM 953 O O . ILE A 1 93 . 24.03 15.307 -4.446 1 6.71 ? O ILE A 93 1 
ATOM 954 C CB . ILE A 1 93 . 24.333 16.738 -1.587 1 6.21 ? CB ILE A 93 1 
ATOM 955 C CG1 . ILE A 1 93 . 25.333 15.828 -0.865 1 6.27 ? CG1 ILE A 93 1 
ATOM 956 C CG2 . ILE A 1 93 . 22.902 16.167 -1.557 1 7.06 ? CG2 ILE A 93 1 
ATOM 957 C CD1 . ILE A 1 93 . 25.221 15.954 0.636 1 7.5 ? CD1 ILE A 93 1 
ATOM 958 N N . MET A 1 94 . 26.239 15.449 -4.108 1 5.89 ? N MET A 94 1 
ATOM 959 C CA . MET A 1 94 . 26.566 14.254 -4.851 1 5.75 ? CA MET A 94 1 
ATOM 960 C C . MET A 1 94 . 26.552 13.067 -3.882 1 5.75 ? C MET A 94 1 
ATOM 961 O O . MET A 1 94 . 27.251 13.059 -2.876 1 6.5 ? O MET A 94 1 
ATOM 962 C CB . MET A 1 94 . 27.96 14.38 -5.473 1 6.27 ? CB MET A 94 1 
ATOM 963 C CG . MET A 1 94 . 28.317 13.227 -6.311 1 7.85 ? CG MET A 94 1 
ATOM 964 S SD . MET A 1 94 . 29.974 13.326 -7.029 1 8.32 ? SD MET A 94 1 
ATOM 965 C CE . MET A 1 94 . 30.937 13.257 -5.51 1 8.11 ? CE MET A 94 1 
ATOM 966 N N . LYS A 1 95 . 25.766 12.057 -4.237 1 5.93 ? N LYS A 95 1 
ATOM 967 C CA . LYS A 1 95 . 25.602 10.87 -3.368 1 6.61 ? CA LYS A 95 1 
ATOM 968 C C . LYS A 1 95 . 26.601 9.841 -3.84 1 6.55 ? C LYS A 95 1 
ATOM 969 O O . LYS A 1 95 . 26.439 9.191 -4.871 1 11.84 ? O LYS A 95 1 
ATOM 970 C CB . LYS A 1 95 . 24.164 10.368 -3.503 1 7.48 ? CB LYS A 95 1 
ATOM 971 C CG . LYS A 1 95 . 23.134 11.381 -3.067 1 8.92 ? CG LYS A 95 1 
ATOM 972 C CD . LYS A 1 95 . 21.733 10.866 -3.19 1 10.99 ? CD LYS A 95 1 
ATOM 973 C CE . LYS A 1 95 . 20.745 11.933 -2.633 1 13.89 ? CE LYS A 95 1 
ATOM 974 N NZ . LYS A 1 95 . 19.357 11.522 -2.698 1 16.81 ? NZ LYS A 95 1 
ATOM 975 N N . MET A 1 96 . 27.693 9.725 -3.105 1 7.44 ? N MET A 96 1 
ATOM 976 C CA . MET A 1 96 . 28.839 8.853 -3.403 1 7.88 ? CA MET A 96 1 
ATOM 977 C C . MET A 1 96 . 29.107 7.922 -2.222 1 6.52 ? C MET A 96 1 
ATOM 978 O O . MET A 1 96 . 29.164 8.379 -1.093 1 7.33 ? O MET A 96 1 
ATOM 979 C CB . MET A 1 96 . 30.134 9.741 -3.632 1 6.95 ? CB MET A 96 1 
ATOM 980 C CG . MET A 1 96 . 31.36 8.862 -3.878 1 7.55 ? CG MET A 96 1 
ATOM 981 S SD . MET A 1 96 . 32.764 9.918 -4.214 1 8.41 ? SD MET A 96 1 
ATOM 982 C CE . MET A 1 96 . 33.959 8.716 -4.75 1 8.51 ? CE MET A 96 1 
ATOM 983 N N A GLU A 1 97 . 29.356 6.681 -2.571 0.51 6.35 ? N GLU A 97 1 
ATOM 984 N N B GLU A 1 97 . 29.437 6.653 -2.489 0.49 6.46 ? N GLU A 97 1 
ATOM 985 C CA A GLU A 1 97 . 30.009 5.767 -1.697 0.51 6.89 ? CA GLU A 97 1 
ATOM 986 C CA B GLU A 1 97 . 30.024 5.697 -1.556 0.49 6.58 ? CA GLU A 97 1 
ATOM 987 C C A GLU A 1 97 . 31.456 5.587 -2.185 0.51 6.23 ? C GLU A 97 1 
ATOM 988 C C B GLU A 1 97 . 31.415 5.414 -2.087 0.49 6.42 ? C GLU A 97 1 
ATOM 989 O O A GLU A 1 97 . 31.698 5.47 -3.376 0.51 6.9 ? O GLU A 97 1 
ATOM 990 O O B GLU A 1 97 . 31.595 5.004 -3.226 0.49 7.9 ? O GLU A 97 1 
ATOM 991 C CB A GLU A 1 97 . 29.24 4.45 -1.683 0.51 10.65 ? CB GLU A 97 1 
ATOM 992 C CB B GLU A 1 97 . 29.227 4.376 -1.574 0.49 7.89 ? CB GLU A 97 1 
ATOM 993 C CG A GLU A 1 97 . 29.585 3.543 -0.451 0.51 10.77 ? CG GLU A 97 1 
ATOM 994 C CG B GLU A 1 97 . 27.925 4.455 -1.085 0.49 12.45 ? CG GLU A 97 1 
ATOM 995 C CD A GLU A 1 97 . 28.848 2.3 -0.322 0.51 15.18 ? CD GLU A 97 1 
ATOM 996 C CD B GLU A 1 97 . 27.832 4.273 0.345 0.49 14.09 ? CD GLU A 97 1 
ATOM 997 O OE1 A GLU A 1 97 . 27.745 2.347 0.292 0.51 18.96 ? OE1 GLU A 97 1 
ATOM 998 O OE1 B GLU A 1 97 . 28.539 3.404 0.9 0.49 17.04 ? OE1 GLU A 97 1 
ATOM 999 O OE2 A GLU A 1 97 . 29.421 1.216 -0.641 0.51 18.85 ? OE2 GLU A 97 1 
ATOM 1000 O OE2 B GLU A 1 97 . 27 4.991 1.055 0.49 12.3 ? OE2 GLU A 97 1 
ATOM 1001 N N . ASP A 1 98 . 32.394 5.619 -1.239 1 5.71 ? N ASP A 98 1 
ATOM 1002 C CA . ASP A 1 98 . 33.812 5.574 -1.592 1 5.81 ? CA ASP A 98 1 
ATOM 1003 C C . ASP A 1 98 . 34.468 4.468 -0.779 1 5.82 ? C ASP A 98 1 
ATOM 1004 O O . ASP A 1 98 . 34.547 4.591 0.442 1 6.32 ? O ASP A 98 1 
ATOM 1005 C CB . ASP A 1 98 . 34.461 6.923 -1.3 1 6.38 ? CB ASP A 98 1 
ATOM 1006 C CG . ASP A 1 98 . 35.887 7.04 -1.732 1 6.82 ? CG ASP A 98 1 
ATOM 1007 O OD1 . ASP A 1 98 . 36.403 6.051 -2.319 1 12.86 ? OD1 ASP A 98 1 
ATOM 1008 O OD2 . ASP A 1 98 . 36.547 8.057 -1.513 1 6.32 ? OD2 ASP A 98 1 
ATOM 1009 N N . SER A 1 99 . 34.865 3.391 -1.414 1 6.27 ? N SER A 99 1 
ATOM 1010 C CA . SER A 1 99 . 35.529 2.28 -0.713 1 7.62 ? CA SER A 99 1 
ATOM 1011 C C . SER A 1 99 . 34.659 1.755 0.421 1 6.9 ? C SER A 99 1 
ATOM 1012 O O . SER A 1 99 . 35.164 1.289 1.445 1 8.04 ? O SER A 99 1 
ATOM 1013 C CB . SER A 1 99 . 36.928 2.741 -0.234 1 10.18 ? CB SER A 99 1 
ATOM 1014 O OG . SER A 1 99 . 37.724 3.181 -1.309 1 12.09 ? OG SER A 99 1 
ATOM 1015 N N . GLY A 1 100 . 33.342 1.773 0.23 1 6.27 ? N GLY A 100 1 
ATOM 1016 C CA . GLY A 1 100 . 32.424 1.273 1.231 1 7.13 ? CA GLY A 100 1 
ATOM 1017 C C . GLY A 1 100 . 31.915 2.284 2.238 1 6.42 ? C GLY A 100 1 
ATOM 1018 O O . GLY A 1 100 . 31.018 1.936 3.011 1 8.24 ? O GLY A 100 1 
ATOM 1019 N N . ASP A 1 101 . 32.443 3.492 2.262 1 6.03 ? N ASP A 101 1 
ATOM 1020 C CA . ASP A 1 101 . 32.003 4.523 3.182 1 6.22 ? CA ASP A 101 1 
ATOM 1021 C C . ASP A 1 101 . 31.07 5.496 2.484 1 6.02 ? C ASP A 101 1 
ATOM 1022 O O . ASP A 1 101 . 31.345 5.983 1.379 1 6.38 ? O ASP A 101 1 
ATOM 1023 C CB . ASP A 1 101 . 33.181 5.34 3.703 1 7.2 ? CB ASP A 101 1 
ATOM 1024 C CG . ASP A 1 101 . 34.201 4.568 4.445 1 8.76 ? CG ASP A 101 1 
ATOM 1025 O OD1 . ASP A 1 101 . 33.819 3.633 5.179 1 9.13 ? OD1 ASP A 101 1 
ATOM 1026 O OD2 . ASP A 1 101 . 35.403 4.989 4.318 1 10.67 ? OD2 ASP A 101 1 
ATOM 1027 N N . LYS A 1 102 . 30.023 5.912 3.188 1 6.36 ? N LYS A 102 1 
ATOM 1028 C CA . LYS A 1 102 . 29.272 7.079 2.734 1 6.02 ? CA LYS A 102 1 
ATOM 1029 C C . LYS A 1 102 . 30.281 8.236 2.64 1 5.48 ? C LYS A 102 1 
ATOM 1030 O O . LYS A 1 102 . 31.084 8.464 3.542 1 6.08 ? O LYS A 102 1 
ATOM 1031 C CB . LYS A 1 102 . 28.162 7.417 3.723 1 6.86 ? CB LYS A 102 1 
ATOM 1032 C CG . LYS A 1 102 . 27.081 8.283 3.15 1 6.63 ? CG LYS A 102 1 
ATOM 1033 C CD . LYS A 1 102 . 26.032 8.704 4.179 1 7.89 ? CD LYS A 102 1 
ATOM 1034 C CE . LYS A 1 102 . 24.858 9.392 3.526 1 8.66 ? CE LYS A 102 1 
ATOM 1035 N NZ . LYS A 1 102 . 23.902 9.927 4.54 1 9.62 ? NZ LYS A 102 1 
ATOM 1036 N N . ASP A 1 103 . 30.189 8.994 1.536 1 5.38 ? N ASP A 103 1 
ATOM 1037 C CA . ASP A 1 103 . 31.193 9.99 1.225 1 4.93 ? CA ASP A 103 1 
ATOM 1038 C C . ASP A 1 103 . 30.585 11.036 0.32 1 5.1 ? C ASP A 103 1 
ATOM 1039 O O . ASP A 1 103 . 31.193 11.514 -0.658 1 5.63 ? O ASP A 103 1 
ATOM 1040 C CB . ASP A 1 103 . 32.432 9.363 0.621 1 5.2 ? CB ASP A 103 1 
ATOM 1041 C CG . ASP A 1 103 . 33.699 10.19 0.62 1 4.98 ? CG ASP A 103 1 
ATOM 1042 O OD1 . ASP A 1 103 . 33.791 11.166 1.406 1 5.3 ? OD1 ASP A 103 1 
ATOM 1043 O OD2 . ASP A 1 103 . 34.586 9.831 -0.15 1 5.65 ? OD2 ASP A 103 1 
ATOM 1044 N N . TRP A 1 104 . 29.356 11.414 0.621 1 5.28 ? N TRP A 104 1 
ATOM 1045 C CA . TRP A 1 104 . 28.618 12.427 -0.113 1 5.36 ? CA TRP A 104 1 
ATOM 1046 C C . TRP A 1 104 . 29.355 13.755 -0.052 1 5.4 ? C TRP A 104 1 
ATOM 1047 O O . TRP A 1 104 . 30.077 14.026 0.875 1 5.88 ? O TRP A 104 1 
ATOM 1048 C CB . TRP A 1 104 . 27.186 12.587 0.471 1 5.75 ? CB TRP A 104 1 
ATOM 1049 C CG . TRP A 1 104 . 26.297 11.398 0.323 1 6.12 ? CG TRP A 104 1 
ATOM 1050 C CD1 . TRP A 1 104 . 26.62 10.096 0.002 1 6.05 ? CD1 TRP A 104 1 
ATOM 1051 C CD2 . TRP A 1 104 . 24.875 11.425 0.458 1 7.21 ? CD2 TRP A 104 1 
ATOM 1052 N NE1 . TRP A 1 104 . 25.481 9.344 -0.071 1 7.24 ? NE1 TRP A 104 1 
ATOM 1053 C CE2 . TRP A 1 104 . 24.397 10.125 0.208 1 7.44 ? CE2 TRP A 104 1 
ATOM 1054 C CE3 . TRP A 1 104 . 23.973 12.428 0.8 1 8.46 ? CE3 TRP A 104 1 
ATOM 1055 C CZ2 . TRP A 1 104 . 23.052 9.815 0.263 1 9.54 ? CZ2 TRP A 104 1 
ATOM 1056 C CZ3 . TRP A 1 104 . 22.615 12.104 0.864 1 10.02 ? CZ3 TRP A 104 1 
ATOM 1057 C CH2 . TRP A 1 104 . 22.184 10.824 0.587 1 10.56 ? CH2 TRP A 104 1 
ATOM 1058 N N . LYS A 1 105 . 29.084 14.593 -1.052 1 5.4 ? N LYS A 105 1 
ATOM 1059 C CA . LYS A 1 105 . 29.835 15.852 -1.183 1 5.79 ? CA LYS A 105 1 
ATOM 1060 C C . LYS A 1 105 . 28.917 16.966 -1.537 1 5.05 ? C LYS A 105 1 
ATOM 1061 O O . LYS A 1 105 . 28.162 16.906 -2.515 1 5.76 ? O LYS A 105 1 
ATOM 1062 C CB . LYS A 1 105 . 30.949 15.745 -2.199 1 5.85 ? CB LYS A 105 1 
ATOM 1063 C CG . LYS A 1 105 . 31.733 14.416 -2.059 1 6.04 ? CG LYS A 105 1 
ATOM 1064 C CD . LYS A 1 105 . 33.074 14.491 -2.749 1 5.87 ? CD LYS A 105 1 
ATOM 1065 C CE . LYS A 1 105 . 33.78 13.151 -2.825 1 5.53 ? CE LYS A 105 1 
ATOM 1066 N NZ . LYS A 1 105 . 33.863 12.496 -1.494 1 5.28 ? NZ LYS A 105 1 
ATOM 1067 N N . VAL A 1 106 . 28.909 18.045 -0.747 1 5.18 ? N VAL A 106 1 
ATOM 1068 C CA . VAL A 1 106 . 28.13 19.212 -1.067 1 5.46 ? CA VAL A 106 1 
ATOM 1069 C C . VAL A 1 106 . 28.621 19.83 -2.348 1 5.29 ? C VAL A 106 1 
ATOM 1070 O O . VAL A 1 106 . 29.836 19.943 -2.56 1 5.45 ? O VAL A 106 1 
ATOM 1071 C CB . VAL A 1 106 . 28.192 20.203 0.078 1 6 ? CB VAL A 106 1 
ATOM 1072 C CG1 . VAL A 1 106 . 27.541 21.551 -0.271 1 6.49 ? CG1 VAL A 106 1 
ATOM 1073 C CG2 . VAL A 1 106 . 27.625 19.644 1.377 1 7.83 ? CG2 VAL A 106 1 
ATOM 1074 N N . LEU A 1 107 . 27.696 20.28 -3.204 1 5.45 ? N LEU A 107 1 
ATOM 1075 C CA . LEU A 1 107 . 27.999 21.154 -4.345 1 5.03 ? CA LEU A 107 1 
ATOM 1076 C C . LEU A 1 107 . 27.539 22.547 -3.978 1 5.1 ? C LEU A 107 1 
ATOM 1077 O O . LEU A 1 107 . 26.384 22.721 -3.56 1 5.76 ? O LEU A 107 1 
ATOM 1078 C CB . LEU A 1 107 . 27.274 20.664 -5.605 1 6.15 ? CB LEU A 107 1 
ATOM 1079 C CG . LEU A 1 107 . 27.599 21.448 -6.866 1 6.87 ? CG LEU A 107 1 
ATOM 1080 C CD1 . LEU A 1 107 . 29.082 21.334 -7.279 1 9.06 ? CD1 LEU A 107 1 
ATOM 1081 C CD2 . LEU A 1 107 . 26.682 21.019 -7.989 1 9.34 ? CD2 LEU A 107 1 
ATOM 1082 N N . ALA A 1 108 . 28.421 23.531 -4.119 1 4.93 ? N ALA A 108 1 
ATOM 1083 C CA . ALA A 1 108 . 28.154 24.877 -3.69 1 5.09 ? CA ALA A 108 1 
ATOM 1084 C C . ALA A 1 108 . 28.705 25.875 -4.675 1 4.9 ? C ALA A 108 1 
ATOM 1085 O O . ALA A 1 108 . 29.6 25.564 -5.461 1 5.71 ? O ALA A 108 1 
ATOM 1086 C CB . ALA A 1 108 . 28.747 25.105 -2.317 1 6.16 ? CB ALA A 108 1 
ATOM 1087 N N . VAL A 1 109 . 28.205 27.108 -4.565 1 5.35 ? N VAL A 109 1 
ATOM 1088 C CA . VAL A 1 109 . 28.721 28.235 -5.335 1 5.67 ? CA VAL A 109 1 
ATOM 1089 C C . VAL A 1 109 . 29.197 29.307 -4.412 1 5.38 ? C VAL A 109 1 
ATOM 1090 O O . VAL A 1 109 . 28.689 29.463 -3.282 1 6.24 ? O VAL A 109 1 
ATOM 1091 C CB . VAL A 1 109 . 27.667 28.79 -6.333 1 6.31 ? CB VAL A 109 1 
ATOM 1092 C CG1 . VAL A 1 109 . 27.348 27.76 -7.432 1 7.55 ? CG1 VAL A 109 1 
ATOM 1093 C CG2 . VAL A 1 109 . 26.387 29.247 -5.628 1 6.79 ? CG2 VAL A 109 1 
ATOM 1094 N N . PRO A 1 110 . 30.157 30.126 -4.829 1 5.76 ? N PRO A 110 1 
ATOM 1095 C CA . PRO A 1 110 . 30.631 31.228 -3.981 1 5.83 ? CA PRO A 110 1 
ATOM 1096 C C . PRO A 1 110 . 29.56 32.283 -3.849 1 6.46 ? C PRO A 110 1 
ATOM 1097 O O . PRO A 1 110 . 29.03 32.77 -4.863 1 7.27 ? O PRO A 110 1 
ATOM 1098 C CB . PRO A 1 110 . 31.867 31.772 -4.742 1 6.89 ? CB PRO A 110 1 
ATOM 1099 C CG . PRO A 1 110 . 31.592 31.369 -6.186 1 7.94 ? CG PRO A 110 1 
ATOM 1100 C CD . PRO A 1 110 . 30.896 30.039 -6.106 1 6.7 ? CD PRO A 110 1 
ATOM 1101 N N . VAL A 1 111 . 29.302 32.728 -2.633 1 6.11 ? N VAL A 111 1 
ATOM 1102 C CA . VAL A 1 111 . 28.364 33.811 -2.394 1 7.1 ? CA VAL A 111 1 
ATOM 1103 C C . VAL A 1 111 . 28.845 35.088 -3.081 1 6.97 ? C VAL A 111 1 
ATOM 1104 O O . VAL A 1 111 . 27.986 35.886 -3.523 1 8.75 ? O VAL A 111 1 
ATOM 1105 C CB . VAL A 1 111 . 28.143 34.043 -0.886 1 10.46 ? CB VAL A 111 1 
ATOM 1106 C CG1 . VAL A 1 111 . 27.4 35.294 -0.549 1 14.55 ? CG1 VAL A 111 1 
ATOM 1107 C CG2 . VAL A 1 111 . 27.512 32.799 -0.266 1 11.66 ? CG2 VAL A 111 1 
ATOM 1108 N N A GLU A 1 112 . 30.122 35.315 -3.146 0.68 6.21 ? N GLU A 112 1 
ATOM 1109 N N B GLU A 1 112 . 30.199 35.303 -3.122 0.32 7.43 ? N GLU A 112 1 
ATOM 1110 C CA A GLU A 1 112 . 30.633 36.6 -3.574 0.68 6.76 ? CA GLU A 112 1 
ATOM 1111 C CA B GLU A 1 112 . 30.866 36.566 -3.63 0.32 7.98 ? CA GLU A 112 1 
ATOM 1112 C C A GLU A 1 112 . 31.222 36.544 -4.989 0.68 6.52 ? C GLU A 112 1 
ATOM 1113 C C B GLU A 1 112 . 31.012 36.691 -5.133 0.32 8.38 ? C GLU A 112 1 
ATOM 1114 O O A GLU A 1 112 . 32.084 37.336 -5.312 0.68 7.85 ? O GLU A 112 1 
ATOM 1115 O O B GLU A 1 112 . 31.455 37.72 -5.636 0.32 10.31 ? O GLU A 112 1 
ATOM 1116 C CB A GLU A 1 112 . 31.665 37.09 -2.567 0.68 7.42 ? CB GLU A 112 1 
ATOM 1117 C CB B GLU A 1 112 . 32.3 36.762 -3.091 0.32 9.3 ? CB GLU A 112 1 
ATOM 1118 C CG A GLU A 1 112 . 31.064 37.313 -1.196 0.68 9.27 ? CG GLU A 112 1 
ATOM 1119 C CG B GLU A 1 112 . 32.378 36.919 -1.598 0.32 10.72 ? CG GLU A 112 1 
ATOM 1120 C CD A GLU A 1 112 . 30.01 38.35 -1.087 0.68 12.08 ? CD GLU A 112 1 
ATOM 1121 C CD B GLU A 1 112 . 31.639 38.118 -1.038 0.32 11.17 ? CD GLU A 112 1 
ATOM 1122 O OE1 A GLU A 1 112 . 29.835 39.155 -2.006 0.68 14.63 ? OE1 GLU A 112 1 
ATOM 1123 O OE1 B GLU A 1 112 . 31.329 39.099 -1.803 0.32 13.11 ? OE1 GLU A 112 1 
ATOM 1124 O OE2 A GLU A 1 112 . 29.301 38.427 -0.05 0.68 17.51 ? OE2 GLU A 112 1 
ATOM 1125 O OE2 B GLU A 1 112 . 31.404 38.206 0.165 0.32 12.44 ? OE2 GLU A 112 1 
ATOM 1126 N N . ASP A 1 113 . 30.68 35.68 -5.877 1 6.66 ? N ASP A 113 1 
ATOM 1127 C CA . ASP A 1 113 . 30.823 35.794 -7.323 1 6.75 ? CA ASP A 113 1 
ATOM 1128 C C . ASP A 1 113 . 29.441 36.015 -7.915 1 6.26 ? C ASP A 113 1 
ATOM 1129 O O . ASP A 1 113 . 28.629 35.084 -7.901 1 6.64 ? O ASP A 113 1 
ATOM 1130 C CB . ASP A 1 113 . 31.478 34.582 -7.932 1 6.88 ? CB ASP A 113 1 
ATOM 1131 C CG . ASP A 1 113 . 31.736 34.728 -9.413 1 6.94 ? CG ASP A 113 1 
ATOM 1132 O OD1 . ASP A 1 113 . 31.272 35.724 -10.006 1 7.21 ? OD1 ASP A 113 1 
ATOM 1133 O OD2 . ASP A 1 113 . 32.441 33.829 -9.987 1 7.37 ? OD2 ASP A 113 1 
ATOM 1134 N N . PRO A 1 114 . 29.159 37.198 -8.452 1 6.94 ? N PRO A 114 1 
ATOM 1135 C CA . PRO A 1 114 . 27.832 37.475 -8.954 1 7.18 ? CA PRO A 114 1 
ATOM 1136 C C . PRO A 1 114 . 27.452 36.633 -10.144 1 6.53 ? C PRO A 114 1 
ATOM 1137 O O . PRO A 1 114 . 26.245 36.487 -10.438 1 7.21 ? O PRO A 114 1 
ATOM 1138 C CB . PRO A 1 114 . 27.88 38.991 -9.28 1 8.19 ? CB PRO A 114 1 
ATOM 1139 C CG . PRO A 1 114 . 29.325 39.227 -9.661 1 9.14 ? CG PRO A 114 1 
ATOM 1140 C CD . PRO A 1 114 . 30.108 38.369 -8.656 1 8.43 ? CD PRO A 114 1 
ATOM 1141 N N . TYR A 1 115 . 28.402 36.01 -10.819 1 6.45 ? N TYR A 115 1 
ATOM 1142 C CA . TYR A 1 115 . 28.091 35.055 -11.906 1 6.22 ? CA TYR A 115 1 
ATOM 1143 C C . TYR A 1 115 . 27.079 34.033 -11.437 1 6.34 ? C TYR A 115 1 
ATOM 1144 O O . TYR A 1 115 . 26.251 33.582 -12.222 1 7.45 ? O TYR A 115 1 
ATOM 1145 C CB . TYR A 1 115 . 29.39 34.39 -12.345 1 6.58 ? CB TYR A 115 1 
ATOM 1146 C CG . TYR A 1 115 . 29.232 33.493 -13.545 1 6.3 ? CG TYR A 115 1 
ATOM 1147 C CD1 . TYR A 1 115 . 28.886 32.163 -13.384 1 7.18 ? CD1 TYR A 115 1 
ATOM 1148 C CD2 . TYR A 1 115 . 29.492 33.963 -14.821 1 6.78 ? CD2 TYR A 115 1 
ATOM 1149 C CE1 . TYR A 1 115 . 28.757 31.337 -14.499 1 8.14 ? CE1 TYR A 115 1 
ATOM 1150 C CE2 . TYR A 1 115 . 29.406 33.13 -15.91 1 8.1 ? CE2 TYR A 115 1 
ATOM 1151 C CZ . TYR A 1 115 . 28.988 31.823 -15.744 1 8.5 ? CZ TYR A 115 1 
ATOM 1152 O OH . TYR A 1 115 . 28.843 31.023 -16.864 1 11.03 ? OH TYR A 115 1 
ATOM 1153 N N . PHE A 1 116 . 27.193 33.599 -10.169 1 6.4 ? N PHE A 116 1 
ATOM 1154 C CA . PHE A 1 116 . 26.391 32.501 -9.631 1 6.99 ? CA PHE A 116 1 
ATOM 1155 C C . PHE A 1 116 . 25.161 32.974 -8.852 1 7.8 ? C PHE A 116 1 
ATOM 1156 O O . PHE A 1 116 . 24.518 32.153 -8.202 1 8.48 ? O PHE A 116 1 
ATOM 1157 C CB . PHE A 1 116 . 27.259 31.558 -8.782 1 7.8 ? CB PHE A 116 1 
ATOM 1158 C CG . PHE A 1 116 . 28.344 30.912 -9.565 1 6.87 ? CG PHE A 116 1 
ATOM 1159 C CD1 . PHE A 1 116 . 29.643 31.358 -9.476 1 7.33 ? CD1 PHE A 116 1 
ATOM 1160 C CD2 . PHE A 1 116 . 28.066 29.85 -10.416 1 7.83 ? CD2 PHE A 116 1 
ATOM 1161 C CE1 . PHE A 1 116 . 30.659 30.765 -10.223 1 8.12 ? CE1 PHE A 116 1 
ATOM 1162 C CE2 . PHE A 1 116 . 29.1 29.236 -11.181 1 7.83 ? CE2 PHE A 116 1 
ATOM 1163 C CZ . PHE A 1 116 . 30.369 29.72 -11.058 1 8.23 ? CZ PHE A 116 1 
ATOM 1164 N N . ASN A 1 117 . 24.803 34.253 -8.94 1 8.52 ? N ASN A 117 1 
ATOM 1165 C CA . ASN A 1 117 . 23.744 34.793 -8.089 1 9.83 ? CA ASN A 117 1 
ATOM 1166 C C . ASN A 1 117 . 22.448 34.011 -8.238 1 11.44 ? C ASN A 117 1 
ATOM 1167 O O . ASN A 1 117 . 21.713 33.898 -7.242 1 13.82 ? O ASN A 117 1 
ATOM 1168 C CB . ASN A 1 117 . 23.48 36.269 -8.385 1 11.42 ? CB ASN A 117 1 
ATOM 1169 C CG . ASN A 1 117 . 24.486 37.19 -7.736 1 12.81 ? CG ASN A 117 1 
ATOM 1170 O OD1 . ASN A 1 117 . 25.24 36.819 -6.832 1 14.65 ? OD1 ASN A 117 1 
ATOM 1171 N ND2 . ASN A 1 117 . 24.489 38.444 -8.227 1 16.66 ? ND2 ASN A 117 1 
ATOM 1172 N N . ASP A 1 118 . 22.127 33.548 -9.428 0.85 9.6 ? N ASP A 118 1 
ATOM 1173 C CA . ASP A 1 118 . 20.89 32.858 -9.684 0.85 11.44 ? CA ASP A 118 1 
ATOM 1174 C C . ASP A 1 118 . 21.01 31.317 -9.564 0.85 12.72 ? C ASP A 118 1 
ATOM 1175 O O . ASP A 1 118 . 20.068 30.616 -9.833 0.85 15.86 ? O ASP A 118 1 
ATOM 1176 C CB . ASP A 1 118 . 20.278 33.306 -10.992 0.85 13.44 ? CB ASP A 118 1 
ATOM 1177 C CG . ASP A 1 118 . 20.001 34.835 -11.001 0.85 18.97 ? CG ASP A 118 1 
ATOM 1178 O OD1 . ASP A 1 118 . 19.515 35.42 -10.007 0.85 24.02 ? OD1 ASP A 118 1 
ATOM 1179 O OD2 . ASP A 1 118 . 20.366 35.547 -11.926 0.85 23.93 ? OD2 ASP A 118 1 
ATOM 1180 N N . TRP A 1 119 . 22.144 30.806 -9.13 1 11.67 ? N TRP A 119 1 
ATOM 1181 C CA . TRP A 1 119 . 22.352 29.373 -8.867 1 11.02 ? CA TRP A 119 1 
ATOM 1182 C C . TRP A 1 119 . 21.987 29.109 -7.446 1 9.51 ? C TRP A 119 1 
ATOM 1183 O O . TRP A 1 119 . 22.738 29.483 -6.555 1 9.97 ? O TRP A 119 1 
ATOM 1184 C CB . TRP A 1 119 . 23.767 28.91 -9.156 1 10.49 ? CB TRP A 119 1 
ATOM 1185 C CG . TRP A 1 119 . 24.223 28.95 -10.579 1 13.41 ? CG TRP A 119 1 
ATOM 1186 C CD1 . TRP A 1 119 . 23.945 29.932 -11.474 1 18.44 ? CD1 TRP A 119 1 
ATOM 1187 C CD2 . TRP A 1 119 . 25.033 28.001 -11.237 1 13.33 ? CD2 TRP A 119 1 
ATOM 1188 N NE1 . TRP A 1 119 . 24.63 29.641 -12.671 1 20.76 ? NE1 TRP A 119 1 
ATOM 1189 C CE2 . TRP A 1 119 . 25.231 28.418 -12.586 1 17.13 ? CE2 TRP A 119 1 
ATOM 1190 C CE3 . TRP A 1 119 . 25.612 26.863 -10.833 1 12.72 ? CE3 TRP A 119 1 
ATOM 1191 C CZ2 . TRP A 1 119 . 26.119 27.773 -13.427 1 18.76 ? CZ2 TRP A 119 1 
ATOM 1192 C CZ3 . TRP A 1 119 . 26.411 26.182 -11.691 1 13.99 ? CZ3 TRP A 119 1 
ATOM 1193 C CH2 . TRP A 1 119 . 26.644 26.61 -12.979 1 15.54 ? CH2 TRP A 119 1 
ATOM 1194 N N . LYS A 1 120 . 20.838 28.447 -7.247 0.85 8.86 ? N LYS A 120 1 
ATOM 1195 C CA . LYS A 1 120 . 20.282 28.21 -5.914 1 9.93 ? CA LYS A 120 1 
ATOM 1196 C C . LYS A 1 120 . 19.909 26.757 -5.667 1 8.83 ? C LYS A 120 1 
ATOM 1197 O O . LYS A 1 120 . 19.697 26.371 -4.502 0.87 8.69 ? O LYS A 120 1 
ATOM 1198 C CB . LYS A 1 120 . 19.062 29.09 -5.723 1 12.63 ? CB LYS A 120 1 
ATOM 1199 C CG . LYS A 1 120 . 19.476 30.588 -5.76 1 15.58 ? CG LYS A 120 1 
ATOM 1200 C CD . LYS A 1 120 . 18.355 31.436 -5.668 1 21.8 ? CD LYS A 120 1 
ATOM 1201 C CE . LYS A 1 120 . 18.764 32.942 -5.8 0.8 37.82 ? CE LYS A 120 1 
ATOM 1202 N NZ . LYS A 1 120 . 17.591 33.871 -5.969 1 50.17 ? NZ LYS A 120 1 
ATOM 1203 N N . ASP A 1 121 . 19.841 25.943 -6.669 1 8.97 ? N ASP A 121 1 
ATOM 1204 C CA . ASP A 1 121 . 19.467 24.537 -6.495 1 8.83 ? CA ASP A 121 1 
ATOM 1205 C C . ASP A 1 121 . 20.058 23.725 -7.618 1 8.95 ? C ASP A 121 1 
ATOM 1206 O O . ASP A 1 121 . 20.618 24.283 -8.606 1 8.9 ? O ASP A 121 1 
ATOM 1207 C CB . ASP A 1 121 . 17.939 24.367 -6.354 0.84 8.97 ? CB ASP A 121 1 
ATOM 1208 C CG . ASP A 1 121 . 17.495 23.179 -5.477 0.89 10.23 ? CG ASP A 121 1 
ATOM 1209 O OD1 . ASP A 1 121 . 18.257 22.297 -5.196 0.96 9.73 ? OD1 ASP A 121 1 
ATOM 1210 O OD2 . ASP A 1 121 . 16.349 23.219 -5.01 0.74 12.37 ? OD2 ASP A 121 1 
ATOM 1211 N N . ILE A 1 122 . 19.934 22.419 -7.493 1 8.9 ? N ILE A 122 1 
ATOM 1212 C CA . ILE A 1 122 . 20.637 21.512 -8.356 1 9.96 ? CA ILE A 122 1 
ATOM 1213 C C . ILE A 1 122 . 20.186 21.633 -9.807 1 9.77 ? C ILE A 122 1 
ATOM 1214 O O . ILE A 1 122 . 20.96 21.425 -10.717 1 11.34 ? O ILE A 122 1 
ATOM 1215 C CB . ILE A 1 122 . 20.499 20.074 -7.759 1 11.1 ? CB ILE A 122 1 
ATOM 1216 C CG1 . ILE A 1 122 . 21.461 19.084 -8.39 1 14.03 ? CG1 ILE A 122 1 
ATOM 1217 C CG2 . ILE A 1 122 . 19.123 19.525 -7.784 1 12.56 ? CG2 ILE A 122 1 
ATOM 1218 C CD1 . ILE A 1 122 . 22.873 19.393 -8.165 1 15.59 ? CD1 ILE A 122 1 
ATOM 1219 N N . SER A 1 123 . 18.931 22.063 -10.03 1 10.45 ? N SER A 123 1 
ATOM 1220 C CA . SER A 1 123 . 18.386 22.326 -11.368 1 11.92 ? CA SER A 123 1 
ATOM 1221 C C . SER A 1 123 . 18.994 23.519 -12.046 1 11.31 ? C SER A 123 1 
ATOM 1222 O O . SER A 1 123 . 18.776 23.642 -13.28 1 13.56 ? O SER A 123 1 
ATOM 1223 C CB . SER A 1 123 . 16.852 22.5 -11.286 1 15.55 ? CB SER A 123 1 
ATOM 1224 O OG . SER A 1 123 . 16.54 23.494 -10.341 1 21.22 ? OG SER A 123 1 
ATOM 1225 N N . ASP A 1 124 . 19.73 24.361 -11.398 1 8.95 ? N ASP A 124 1 
ATOM 1226 C CA . ASP A 1 124 . 20.355 25.493 -12.009 1 9.27 ? CA ASP A 124 1 
ATOM 1227 C C . ASP A 1 124 . 21.702 25.15 -12.678 1 9.42 ? C ASP A 124 1 
ATOM 1228 O O . ASP A 1 124 . 22.274 25.994 -13.366 1 11.43 ? O ASP A 124 1 
ATOM 1229 C CB . ASP A 1 124 . 20.552 26.57 -10.968 1 9.94 ? CB ASP A 124 1 
ATOM 1230 C CG . ASP A 1 124 . 19.258 27.131 -10.434 1 10.3 ? CG ASP A 124 1 
ATOM 1231 O OD1 . ASP A 1 124 . 18.336 27.346 -11.272 1 12.9 ? OD1 ASP A 124 1 
ATOM 1232 O OD2 . ASP A 1 124 . 19.135 27.314 -9.231 1 9.65 ? OD2 ASP A 124 1 
ATOM 1233 N N . VAL A 1 125 . 22.208 23.963 -12.415 1 8.97 ? N VAL A 125 1 
ATOM 1234 C CA . VAL A 1 125 . 23.512 23.58 -12.934 1 8.19 ? CA VAL A 125 1 
ATOM 1235 C C . VAL A 1 125 . 23.349 22.902 -14.305 1 8.89 ? C VAL A 125 1 
ATOM 1236 O O . VAL A 1 125 . 22.463 22.062 -14.491 1 9.9 ? O VAL A 125 1 
ATOM 1237 C CB . VAL A 1 125 . 24.158 22.544 -11.973 1 8.33 ? CB VAL A 125 1 
ATOM 1238 C CG1 . VAL A 1 125 . 25.571 22.225 -12.481 1 8.14 ? CG1 VAL A 125 1 
ATOM 1239 C CG2 . VAL A 1 125 . 24.18 23.1 -10.545 1 9.03 ? CG2 VAL A 125 1 
ATOM 1240 N N . PRO A 1 126 . 24.212 23.215 -15.281 1 9.05 ? N PRO A 126 1 
ATOM 1241 C CA . PRO A 1 126 . 24.142 22.471 -16.556 1 9.13 ? CA PRO A 126 1 
ATOM 1242 C C . PRO A 1 126 . 24.222 20.969 -16.328 1 8.47 ? C PRO A 126 1 
ATOM 1243 O O . PRO A 1 126 . 25.075 20.476 -15.61 1 8.06 ? O PRO A 126 1 
ATOM 1244 C CB . PRO A 1 126 . 25.307 22.981 -17.332 1 10.28 ? CB PRO A 126 1 
ATOM 1245 C CG . PRO A 1 126 . 25.471 24.371 -16.838 1 12.04 ? CG PRO A 126 1 
ATOM 1246 C CD . PRO A 1 126 . 25.247 24.268 -15.325 1 10.15 ? CD PRO A 126 1 
ATOM 1247 N N . LYS A 1 127 . 23.315 20.215 -16.977 1 9.37 ? N LYS A 127 1 
ATOM 1248 C CA . LYS A 1 127 . 23.283 18.776 -16.762 1 10.12 ? CA LYS A 127 1 
ATOM 1249 C C . LYS A 1 127 . 24.621 18.123 -17.093 1 8.05 ? C LYS A 127 1 
ATOM 1250 O O . LYS A 1 127 . 25.069 17.2 -16.383 1 8.74 ? O LYS A 127 1 
ATOM 1251 C CB . LYS A 1 127 . 22.159 18.15 -17.648 1 19.4 ? CB LYS A 127 1 
ATOM 1252 C CG . LYS A 1 127 . 21.959 16.685 -17.366 1 55.16 ? CG LYS A 127 1 
ATOM 1253 C CD . LYS A 1 127 . 21.83 16.409 -15.856 1 90.61 ? CD LYS A 127 1 
ATOM 1254 C CE . LYS A 1 127 . 21.509 14.954 -15.543 1 122.15 ? CE LYS A 127 1 
ATOM 1255 N NZ . LYS A 1 127 . 21.262 14.772 -14.091 1 151.23 ? NZ LYS A 127 1 
ATOM 1256 N N . ALA A 1 128 . 25.281 18.578 -18.18 1 6.97 ? N ALA A 128 1 
ATOM 1257 C CA . ALA A 1 128 . 26.518 17.968 -18.552 1 6.77 ? CA ALA A 128 1 
ATOM 1258 C C . ALA A 1 128 . 27.599 18.19 -17.484 1 6.08 ? C ALA A 128 1 
ATOM 1259 O O . ALA A 1 128 . 28.527 17.359 -17.379 1 6.5 ? O ALA A 128 1 
ATOM 1260 C CB . ALA A 1 128 . 27.004 18.487 -19.876 1 7.98 ? CB ALA A 128 1 
ATOM 1261 N N . PHE A 1 129 . 27.518 19.251 -16.732 1 5.95 ? N PHE A 129 1 
ATOM 1262 C CA . PHE A 1 129 . 28.476 19.525 -15.692 1 5.88 ? CA PHE A 129 1 
ATOM 1263 C C . PHE A 1 129 . 28.273 18.566 -14.507 1 5.89 ? C PHE A 129 1 
ATOM 1264 O O . PHE A 1 129 . 29.244 18.024 -13.973 1 5.78 ? O PHE A 129 1 
ATOM 1265 C CB . PHE A 1 129 . 28.411 20.993 -15.255 1 6.44 ? CB PHE A 129 1 
ATOM 1266 C CG . PHE A 1 129 . 29.521 21.422 -14.341 1 6.34 ? CG PHE A 129 1 
ATOM 1267 C CD1 . PHE A 1 129 . 30.845 21.356 -14.726 1 7.99 ? CD1 PHE A 129 1 
ATOM 1268 C CD2 . PHE A 1 129 . 29.254 21.882 -13.079 1 7.95 ? CD2 PHE A 129 1 
ATOM 1269 C CE1 . PHE A 1 129 . 31.85 21.75 -13.859 1 8.99 ? CE1 PHE A 129 1 
ATOM 1270 C CE2 . PHE A 1 129 . 30.272 22.31 -12.226 1 10.32 ? CE2 PHE A 129 1 
ATOM 1271 C CZ . PHE A 1 129 . 31.579 22.243 -12.652 1 9.68 ? CZ PHE A 129 1 
ATOM 1272 N N . LEU A 1 130 . 27.024 18.367 -14.095 1 5.84 ? N LEU A 130 1 
ATOM 1273 C CA . LEU A 1 130 . 26.777 17.344 -13.081 1 5.78 ? CA LEU A 130 1 
ATOM 1274 C C . LEU A 1 130 . 27.273 16.007 -13.531 1 5.7 ? C LEU A 130 1 
ATOM 1275 O O . LEU A 1 130 . 27.884 15.252 -12.772 1 6.45 ? O LEU A 130 1 
ATOM 1276 C CB . LEU A 1 130 . 25.286 17.297 -12.757 1 6.96 ? CB LEU A 130 1 
ATOM 1277 C CG . LEU A 1 130 . 24.694 18.54 -12.116 1 7.2 ? CG LEU A 130 1 
ATOM 1278 C CD1 . LEU A 1 130 . 23.23 18.328 -11.823 1 9.8 ? CD1 LEU A 130 1 
ATOM 1279 C CD2 . LEU A 1 130 . 25.422 18.942 -10.841 1 8.35 ? CD2 LEU A 130 1 
ATOM 1280 N N . ASP A 1 131 . 27.049 15.654 -14.799 1 6.12 ? N ASP A 131 1 
ATOM 1281 C CA . ASP A 1 131 . 27.514 14.378 -15.318 1 6.35 ? CA ASP A 131 1 
ATOM 1282 C C . ASP A 1 131 . 29.039 14.284 -15.289 1 5.75 ? C ASP A 131 1 
ATOM 1283 O O . ASP A 1 131 . 29.574 13.223 -14.983 1 6.12 ? O ASP A 131 1 
ATOM 1284 C CB . ASP A 1 131 . 27.015 14.162 -16.74 1 8.56 ? CB ASP A 131 1 
ATOM 1285 C CG . ASP A 1 131 . 25.58 13.916 -16.854 1 14.46 ? CG ASP A 131 1 
ATOM 1286 O OD1 . ASP A 1 131 . 24.854 13.736 -15.877 1 15.16 ? OD1 ASP A 131 1 
ATOM 1287 O OD2 . ASP A 1 131 . 25.119 14.028 -18.032 1 20.29 ? OD2 ASP A 131 1 
ATOM 1288 N N . GLU A 1 132 . 29.731 15.374 -15.618 1 5.63 ? N GLU A 132 1 
ATOM 1289 C CA . GLU A 1 132 . 31.181 15.35 -15.652 1 5.6 ? CA GLU A 132 1 
ATOM 1290 C C . GLU A 1 132 . 31.736 15.117 -14.238 1 5.33 ? C GLU A 132 1 
ATOM 1291 O O . GLU A 1 132 . 32.746 14.397 -14.055 1 5.66 ? O GLU A 132 1 
ATOM 1292 C CB . GLU A 1 132 . 31.776 16.61 -16.301 1 6.15 ? CB GLU A 132 1 
ATOM 1293 C CG . GLU A 1 132 . 32.249 17.709 -15.375 1 6.84 ? CG GLU A 132 1 
ATOM 1294 C CD . GLU A 1 132 . 32.959 18.803 -16.157 1 6.48 ? CD GLU A 132 1 
ATOM 1295 O OE1 . GLU A 1 132 . 32.412 19.234 -17.209 1 6.69 ? OE1 GLU A 132 1 
ATOM 1296 O OE2 . GLU A 1 132 . 34.048 19.253 -15.706 1 6.97 ? OE2 GLU A 132 1 
ATOM 1297 N N . ILE A 1 133 . 31.121 15.736 -13.244 1 5.42 ? N ILE A 133 1 
ATOM 1298 C CA . ILE A 1 133 . 31.576 15.583 -11.872 1 5.34 ? CA ILE A 133 1 
ATOM 1299 C C . ILE A 1 133 . 31.337 14.134 -11.424 1 5.33 ? C ILE A 133 1 
ATOM 1300 O O . ILE A 1 133 . 32.24 13.488 -10.88 1 5.65 ? O ILE A 133 1 
ATOM 1301 C CB . ILE A 1 133 . 30.891 16.589 -10.915 1 5.79 ? CB ILE A 133 1 
ATOM 1302 C CG1 . ILE A 1 133 . 31.236 18.026 -11.291 1 6.07 ? CG1 ILE A 133 1 
ATOM 1303 C CG2 . ILE A 1 133 . 31.261 16.275 -9.489 1 7.06 ? CG2 ILE A 133 1 
ATOM 1304 C CD1 . ILE A 1 133 . 30.351 19.054 -10.577 1 7.92 ? CD1 ILE A 133 1 
ATOM 1305 N N . ALA A 1 134 . 30.142 13.634 -11.639 1 5.41 ? N ALA A 134 1 
ATOM 1306 C CA . ALA A 1 134 . 29.839 12.256 -11.238 1 5.92 ? CA ALA A 134 1 
ATOM 1307 C C . ALA A 1 134 . 30.784 11.279 -11.925 1 5.6 ? C ALA A 134 1 
ATOM 1308 O O . ALA A 1 134 . 31.227 10.318 -11.307 1 6.1 ? O ALA A 134 1 
ATOM 1309 C CB . ALA A 1 134 . 28.378 11.953 -11.553 1 7.1 ? CB ALA A 134 1 
ATOM 1310 N N . HIS A 1 135 . 31.039 11.48 -13.23 1 5.58 ? N HIS A 135 1 
ATOM 1311 C CA . HIS A 1 135 . 31.884 10.558 -13.964 1 5.72 ? CA HIS A 135 1 
ATOM 1312 C C . HIS A 1 135 . 33.319 10.532 -13.413 1 5.59 ? C HIS A 135 1 
ATOM 1313 O O . HIS A 1 135 . 33.95 9.485 -13.293 1 5.62 ? O HIS A 135 1 
ATOM 1314 C CB . HIS A 1 135 . 31.869 10.882 -15.438 1 6.16 ? CB HIS A 135 1 
ATOM 1315 C CG . HIS A 1 135 . 32.522 9.861 -16.287 1 5.81 ? CG HIS A 135 1 
ATOM 1316 N ND1 . HIS A 1 135 . 33.444 10.187 -17.238 1 6.31 ? ND1 HIS A 135 1 
ATOM 1317 C CD2 . HIS A 1 135 . 32.325 8.526 -16.321 1 7.03 ? CD2 HIS A 135 1 
ATOM 1318 C CE1 . HIS A 1 135 . 33.806 9.055 -17.809 1 6.99 ? CE1 HIS A 135 1 
ATOM 1319 N NE2 . HIS A 1 135 . 33.144 8.038 -17.274 1 7.1 ? NE2 HIS A 135 1 
ATOM 1320 N N . PHE A 1 136 . 33.834 11.728 -13.091 1 5.36 ? N PHE A 136 1 
ATOM 1321 C CA . PHE A 1 136 . 35.135 11.794 -12.433 1 5.33 ? CA PHE A 136 1 
ATOM 1322 C C . PHE A 1 136 . 35.182 10.909 -11.19 1 5.22 ? C PHE A 136 1 
ATOM 1323 O O . PHE A 1 136 . 36.096 10.097 -11.027 1 5.59 ? O PHE A 136 1 
ATOM 1324 C CB . PHE A 1 136 . 35.42 13.273 -12.092 1 5.6 ? CB PHE A 136 1 
ATOM 1325 C CG . PHE A 1 136 . 36.667 13.496 -11.264 1 5.68 ? CG PHE A 136 1 
ATOM 1326 C CD1 . PHE A 1 136 . 37.937 13.561 -11.849 1 6.1 ? CD1 PHE A 136 1 
ATOM 1327 C CD2 . PHE A 1 136 . 36.567 13.658 -9.903 1 6.18 ? CD2 PHE A 136 1 
ATOM 1328 C CE1 . PHE A 1 136 . 39.044 13.786 -11.027 1 6.38 ? CE1 PHE A 136 1 
ATOM 1329 C CE2 . PHE A 1 136 . 37.689 13.862 -9.105 1 7.41 ? CE2 PHE A 136 1 
ATOM 1330 C CZ . PHE A 1 136 . 38.927 13.933 -9.704 1 6.09 ? CZ PHE A 136 1 
ATOM 1331 N N . PHE A 1 137 . 34.19 11.068 -10.308 1 5.22 ? N PHE A 137 1 
ATOM 1332 C CA . PHE A 1 137 . 34.195 10.274 -9.077 1 5.53 ? CA PHE A 137 1 
ATOM 1333 C C . PHE A 1 137 . 33.901 8.807 -9.346 1 5.81 ? C PHE A 137 1 
ATOM 1334 O O . PHE A 1 137 . 34.333 7.959 -8.554 1 6.75 ? O PHE A 137 1 
ATOM 1335 C CB . PHE A 1 137 . 33.28 10.91 -8.037 1 6.28 ? CB PHE A 137 1 
ATOM 1336 C CG . PHE A 1 137 . 33.833 12.212 -7.467 1 5.99 ? CG PHE A 137 1 
ATOM 1337 C CD1 . PHE A 1 137 . 34.892 12.16 -6.591 1 6.04 ? CD1 PHE A 137 1 
ATOM 1338 C CD2 . PHE A 1 137 . 33.401 13.445 -7.893 1 6.63 ? CD2 PHE A 137 1 
ATOM 1339 C CE1 . PHE A 1 137 . 35.454 13.321 -6.078 1 6.64 ? CE1 PHE A 137 1 
ATOM 1340 C CE2 . PHE A 1 137 . 33.971 14.623 -7.413 1 6.81 ? CE2 PHE A 137 1 
ATOM 1341 C CZ . PHE A 1 137 . 35.004 14.555 -6.489 1 7.09 ? CZ PHE A 137 1 
ATOM 1342 N N . GLN A 1 138 . 33.22 8.48 -10.417 1 5.69 ? N GLN A 138 1 
ATOM 1343 C CA A GLN A 1 138 . 32.973 7.116 -10.805 0.58 5.18 ? CA GLN A 138 1 
ATOM 1344 C CA B GLN A 1 138 . 32.98 7.092 -10.763 0.42 8.58 ? CA GLN A 138 1 
ATOM 1345 C C . GLN A 1 138 . 34.26 6.395 -11.227 1 5.78 ? C GLN A 138 1 
ATOM 1346 O O . GLN A 1 138 . 34.36 5.188 -11.006 1 6.9 ? O GLN A 138 1 
ATOM 1347 C CB A GLN A 1 138 . 31.952 7.076 -11.969 0.58 5 ? CB GLN A 138 1 
ATOM 1348 C CB B GLN A 1 138 . 31.977 6.959 -11.895 0.42 12.08 ? CB GLN A 138 1 
ATOM 1349 C CG A GLN A 1 138 . 31.466 5.721 -12.334 0.58 7.28 ? CG GLN A 138 1 
ATOM 1350 C CG B GLN A 1 138 . 30.6 7.218 -11.49 0.42 12.47 ? CG GLN A 138 1 
ATOM 1351 C CD A GLN A 1 138 . 30.487 5.646 -13.43 0.58 11.27 ? CD GLN A 138 1 
ATOM 1352 C CD B GLN A 1 138 . 29.621 7.098 -12.629 0.42 15.04 ? CD GLN A 138 1 
ATOM 1353 O OE1 A GLN A 1 138 . 29.726 4.678 -13.474 0.58 18.8 ? OE1 GLN A 138 1 
ATOM 1354 O OE1 B GLN A 1 138 . 28.532 6.51 -12.457 0.42 18.94 ? OE1 GLN A 138 1 
ATOM 1355 N NE2 A GLN A 1 138 . 30.485 6.528 -14.275 0.58 12.35 ? NE2 GLN A 138 1 
ATOM 1356 N NE2 B GLN A 1 138 . 29.972 7.581 -13.787 0.42 14.43 ? NE2 GLN A 138 1 
ATOM 1357 N N . ARG A 1 139 . 35.171 7.088 -11.905 1 5.69 ? N ARG A 139 1 
ATOM 1358 C CA A ARG A 1 139 . 36.299 6.456 -12.628 0.57 5.65 ? CA ARG A 139 1 
ATOM 1359 C CA B ARG A 1 139 . 36.311 6.415 -12.508 0.43 7.1 ? CA ARG A 139 1 
ATOM 1360 C C . ARG A 1 139 . 37.667 6.778 -12.01 1 5.81 ? C ARG A 139 1 
ATOM 1361 O O . ARG A 1 139 . 38.647 6.06 -12.325 1 6.48 ? O ARG A 139 1 
ATOM 1362 C CB A ARG A 1 139 . 36.238 6.68 -14.152 0.57 5.73 ? CB ARG A 139 1 
ATOM 1363 C CB B ARG A 1 139 . 36.335 6.737 -14.001 0.43 7.85 ? CB ARG A 139 1 
ATOM 1364 C CG A ARG A 1 139 . 34.961 6.2 -14.802 0.57 6.63 ? CG ARG A 139 1 
ATOM 1365 C CG B ARG A 1 139 . 35.172 6.122 -14.814 0.43 9.66 ? CG ARG A 139 1 
ATOM 1366 C CD A ARG A 1 139 . 34.762 4.697 -14.613 0.57 8.67 ? CD ARG A 139 1 
ATOM 1367 C CD B ARG A 1 139 . 35.01 4.632 -14.586 0.43 8.53 ? CD ARG A 139 1 
ATOM 1368 N NE A ARG A 1 139 . 33.575 4.267 -15.329 0.57 9.6 ? NE ARG A 139 1 
ATOM 1369 N NE B ARG A 1 139 . 34.13 4.014 -15.565 0.43 7.91 ? NE ARG A 139 1 
ATOM 1370 C CZ A ARG A 1 139 . 32.838 3.25 -14.986 0.57 12.06 ? CZ ARG A 139 1 
ATOM 1371 C CZ B ARG A 1 139 . 33.809 2.743 -15.522 0.43 8.48 ? CZ ARG A 139 1 
ATOM 1372 N NH1 A ARG A 1 139 . 33.11 2.551 -13.894 0.57 14.03 ? NH1 ARG A 139 1 
ATOM 1373 N NH1 B ARG A 1 139 . 34.286 1.934 -14.561 0.43 11.47 ? NH1 ARG A 139 1 
ATOM 1374 N NH2 A ARG A 1 139 . 31.794 2.962 -15.76 0.57 14.24 ? NH2 ARG A 139 1 
ATOM 1375 N NH2 B ARG A 1 139 . 33.063 2.202 -16.49 0.43 10.75 ? NH2 ARG A 139 1 
ATOM 1376 N N . TYR A 1 140 . 37.815 7.843 -11.239 1 5.75 ? N TYR A 140 1 
ATOM 1377 C CA . TYR A 1 140 . 39.147 8.309 -10.9 1 6.16 ? CA TYR A 140 1 
ATOM 1378 C C . TYR A 1 140 . 39.982 7.364 -10.026 1 6.02 ? C TYR A 140 1 
ATOM 1379 O O . TYR A 1 140 . 41.205 7.528 -10.034 1 7.17 ? O TYR A 140 1 
ATOM 1380 C CB . TYR A 1 140 . 39.118 9.713 -10.248 1 6.11 ? CB TYR A 140 1 
ATOM 1381 C CG . TYR A 1 140 . 38.676 9.785 -8.81 1 5.87 ? CG TYR A 140 1 
ATOM 1382 C CD1 . TYR A 1 140 . 37.571 9.049 -8.334 1 5.89 ? CD1 TYR A 140 1 
ATOM 1383 C CD2 . TYR A 1 140 . 39.302 10.662 -7.934 1 7.11 ? CD2 TYR A 140 1 
ATOM 1384 C CE1 . TYR A 1 140 . 37.171 9.217 -7.001 1 6.5 ? CE1 TYR A 140 1 
ATOM 1385 C CE2 . TYR A 1 140 . 38.904 10.833 -6.641 1 7.2 ? CE2 TYR A 140 1 
ATOM 1386 C CZ . TYR A 1 140 . 37.805 10.111 -6.174 1 6.47 ? CZ TYR A 140 1 
ATOM 1387 O OH . TYR A 1 140 . 37.341 10.282 -4.897 1 7.76 ? OH TYR A 140 1 
ATOM 1388 N N A LYS A 1 141 . 39.334 6.374 -9.444 0.65 6.54 ? N LYS A 141 1 
ATOM 1389 N N B LYS A 1 141 . 39.399 6.481 -9.156 0.35 4.65 ? N LYS A 141 1 
ATOM 1390 C CA A LYS A 1 141 . 40.08 5.402 -8.617 0.65 6.74 ? CA LYS A 141 1 
ATOM 1391 C CA B LYS A 1 141 . 40.138 5.557 -8.275 0.35 4.38 ? CA LYS A 141 1 
ATOM 1392 C C A LYS A 1 141 . 40.154 4.059 -9.305 0.65 5.45 ? C LYS A 141 1 
ATOM 1393 C C B LYS A 1 141 . 40.247 4.137 -8.894 0.35 4.67 ? C LYS A 141 1 
ATOM 1394 O O A LYS A 1 141 . 40.627 3.09 -8.722 0.65 6.34 ? O LYS A 141 1 
ATOM 1395 O O B LYS A 1 141 . 40.745 3.205 -8.235 0.35 4.3 ? O LYS A 141 1 
ATOM 1396 C CB A LYS A 1 141 . 39.454 5.244 -7.208 0.65 7.81 ? CB LYS A 141 1 
ATOM 1397 C CB B LYS A 1 141 . 39.489 5.478 -6.893 0.35 5.84 ? CB LYS A 141 1 
ATOM 1398 C CG A LYS A 1 141 . 39.61 6.464 -6.324 0.65 8.83 ? CG LYS A 141 1 
ATOM 1399 C CG B LYS A 1 141 . 39.714 6.749 -6.182 0.35 6.48 ? CG LYS A 141 1 
ATOM 1400 C CD A LYS A 1 141 . 39.119 6.202 -4.846 0.65 11.13 ? CD LYS A 141 1 
ATOM 1401 C CD B LYS A 1 141 . 39.016 6.787 -4.837 0.35 5.7 ? CD LYS A 141 1 
ATOM 1402 C CE A LYS A 1 141 . 39.189 7.498 -4.021 0.65 12.78 ? CE LYS A 141 1 
ATOM 1403 C CE B LYS A 1 141 . 39.3 5.554 -3.992 0.35 8 ? CE LYS A 141 1 
ATOM 1404 N NZ A LYS A 1 141 . 39.154 7.178 -2.52 0.65 12.01 ? NZ LYS A 141 1 
ATOM 1405 N NZ B LYS A 1 141 . 38.626 5.738 -2.662 0.35 6.96 ? NZ LYS A 141 1 
ATOM 1406 N N A GLU A 1 142 . 39.749 3.959 -10.549 0.65 6.12 ? N GLU A 142 1 
ATOM 1407 N N B GLU A 1 142 . 39.839 3.986 -10.151 0.35 4.14 ? N GLU A 142 1 
ATOM 1408 C CA A GLU A 1 142 . 39.705 2.625 -11.168 0.65 6.63 ? CA GLU A 142 1 
ATOM 1409 C CA B GLU A 1 142 . 39.874 2.687 -10.799 0.35 5.65 ? CA GLU A 142 1 
ATOM 1410 C C A GLU A 1 142 . 41.117 1.991 -11.171 0.65 5.71 ? C GLU A 142 1 
ATOM 1411 C C B GLU A 1 142 . 41.232 2.018 -10.792 0.35 7.42 ? C GLU A 142 1 
ATOM 1412 O O A GLU A 1 142 . 41.273 0.814 -10.86 0.65 6.22 ? O GLU A 142 1 
ATOM 1413 O O B GLU A 1 142 . 41.361 0.789 -10.44 0.35 14.7 ? O GLU A 142 1 
ATOM 1414 C CB A GLU A 1 142 . 39.096 2.702 -12.518 0.65 6.24 ? CB GLU A 142 1 
ATOM 1415 C CB B GLU A 1 142 . 39.381 2.82 -12.25 0.35 8.82 ? CB GLU A 142 1 
ATOM 1416 C CG A GLU A 1 142 . 38.883 1.468 -13.091 0.65 8.74 ? CG GLU A 142 1 
ATOM 1417 C CG B GLU A 1 142 . 37.822 2.73 -12.357 0.35 14.22 ? CG GLU A 142 1 
ATOM 1418 C CD A GLU A 1 142 . 38.07 1.501 -14.407 0.65 9.36 ? CD GLU A 142 1 
ATOM 1419 C CD B GLU A 1 142 . 37.179 2.442 -13.749 0.35 13.68 ? CD GLU A 142 1 
ATOM 1420 O OE1 A GLU A 1 142 . 37.772 2.661 -14.965 0.65 7.7 ? OE1 GLU A 142 1 
ATOM 1421 O OE1 B GLU A 1 142 . 37.809 2.516 -14.811 0.35 16.25 ? OE1 GLU A 142 1 
ATOM 1422 O OE2 A GLU A 1 142 . 37.7 0.39 -14.822 0.65 15.28 ? OE2 GLU A 142 1 
ATOM 1423 O OE2 B GLU A 1 142 . 36.032 1.938 -13.677 0.35 15.47 ? OE2 GLU A 142 1 
ATOM 1424 N N . LEU A 1 143 . 42.211 2.738 -11.379 1 7.31 ? N LEU A 143 1 
ATOM 1425 C CA . LEU A 1 143 . 43.538 2.151 -11.442 1 7.31 ? CA LEU A 143 1 
ATOM 1426 C C . LEU A 1 143 . 44.123 1.868 -10.059 1 8.47 ? C LEU A 143 1 
ATOM 1427 O O . LEU A 1 143 . 45.105 1.124 -9.951 1 10.57 ? O LEU A 143 1 
ATOM 1428 C CB . LEU A 1 143 . 44.513 3.03 -12.225 1 7.31 ? CB LEU A 143 1 
ATOM 1429 C CG . LEU A 1 143 . 44.216 3.159 -13.736 1 8.14 ? CG LEU A 143 1 
ATOM 1430 C CD1 . LEU A 1 143 . 45.325 4.019 -14.346 1 7.91 ? CD1 LEU A 143 1 
ATOM 1431 C CD2 . LEU A 1 143 . 44.14 1.805 -14.399 1 11.51 ? CD2 LEU A 143 1 
ATOM 1432 N N . GLN A 1 144 . 43.546 2.442 -9.019 1 8.41 ? N GLN A 144 1 
ATOM 1433 C CA . GLN A 1 144 . 43.897 2.045 -7.665 1 10.9 ? CA GLN A 144 1 
ATOM 1434 C C . GLN A 1 144 . 43.221 0.786 -7.199 1 11.54 ? C GLN A 144 1 
ATOM 1435 O O . GLN A 1 144 . 43.522 0.253 -6.141 1 14.83 ? O GLN A 144 1 
ATOM 1436 C CB . GLN A 1 144 . 43.543 3.129 -6.681 1 10.83 ? CB GLN A 144 1 
ATOM 1437 C CG . GLN A 1 144 . 44.272 4.422 -6.898 1 11.64 ? CG GLN A 144 1 
ATOM 1438 C CD . GLN A 1 144 . 43.851 5.545 -5.914 1 12.36 ? CD GLN A 144 1 
ATOM 1439 O OE1 . GLN A 1 144 . 43.342 6.635 -6.267 1 13.75 ? OE1 GLN A 144 1 
ATOM 1440 N NE2 . GLN A 1 144 . 44.116 5.289 -4.661 1 15.89 ? NE2 GLN A 144 1 
ATOM 1441 N N . GLY A 1 145 . 42.281 0.29 -7.959 1 11.6 ? N GLY A 145 1 
ATOM 1442 C CA . GLY A 1 145 . 41.565 -0.916 -7.547 1 13.97 ? CA GLY A 145 1 
ATOM 1443 C C . GLY A 1 145 . 40.613 -0.637 -6.393 1 14.34 ? C GLY A 145 1 
ATOM 1444 O O . GLY A 1 145 . 40.325 -1.565 -5.668 1 20.37 ? O GLY A 145 1 
ATOM 1445 N N . LYS A 1 146 . 40.101 0.566 -6.265 1 10.17 ? N LYS A 146 1 
ATOM 1446 C CA . LYS A 1 146 . 39.186 0.915 -5.206 1 10 ? CA LYS A 146 1 
ATOM 1447 C C . LYS A 1 146 . 37.823 1.196 -5.786 1 11.72 ? C LYS A 146 1 
ATOM 1448 O O . LYS A 1 146 . 37.723 1.845 -6.792 1 22.27 ? O LYS A 146 1 
ATOM 1449 C CB . LYS A 1 146 . 39.671 2.064 -4.403 1 12.21 ? CB LYS A 146 1 
ATOM 1450 C CG . LYS A 1 146 . 41.003 1.714 -3.684 1 22.54 ? CG LYS A 146 1 
ATOM 1451 C CD . LYS A 1 146 . 41.524 2.833 -2.824 1 52.94 ? CD LYS A 146 1 
ATOM 1452 C CE . LYS A 1 146 . 42.639 2.36 -1.958 1 80.4 ? CE LYS A 146 1 
ATOM 1453 N NZ . LYS A 1 146 . 43.106 3.427 -1.041 1 103.43 ? NZ LYS A 146 1 
ATOM 1454 N N . THR A 1 147 . 36.784 0.756 -5.159 1 7.27 ? N THR A 147 1 
ATOM 1455 C CA . THR A 1 147 . 35.42 0.89 -5.672 1 6.89 ? CA THR A 147 1 
ATOM 1456 C C . THR A 1 147 . 34.774 2.169 -5.212 1 6.26 ? C THR A 147 1 
ATOM 1457 O O . THR A 1 147 . 34.794 2.505 -4.054 1 8.18 ? O THR A 147 1 
ATOM 1458 C CB . THR A 1 147 . 34.597 -0.311 -5.174 1 7.69 ? CB THR A 147 1 
ATOM 1459 O OG1 . THR A 1 147 . 35.183 -1.472 -5.803 1 9.78 ? OG1 THR A 147 1 
ATOM 1460 C CG2 . THR A 1 147 . 33.14 -0.188 -5.476 1 9.33 ? CG2 THR A 147 1 
ATOM 1461 N N . THR A 1 148 . 34.136 2.837 -6.174 1 6.5 ? N THR A 148 1 
ATOM 1462 C CA . THR A 1 148 . 33.266 3.961 -5.859 1 6.74 ? CA THR A 148 1 
ATOM 1463 C C . THR A 1 148 . 31.907 3.707 -6.508 1 6.73 ? C THR A 148 1 
ATOM 1464 O O . THR A 1 148 . 31.8 2.998 -7.529 1 8.17 ? O THR A 148 1 
ATOM 1465 C CB . THR A 1 148 . 33.824 5.303 -6.352 1 7.06 ? CB THR A 148 1 
ATOM 1466 O OG1 . THR A 1 148 . 33.75 5.307 -7.788 1 8.84 ? OG1 THR A 148 1 
ATOM 1467 C CG2 . THR A 1 148 . 35.242 5.539 -5.875 1 7.62 ? CG2 THR A 148 1 
ATOM 1468 N N . LYS A 1 149 . 30.881 4.289 -5.929 1 7.22 ? N LYS A 149 1 
ATOM 1469 C CA . LYS A 1 149 . 29.53 4.194 -6.478 1 8.59 ? CA LYS A 149 1 
ATOM 1470 C C . LYS A 1 149 . 28.897 5.568 -6.382 1 8.3 ? C LYS A 149 1 
ATOM 1471 O O . LYS A 1 149 . 28.881 6.164 -5.312 1 9.71 ? O LYS A 149 1 
ATOM 1472 C CB . LYS A 1 149 . 28.687 3.195 -5.726 1 11.47 ? CB LYS A 149 1 
ATOM 1473 C CG . LYS A 1 149 . 27.368 2.926 -6.312 1 18.91 ? CG LYS A 149 1 
ATOM 1474 C CD . LYS A 1 149 . 26.596 1.748 -5.635 1 24.49 ? CD LYS A 149 1 
ATOM 1475 C CE . LYS A 1 149 . 27.384 0.447 -5.606 1 27.79 ? CE LYS A 149 1 
ATOM 1476 N NZ . LYS A 1 149 . 26.351 -0.68 -5.268 1 30.16 ? NZ LYS A 149 1 
ATOM 1477 N N . ILE A 1 150 . 28.334 6.052 -7.489 1 8.1 ? N ILE A 150 1 
ATOM 1478 C CA . ILE A 1 150 . 27.657 7.312 -7.503 1 8.49 ? CA ILE A 150 1 
ATOM 1479 C C . ILE A 1 150 . 26.166 7.045 -7.712 1 9.29 ? C ILE A 150 1 
ATOM 1480 O O . ILE A 1 150 . 25.778 6.494 -8.738 1 14.86 ? O ILE A 150 1 
ATOM 1481 C CB . ILE A 1 150 . 28.226 8.277 -8.6 1 12.17 ? CB ILE A 150 1 
ATOM 1482 C CG1 . ILE A 1 150 . 29.738 8.275 -8.63 1 16.32 ? CG1 ILE A 150 1 
ATOM 1483 C CG2 . ILE A 1 150 . 27.537 9.682 -8.45 1 15.08 ? CG2 ILE A 150 1 
ATOM 1484 C CD1 . ILE A 1 150 . 30.33 8.773 -7.421 1 20.28 ? CD1 ILE A 150 1 
ATOM 1485 N N . GLU A 1 151 . 25.385 7.387 -6.762 0.79 7.82 ? N GLU A 151 1 
ATOM 1486 C CA . GLU A 1 151 . 23.935 7.175 -6.806 0.79 10.79 ? CA GLU A 151 1 
ATOM 1487 C C . GLU A 1 151 . 23.166 8.181 -7.557 0.79 13.76 ? C GLU A 151 1 
ATOM 1488 O O . GLU A 1 151 . 22.192 7.803 -8.279 0.79 17.94 ? O GLU A 151 1 
ATOM 1489 C CB . GLU A 1 151 . 23.398 6.927 -5.384 0.79 14.75 ? CB GLU A 151 1 
ATOM 1490 C CG . GLU A 1 151 . 21.932 7.003 -5.246 0.79 27.48 ? CG GLU A 151 1 
ATOM 1491 C CD . GLU A 1 151 . 21.425 7.122 -3.751 0.79 29.46 ? CD GLU A 151 1 
ATOM 1492 O OE1 . GLU A 1 151 . 20.216 7.378 -3.633 0.79 29.14 ? OE1 GLU A 151 1 
ATOM 1493 O OE2 . GLU A 1 151 . 22.136 6.937 -2.671 0.79 29.71 ? OE2 GLU A 151 1 
ATOM 1494 N N . GLY A 1 152 . 23.634 9.355 -7.617 1 11.58 ? N GLY A 152 1 
ATOM 1495 C CA . GLY A 1 152 . 23.001 10.534 -8.239 1 11.7 ? CA GLY A 152 1 
ATOM 1496 C C . GLY A 1 152 . 23.197 11.755 -7.34 1 8.45 ? C GLY A 152 1 
ATOM 1497 O O . GLY A 1 152 . 24.15 11.825 -6.593 1 9.67 ? O GLY A 152 1 
ATOM 1498 N N . TRP A 1 153 . 22.282 12.699 -7.537 1 8.01 ? N TRP A 153 1 
ATOM 1499 C CA . TRP A 1 153 . 22.364 14.008 -6.921 1 8.04 ? CA TRP A 153 1 
ATOM 1500 C C . TRP A 1 153 . 21.127 14.253 -6.07 1 8.17 ? C TRP A 153 1 
ATOM 1501 O O . TRP A 1 153 . 20.009 13.915 -6.475 1 12.71 ? O TRP A 153 1 
ATOM 1502 C CB . TRP A 1 153 . 22.472 15.122 -7.991 1 8.95 ? CB TRP A 153 1 
ATOM 1503 C CG . TRP A 1 153 . 23.7 15.043 -8.801 1 8.38 ? CG TRP A 153 1 
ATOM 1504 C CD1 . TRP A 1 153 . 23.909 14.311 -9.915 1 8.87 ? CD1 TRP A 153 1 
ATOM 1505 C CD2 . TRP A 1 153 . 24.938 15.682 -8.494 1 7.11 ? CD2 TRP A 153 1 
ATOM 1506 N NE1 . TRP A 1 153 . 25.213 14.452 -10.346 1 9.09 ? NE1 TRP A 153 1 
ATOM 1507 C CE2 . TRP A 1 153 . 25.861 15.288 -9.482 1 7.9 ? CE2 TRP A 153 1 
ATOM 1508 C CE3 . TRP A 1 153 . 25.38 16.554 -7.489 1 7.32 ? CE3 TRP A 153 1 
ATOM 1509 C CZ2 . TRP A 1 153 . 27.165 15.752 -9.495 1 8.09 ? CZ2 TRP A 153 1 
ATOM 1510 C CZ3 . TRP A 1 153 . 26.666 17.022 -7.533 1 7.54 ? CZ3 TRP A 153 1 
ATOM 1511 C CH2 . TRP A 1 153 . 27.55 16.605 -8.54 1 7.81 ? CH2 TRP A 153 1 
ATOM 1512 N N . GLY A 1 154 . 21.316 14.891 -4.968 1 7.35 ? N GLY A 154 1 
ATOM 1513 C CA . GLY A 1 154 . 20.256 15.472 -4.172 1 7.77 ? CA GLY A 154 1 
ATOM 1514 C C . GLY A 1 154 . 20.202 16.98 -4.288 1 6.88 ? C GLY A 154 1 
ATOM 1515 O O . GLY A 1 154 . 21.18 17.622 -4.717 1 7.17 ? O GLY A 154 1 
ATOM 1516 N N . ASN A 1 155 . 19.073 17.55 -3.912 1 7.28 ? N ASN A 155 1 
ATOM 1517 C CA . ASN A 1 155 . 18.852 18.943 -4.011 1 7.43 ? CA ASN A 155 1 
ATOM 1518 C C . ASN A 1 155 . 19.435 19.717 -2.841 1 6.97 ? C ASN A 155 1 
ATOM 1519 O O . ASN A 1 155 . 20.091 19.169 -1.927 1 7.57 ? O ASN A 155 1 
ATOM 1520 C CB . ASN A 1 155 . 17.362 19.233 -4.222 1 8.61 ? CB ASN A 155 1 
ATOM 1521 C CG . ASN A 1 155 . 16.487 18.884 -3.054 1 10.04 ? CG ASN A 155 1 
ATOM 1522 O OD1 . ASN A 1 155 . 15.221 18.819 -3.29 1 14.72 ? OD1 ASN A 155 1 
ATOM 1523 N ND2 . ASN A 1 155 . 16.958 18.724 -1.926 1 8.45 ? ND2 ASN A 155 1 
ATOM 1524 N N . ALA A 1 156 . 19.254 21.011 -2.85 1 7.3 ? N ALA A 156 1 
ATOM 1525 C CA . ALA A 1 156 . 19.864 21.866 -1.844 1 7.65 ? CA ALA A 156 1 
ATOM 1526 C C . ALA A 1 156 . 19.349 21.542 -0.466 1 7.83 ? C ALA A 156 1 
ATOM 1527 O O . ALA A 1 156 . 20.101 21.626 0.531 1 8.21 ? O ALA A 156 1 
ATOM 1528 C CB . ALA A 1 156 . 19.604 23.345 -2.192 1 9.3 ? CB ALA A 156 1 
ATOM 1529 N N A GLU A 1 157 . 18.068 21.257 -0.274 0.56 8.06 ? N GLU A 157 1 
ATOM 1530 N N B GLU A 1 157 . 18.088 21.158 -0.401 0.44 7.89 ? N GLU A 157 1 
ATOM 1531 C CA A GLU A 1 157 . 17.569 20.854 1.041 0.56 9.17 ? CA GLU A 157 1 
ATOM 1532 C CA B GLU A 1 157 . 17.516 20.837 0.882 0.44 8.8 ? CA GLU A 157 1 
ATOM 1533 C C A GLU A 1 157 . 18.277 19.59 1.505 0.56 8.6 ? C GLU A 157 1 
ATOM 1534 C C B GLU A 1 157 . 18.115 19.579 1.495 0.44 8.83 ? C GLU A 157 1 
ATOM 1535 O O A GLU A 1 157 . 18.672 19.519 2.677 0.56 8.06 ? O GLU A 157 1 
ATOM 1536 O O B GLU A 1 157 . 18.347 19.494 2.707 0.44 9.77 ? O GLU A 157 1 
ATOM 1537 C CB A GLU A 1 157 . 16.036 20.668 0.984 0.56 10.69 ? CB GLU A 157 1 
ATOM 1538 C CB B GLU A 1 157 . 16.02 20.667 0.769 0.44 10.6 ? CB GLU A 157 1 
ATOM 1539 C CG A GLU A 1 157 . 15.272 21.978 0.677 0.56 14.71 ? CG GLU A 157 1 
ATOM 1540 C CG B GLU A 1 157 . 15.467 20.218 2.076 0.44 11.73 ? CG GLU A 157 1 
ATOM 1541 C CD A GLU A 1 157 . 15.392 23.135 1.74 0.56 18.56 ? CD GLU A 157 1 
ATOM 1542 C CD B GLU A 1 157 . 15.548 21.223 3.194 0.44 15.17 ? CD GLU A 157 1 
ATOM 1543 O OE1 A GLU A 1 157 . 15.565 24.392 1.428 0.56 19.99 ? OE1 GLU A 157 1 
ATOM 1544 O OE1 B GLU A 1 157 . 15.153 20.837 4.364 0.44 21.23 ? OE1 GLU A 157 1 
ATOM 1545 O OE2 A GLU A 1 157 . 15.207 22.895 2.929 0.56 22.25 ? OE2 GLU A 157 1 
ATOM 1546 O OE2 B GLU A 1 157 . 15.924 22.384 3.004 0.44 17.97 ? OE2 GLU A 157 1 
ATOM 1547 N N . GLU A 1 158 . 18.411 18.587 0.668 1 8.26 ? N GLU A 158 1 
ATOM 1548 C CA . GLU A 1 158 . 19.071 17.39 1.127 1 8.54 ? CA GLU A 158 1 
ATOM 1549 C C . GLU A 1 158 . 20.528 17.679 1.508 1 8.14 ? C GLU A 158 1 
ATOM 1550 O O . GLU A 1 158 . 21.066 17.111 2.463 1 8.62 ? O GLU A 158 1 
ATOM 1551 C CB . GLU A 1 158 . 19.017 16.302 0.032 1 9.5 ? CB GLU A 158 1 
ATOM 1552 C CG . GLU A 1 158 . 19.377 14.954 0.551 1 10.88 ? CG GLU A 158 1 
ATOM 1553 C CD . GLU A 1 158 . 19.017 13.77 -0.329 1 11.68 ? CD GLU A 158 1 
ATOM 1554 O OE1 . GLU A 1 158 . 18.579 13.956 -1.508 1 12.82 ? OE1 GLU A 158 1 
ATOM 1555 O OE2 . GLU A 1 158 . 19.144 12.633 0.185 1 14.3 ? OE2 GLU A 158 1 
ATOM 1556 N N . ALA A 1 159 . 21.173 18.574 0.748 1 6.98 ? N ALA A 159 1 
ATOM 1557 C CA . ALA A 1 159 . 22.54 18.969 1.082 1 7.04 ? CA ALA A 159 1 
ATOM 1558 C C . ALA A 1 159 . 22.622 19.62 2.447 1 7.02 ? C ALA A 159 1 
ATOM 1559 O O . ALA A 1 159 . 23.504 19.321 3.258 1 7.41 ? O ALA A 159 1 
ATOM 1560 C CB . ALA A 1 159 . 23.046 19.952 0.02 1 7.75 ? CB ALA A 159 1 
ATOM 1561 N N . LYS A 1 160 . 21.709 20.564 2.706 1 6.96 ? N LYS A 160 1 
ATOM 1562 C CA . LYS A 1 160 . 21.672 21.266 3.976 1 7.49 ? CA LYS A 160 1 
ATOM 1563 C C . LYS A 1 160 . 21.444 20.315 5.146 1 7.88 ? C LYS A 160 1 
ATOM 1564 O O . LYS A 1 160 . 22.077 20.451 6.193 1 8.26 ? O LYS A 160 1 
ATOM 1565 C CB . LYS A 1 160 . 20.668 22.392 3.942 1 8.24 ? CB LYS A 160 1 
ATOM 1566 C CG . LYS A 1 160 . 21.112 23.525 3.008 1 9 ? CG LYS A 160 1 
ATOM 1567 C CD . LYS A 1 160 . 20.15 24.674 2.959 1 11.31 ? CD LYS A 160 1 
ATOM 1568 C CE . LYS A 1 160 . 18.851 24.331 2.445 1 14.26 ? CE LYS A 160 1 
ATOM 1569 N NZ . LYS A 1 160 . 17.942 25.543 2.396 1 17.19 ? NZ LYS A 160 1 
ATOM 1570 N N . ARG A 1 161 . 20.536 19.346 4.969 1 7.94 ? N ARG A 161 1 
ATOM 1571 C CA . ARG A 1 161 . 20.344 18.36 6.035 1 9.02 ? CA ARG A 161 1 
ATOM 1572 C C . ARG A 1 161 . 21.613 17.581 6.301 1 7.95 ? C ARG A 161 1 
ATOM 1573 O O . ARG A 1 161 . 21.936 17.253 7.46 1 8.5 ? O ARG A 161 1 
ATOM 1574 C CB . ARG A 1 161 . 19.196 17.443 5.658 1 10.76 ? CB ARG A 161 1 
ATOM 1575 C CG . ARG A 1 161 . 17.845 18.12 5.689 1 15.91 ? CG ARG A 161 1 
ATOM 1576 C CD . ARG A 1 161 . 16.637 17.117 5.636 1 26.83 ? CD ARG A 161 1 
ATOM 1577 N NE . ARG A 1 161 . 16.56 16.339 4.376 1 35.18 ? NE ARG A 161 1 
ATOM 1578 C CZ . ARG A 1 161 . 15.9 16.717 3.259 1 46.06 ? CZ ARG A 161 1 
ATOM 1579 N NH1 . ARG A 1 161 . 15.173 17.832 3.274 1 61.49 ? NH1 ARG A 161 1 
ATOM 1580 N NH2 . ARG A 1 161 . 15.921 15.951 2.18 1 51.06 ? NH2 ARG A 161 1 
ATOM 1581 N N . GLU A 1 162 . 22.373 17.233 5.26 1 7.13 ? N GLU A 162 1 
ATOM 1582 C CA . GLU A 1 162 . 23.582 16.487 5.444 1 7.33 ? CA GLU A 162 1 
ATOM 1583 C C . GLU A 1 162 . 24.67 17.311 6.128 1 6.76 ? C GLU A 162 1 
ATOM 1584 O O . GLU A 1 162 . 25.438 16.784 6.943 1 7.13 ? O GLU A 162 1 
ATOM 1585 C CB . GLU A 1 162 . 24.076 15.864 4.155 1 7.46 ? CB GLU A 162 1 
ATOM 1586 C CG . GLU A 1 162 . 24.987 14.652 4.368 1 7.52 ? CG GLU A 162 1 
ATOM 1587 C CD . GLU A 1 162 . 24.294 13.429 4.929 1 8.3 ? CD GLU A 162 1 
ATOM 1588 O OE1 . GLU A 1 162 . 23.035 13.445 5.018 1 10.45 ? OE1 GLU A 162 1 
ATOM 1589 O OE2 . GLU A 1 162 . 25.009 12.45 5.201 1 8.26 ? OE2 GLU A 162 1 
ATOM 1590 N N . ILE A 1 163 . 24.741 18.6 5.812 1 6.57 ? N ILE A 163 1 
ATOM 1591 C CA . ILE A 1 163 . 25.657 19.492 6.512 1 6.37 ? CA ILE A 163 1 
ATOM 1592 C C . ILE A 1 163 . 25.345 19.463 8.012 1 6.92 ? C ILE A 163 1 
ATOM 1593 O O . ILE A 1 163 . 26.263 19.356 8.835 1 7.33 ? O ILE A 163 1 
ATOM 1594 C CB . ILE A 1 163 . 25.545 20.911 5.945 1 7.08 ? CB ILE A 163 1 
ATOM 1595 C CG1 . ILE A 1 163 . 26.109 20.986 4.521 1 6.6 ? CG1 ILE A 163 1 
ATOM 1596 C CG2 . ILE A 1 163 . 26.2 21.931 6.865 1 7.57 ? CG2 ILE A 163 1 
ATOM 1597 C CD1 . ILE A 1 163 . 25.735 22.212 3.741 1 7.43 ? CD1 ILE A 163 1 
ATOM 1598 N N . LEU A 1 164 . 24.077 19.559 8.382 1 7.17 ? N LEU A 164 1 
ATOM 1599 C CA . LEU A 1 164 . 23.746 19.533 9.818 1 7.92 ? CA LEU A 164 1 
ATOM 1600 C C . LEU A 1 164 . 24.159 18.233 10.424 1 7.73 ? C LEU A 164 1 
ATOM 1601 O O . LEU A 1 164 . 24.699 18.26 11.572 1 8.39 ? O LEU A 164 1 
ATOM 1602 C CB . LEU A 1 164 . 22.241 19.759 9.972 1 9.68 ? CB LEU A 164 1 
ATOM 1603 C CG . LEU A 1 164 . 21.761 21.137 9.57 1 10.69 ? CG LEU A 164 1 
ATOM 1604 C CD1 . LEU A 1 164 . 20.235 21.189 9.67 1 14.89 ? CD1 LEU A 164 1 
ATOM 1605 C CD2 . LEU A 1 164 . 22.38 22.245 10.36 1 13.66 ? CD2 LEU A 164 1 
ATOM 1606 N N . ARG A 1 165 . 23.996 17.108 9.767 1 7.53 ? N ARG A 165 1 
ATOM 1607 C CA . ARG A 1 165 . 24.457 15.816 10.299 1 7.54 ? CA ARG A 165 1 
ATOM 1608 C C . ARG A 1 165 . 25.955 15.836 10.515 1 7.52 ? C ARG A 165 1 
ATOM 1609 O O . ARG A 1 165 . 26.437 15.381 11.577 1 8.14 ? O ARG A 165 1 
ATOM 1610 C CB . ARG A 1 165 . 24.085 14.714 9.324 1 8.17 ? CB ARG A 165 1 
ATOM 1611 C CG . ARG A 1 165 . 24.695 13.373 9.687 1 9.58 ? CG ARG A 165 1 
ATOM 1612 C CD . ARG A 1 165 . 24.214 12.254 8.793 1 10.42 ? CD ARG A 165 1 
ATOM 1613 N NE . ARG A 1 165 . 24.85 10.979 9.203 0.93 10.16 ? NE ARG A 165 1 
ATOM 1614 C CZ . ARG A 1 165 . 25.89 10.365 8.61 0.88 8.73 ? CZ ARG A 165 1 
ATOM 1615 N NH1 . ARG A 1 165 . 26.424 9.296 9.161 1 10.57 ? NH1 ARG A 165 1 
ATOM 1616 N NH2 . ARG A 1 165 . 26.325 10.776 7.426 1 10.08 ? NH2 ARG A 165 1 
ATOM 1617 N N . ALA A 1 166 . 26.721 16.304 9.539 1 7.02 ? N ALA A 166 1 
ATOM 1618 C CA . ALA A 1 166 . 28.183 16.273 9.613 1 6.68 ? CA ALA A 166 1 
ATOM 1619 C C . ALA A 1 166 . 28.701 17.158 10.744 1 6.82 ? C ALA A 166 1 
ATOM 1620 O O . ALA A 1 166 . 29.713 16.848 11.382 1 7.05 ? O ALA A 166 1 
ATOM 1621 C CB . ALA A 1 166 . 28.758 16.658 8.275 1 7.28 ? CB ALA A 166 1 
ATOM 1622 N N . ILE A 1 167 . 28.029 18.295 10.975 1 7.08 ? N ILE A 167 1 
ATOM 1623 C CA . ILE A 1 167 . 28.371 19.172 12.079 1 7.36 ? CA ILE A 167 1 
ATOM 1624 C C . ILE A 1 167 . 28.184 18.429 13.431 1 7.73 ? C ILE A 167 1 
ATOM 1625 O O . ILE A 1 167 . 29.045 18.537 14.31 1 8.71 ? O ILE A 167 1 
ATOM 1626 C CB . ILE A 1 167 . 27.52 20.438 12.026 1 8 ? CB ILE A 167 1 
ATOM 1627 C CG1 . ILE A 1 167 . 28.011 21.296 10.843 1 8.5 ? CG1 ILE A 167 1 
ATOM 1628 C CG2 . ILE A 1 167 . 27.494 21.206 13.321 1 9.65 ? CG2 ILE A 167 1 
ATOM 1629 C CD1 . ILE A 1 167 . 27.173 22.5 10.573 1 10.01 ? CD1 ILE A 167 1 
ATOM 1630 N N . GLU A 1 168 . 27.099 17.671 13.553 1 8.34 ? N GLU A 168 1 
ATOM 1631 C CA . GLU A 1 168 . 26.887 16.908 14.788 1 8.74 ? CA GLU A 168 1 
ATOM 1632 C C . GLU A 1 168 . 27.895 15.757 14.915 1 8.52 ? C GLU A 168 1 
ATOM 1633 O O . GLU A 1 168 . 28.299 15.445 16.046 1 10.05 ? O GLU A 168 1 
ATOM 1634 C CB . GLU A 1 168 . 25.464 16.367 14.847 1 9.72 ? CB GLU A 168 1 
ATOM 1635 C CG . GLU A 1 168 . 24.433 17.481 14.893 1 11.73 ? CG GLU A 168 1 
ATOM 1636 C CD . GLU A 1 168 . 24.657 18.481 16.014 1 12.77 ? CD GLU A 168 1 
ATOM 1637 O OE1 . GLU A 1 168 . 24.596 19.743 15.764 1 16.08 ? OE1 GLU A 168 1 
ATOM 1638 O OE2 . GLU A 1 168 . 25.027 18.075 17.135 1 12.98 ? OE2 GLU A 168 1 
ATOM 1639 N N . MET A 1 169 . 28.311 15.17 13.813 1 8.29 ? N MET A 169 1 
ATOM 1640 C CA . MET A 1 169 . 29.325 14.1 13.884 1 8.29 ? CA MET A 169 1 
ATOM 1641 C C . MET A 1 169 . 30.644 14.613 14.43 1 8.32 ? C MET A 169 1 
ATOM 1642 O O . MET A 1 169 . 31.33 13.929 15.191 1 9.23 ? O MET A 169 1 
ATOM 1643 C CB . MET A 1 169 . 29.516 13.426 12.522 1 8.62 ? CB MET A 169 1 
ATOM 1644 C CG . MET A 1 169 . 28.309 12.658 12.025 1 10.2 ? CG MET A 169 1 
ATOM 1645 S SD . MET A 1 169 . 28.471 11.962 10.387 1 11.37 ? SD MET A 169 1 
ATOM 1646 C CE . MET A 1 169 . 29.623 10.733 10.709 1 14.74 ? CE MET A 169 1 
ATOM 1647 N N . TYR A 1 170 . 31.023 15.836 14.068 1 7.89 ? N TYR A 170 1 
ATOM 1648 C CA . TYR A 1 170 . 32.21 16.443 14.647 1 7.78 ? CA TYR A 170 1 
ATOM 1649 C C . TYR A 1 170 . 32.076 16.668 16.131 1 9.1 ? C TYR A 170 1 
ATOM 1650 O O . TYR A 1 170 . 32.982 16.394 16.904 1 10.18 ? O TYR A 170 1 
ATOM 1651 C CB . TYR A 1 170 . 32.493 17.787 13.924 1 8.41 ? CB TYR A 170 1 
ATOM 1652 C CG . TYR A 1 170 . 33.672 18.55 14.505 1 8.3 ? CG TYR A 170 1 
ATOM 1653 C CD1 . TYR A 1 170 . 33.507 19.383 15.594 1 9.52 ? CD1 TYR A 170 1 
ATOM 1654 C CD2 . TYR A 1 170 . 34.944 18.4 13.988 1 8.66 ? CD2 TYR A 170 1 
ATOM 1655 C CE1 . TYR A 1 170 . 34.592 20.072 16.122 1 10.76 ? CE1 TYR A 170 1 
ATOM 1656 C CE2 . TYR A 1 170 . 36.028 19.088 14.525 1 9.44 ? CE2 TYR A 170 1 
ATOM 1657 C CZ . TYR A 1 170 . 35.858 19.865 15.638 1 10.21 ? CZ TYR A 170 1 
ATOM 1658 O OH . TYR A 1 170 . 36.881 20.559 16.222 1 12.23 ? OH TYR A 170 1 
ATOM 1659 N N . LYS A 1 171 . 30.917 17.211 16.578 1 10 ? N LYS A 171 1 
ATOM 1660 C CA . LYS A 1 171 . 30.711 17.436 18.009 1 12.97 ? CA LYS A 171 1 
ATOM 1661 C C . LYS A 1 171 . 30.841 16.128 18.782 1 14.25 ? C LYS A 171 1 
ATOM 1662 O O . LYS A 1 171 . 31.403 16.154 19.871 1 16.52 ? O LYS A 171 1 
ATOM 1663 C CB . LYS A 1 171 . 29.371 18.112 18.226 1 13.85 ? CB LYS A 171 1 
ATOM 1664 C CG . LYS A 1 171 . 29.276 19.491 17.723 1 14.74 ? CG LYS A 171 1 
ATOM 1665 C CD . LYS A 1 171 . 27.856 20.038 17.865 1 24.07 ? CD LYS A 171 1 
ATOM 1666 C CE . LYS A 1 171 . 27.663 21.371 17.224 1 44.24 ? CE LYS A 171 1 
ATOM 1667 N NZ . LYS A 1 171 . 26.253 21.803 17.292 1 60.91 ? NZ LYS A 171 1 
ATOM 1668 N N . GLU A 1 172 . 30.3 15.061 18.226 1 13.58 ? N GLU A 172 1 
ATOM 1669 C CA . GLU A 1 172 . 30.323 13.81 18.915 1 14.99 ? CA GLU A 172 1 
ATOM 1670 C C . GLU A 1 172 . 31.716 13.281 18.969 1 17.08 ? C GLU A 172 1 
ATOM 1671 O O . GLU A 1 172 . 32.193 12.765 20.012 1 22.94 ? O GLU A 172 1 
ATOM 1672 C CB . GLU A 1 172 . 29.353 12.866 18.235 1 14.62 ? CB GLU A 172 1 
ATOM 1673 C CG . GLU A 1 172 . 29.29 11.521 18.857 1 14.81 ? CG GLU A 172 1 
ATOM 1674 C CD . GLU A 1 172 . 28.857 11.53 20.367 1 15.18 ? CD GLU A 172 1 
ATOM 1675 O OE1 . GLU A 1 172 . 29.213 10.505 21.005 1 18.01 ? OE1 GLU A 172 1 
ATOM 1676 O OE2 . GLU A 1 172 . 28.181 12.505 20.788 1 18.82 ? OE2 GLU A 172 1 
ATOM 1677 N N . LYS A 1 173 . 32.481 13.425 17.873 1 16.19 ? N LYS A 173 1 
ATOM 1678 C CA . LYS A 1 173 . 33.822 12.901 17.841 1 19.04 ? CA LYS A 173 1 
ATOM 1679 C C . LYS A 1 173 . 34.84 13.681 18.707 1 18.27 ? C LYS A 173 1 
ATOM 1680 O O . LYS A 1 173 . 35.641 13.119 19.439 1 24.3 ? O LYS A 173 1 
ATOM 1681 C CB . LYS A 1 173 . 34.373 12.803 16.424 1 30.69 ? CB LYS A 173 1 
ATOM 1682 C CG . LYS A 1 173 . 35.837 12.371 16.353 1 54.54 ? CG LYS A 173 1 
ATOM 1683 C CD . LYS A 1 173 . 36.15 11.415 15.282 1 76.44 ? CD LYS A 173 1 
ATOM 1684 C CE . LYS A 1 173 . 37.575 10.982 15.365 1 97.97 ? CE LYS A 173 1 
ATOM 1685 N NZ . LYS A 1 173 . 37.698 9.584 15.771 1 119.88 ? NZ LYS A 173 1 
ATOM 1686 N N . PHE A 1 174 . 34.791 14.969 18.582 1 15.43 ? N PHE A 174 1 
ATOM 1687 C CA . PHE A 1 174 . 35.79 15.845 19.193 1 18.59 ? CA PHE A 174 1 
ATOM 1688 C C . PHE A 1 174 . 35.143 16.532 20.437 1 27.35 ? C PHE A 174 1 
ATOM 1689 C CB . PHE A 1 174 . 36.291 16.844 18.216 1 16.46 ? CB PHE A 174 1 
ATOM 1690 C CG . PHE A 1 174 . 37.038 16.193 17.114 1 15.09 ? CG PHE A 174 1 
ATOM 1691 C CD1 . PHE A 1 174 . 38.372 15.774 17.257 1 16.67 ? CD1 PHE A 174 1 
ATOM 1692 C CD2 . PHE A 1 174 . 36.414 15.995 15.865 1 15.63 ? CD2 PHE A 174 1 
ATOM 1693 C CE1 . PHE A 1 174 . 39.025 15.165 16.274 1 18.55 ? CE1 PHE A 174 1 
ATOM 1694 C CE2 . PHE A 1 174 . 37.108 15.44 14.815 1 16.2 ? CE2 PHE A 174 1 
ATOM 1695 C CZ . PHE A 1 174 . 38.415 14.975 14.956 1 18.16 ? CZ PHE A 174 1 
ATOM 1696 N N . GLY A 1 175 . 34.019 16.068 20.969 1 29.76 ? N GLY A 175 1 
ATOM 1697 C CA . GLY A 1 175 . 33.648 16.457 22.356 1 29.86 ? CA GLY A 175 1 
ATOM 1698 C C . GLY A 1 175 . 34.475 15.551 23.265 1 30.3 ? C GLY A 175 1 
ATOM 1699 O O . GLY A 1 175 . 34.978 15.937 24.358 1 30.14 ? O GLY A 175 1 
ATOM 1700 N N . LYS A 1 176 . 34.65 14.286 22.859 0.82 37.57 ? N LYS A 176 1 
ATOM 1701 C CA . LYS A 1 176 . 35.511 13.342 23.582 0.85 33.27 ? CA LYS A 176 1 
ATOM 1702 C C . LYS A 1 176 . 36.922 13.414 22.992 0.84 33.34 ? C LYS A 176 1 
ATOM 1703 O O . LYS A 1 176 . 37.9 13.566 23.757 0.73 34.6 ? O LYS A 176 1 
ATOM 1704 C CB . LYS A 1 176 . 34.96 11.917 23.537 0.85 30.77 ? CB LYS A 176 1 
ATOM 1705 C CG . LYS A 1 176 . 33.469 11.755 23.274 0.87 28.43 ? CG LYS A 176 1 
ATOM 1706 C CD . LYS A 1 176 . 33.296 11.531 21.825 0.83 27.66 ? CD LYS A 176 1 
ATOM 1707 C CE . LYS A 1 176 . 32.754 10.156 21.553 0.81 27.26 ? CE LYS A 176 1 
ATOM 1708 N NZ . LYS A 1 176 . 31.809 9.859 22.714 0.85 28.19 ? NZ LYS A 176 1 
ATOM 1709 N N . GLU A 1 177 . 37.046 13.352 21.644 0.81 33.42 ? N GLU A 177 1 
ATOM 1710 C CA . GLU A 1 177 . 38.414 13.424 21.02 0.85 31.59 ? CA GLU A 177 1 
ATOM 1711 C C . GLU A 1 177 . 39.022 14.791 21.36 0.83 32.11 ? C GLU A 177 1 
ATOM 1712 O O . GLU A 1 177 . 39.331 15.071 22.535 0.69 34.38 ? O GLU A 177 1 
ATOM 1713 C CB . GLU A 1 177 . 38.4 13.267 19.512 0.85 28.63 ? CB GLU A 177 1 
ATOM 1714 C CG . GLU A 1 177 . 38.782 11.93 18.873 0.89 29.06 ? CG GLU A 177 1 
ATOM 1715 C CD . GLU A 1 177 . 40.27 11.921 18.496 0.85 30.59 ? CD GLU A 177 1 
ATOM 1716 O OE1 . GLU A 1 177 . 40.916 10.857 18.423 0.7 33.43 ? OE1 GLU A 177 1 
ATOM 1717 O OE2 . GLU A 1 177 . 40.869 13.021 18.283 0.73 32.65 ? OE2 GLU A 177 1 
ATOM 1718 N N . GLU A 1 178 . 39.17 15.639 20.349 0.74 30.04 ? N GLU A 178 1 
ATOM 1719 C CA . GLU A 1 178 . 39.678 16.988 20.552 0.87 29.37 ? CA GLU A 178 1 
ATOM 1720 C C . GLU A 1 178 . 38.567 17.918 21.033 0.81 29.87 ? C GLU A 178 1 
ATOM 1721 O O . GLU A 1 178 . 38.6 19.124 20.787 0.7 29.95 ? O GLU A 178 1 
ATOM 1722 C CB . GLU A 1 178 . 40.303 17.521 19.261 0.54 20.61 ? CB GLU A 178 1 
ATOM 1723 C CG . GLU A 1 178 . 40.015 18.984 18.981 0.63 20.13 ? CG GLU A 178 1 
ATOM 1724 C CD . GLU A 1 178 . 41.153 19.883 19.405 0.56 20.13 ? CD GLU A 178 1 
ATOM 1725 O OE1 . GLU A 1 178 . 40.997 20.604 20.412 0.2 20.18 ? OE1 GLU A 178 1 
ATOM 1726 O OE2 . GLU A 1 178 . 42.206 19.863 18.736 0.25 20.19 ? OE2 GLU A 178 1 
ATOM 1727 N N A MET A-2 1 1 . 50.672 24.685 13.387 0.36 40.14 ? N MET A-2 1 1 
ATOM 1728 N N B MET A-2 1 1 . 50.723 24.187 13.468 0.25 40.26 ? N MET A-2 1 1 
ATOM 1729 C CA A MET A-2 1 1 . 51.904 24.191 13.97 0.36 35.49 ? CA MET A-2 1 1 
ATOM 1730 C CA B MET A-2 1 1 . 52.049 23.948 14.015 0.25 35.98 ? CA MET A-2 1 1 
ATOM 1731 C CA C MET A-2 1 1 . 53.545 25.539 15.416 0.28 34.51 ? CA MET A-2 1 1 
ATOM 1732 C CA D MET A-2 1 1 . 53.599 25.439 15.468 0.11 34.38 ? CA MET A-2 1 1 
ATOM 1733 C C A MET A-2 1 1 . 53.029 24.392 12.99 0.36 32.17 ? C MET A-2 1 1 
ATOM 1734 C C B MET A-2 1 1 . 53.079 24.564 13.09 0.25 32.13 ? C MET A-2 1 1 
ATOM 1735 C C C MET A-2 1 1 . 54.413 25.474 14.178 0.28 32.62 ? C MET A-2 1 1 
ATOM 1736 C C D MET A-2 1 1 . 54.407 25.451 14.179 0.11 32.43 ? C MET A-2 1 1 
ATOM 1737 O O A MET A-2 1 1 . 52.839 24.187 11.848 0.36 29.44 ? O MET A-2 1 1 
ATOM 1738 O O B MET A-2 1 1 . 52.963 24.362 11.916 0.25 29.37 ? O MET A-2 1 1 
ATOM 1739 O O C MET A-2 1 1 . 54.31 24.528 13.384 0.28 31.69 ? O MET A-2 1 1 
ATOM 1740 O O D MET A-2 1 1 . 54.286 24.545 13.353 0.11 31.49 ? O MET A-2 1 1 
ATOM 1741 C CB A MET A-2 1 1 . 51.771 22.706 14.248 0.36 34.98 ? CB MET A-2 1 1 
ATOM 1742 C CB B MET A-2 1 1 . 52.309 22.439 14.099 0.25 35.51 ? CB MET A-2 1 1 
ATOM 1743 C CB C MET A-2 1 1 . 54.293 26.307 16.495 0.28 34.42 ? CB MET A-2 1 1 
ATOM 1744 C CB D MET A-2 1 1 . 54.485 24.933 16.607 0.11 34.16 ? CB MET A-2 1 1 
ATOM 1745 C CG A MET A-2 1 1 . 50.449 22.37 14.924 0.36 34.12 ? CG MET A-2 1 1 
ATOM 1746 C CG B MET A-2 1 1 . 51.337 21.705 15.005 0.25 35.7 ? CG MET A-2 1 1 
ATOM 1747 C CG C MET A-2 1 1 . 53.597 26.305 17.829 0.28 33.1 ? CG MET A-2 1 1 
ATOM 1748 C CG D MET A-2 1 1 . 54.414 23.435 16.819 0.11 32.87 ? CG MET A-2 1 1 
ATOM 1749 S SD A MET A-2 1 1 . 50.615 20.781 15.737 0.36 36.19 ? SD MET A-2 1 1 
ATOM 1750 S SD B MET A-2 1 1 . 51.68 19.939 15.103 0.25 35.99 ? SD MET A-2 1 1 
ATOM 1751 S SD C MET A-2 1 1 . 54.786 26.158 19.162 0.28 33.31 ? SD MET A-2 1 1 
ATOM 1752 S SD D MET A-2 1 1 . 55.899 22.537 16.313 0.11 31.06 ? SD MET A-2 1 1 
ATOM 1753 C CE A MET A-2 1 1 . 52.213 20.957 16.5 0.36 35.71 ? CE MET A-2 1 1 
ATOM 1754 C CE B MET A-2 1 1 . 50.687 19.45 16.502 0.25 37.61 ? CE MET A-2 1 1 
ATOM 1755 C CE C MET A-2 1 1 . 54.027 24.952 20.209 0.28 34.8 ? CE MET A-2 1 1 
ATOM 1756 C CE D MET A-2 1 1 . 56.835 22.508 17.832 0.11 34.52 ? CE MET A-2 1 1 
ATOM 1757 N N A ASN A-2 1 2 . 54.211 24.752 13.515 0.36 33.6 ? N ASN A-2 2 1 
ATOM 1758 N N B ASN A-2 1 2 . 54.067 25.296 13.649 0.25 32.8 ? N ASN A-2 2 1 
ATOM 1759 N N C ASN A-2 1 2 . 55.251 26.48 14.004 0.28 32.44 ? N ASN A-2 2 1 
ATOM 1760 N N D ASN A-2 1 2 . 55.223 26.483 14.012 0.11 31.64 ? N ASN A-2 2 1 
ATOM 1761 C CA A ASN A-2 1 2 . 55.4 25.07 12.71 0.36 34.36 ? CA ASN A-2 2 1 
ATOM 1762 C CA B ASN A-2 1 2 . 55.252 25.791 12.9 0.25 33.95 ? CA ASN A-2 2 1 
ATOM 1763 C CA C ASN A-2 1 2 . 56.255 26.46 12.924 0.28 33.7 ? CA ASN A-2 2 1 
ATOM 1764 C CA D ASN A-2 1 2 . 56.199 26.55 12.914 0.11 33.1 ? CA ASN A-2 2 1 
ATOM 1765 C C A ASN A-2 1 2 . 55.85 23.853 11.942 0.36 26.62 ? C ASN A-2 2 1 
ATOM 1766 C C B ASN A-2 1 2 . 55.999 24.669 12.24 0.25 25.14 ? C ASN A-2 2 1 
ATOM 1767 C C C ASN A-2 1 2 . 56.465 25.061 12.315 0.28 24.9 ? C ASN A-2 2 1 
ATOM 1768 C C D ASN A-2 1 2 . 56.575 25.181 12.319 0.11 25.36 ? C ASN A-2 2 1 
ATOM 1769 O O A ASN A-2 1 2 . 56.116 22.789 12.513 0.36 28.36 ? O ASN A-2 2 1 
ATOM 1770 O O B ASN A-2 1 2 . 56.602 23.883 12.945 0.25 23.83 ? O ASN A-2 2 1 
ATOM 1771 O O C ASN A-2 1 2 . 56.88 24.162 13.025 0.28 24.62 ? O ASN A-2 2 1 
ATOM 1772 O O D ASN A-2 1 2 . 56.993 24.292 13.05 0.11 23.05 ? O ASN A-2 2 1 
ATOM 1773 C CB A ASN A-2 1 2 . 56.508 25.598 13.621 0.36 44.1 ? CB ASN A-2 2 1 
ATOM 1774 C CB B ASN A-2 1 2 . 56.229 26.514 13.831 0.25 43.76 ? CB ASN A-2 2 1 
ATOM 1775 C CB C ASN A-2 1 2 . 57.598 27.011 13.435 0.28 43.96 ? CB ASN A-2 2 1 
ATOM 1776 C CB D ASN A-2 1 2 . 57.465 27.265 13.401 0.11 43.6 ? CB ASN A-2 2 1 
ATOM 1777 C CG A ASN A-2 1 2 . 57.67 26.244 12.855 0.36 49.12 ? CG ASN A-2 2 1 
ATOM 1778 C CG B ASN A-2 1 2 . 57.627 26.71 13.206 0.25 48.37 ? CG ASN A-2 2 1 
ATOM 1779 C CG C ASN A-2 1 2 . 58.56 27.35 12.314 0.28 48.56 ? CG ASN A-2 2 1 
ATOM 1780 C CG D ASN A-2 1 2 . 58.504 27.443 12.309 0.11 48.28 ? CG ASN A-2 2 1 
ATOM 1781 O OD1 A ASN A-2 1 2 . 58.376 25.598 12.108 0.36 42.33 ? OD1 ASN A-2 2 1 
ATOM 1782 O OD1 B ASN A-2 1 2 . 58.267 25.764 12.703 0.25 42.07 ? OD1 ASN A-2 2 1 
ATOM 1783 O OD1 C ASN A-2 1 2 . 58.618 26.672 11.298 0.28 40.84 ? OD1 ASN A-2 2 1 
ATOM 1784 O OD1 D ASN A-2 1 2 . 58.556 26.687 11.343 0.11 40.32 ? OD1 ASN A-2 2 1 
ATOM 1785 N ND2 A ASN A-2 1 2 . 57.867 27.525 13.067 0.36 59.17 ? ND2 ASN A-2 2 1 
ATOM 1786 N ND2 B ASN A-2 1 2 . 58.102 27.934 13.234 0.25 59.12 ? ND2 ASN A-2 2 1 
ATOM 1787 N ND2 C ASN A-2 1 2 . 59.338 28.407 12.509 0.28 59.36 ? ND2 ASN A-2 2 1 
ATOM 1788 N ND2 D ASN A-2 1 2 . 59.357 28.447 12.473 0.11 59.28 ? ND2 ASN A-2 2 1 
ATOM 1789 N N A PRO A-2 1 3 . 55.967 23.996 10.619 0.36 21.88 ? N PRO A-2 3 1 
ATOM 1790 N N B PRO A-2 1 3 . 55.991 24.655 10.913 0.25 19.02 ? N PRO A-2 3 1 
ATOM 1791 N N C PRO A-2 1 3 . 56.149 24.91 11.03 0.28 19.35 ? N PRO A-2 3 1 
ATOM 1792 C CA A PRO A-2 1 3 . 56.232 22.777 9.836 0.36 22.47 ? CA PRO A-2 3 1 
ATOM 1793 C CA B PRO A-2 1 3 . 56.292 23.425 10.192 0.25 18.02 ? CA PRO A-2 3 1 
ATOM 1794 C CA C PRO A-2 1 3 . 56.251 23.599 10.388 0.28 19.53 ? CA PRO A-2 3 1 
ATOM 1795 C C A PRO A-2 1 3 . 57.713 22.449 9.778 0.36 20.39 ? C PRO A-2 3 1 
ATOM 1796 C C B PRO A-2 1 3 . 57.649 22.847 10.479 0.25 11.06 ? C PRO A-2 3 1 
ATOM 1797 C C C PRO A-2 1 3 . 57.603 22.926 10.548 0.28 14.57 ? C PRO A-2 3 1 
ATOM 1798 O O A PRO A-2 1 3 . 58.066 21.548 9.091 0.36 22.55 ? O PRO A-2 3 1 
ATOM 1799 O O B PRO A-2 1 3 . 57.783 21.672 10.631 0.25 10.59 ? O PRO A-2 3 1 
ATOM 1800 O O C PRO A-2 1 3 . 57.74 21.71 10.657 0.28 14.5 ? O PRO A-2 3 1 
ATOM 1801 C CB A PRO A-2 1 3 . 55.789 23.175 8.457 0.36 23.61 ? CB PRO A-2 3 1 
ATOM 1802 C CB B PRO A-2 1 3 . 56.149 23.869 8.709 0.25 21.61 ? CB PRO A-2 3 1 
ATOM 1803 C CB C PRO A-2 1 3 . 55.983 23.942 8.894 0.28 22.9 ? CB PRO A-2 3 1 
ATOM 1804 C CG A PRO A-2 1 3 . 55.893 24.698 8.454 0.36 23.1 ? CG PRO A-2 3 1 
ATOM 1805 C CG B PRO A-2 1 3 . 55.437 25.123 8.725 0.25 22.53 ? CG PRO A-2 3 1 
ATOM 1806 C CG C PRO A-2 1 3 . 55.281 25.235 8.902 0.28 23.91 ? CG PRO A-2 3 1 
ATOM 1807 C CD A PRO A-2 1 3 . 55.507 25.142 9.774 0.36 21.97 ? CD PRO A-2 3 1 
ATOM 1808 C CD B PRO A-2 1 3 . 55.654 25.782 10.007 0.25 17.71 ? CD PRO A-2 3 1 
ATOM 1809 C CD C PRO A-2 1 3 . 55.746 25.981 10.08 0.28 20.95 ? CD PRO A-2 3 1 
ATOM 1810 N N A PHE A-2 1 4 . 58.515 23.216 10.513 0.36 17.27 ? N PHE A-2 4 1 
ATOM 1811 N N B PHE A-2 1 4 . 58.66 23.689 10.45 0.25 9.76 ? N PHE A-2 4 1 
ATOM 1812 N N C PHE A-2 1 4 . 58.639 23.737 10.485 0.28 10.24 ? N PHE A-2 4 1 
ATOM 1813 C CA A PHE A-2 1 4 . 59.947 22.934 10.621 0.36 13.99 ? CA PHE A-2 4 1 
ATOM 1814 C CA B PHE A-2 1 4 . 60.021 23.226 10.607 0.25 9.85 ? CA PHE A-2 4 1 
ATOM 1815 C CA C PHE A-2 1 4 . 60.012 23.22 10.609 0.28 10.21 ? CA PHE A-2 4 1 
ATOM 1816 C C A PHE A-2 1 4 . 60.293 22.401 12.032 0.36 12.25 ? C PHE A-2 4 1 
ATOM 1817 C C B PHE A-2 1 4 . 60.222 22.461 11.95 0.25 9.54 ? C PHE A-2 4 1 
ATOM 1818 C C C PHE A-2 1 4 . 60.259 22.469 11.962 0.28 10.14 ? C PHE A-2 4 1 
ATOM 1819 O O A PHE A-2 1 4 . 61.111 21.494 12.201 0.36 18.17 ? O PHE A-2 4 1 
ATOM 1820 O O B PHE A-2 1 4 . 60.843 21.418 11.986 0.25 6.57 ? O PHE A-2 4 1 
ATOM 1821 O O C PHE A-2 1 4 . 60.962 21.441 12.01 0.28 8.76 ? O PHE A-2 4 1 
ATOM 1822 C CB A PHE A-2 1 4 . 60.682 24.224 10.348 0.36 15.15 ? CB PHE A-2 4 1 
ATOM 1823 C CB B PHE A-2 1 4 . 60.878 24.448 10.459 0.25 11.01 ? CB PHE A-2 4 1 
ATOM 1824 C CB C PHE A-2 1 4 . 60.914 24.401 10.377 0.28 11.46 ? CB PHE A-2 4 1 
ATOM 1825 C CG A PHE A-2 1 4 . 62.126 24.219 10.816 0.36 14.46 ? CG PHE A-2 4 1 
ATOM 1826 C CG B PHE A-2 1 4 . 62.317 24.255 10.893 0.25 10.49 ? CG PHE A-2 4 1 
ATOM 1827 C CG C PHE A-2 1 4 . 62.347 24.22 10.881 0.28 11.5 ? CG PHE A-2 4 1 
ATOM 1828 C CD1 A PHE A-2 1 4 . 63.01 23.21 10.425 0.36 15 ? CD1 PHE A-2 4 1 
ATOM 1829 C CD1 B PHE A-2 1 4 . 62.91 25.178 11.773 0.25 13.65 ? CD1 PHE A-2 4 1 
ATOM 1830 C CD1 C PHE A-2 1 4 . 63.093 23.088 10.607 0.28 13.71 ? CD1 PHE A-2 4 1 
ATOM 1831 C CD2 A PHE A-2 1 4 . 62.572 25.221 11.699 0.36 17.16 ? CD2 PHE A-2 4 1 
ATOM 1832 C CD2 B PHE A-2 1 4 . 63.044 23.149 10.527 0.25 8.78 ? CD2 PHE A-2 4 1 
ATOM 1833 C CD2 C PHE A-2 1 4 . 62.917 25.2 11.712 0.28 11.9 ? CD2 PHE A-2 4 1 
ATOM 1834 C CE1 A PHE A-2 1 4 . 64.346 23.216 10.873 0.36 16.5 ? CE1 PHE A-2 4 1 
ATOM 1835 C CE1 B PHE A-2 1 4 . 64.221 25.04 12.199 0.25 13.74 ? CE1 PHE A-2 4 1 
ATOM 1836 C CE1 C PHE A-2 1 4 . 64.406 22.969 11.088 0.28 13.78 ? CE1 PHE A-2 4 1 
ATOM 1837 C CE2 A PHE A-2 1 4 . 63.884 25.238 12.154 0.36 18.34 ? CE2 PHE A-2 4 1 
ATOM 1838 C CE2 B PHE A-2 1 4 . 64.37 22.976 10.974 0.25 9.68 ? CE2 PHE A-2 4 1 
ATOM 1839 C CE2 C PHE A-2 1 4 . 64.202 25.106 12.169 0.28 12.79 ? CE2 PHE A-2 4 1 
ATOM 1840 C CZ A PHE A-2 1 4 . 64.774 24.217 11.739 0.36 16.8 ? CZ PHE A-2 4 1 
ATOM 1841 C CZ B PHE A-2 1 4 . 64.918 23.925 11.823 0.25 11.74 ? CZ PHE A-2 4 1 
ATOM 1842 C CZ C PHE A-2 1 4 . 64.916 23.967 11.88 0.28 12.79 ? CZ PHE A-2 4 1 
ATOM 1843 N N . HIS A-2 1 5 . 59.686 23.023 13.04 0.88 10.61 ? N HIS A-2 5 1 
ATOM 1844 C CA . HIS A-2 1 5 . 59.845 22.46 14.388 0.88 10.48 ? CA HIS A-2 5 1 
ATOM 1845 C C . HIS A-2 1 5 . 58.787 21.437 14.732 0.88 11.8 ? C HIS A-2 5 1 
ATOM 1846 O O . HIS A-2 1 5 . 59.038 20.538 15.526 0.88 14.12 ? O HIS A-2 5 1 
ATOM 1847 C CB . HIS A-2 1 5 . 59.838 23.597 15.436 0.88 11.97 ? CB HIS A-2 5 1 
ATOM 1848 C CG . HIS A-2 1 5 . 61.008 24.508 15.301 0.88 12.95 ? CG HIS A-2 5 1 
ATOM 1849 N ND1 . HIS A-2 1 5 . 62.296 24.056 15.492 0.88 13.88 ? ND1 HIS A-2 5 1 
ATOM 1850 C CD2 . HIS A-2 1 5 . 61.071 25.865 15.075 0.88 13.3 ? CD2 HIS A-2 5 1 
ATOM 1851 C CE1 . HIS A-2 1 5 . 63.098 25.104 15.386 0.88 13.77 ? CE1 HIS A-2 5 1 
ATOM 1852 N NE2 . HIS A-2 1 5 . 62.401 26.218 15.095 0.88 15.05 ? NE2 HIS A-2 5 1 
ATOM 1853 N N A GLU A-2 1 6 . 57.608 21.525 14.188 0.62 11.43 ? N GLU A-2 6 1 
ATOM 1854 N N B GLU A-2 1 6 . 57.593 21.58 14.169 0.38 12.39 ? N GLU A-2 6 1 
ATOM 1855 C CA A GLU A-2 1 6 . 56.58 20.703 14.721 0.62 15.19 ? CA GLU A-2 6 1 
ATOM 1856 C CA B GLU A-2 1 6 . 56.451 20.739 14.515 0.38 15.6 ? CA GLU A-2 6 1 
ATOM 1857 C C A GLU A-2 1 6 . 56.243 19.498 13.897 0.62 13.6 ? C GLU A-2 6 1 
ATOM 1858 C C B GLU A-2 1 6 . 56.429 19.415 13.785 0.38 15.58 ? C GLU A-2 6 1 
ATOM 1859 O O A GLU A-2 1 6 . 55.772 18.666 14.57 0.62 18.14 ? O GLU A-2 6 1 
ATOM 1860 O O B GLU A-2 1 6 . 56.013 18.428 14.366 0.38 18.6 ? O GLU A-2 6 1 
ATOM 1861 C CB A GLU A-2 1 6 . 55.361 21.631 14.998 0.62 18.67 ? CB GLU A-2 6 1 
ATOM 1862 C CB B GLU A-2 1 6 . 55.142 21.548 14.176 0.38 18.73 ? CB GLU A-2 6 1 
ATOM 1863 N N A LEU A-2 1 7 . 56.606 19.402 12.618 0.62 13.54 ? N LEU A-2 7 1 
ATOM 1864 N N B LEU A-2 1 7 . 56.875 19.394 12.558 0.38 16.64 ? N LEU A-2 7 1 
ATOM 1865 C CA A LEU A-2 1 7 . 56.607 18.144 11.884 0.62 13.63 ? CA LEU A-2 7 1 
ATOM 1866 C CA B LEU A-2 1 7 . 56.822 18.153 11.828 0.38 20.47 ? CA LEU A-2 7 1 
ATOM 1867 C C A LEU A-2 1 7 . 57.805 17.271 12.232 0.62 12.89 ? C LEU A-2 7 1 
ATOM 1868 C C B LEU A-2 1 7 . 57.995 17.286 12.297 0.38 15.58 ? C LEU A-2 7 1 
ATOM 1869 O O A LEU A-2 1 7 . 58.841 17.733 12.213 0.62 11.25 ? O LEU A-2 7 1 
ATOM 1870 O O B LEU A-2 1 7 . 58.991 17.839 12.659 0.38 13.67 ? O LEU A-2 7 1 
ATOM 1871 C CB A LEU A-2 1 7 . 56.605 18.398 10.423 0.62 18.62 ? CB LEU A-2 7 1 
ATOM 1872 C CB B LEU A-2 1 7 . 56.958 18.471 10.351 0.38 32.14 ? CB LEU A-2 7 1 
ATOM 1873 C CG A LEU A-2 1 7 . 55.385 18.907 9.723 0.62 39.31 ? CG LEU A-2 7 1 
ATOM 1874 C CG B LEU A-2 1 7 . 55.913 18.046 9.321 0.38 47.02 ? CG LEU A-2 7 1 
ATOM 1875 C CD1 A LEU A-2 1 7 . 55.73 19.31 8.304 0.62 46.43 ? CD1 LEU A-2 7 1 
ATOM 1876 C CD1 B LEU A-2 1 7 . 54.581 17.656 9.954 0.38 52.14 ? CD1 LEU A-2 7 1 
ATOM 1877 C CD2 A LEU A-2 1 7 . 54.318 17.797 9.724 0.62 52.8 ? CD2 LEU A-2 7 1 
ATOM 1878 C CD2 B LEU A-2 1 7 . 55.731 19.129 8.268 0.38 56.97 ? CD2 LEU A-2 7 1 
ATOM 1879 N N A GLU A-2 1 8 . 57.637 15.955 12.38 0.62 13.39 ? N GLU A-2 8 1 
ATOM 1880 N N B GLU A-2 1 8 . 57.845 15.951 12.166 0.38 17.54 ? N GLU A-2 8 1 
ATOM 1881 C CA A GLU A-2 1 8 . 58.794 15.033 12.471 0.62 14.22 ? CA GLU A-2 8 1 
ATOM 1882 C CA B GLU A-2 1 8 . 58.875 14.986 12.589 0.38 17.23 ? CA GLU A-2 8 1 
ATOM 1883 C C A GLU A-2 1 8 . 59.605 14.976 11.155 0.62 8.36 ? C GLU A-2 8 1 
ATOM 1884 C C B GLU A-2 1 8 . 59.533 14.601 11.267 0.38 14.86 ? C GLU A-2 8 1 
ATOM 1885 O O A GLU A-2 1 8 . 59.079 15.33 10.107 0.62 7.86 ? O GLU A-2 8 1 
ATOM 1886 O O B GLU A-2 1 8 . 58.835 14.48 10.36 0.38 20.08 ? O GLU A-2 8 1 
ATOM 1887 C CB A GLU A-2 1 8 . 58.331 13.62 12.839 0.62 18.66 ? CB GLU A-2 8 1 
ATOM 1888 C CB B GLU A-2 1 8 . 58.231 13.755 13.253 0.38 22.1 ? CB GLU A-2 8 1 
ATOM 1889 C CG A GLU A-2 1 8 . 57.741 13.488 14.231 0.62 22.7 ? CG GLU A-2 8 1 
ATOM 1890 C CG B GLU A-2 1 8 . 57.305 12.954 12.394 0.38 26.07 ? CG GLU A-2 8 1 
ATOM 1891 C CD A GLU A-2 1 8 . 58.68 13.989 15.306 0.62 24.7 ? CD GLU A-2 8 1 
ATOM 1892 C CD B GLU A-2 1 8 . 57.252 11.492 12.836 0.38 28.27 ? CD GLU A-2 8 1 
ATOM 1893 O OE1 A GLU A-2 1 8 . 58.255 14.849 16.105 0.62 25.67 ? OE1 GLU A-2 8 1 
ATOM 1894 O OE1 B GLU A-2 1 8 . 57.994 11.112 13.782 0.38 29.43 ? OE1 GLU A-2 8 1 
ATOM 1895 O OE2 A GLU A-2 1 8 . 59.837 13.525 15.353 0.62 26.17 ? OE2 GLU A-2 8 1 
ATOM 1896 O OE2 B GLU A-2 1 8 . 56.452 10.694 12.285 0.38 29.5 ? OE2 GLU A-2 8 1 
ATOM 1897 N N . PRO A-2 1 9 . 60.84 14.452 11.19 1 10.23 ? N PRO A-2 9 1 
ATOM 1898 C CA . PRO A-2 1 9 . 61.552 14.344 9.883 1 9.19 ? CA PRO A-2 9 1 
ATOM 1899 C C . PRO A-2 1 9 . 60.843 13.442 8.919 1 8.97 ? C PRO A-2 9 1 
ATOM 1900 O O . PRO A-2 1 9 . 61.05 13.611 7.694 1 9.65 ? O PRO A-2 9 1 
ATOM 1901 C CB . PRO A-2 1 9 . 62.942 13.905 10.287 1 10.04 ? CB PRO A-2 9 1 
ATOM 1902 C CG . PRO A-2 1 9 . 63.135 14.339 11.693 1 11.28 ? CG PRO A-2 9 1 
ATOM 1903 C CD . PRO A-2 1 9 . 61.744 14.159 12.311 1 12.21 ? CD PRO A-2 9 1 
ATOM 1904 N N . GLY A-2 1 10 . 60.104 12.439 9.349 1 8.68 ? N GLY A-2 10 1 
ATOM 1905 C CA . GLY A-2 1 10 . 59.512 11.542 8.425 1 9.71 ? CA GLY A-2 10 1 
ATOM 1906 C C . GLY A-2 1 10 . 58.717 10.473 9.178 1 9.57 ? C GLY A-2 10 1 
ATOM 1907 O O . GLY A-2 1 10 . 58.859 10.286 10.388 1 11.97 ? O GLY A-2 10 1 
ATOM 1908 N N . PRO A-2 1 11 . 57.931 9.686 8.438 1 10.16 ? N PRO A-2 11 1 
ATOM 1909 C CA . PRO A-2 1 11 . 57.18 8.584 9.026 1 12.01 ? CA PRO A-2 11 1 
ATOM 1910 C C . PRO A-2 1 11 . 57.977 7.33 9.153 1 11.05 ? C PRO A-2 11 1 
ATOM 1911 O O . PRO A-2 1 11 . 57.589 6.441 9.956 1 14.23 ? O PRO A-2 11 1 
ATOM 1912 C CB . PRO A-2 1 11 . 56.001 8.448 8.082 1 12.83 ? CB PRO A-2 11 1 
ATOM 1913 C CG . PRO A-2 1 11 . 56.604 8.783 6.753 1 12.81 ? CG PRO A-2 11 1 
ATOM 1914 C CD . PRO A-2 1 11 . 57.507 9.986 7.04 1 11 ? CD PRO A-2 11 1 
ATOM 1915 N N . GLU A-2 1 12 . 59.041 7.158 8.369 1 10.84 ? N GLU A-2 12 1 
ATOM 1916 C CA . GLU A-2 1 12 . 59.867 5.913 8.459 1 11.83 ? CA GLU A-2 12 1 
ATOM 1917 C C . GLU A-2 1 12 . 61.339 6.3 8.144 1 9.88 ? C GLU A-2 12 1 
ATOM 1918 O O . GLU A-2 1 12 . 61.918 5.866 7.162 1 10.77 ? O GLU A-2 12 1 
ATOM 1919 C CB . GLU A-2 1 12 . 59.427 4.859 7.476 1 13.11 ? CB GLU A-2 12 1 
ATOM 1920 C CG . GLU A-2 1 12 . 58.101 4.403 7.491 1 21.98 ? CG GLU A-2 12 1 
ATOM 1921 C CD . GLU A-2 1 12 . 57.806 3.348 6.402 1 25.94 ? CD GLU A-2 12 1 
ATOM 1922 O OE1 . GLU A-2 1 12 . 58.699 2.436 6.085 1 27.73 ? OE1 GLU A-2 12 1 
ATOM 1923 O OE2 . GLU A-2 1 12 . 56.739 3.506 5.835 1 31.25 ? OE2 GLU A-2 12 1 
ATOM 1924 N N . VAL A-2 1 13 . 61.894 7.15 8.994 1 9.87 ? N VAL A-2 13 1 
ATOM 1925 C CA . VAL A-2 1 13 . 63.201 7.696 8.734 1 9.74 ? CA VAL A-2 13 1 
ATOM 1926 C C . VAL A-2 1 13 . 64.223 6.611 8.733 1 9.69 ? C VAL A-2 13 1 
ATOM 1927 O O . VAL A-2 1 13 . 64.214 5.756 9.645 1 10.53 ? O VAL A-2 13 1 
ATOM 1928 C CB . VAL A-2 1 13 . 63.503 8.74 9.814 1 11.11 ? CB VAL A-2 13 1 
ATOM 1929 C CG1 . VAL A-2 1 13 . 64.969 9.175 9.824 1 13.51 ? CG1 VAL A-2 13 1 
ATOM 1930 C CG2 . VAL A-2 1 13 . 62.586 9.998 9.694 1 13.73 ? CG2 VAL A-2 13 1 
ATOM 1931 N N . PRO A-2 1 14 . 65.201 6.621 7.814 1 9.3 ? N PRO A-2 14 1 
ATOM 1932 C CA . PRO A-2 1 14 . 65.441 7.56 6.724 1 9.51 ? CA PRO A-2 14 1 
ATOM 1933 C C . PRO A-2 1 14 . 64.89 7.064 5.383 1 9.02 ? C PRO A-2 14 1 
ATOM 1934 O O . PRO A-2 1 14 . 65.132 7.746 4.373 1 10.43 ? O PRO A-2 14 1 
ATOM 1935 C CB . PRO A-2 1 14 . 66.949 7.676 6.704 1 9.81 ? CB PRO A-2 14 1 
ATOM 1936 C CG . PRO A-2 1 14 . 67.395 6.25 6.983 1 10.63 ? CG PRO A-2 14 1 
ATOM 1937 C CD . PRO A-2 1 14 . 66.379 5.748 8.048 1 9.98 ? CD PRO A-2 14 1 
ATOM 1938 N N . GLU A-2 1 15 . 64.214 5.913 5.358 1 9.93 ? N GLU A-2 15 1 
ATOM 1939 C CA . GLU A-2 1 15 . 63.69 5.407 4.073 1 12.14 ? CA GLU A-2 15 1 
ATOM 1940 C C . GLU A-2 1 15 . 62.539 6.188 3.519 1 10.18 ? C GLU A-2 15 1 
ATOM 1941 O O . GLU A-2 1 15 . 62.386 6.229 2.271 1 10.58 ? O GLU A-2 15 1 
ATOM 1942 C CB . GLU A-2 1 15 . 63.252 3.937 4.214 1 14.92 ? CB GLU A-2 15 1 
ATOM 1943 C CG . GLU A-2 1 15 . 64.44 2.964 4.514 1 19.13 ? CG GLU A-2 15 1 
ATOM 1944 C CD . GLU A-2 1 15 . 64.688 2.937 5.926 1 16.96 ? CD GLU A-2 15 1 
ATOM 1945 O OE1 . GLU A-2 1 15 . 65.802 2.616 6.21 1 21.22 ? OE1 GLU A-2 15 1 
ATOM 1946 O OE2 . GLU A-2 1 15 . 63.785 3.253 6.666 1 20.35 ? OE2 GLU A-2 15 1 
ATOM 1947 N N . VAL A-2 1 16 . 61.716 6.803 4.362 1 9.52 ? N VAL A-2 16 1 
ATOM 1948 C CA . VAL A-2 1 16 . 60.623 7.682 3.96 1 9.2 ? CA VAL A-2 16 1 
ATOM 1949 C C . VAL A-2 1 16 . 60.702 8.886 4.847 1 8.11 ? C VAL A-2 16 1 
ATOM 1950 O O . VAL A-2 1 16 . 60.655 8.736 6.092 1 10.13 ? O VAL A-2 16 1 
ATOM 1951 C CB . VAL A-2 1 16 . 59.246 7.046 4.037 1 11.17 ? CB VAL A-2 16 1 
ATOM 1952 C CG1 . VAL A-2 1 16 . 58.227 8.029 3.545 1 12.09 ? CG1 VAL A-2 16 1 
ATOM 1953 C CG2 . VAL A-2 1 16 . 59.194 5.718 3.221 1 13.96 ? CG2 VAL A-2 16 1 
ATOM 1954 N N . VAL A-2 1 17 . 60.83 10.039 4.273 1 6.81 ? N VAL A-2 17 1 
ATOM 1955 C CA . VAL A-2 1 17 . 60.888 11.291 4.975 1 6.7 ? CA VAL A-2 17 1 
ATOM 1956 C C . VAL A-2 1 17 . 59.726 12.17 4.558 1 6.82 ? C VAL A-2 17 1 
ATOM 1957 O O . VAL A-2 1 17 . 59.101 11.969 3.505 1 7.92 ? O VAL A-2 17 1 
ATOM 1958 C CB . VAL A-2 1 17 . 62.227 12.016 4.759 1 7.7 ? CB VAL A-2 17 1 
ATOM 1959 C CG1 . VAL A-2 1 17 . 63.372 11.162 5.346 1 9.56 ? CG1 VAL A-2 17 1 
ATOM 1960 C CG2 . VAL A-2 1 17 . 62.469 12.44 3.351 1 8.28 ? CG2 VAL A-2 17 1 
ATOM 1961 N N . TYR A-2 1 18 . 59.471 13.22 5.334 1 7.2 ? N TYR A-2 18 1 
ATOM 1962 C CA . TYR A-2 1 18 . 58.633 14.337 4.884 1 7.62 ? CA TYR A-2 18 1 
ATOM 1963 C C . TYR A-2 1 18 . 59.482 15.372 4.196 1 7.56 ? C TYR A-2 18 1 
ATOM 1964 O O . TYR A-2 1 18 . 60.536 15.818 4.723 1 9.26 ? O TYR A-2 18 1 
ATOM 1965 C CB . TYR A-2 1 18 . 57.887 14.984 6.035 1 8.7 ? CB TYR A-2 18 1 
ATOM 1966 C CG . TYR A-2 1 18 . 56.901 14.134 6.668 1 9.74 ? CG TYR A-2 18 1 
ATOM 1967 C CD1 . TYR A-2 1 18 . 56.916 13.939 8.063 1 12.56 ? CD1 TYR A-2 18 1 
ATOM 1968 C CD2 . TYR A-2 1 18 . 55.943 13.439 5.993 1 10.23 ? CD2 TYR A-2 18 1 
ATOM 1969 C CE1 . TYR A-2 1 18 . 56.016 13.044 8.733 1 15.07 ? CE1 TYR A-2 18 1 
ATOM 1970 C CE2 . TYR A-2 1 18 . 54.96 12.684 6.623 1 13.52 ? CE2 TYR A-2 18 1 
ATOM 1971 C CZ . TYR A-2 1 18 . 55.006 12.472 7.97 1 14.9 ? CZ TYR A-2 18 1 
ATOM 1972 O OH . TYR A-2 1 18 . 54.132 11.639 8.601 1 19.53 ? OH TYR A-2 18 1 
ATOM 1973 N N . ALA A-2 1 19 . 59.046 15.782 3.046 1 6.71 ? N ALA A-2 19 1 
ATOM 1974 C CA . ALA A-2 1 19 . 59.564 16.97 2.385 1 6.98 ? CA ALA A-2 19 1 
ATOM 1975 C C . ALA A-2 1 19 . 58.543 18.072 2.555 1 6.79 ? C ALA A-2 19 1 
ATOM 1976 O O . ALA A-2 1 19 . 57.384 17.912 2.14 1 9.69 ? O ALA A-2 19 1 
ATOM 1977 C CB . ALA A-2 1 19 . 59.815 16.712 0.936 1 7.22 ? CB ALA A-2 19 1 
ATOM 1978 N N . LEU A-2 1 20 . 58.936 19.175 3.113 1 5.56 ? N LEU A-2 20 1 
ATOM 1979 C CA . LEU A-2 1 20 . 58.107 20.399 3.19 1 5.58 ? CA LEU A-2 20 1 
ATOM 1980 C C . LEU A-2 1 20 . 58.586 21.26 2.038 1 5.22 ? C LEU A-2 20 1 
ATOM 1981 O O . LEU A-2 1 20 . 59.711 21.802 2.073 1 5.58 ? O LEU A-2 20 1 
ATOM 1982 C CB . LEU A-2 1 20 . 58.262 21.045 4.521 1 6.33 ? CB LEU A-2 20 1 
ATOM 1983 C CG . LEU A-2 1 20 . 57.39 22.3 4.701 1 8.44 ? CG LEU A-2 20 1 
ATOM 1984 C CD1 . LEU A-2 1 20 . 55.913 21.951 4.728 1 9.53 ? CD1 LEU A-2 20 1 
ATOM 1985 C CD2 . LEU A-2 1 20 . 57.812 23.001 5.98 1 15.85 ? CD2 LEU A-2 20 1 
ATOM 1986 N N . ILE A-2 1 21 . 57.774 21.38 0.994 1 5.48 ? N ILE A-2 21 1 
ATOM 1987 C CA . ILE A-2 1 21 . 58.187 22.11 -0.203 1 5.2 ? CA ILE A-2 21 1 
ATOM 1988 C C . ILE A-2 1 21 . 58.105 23.582 0.013 1 5.21 ? C ILE A-2 21 1 
ATOM 1989 O O . ILE A-2 1 21 . 57.118 24.108 0.543 1 7.29 ? O ILE A-2 21 1 
ATOM 1990 C CB . ILE A-2 1 21 . 57.366 21.636 -1.429 1 5.8 ? CB ILE A-2 21 1 
ATOM 1991 C CG1 . ILE A-2 1 21 . 57.577 20.14 -1.657 1 6.59 ? CG1 ILE A-2 21 1 
ATOM 1992 C CG2 . ILE A-2 1 21 . 57.677 22.473 -2.647 1 6.11 ? CG2 ILE A-2 21 1 
ATOM 1993 C CD1 . ILE A-2 1 21 . 59.027 19.679 -1.756 1 7.65 ? CD1 ILE A-2 21 1 
ATOM 1994 N N . GLU A-2 1 22 . 59.15 24.282 -0.391 1 5.02 ? N GLU A-2 22 1 
ATOM 1995 C CA . GLU A-2 1 22 . 59.214 25.753 -0.422 1 5.03 ? CA GLU A-2 22 1 
ATOM 1996 C C . GLU A-2 1 22 . 59.011 26.313 -1.826 1 5.04 ? C GLU A-2 22 1 
ATOM 1997 O O . GLU A-2 1 22 . 58.412 27.366 -1.979 1 5.87 ? O GLU A-2 22 1 
ATOM 1998 C CB . GLU A-2 1 22 . 60.562 26.219 0.156 1 5.37 ? CB GLU A-2 22 1 
ATOM 1999 C CG . GLU A-2 1 22 . 60.751 25.898 1.63 1 5.95 ? CG GLU A-2 22 1 
ATOM 2000 C CD . GLU A-2 1 22 . 62.178 25.972 2.089 1 5.27 ? CD GLU A-2 22 1 
ATOM 2001 O OE1 . GLU A-2 1 22 . 63.067 25.448 1.368 1 5.65 ? OE1 GLU A-2 22 1 
ATOM 2002 O OE2 . GLU A-2 1 22 . 62.42 26.515 3.206 1 6.15 ? OE2 GLU A-2 22 1 
ATOM 2003 N N . ILE A-2 1 23 . 59.584 25.645 -2.821 1 4.85 ? N ILE A-2 23 1 
ATOM 2004 C CA . ILE A-2 1 23 . 59.667 26.151 -4.179 1 4.97 ? CA ILE A-2 23 1 
ATOM 2005 C C . ILE A-2 1 23 . 59.086 25.118 -5.136 1 4.87 ? C ILE A-2 23 1 
ATOM 2006 O O . ILE A-2 1 23 . 59.671 24.048 -5.337 1 5.92 ? O ILE A-2 23 1 
ATOM 2007 C CB . ILE A-2 1 23 . 61.081 26.481 -4.637 1 5.14 ? CB ILE A-2 23 1 
ATOM 2008 C CG1 . ILE A-2 1 23 . 61.833 27.295 -3.594 1 6.35 ? CG1 ILE A-2 23 1 
ATOM 2009 C CG2 . ILE A-2 1 23 . 61.038 27.184 -5.984 1 6.16 ? CG2 ILE A-2 23 1 
ATOM 2010 C CD1 . ILE A-2 1 23 . 63.286 27.583 -3.991 1 6.53 ? CD1 ILE A-2 23 1 
ATOM 2011 N N . PRO A-2 1 24 . 57.972 25.401 -5.792 1 5.11 ? N PRO A-2 24 1 
ATOM 2012 C CA . PRO A-2 1 24 . 57.467 24.482 -6.837 1 5.7 ? CA PRO A-2 24 1 
ATOM 2013 C C . PRO A-2 1 24 . 58.427 24.46 -8.026 1 5.52 ? C PRO A-2 24 1 
ATOM 2014 O O . PRO A-2 1 24 . 58.957 25.487 -8.432 1 5.71 ? O PRO A-2 24 1 
ATOM 2015 C CB . PRO A-2 1 24 . 56.115 25.086 -7.221 1 6.68 ? CB PRO A-2 24 1 
ATOM 2016 C CG . PRO A-2 1 24 . 55.727 25.969 -6.014 1 7.48 ? CG PRO A-2 24 1 
ATOM 2017 C CD . PRO A-2 1 24 . 57.051 26.552 -5.567 1 6.62 ? CD PRO A-2 24 1 
ATOM 2018 N N . LYS A-2 1 25 . 58.576 23.289 -8.647 1 5.89 ? N LYS A-2 25 1 
ATOM 2019 C CA A LYS A-2 1 25 . 59.349 23.234 -9.861 0.44 5.63 ? CA LYS A-2 25 1 
ATOM 2020 C CA B LYS A-2 1 25 . 59.282 23.186 -9.941 0.56 5.33 ? CA LYS A-2 25 1 
ATOM 2021 C C . LYS A-2 1 25 . 58.759 24.263 -10.864 1 5.44 ? C LYS A-2 25 1 
ATOM 2022 O O . LYS A-2 1 25 . 57.55 24.436 -10.983 1 5.97 ? O LYS A-2 25 1 
ATOM 2023 C CB A LYS A-2 1 25 . 59.241 21.812 -10.442 0.44 7.25 ? CB LYS A-2 25 1 
ATOM 2024 C CB B LYS A-2 1 25 . 59.065 21.798 -10.622 0.56 7.17 ? CB LYS A-2 25 1 
ATOM 2025 C CG A LYS A-2 1 25 . 59.943 21.594 -11.793 0.44 8.32 ? CG LYS A-2 25 1 
ATOM 2026 C CG B LYS A-2 1 25 . 59.489 21.692 -12.03 0.56 6.78 ? CG LYS A-2 25 1 
ATOM 2027 C CD A LYS A-2 1 25 . 59.01 21.747 -12.985 0.44 10.38 ? CD LYS A-2 25 1 
ATOM 2028 C CD B LYS A-2 1 25 . 59.24 20.334 -12.562 0.56 7.51 ? CD LYS A-2 25 1 
ATOM 2029 C CE A LYS A-2 1 25 . 59.584 21.257 -14.276 0.44 15.53 ? CE LYS A-2 25 1 
ATOM 2030 C CE B LYS A-2 1 25 . 57.766 19.975 -12.672 0.56 10.42 ? CE LYS A-2 25 1 
ATOM 2031 N NZ A LYS A-2 1 25 . 58.548 21.448 -15.349 0.44 27.79 ? NZ LYS A-2 25 1 
ATOM 2032 N NZ B LYS A-2 1 25 . 57.399 18.706 -13.448 0.56 9.27 ? NZ LYS A-2 25 1 
ATOM 2033 N N . GLY A-2 1 26 . 59.683 24.916 -11.574 1 5.55 ? N GLY A-2 26 1 
ATOM 2034 C CA . GLY A-2 1 26 . 59.327 25.912 -12.552 1 5.49 ? CA GLY A-2 26 1 
ATOM 2035 C C . GLY A-2 1 26 . 59.416 27.339 -12.051 1 5.73 ? C GLY A-2 26 1 
ATOM 2036 O O . GLY A-2 1 26 . 59.264 28.263 -12.829 1 7.67 ? O GLY A-2 26 1 
ATOM 2037 N N . SER A-2 1 27 . 59.683 27.534 -10.762 1 5.42 ? N SER A-2 27 1 
ATOM 2038 C CA A SER A-2 1 27 . 59.771 28.867 -10.16 0.74 5.55 ? CA SER A-2 27 1 
ATOM 2039 C CA B SER A-2 1 27 . 59.764 28.858 -10.226 0.26 4.82 ? CA SER A-2 27 1 
ATOM 2040 C C . SER A-2 1 27 . 61.189 29.445 -10.332 1 4.77 ? C SER A-2 27 1 
ATOM 2041 O O . SER A-2 1 27 . 62.161 28.735 -10.146 1 5.65 ? O SER A-2 27 1 
ATOM 2042 C CB A SER A-2 1 27 . 59.542 28.788 -8.658 0.74 6.56 ? CB SER A-2 27 1 
ATOM 2043 C CB B SER A-2 1 27 . 59.313 28.817 -8.744 0.26 5.87 ? CB SER A-2 27 1 
ATOM 2044 O OG A SER A-2 1 27 . 58.263 28.135 -8.408 0.74 6.87 ? OG SER A-2 27 1 
ATOM 2045 O OG B SER A-2 1 27 . 59.536 30.03 -8.1 0.26 7.98 ? OG SER A-2 27 1 
ATOM 2046 N N . ARG A-2 1 28 . 61.238 30.735 -10.574 1 5.09 ? N ARG A-2 28 1 
ATOM 2047 C CA . ARG A-2 1 28 . 62.439 31.541 -10.48 1 5.37 ? CA ARG A-2 28 1 
ATOM 2048 C C . ARG A-2 1 28 . 62.573 32.25 -9.142 1 5.59 ? C ARG A-2 28 1 
ATOM 2049 O O . ARG A-2 1 28 . 63.662 32.709 -8.755 1 6.91 ? O ARG A-2 28 1 
ATOM 2050 C CB . ARG A-2 1 28 . 62.477 32.53 -11.627 1 6.42 ? CB ARG A-2 28 1 
ATOM 2051 C CG . ARG A-2 1 28 . 63.692 33.441 -11.652 1 6.95 ? CG ARG A-2 28 1 
ATOM 2052 C CD . ARG A-2 1 28 . 63.658 34.375 -12.821 1 7.78 ? CD ARG A-2 28 1 
ATOM 2053 N NE . ARG A-2 1 28 . 64.747 35.335 -12.737 1 6.37 ? NE ARG A-2 28 1 
ATOM 2054 C CZ . ARG A-2 1 28 . 65.141 36.087 -13.741 1 5.64 ? CZ ARG A-2 28 1 
ATOM 2055 N NH1 . ARG A-2 1 28 . 64.39 36.193 -14.836 1 7.13 ? NH1 ARG A-2 28 1 
ATOM 2056 N NH2 . ARG A-2 1 28 . 66.292 36.734 -13.659 1 5.92 ? NH2 ARG A-2 28 1 
ATOM 2057 N N . ASN A-2 1 29 . 61.487 32.393 -8.402 1 5.68 ? N ASN A-2 29 1 
ATOM 2058 C CA . ASN A-2 1 29 . 61.516 32.967 -7.055 1 6.22 ? CA ASN A-2 29 1 
ATOM 2059 C C . ASN A-2 1 29 . 62.039 31.916 -6.065 1 5.91 ? C ASN A-2 29 1 
ATOM 2060 O O . ASN A-2 1 29 . 61.524 30.818 -5.983 1 7.08 ? O ASN A-2 29 1 
ATOM 2061 C CB . ASN A-2 1 29 . 60.148 33.435 -6.641 1 5.89 ? CB ASN A-2 29 1 
ATOM 2062 C CG . ASN A-2 1 29 . 59.651 34.647 -7.402 1 6.16 ? CG ASN A-2 29 1 
ATOM 2063 O OD1 . ASN A-2 1 29 . 60.441 35.387 -8.018 1 7.04 ? OD1 ASN A-2 29 1 
ATOM 2064 N ND2 . ASN A-2 1 29 . 58.374 34.898 -7.288 1 6.83 ? ND2 ASN A-2 29 1 
ATOM 2065 N N A LYS A-2 1 30 . 63.076 32.309 -5.321 0.73 5.89 ? N LYS A-2 30 1 
ATOM 2066 N N B LYS A-2 1 30 . 63.119 32.283 -5.38 0.27 5.78 ? N LYS A-2 30 1 
ATOM 2067 C CA A LYS A-2 1 30 . 63.662 31.446 -4.298 0.73 5.88 ? CA LYS A-2 30 1 
ATOM 2068 C CA B LYS A-2 1 30 . 63.671 31.462 -4.306 0.27 5.82 ? CA LYS A-2 30 1 
ATOM 2069 C C A LYS A-2 1 30 . 62.992 31.696 -2.952 0.73 5.33 ? C LYS A-2 30 1 
ATOM 2070 C C B LYS A-2 1 30 . 62.968 31.736 -2.978 0.27 5.44 ? C LYS A-2 30 1 
ATOM 2071 O O A LYS A-2 1 30 . 63.358 32.609 -2.217 0.73 8.13 ? O LYS A-2 30 1 
ATOM 2072 O O B LYS A-2 1 30 . 63.482 32.479 -2.141 0.27 8.04 ? O LYS A-2 30 1 
ATOM 2073 C CB A LYS A-2 1 30 . 65.178 31.664 -4.205 0.73 7.06 ? CB LYS A-2 30 1 
ATOM 2074 C CB B LYS A-2 1 30 . 65.174 31.714 -4.158 0.27 7.08 ? CB LYS A-2 30 1 
ATOM 2075 C CG A LYS A-2 1 30 . 65.806 31.386 -2.828 0.73 10.97 ? CG LYS A-2 30 1 
ATOM 2076 C CG B LYS A-2 1 30 . 65.998 30.457 -3.945 0.27 9.72 ? CG LYS A-2 30 1 
ATOM 2077 C CD A LYS A-2 1 30 . 65.742 29.913 -2.449 0.73 5.69 ? CD LYS A-2 30 1 
ATOM 2078 C CD B LYS A-2 1 30 . 65.767 29.858 -2.57 0.27 8.17 ? CD LYS A-2 30 1 
ATOM 2079 C CE A LYS A-2 1 30 . 66.894 29.497 -1.532 0.73 10.85 ? CE LYS A-2 30 1 
ATOM 2080 C CE B LYS A-2 1 30 . 66.726 28.706 -2.314 0.27 9.73 ? CE LYS A-2 30 1 
ATOM 2081 N NZ A LYS A-2 1 30 . 66.724 28.122 -0.983 0.73 7.38 ? NZ LYS A-2 30 1 
ATOM 2082 N NZ B LYS A-2 1 30 . 66.548 28.113 -0.96 0.27 7.75 ? NZ LYS A-2 30 1 
ATOM 2083 N N . TYR A-2 1 31 . 61.908 30.977 -2.712 1 5.95 ? N TYR A-2 31 1 
ATOM 2084 C CA . TYR A-2 1 31 . 61.193 31.035 -1.435 1 6.3 ? CA TYR A-2 31 1 
ATOM 2085 C C . TYR A-2 1 31 . 61.913 30.197 -0.401 1 6.04 ? C TYR A-2 31 1 
ATOM 2086 O O . TYR A-2 1 31 . 62.465 29.162 -0.736 1 6.73 ? O TYR A-2 31 1 
ATOM 2087 C CB . TYR A-2 1 31 . 59.804 30.472 -1.601 1 6.66 ? CB TYR A-2 31 1 
ATOM 2088 C CG . TYR A-2 1 31 . 58.982 31.106 -2.698 1 6.12 ? CG TYR A-2 31 1 
ATOM 2089 C CD1 . TYR A-2 1 31 . 58.598 30.396 -3.818 1 6.39 ? CD1 TYR A-2 31 1 
ATOM 2090 C CD2 . TYR A-2 1 31 . 58.548 32.426 -2.596 1 7.17 ? CD2 TYR A-2 31 1 
ATOM 2091 C CE1 . TYR A-2 1 31 . 57.862 30.945 -4.825 1 6.75 ? CE1 TYR A-2 31 1 
ATOM 2092 C CE2 . TYR A-2 1 31 . 57.797 32.991 -3.6 1 7.68 ? CE2 TYR A-2 31 1 
ATOM 2093 C CZ . TYR A-2 1 31 . 57.462 32.24 -4.714 1 7.11 ? CZ TYR A-2 31 1 
ATOM 2094 O OH . TYR A-2 1 31 . 56.729 32.867 -5.704 1 8.29 ? OH TYR A-2 31 1 
ATOM 2095 N N . GLU A-2 1 32 . 61.832 30.621 0.852 1 6.11 ? N GLU A-2 32 1 
ATOM 2096 C CA . GLU A-2 1 32 . 62.304 29.846 1.977 1 6.34 ? CA GLU A-2 32 1 
ATOM 2097 C C . GLU A-2 1 32 . 61.298 29.985 3.104 1 7 ? C GLU A-2 32 1 
ATOM 2098 O O . GLU A-2 1 32 . 60.681 31.012 3.279 1 8.98 ? O GLU A-2 32 1 
ATOM 2099 C CB . GLU A-2 1 32 . 63.66 30.305 2.504 1 7.23 ? CB GLU A-2 32 1 
ATOM 2100 C CG . GLU A-2 1 32 . 64.799 30.051 1.507 1 7.38 ? CG GLU A-2 32 1 
ATOM 2101 C CD . GLU A-2 1 32 . 66.175 30.418 2.018 1 7.62 ? CD GLU A-2 32 1 
ATOM 2102 O OE1 . GLU A-2 1 32 . 67.154 29.793 1.535 1 9.9 ? OE1 GLU A-2 32 1 
ATOM 2103 O OE2 . GLU A-2 1 32 . 66.313 31.319 2.886 1 9.21 ? OE2 GLU A-2 32 1 
ATOM 2104 N N A LEU A-2 1 33 . 61.285 28.941 3.945 0.13 8.75 ? N LEU A-2 33 1 
ATOM 2105 N N B LEU A-2 1 33 . 61.174 28.934 3.922 0.87 7.07 ? N LEU A-2 33 1 
ATOM 2106 C CA A LEU A-2 1 33 . 60.559 28.95 5.216 0.13 13.4 ? CA LEU A-2 33 1 
ATOM 2107 C CA B LEU A-2 1 33 . 60.422 29.07 5.155 0.87 8.33 ? CA LEU A-2 33 1 
ATOM 2108 C C A LEU A-2 1 33 . 61.28 29.787 6.275 0.13 13.71 ? C LEU A-2 33 1 
ATOM 2109 C C B LEU A-2 1 33 . 61.132 30.067 6.041 0.87 11.32 ? C LEU A-2 33 1 
ATOM 2110 O O A LEU A-2 1 33 . 62.282 29.377 6.861 0.13 11.04 ? O LEU A-2 33 1 
ATOM 2111 O O B LEU A-2 1 33 . 62.379 30.085 6.215 0.87 12.93 ? O LEU A-2 33 1 
ATOM 2112 C CB A LEU A-2 1 33 . 60.401 27.502 5.702 0.13 18 ? CB LEU A-2 33 1 
ATOM 2113 C CB B LEU A-2 1 33 . 60.339 27.64 5.819 0.87 9.47 ? CB LEU A-2 33 1 
ATOM 2114 C CG A LEU A-2 1 33 . 59.967 27.197 7.138 0.13 24.71 ? CG LEU A-2 33 1 
ATOM 2115 C CG B LEU A-2 1 33 . 59.493 27.635 7.099 0.87 11.47 ? CG LEU A-2 33 1 
ATOM 2116 C CD1 A LEU A-2 1 33 . 59.658 25.71 7.251 0.13 26.72 ? CD1 LEU A-2 33 1 
ATOM 2117 C CD1 B LEU A-2 1 33 . 57.999 27.707 6.641 0.87 15.16 ? CD1 LEU A-2 33 1 
ATOM 2118 C CD2 A LEU A-2 1 33 . 61.036 27.584 8.155 0.13 29.05 ? CD2 LEU A-2 33 1 
ATOM 2119 C CD2 B LEU A-2 1 33 . 59.518 26.315 7.694 0.87 16.24 ? CD2 LEU A-2 33 1 
ATOM 2120 N N A ASP A-2 1 34 . 60.734 30.961 6.56 0.13 18.46 ? N ASP A-2 34 1 
ATOM 2121 N N B ASP A-2 1 34 . 60.31 30.961 6.622 0.87 13.67 ? N ASP A-2 34 1 
ATOM 2122 C CA A ASP A-2 1 34 . 61.312 31.792 7.609 0.13 23.8 ? CA ASP A-2 34 1 
ATOM 2123 C CA B ASP A-2 1 34 . 60.843 31.887 7.643 0.87 16.96 ? CA ASP A-2 34 1 
ATOM 2124 C C A ASP A-2 1 34 . 61.372 30.987 8.908 0.13 25.77 ? C ASP A-2 34 1 
ATOM 2125 C C B ASP A-2 1 34 . 60.996 31.1 8.943 0.87 21.25 ? C ASP A-2 34 1 
ATOM 2126 O O A ASP A-2 1 34 . 60.416 30.334 9.281 0.13 24.05 ? O ASP A-2 34 1 
ATOM 2127 O O B ASP A-2 1 34 . 60.016 30.759 9.443 0.87 25.41 ? O ASP A-2 34 1 
ATOM 2128 C CB A ASP A-2 1 34 . 60.465 33.049 7.793 0.13 26.59 ? CB ASP A-2 34 1 
ATOM 2129 C CB B ASP A-2 1 34 . 59.86 33.13 7.74 0.87 18.99 ? CB ASP A-2 34 1 
ATOM 2130 C CG A ASP A-2 1 34 . 61.124 34.069 8.697 0.13 25.83 ? CG ASP A-2 34 1 
ATOM 2131 C CG B ASP A-2 1 34 . 60.287 34.133 8.807 0.87 25.66 ? CG ASP A-2 34 1 
ATOM 2132 O OD1 A ASP A-2 1 34 . 61.224 33.81 9.919 0.13 24.87 ? OD1 ASP A-2 34 1 
ATOM 2133 O OD1 B ASP A-2 1 34 . 59.412 34.473 9.621 0.87 27.67 ? OD1 ASP A-2 34 1 
ATOM 2134 O OD2 A ASP A-2 1 34 . 61.535 35.136 8.197 0.13 25.29 ? OD2 ASP A-2 34 1 
ATOM 2135 O OD2 B ASP A-2 1 34 . 61.467 34.497 8.833 0.87 30.06 ? OD2 ASP A-2 34 1 
ATOM 2136 N N A LYS A-2 1 35 . 62.512 31.029 9.591 0.13 31.19 ? N LYS A-2 35 1 
ATOM 2137 N N B LYS A-2 1 35 . 62.213 30.978 9.477 0.87 23.84 ? N LYS A-2 35 1 
ATOM 2138 C CA A LYS A-2 1 35 . 62.659 30.315 10.85 0.13 38.08 ? CA LYS A-2 35 1 
ATOM 2139 C CA B LYS A-2 1 35 . 62.487 30.203 10.661 0.87 32.14 ? CA LYS A-2 35 1 
ATOM 2140 C C A LYS A-2 1 35 . 61.867 31.017 11.958 0.13 35.69 ? C LYS A-2 35 1 
ATOM 2141 C C B LYS A-2 1 35 . 61.732 30.889 11.874 0.87 32.28 ? C LYS A-2 35 1 
ATOM 2142 O O A LYS A-2 1 35 . 61.286 30.368 12.822 0.13 33.54 ? O LYS A-2 35 1 
ATOM 2143 O O B LYS A-2 1 35 . 61.081 30.221 12.613 0.87 32.37 ? O LYS A-2 35 1 
ATOM 2144 C CB A LYS A-2 1 35 . 64.135 30.216 11.235 0.13 48.24 ? CB LYS A-2 35 1 
ATOM 2145 C CB B LYS A-2 1 35 . 63.977 30.166 10.977 0.87 45.29 ? CB LYS A-2 35 1 
ATOM 2146 C CG A LYS A-2 1 35 . 64.795 28.901 10.853 0.13 56.16 ? CG LYS A-2 35 1 
ATOM 2147 C CG B LYS A-2 1 35 . 64.711 28.944 10.462 0.87 54.48 ? CG LYS A-2 35 1 
ATOM 2148 C CD A LYS A-2 1 35 . 66.116 29.114 10.129 0.13 62.07 ? CD LYS A-2 35 1 
ATOM 2149 C CD B LYS A-2 1 35 . 66.171 29.275 10.263 0.87 60.05 ? CD LYS A-2 35 1 
ATOM 2150 C CE A LYS A-2 1 35 . 66.953 30.2 10.777 0.13 67.75 ? CE LYS A-2 35 1 
ATOM 2151 C CE B LYS A-2 1 35 . 66.284 30.28 9.146 0.87 66.06 ? CE LYS A-2 35 1 
ATOM 2152 N NZ A LYS A-2 1 35 . 68.336 30.226 10.229 0.13 72.93 ? NZ LYS A-2 35 1 
ATOM 2153 N NZ B LYS A-2 1 35 . 67.64 30.75 9 0.87 71.33 ? NZ LYS A-2 35 1 
ATOM 2154 N N A ALA A-2 1 36 . 61.841 32.346 11.909 0.13 38.02 ? N ALA A-2 36 1 
ATOM 2155 N N B ALA A-2 1 36 . 61.745 32.223 11.944 0.87 35.81 ? N ALA A-2 36 1 
ATOM 2156 C CA A ALA A-2 1 36 . 61.159 33.155 12.923 0.13 41.53 ? CA ALA A-2 36 1 
ATOM 2157 C CA B ALA A-2 1 36 . 61.134 32.926 13.112 0.87 41.15 ? CA ALA A-2 36 1 
ATOM 2158 C C A ALA A-2 1 36 . 59.712 32.737 13.109 0.13 38.04 ? C ALA A-2 36 1 
ATOM 2159 C C B ALA A-2 1 36 . 59.674 32.679 13.158 0.87 37.73 ? C ALA A-2 36 1 
ATOM 2160 O O A ALA A-2 1 36 . 59.282 32.405 14.211 0.13 36.07 ? O ALA A-2 36 1 
ATOM 2161 O O B ALA A-2 1 36 . 59.122 32.499 14.257 0.87 36.23 ? O ALA A-2 36 1 
ATOM 2162 C CB A ALA A-2 1 36 . 61.226 34.639 12.54 0.13 48.73 ? CB ALA A-2 36 1 
ATOM 2163 C CB B ALA A-2 1 36 . 61.423 34.451 13.036 0.87 48.66 ? CB ALA A-2 36 1 
ATOM 2164 N N . THR A-2 1 37 . 58.973 32.774 12.01 1 39.66 ? N THR A-2 37 1 
ATOM 2165 C CA . THR A-2 1 37 . 57.534 32.622 12.011 1 34.01 ? CA THR A-2 37 1 
ATOM 2166 C C . THR A-2 1 37 . 56.855 31.46 11.435 1 30.32 ? C THR A-2 37 1 
ATOM 2167 O O . THR A-2 1 37 . 55.636 31.379 11.537 1 29.69 ? O THR A-2 37 1 
ATOM 2168 C CB . THR A-2 1 37 . 56.843 33.735 11.23 1 33.29 ? CB THR A-2 37 1 
ATOM 2169 O OG1 . THR A-2 1 37 . 57.018 33.547 9.807 1 28.71 ? OG1 THR A-2 37 1 
ATOM 2170 C CG2 . THR A-2 1 37 . 57.324 35.151 11.711 1 37.3 ? CG2 THR A-2 37 1 
ATOM 2171 N N . GLY A-2 1 38 . 57.479 30.685 10.545 1 27.54 ? N GLY A-2 38 1 
ATOM 2172 C CA . GLY A-2 1 38 . 56.659 29.657 9.902 1 30.59 ? CA GLY A-2 38 1 
ATOM 2173 C C . GLY A-2 1 38 . 56.091 30.007 8.518 1 24.91 ? C GLY A-2 38 1 
ATOM 2174 O O . GLY A-2 1 38 . 55.532 29.164 7.785 1 28.51 ? O GLY A-2 38 1 
ATOM 2175 N N . LEU A-2 1 39 . 56.177 31.286 8.141 1 18.54 ? N LEU A-2 39 1 
ATOM 2176 C CA . LEU A-2 1 39 . 55.552 31.744 6.871 1 15.79 ? CA LEU A-2 39 1 
ATOM 2177 C C . LEU A-2 1 39 . 56.526 31.552 5.716 1 12.44 ? C LEU A-2 39 1 
ATOM 2178 O O . LEU A-2 1 39 . 57.771 31.515 5.945 1 15.33 ? O LEU A-2 39 1 
ATOM 2179 C CB . LEU A-2 1 39 . 55.217 33.173 6.968 1 18.53 ? CB LEU A-2 39 1 
ATOM 2180 C CG . LEU A-2 1 39 . 54.071 33.513 7.949 1 48.12 ? CG LEU A-2 39 1 
ATOM 2181 C CD1 . LEU A-2 1 39 . 54.057 35.028 8.218 1 64.95 ? CD1 LEU A-2 39 1 
ATOM 2182 C CD2 . LEU A-2 1 39 . 52.775 33.041 7.416 1 67.63 ? CD2 LEU A-2 39 1 
ATOM 2183 N N . LEU A-2 1 40 . 56.049 31.485 4.507 1 10.69 ? N LEU A-2 40 1 
ATOM 2184 C CA . LEU A-2 1 40 . 56.909 31.538 3.322 1 8.78 ? CA LEU A-2 40 1 
ATOM 2185 C C . LEU A-2 1 40 . 57.454 32.959 3.151 1 7.17 ? C LEU A-2 40 1 
ATOM 2186 O O . LEU A-2 1 40 . 56.715 33.914 3.255 1 6.72 ? O LEU A-2 40 1 
ATOM 2187 C CB . LEU A-2 1 40 . 56.133 31.101 2.084 1 9.06 ? CB LEU A-2 40 1 
ATOM 2188 C CG . LEU A-2 1 40 . 56.973 30.637 0.901 1 9.95 ? CG LEU A-2 40 1 
ATOM 2189 C CD1 . LEU A-2 1 40 . 57.617 29.256 1.225 1 9.81 ? CD1 LEU A-2 40 1 
ATOM 2190 C CD2 . LEU A-2 1 40 . 56.176 30.61 -0.376 1 10.28 ? CD2 LEU A-2 40 1 
ATOM 2191 N N . LYS A-2 1 41 . 58.726 33.051 2.785 1 7.49 ? N LYS A-2 41 1 
ATOM 2192 C CA . LYS A-2 1 41 . 59.385 34.327 2.543 1 7.14 ? CA LYS A-2 41 1 
ATOM 2193 C C . LYS A-2 1 41 . 60.111 34.247 1.2 1 6.45 ? C LYS A-2 41 1 
ATOM 2194 O O . LYS A-2 1 41 . 60.681 33.211 0.823 1 8.05 ? O LYS A-2 41 1 
ATOM 2195 C CB . LYS A-2 1 41 . 60.32 34.653 3.631 1 9.51 ? CB LYS A-2 41 1 
ATOM 2196 C CG . LYS A-2 1 41 . 61 35.984 3.546 1 15.34 ? CG LYS A-2 41 1 
ATOM 2197 C CD . LYS A-2 1 41 . 61.725 36.277 4.872 1 48.26 ? CD LYS A-2 41 1 
ATOM 2198 C CE . LYS A-2 1 41 . 62.575 37.561 4.79 1 80.95 ? CE LYS A-2 41 1 
ATOM 2199 N NZ . LYS A-2 1 41 . 63.141 37.905 6.119 1 108.74 ? NZ LYS A-2 41 1 
ATOM 2200 N N . LEU A-2 1 42 . 60.13 35.353 0.454 1 6.14 ? N LEU A-2 42 1 
ATOM 2201 C CA . LEU A-2 1 42 . 60.986 35.474 -0.696 1 6.13 ? CA LEU A-2 42 1 
ATOM 2202 C C . LEU A-2 1 42 . 62.408 35.709 -0.218 1 6.32 ? C LEU A-2 42 1 
ATOM 2203 O O . LEU A-2 1 42 . 62.716 36.776 0.319 1 8.31 ? O LEU A-2 42 1 
ATOM 2204 C CB . LEU A-2 1 42 . 60.518 36.638 -1.576 1 6.73 ? CB LEU A-2 42 1 
ATOM 2205 C CG . LEU A-2 1 42 . 61.299 36.821 -2.839 1 7.26 ? CG LEU A-2 42 1 
ATOM 2206 C CD1 . LEU A-2 1 42 . 61.007 35.69 -3.874 1 8.59 ? CD1 LEU A-2 42 1 
ATOM 2207 C CD2 . LEU A-2 1 42 . 61.006 38.188 -3.462 1 8.3 ? CD2 LEU A-2 42 1 
ATOM 2208 N N . ASP A-2 1 43 . 63.29 34.747 -0.396 0.91 5.74 ? N ASP A-2 43 1 
ATOM 2209 C CA . ASP A-2 1 43 . 64.724 34.952 -0.08 0.91 6.25 ? CA ASP A-2 43 1 
ATOM 2210 C C . ASP A-2 1 43 . 65.366 35.816 -1.138 0.91 7.16 ? C ASP A-2 43 1 
ATOM 2211 O O . ASP A-2 1 43 . 65.981 36.859 -0.833 0.91 9.66 ? O ASP A-2 43 1 
ATOM 2212 C CB . ASP A-2 1 43 . 65.435 33.597 -0.021 0.91 8.57 ? CB ASP A-2 43 1 
ATOM 2213 C CG . ASP A-2 1 43 . 66.966 33.688 0.079 0.91 13.17 ? CG ASP A-2 43 1 
ATOM 2214 O OD1 . ASP A-2 1 43 . 67.354 34.493 0.969 0.91 19.08 ? OD1 ASP A-2 43 1 
ATOM 2215 O OD2 . ASP A-2 1 43 . 67.718 32.906 -0.537 0.91 13.49 ? OD2 ASP A-2 43 1 
ATOM 2216 N N A ARG A-2 1 44 . 65.195 35.452 -2.432 0.88 7.5 ? N ARG A-2 44 1 
ATOM 2217 N N B ARG A-2 1 44 . 64.868 35.581 -2.334 0.12 10.17 ? N ARG A-2 44 1 
ATOM 2218 C CA A ARG A-2 1 44 . 65.586 36.412 -3.531 0.88 9.02 ? CA ARG A-2 44 1 
ATOM 2219 C CA B ARG A-2 1 44 . 65.541 35.948 -3.559 0.12 10.27 ? CA ARG A-2 44 1 
ATOM 2220 C C A ARG A-2 1 44 . 64.954 35.815 -4.78 0.88 6.96 ? C ARG A-2 44 1 
ATOM 2221 C C B ARG A-2 1 44 . 64.507 36.286 -4.69 0.12 8.97 ? C ARG A-2 44 1 
ATOM 2222 O O A ARG A-2 1 44 . 64.277 34.816 -4.785 0.88 7.94 ? O ARG A-2 44 1 
ATOM 2223 O O B ARG A-2 1 44 . 63.328 36.444 -4.434 0.12 11 ? O ARG A-2 44 1 
ATOM 2224 C CB A ARG A-2 1 44 . 67.108 36.532 -3.756 0.88 10.81 ? CB ARG A-2 44 1 
ATOM 2225 C CB B ARG A-2 1 44 . 66.236 34.682 -3.932 0.12 12.35 ? CB ARG A-2 44 1 
ATOM 2226 C CG A ARG A-2 1 44 . 67.507 35.061 -4.028 0.88 16.06 ? CG ARG A-2 44 1 
ATOM 2227 C CG B ARG A-2 1 44 . 67.76 34.659 -3.815 0.12 15.56 ? CG ARG A-2 44 1 
ATOM 2228 C CD A ARG A-2 1 44 . 68.889 34.911 -3.813 0.88 19.5 ? CD ARG A-2 44 1 
ATOM 2229 C CD B ARG A-2 1 44 . 68.278 34.721 -2.4 0.12 17.61 ? CD ARG A-2 44 1 
ATOM 2230 N NE A ARG A-2 1 44 . 69.518 33.789 -4.561 0.88 17.14 ? NE ARG A-2 44 1 
ATOM 2231 N NE B ARG A-2 1 44 . 69.225 35.819 -2.249 0.12 17.66 ? NE ARG A-2 44 1 
ATOM 2232 C CZ A ARG A-2 1 44 . 69.691 32.55 -4.122 0.88 12.3 ? CZ ARG A-2 44 1 
ATOM 2233 C CZ B ARG A-2 1 44 . 70.034 35.994 -1.209 0.12 14.5 ? CZ ARG A-2 44 1 
ATOM 2234 N NH1 A ARG A-2 1 44 . 69.065 32.085 -3.067 0.88 14.44 ? NH1 ARG A-2 44 1 
ATOM 2235 N NH1 B ARG A-2 1 44 . 70.032 35.147 -0.193 0.12 14.11 ? NH1 ARG A-2 44 1 
ATOM 2236 N NH2 A ARG A-2 1 44 . 70.36 31.757 -4.98 0.88 13.08 ? NH2 ARG A-2 44 1 
ATOM 2237 N NH2 B ARG A-2 1 44 . 70.855 37.027 -1.204 0.12 14.3 ? NH2 ARG A-2 44 1 
ATOM 2238 N N . VAL A-2 1 45 . 65.04 36.671 -5.834 1 7.95 ? N VAL A-2 45 1 
ATOM 2239 C CA . VAL A-2 1 45 . 64.716 36.281 -7.191 1 6.98 ? CA VAL A-2 45 1 
ATOM 2240 C C . VAL A-2 1 45 . 66.022 35.836 -7.865 1 5.99 ? C VAL A-2 45 1 
ATOM 2241 O O . VAL A-2 1 45 . 67.005 36.547 -7.791 1 6.51 ? O VAL A-2 45 1 
ATOM 2242 C CB . VAL A-2 1 45 . 64.068 37.442 -7.96 1 8.01 ? CB VAL A-2 45 1 
ATOM 2243 C CG1 . VAL A-2 1 45 . 63.761 37.08 -9.391 1 8.04 ? CG1 VAL A-2 45 1 
ATOM 2244 C CG2 . VAL A-2 1 45 . 62.766 37.895 -7.228 1 8.74 ? CG2 VAL A-2 45 1 
ATOM 2245 N N . LEU A-2 1 46 . 66.045 34.663 -8.515 1 5.69 ? N LEU A-2 46 1 
ATOM 2246 C CA . LEU A-2 1 46 . 67.278 34.26 -9.16 1 5.49 ? CA LEU A-2 46 1 
ATOM 2247 C C . LEU A-2 1 46 . 67.702 35.324 -10.156 1 5.41 ? C LEU A-2 46 1 
ATOM 2248 O O . LEU A-2 1 46 . 66.877 35.903 -10.884 1 5.8 ? O LEU A-2 46 1 
ATOM 2249 C CB . LEU A-2 1 46 . 67.183 32.917 -9.845 1 6.35 ? CB LEU A-2 46 1 
ATOM 2250 C CG . LEU A-2 1 46 . 66.826 31.731 -8.963 1 6.78 ? CG LEU A-2 46 1 
ATOM 2251 C CD1 . LEU A-2 1 46 . 66.84 30.447 -9.819 1 7.51 ? CD1 LEU A-2 46 1 
ATOM 2252 C CD2 . LEU A-2 1 46 . 67.778 31.577 -7.79 1 7.52 ? CD2 LEU A-2 46 1 
ATOM 2253 N N A TYR A-2 1 47 . 69 35.481 -10.31 0.58 5.39 ? N TYR A-2 47 1 
ATOM 2254 N N B TYR A-2 1 47 . 68.978 35.667 -10.203 0.42 6.2 ? N TYR A-2 47 1 
ATOM 2255 C CA A TYR A-2 1 47 . 69.533 36.587 -11.04 0.58 5.76 ? CA TYR A-2 47 1 
ATOM 2256 C CA B TYR A-2 1 47 . 69.501 36.74 -11.139 0.42 6.19 ? CA TYR A-2 47 1 
ATOM 2257 C C A TYR A-2 1 47 . 69.618 36.258 -12.502 0.58 5.11 ? C TYR A-2 47 1 
ATOM 2258 C C B TYR A-2 1 47 . 69.374 36.348 -12.636 0.42 5.23 ? C TYR A-2 47 1 
ATOM 2259 O O A TYR A-2 1 47 . 69.893 37.134 -13.32 0.58 5.35 ? O TYR A-2 47 1 
ATOM 2260 O O B TYR A-2 1 47 . 69.465 37.186 -13.512 0.42 5.77 ? O TYR A-2 47 1 
ATOM 2261 C CB A TYR A-2 1 47 . 70.934 37.014 -10.531 0.58 5.3 ? CB TYR A-2 47 1 
ATOM 2262 C CB B TYR A-2 1 47 . 71.017 37.029 -10.875 0.42 6.51 ? CB TYR A-2 47 1 
ATOM 2263 C CG A TYR A-2 1 47 . 70.999 37.796 -9.261 0.58 5.44 ? CG TYR A-2 47 1 
ATOM 2264 C CG B TYR A-2 1 47 . 71.297 37.94 -9.689 0.42 6.61 ? CG TYR A-2 47 1 
ATOM 2265 C CD1 A TYR A-2 1 47 . 72.03 38.7 -9.092 0.58 5.84 ? CD1 TYR A-2 47 1 
ATOM 2266 C CD1 B TYR A-2 1 47 . 72.215 38.911 -9.773 0.42 7.13 ? CD1 TYR A-2 47 1 
ATOM 2267 C CD2 A TYR A-2 1 47 . 70.049 37.648 -8.226 0.58 6.24 ? CD2 TYR A-2 47 1 
ATOM 2268 C CD2 B TYR A-2 1 47 . 70.498 37.917 -8.577 0.42 8.83 ? CD2 TYR A-2 47 1 
ATOM 2269 C CE1 A TYR A-2 1 47 . 72.125 39.455 -7.973 0.58 6.41 ? CE1 TYR A-2 47 1 
ATOM 2270 C CE1 B TYR A-2 1 47 . 72.438 39.832 -8.729 0.42 10.16 ? CE1 TYR A-2 47 1 
ATOM 2271 C CE2 A TYR A-2 1 47 . 70.181 38.384 -7.07 0.58 7.02 ? CE2 TYR A-2 47 1 
ATOM 2272 C CE2 B TYR A-2 1 47 . 70.718 38.842 -7.438 0.42 9.94 ? CE2 TYR A-2 47 1 
ATOM 2273 C CZ A TYR A-2 1 47 . 71.201 39.31 -6.97 0.58 7.68 ? CZ TYR A-2 47 1 
ATOM 2274 C CZ B TYR A-2 1 47 . 71.693 39.781 -7.573 0.42 9.86 ? CZ TYR A-2 47 1 
ATOM 2275 O OH A TYR A-2 1 47 . 71.352 40.101 -5.857 0.58 10.27 ? OH TYR A-2 47 1 
ATOM 2276 O OH B TYR A-2 1 47 . 71.943 40.716 -6.596 0.42 14.03 ? OH TYR A-2 47 1 
ATOM 2277 N N . SER A-2 1 48 . 69.324 35.037 -12.88 1 5.85 ? N SER A-2 48 1 
ATOM 2278 C CA . SER A-2 1 48 . 69.344 34.492 -14.237 1 5.71 ? CA SER A-2 48 1 
ATOM 2279 C C . SER A-2 1 48 . 67.981 33.891 -14.54 1 5.4 ? C SER A-2 48 1 
ATOM 2280 O O . SER A-2 1 48 . 67.264 33.492 -13.611 1 5.44 ? O SER A-2 48 1 
ATOM 2281 C CB . SER A-2 1 48 . 70.423 33.435 -14.328 1 6.22 ? CB SER A-2 48 1 
ATOM 2282 O OG . SER A-2 1 48 . 71.663 34.02 -14.027 1 6.9 ? OG SER A-2 48 1 
ATOM 2283 N N . PRO A-2 1 49 . 67.627 33.726 -15.828 1 5.28 ? N PRO A-2 49 1 
ATOM 2284 C CA . PRO A-2 1 49 . 66.313 33.174 -16.205 1 5.38 ? CA PRO A-2 49 1 
ATOM 2285 C C . PRO A-2 1 49 . 66.355 31.655 -16.187 1 4.94 ? C PRO A-2 49 1 
ATOM 2286 O O . PRO A-2 1 49 . 66.311 30.956 -17.196 1 5.7 ? O PRO A-2 49 1 
ATOM 2287 C CB . PRO A-2 1 49 . 66.099 33.735 -17.603 1 5.93 ? CB PRO A-2 49 1 
ATOM 2288 C CG . PRO A-2 1 49 . 67.489 33.836 -18.157 1 6.3 ? CG PRO A-2 49 1 
ATOM 2289 C CD . PRO A-2 1 49 . 68.358 34.213 -17.003 1 6.46 ? CD PRO A-2 49 1 
ATOM 2290 N N . PHE A-2 1 50 . 66.526 31.145 -14.966 1 5.13 ? N PHE A-2 50 1 
ATOM 2291 C CA . PHE A-2 1 50 . 66.592 29.756 -14.643 1 5.13 ? CA PHE A-2 50 1 
ATOM 2292 C C . PHE A-2 1 50 . 65.427 29.422 -13.717 1 5.39 ? C PHE A-2 50 1 
ATOM 2293 O O . PHE A-2 1 50 . 64.925 30.316 -13.012 0.89 5.68 ? O PHE A-2 50 1 
ATOM 2294 C CB . PHE A-2 1 50 . 67.922 29.404 -13.956 1 5.97 ? CB PHE A-2 50 1 
ATOM 2295 C CG . PHE A-2 1 50 . 69.205 29.797 -14.692 1 5.75 ? CG PHE A-2 50 1 
ATOM 2296 C CD1 . PHE A-2 1 50 . 70.375 29.718 -13.985 1 6.42 ? CD1 PHE A-2 50 1 
ATOM 2297 C CD2 . PHE A-2 1 50 . 69.26 30.162 -16.024 1 5.44 ? CD2 PHE A-2 50 1 
ATOM 2298 C CE1 . PHE A-2 1 50 . 71.587 30.006 -14.604 1 6.95 ? CE1 PHE A-2 50 1 
ATOM 2299 C CE2 . PHE A-2 1 50 . 70.474 30.477 -16.629 0.94 5.48 ? CE2 PHE A-2 50 1 
ATOM 2300 C CZ . PHE A-2 1 50 . 71.657 30.387 -15.898 1 6.74 ? CZ PHE A-2 50 1 
ATOM 2301 N N . PHE A-2 1 51 . 65.009 28.169 -13.708 1 5.53 ? N PHE A-2 51 1 
ATOM 2302 C CA . PHE A-2 1 51 . 63.946 27.752 -12.863 1 5.8 ? CA PHE A-2 51 1 
ATOM 2303 C C . PHE A-2 1 51 . 64.319 26.503 -12.091 1 4.96 ? C PHE A-2 51 1 
ATOM 2304 O O . PHE A-2 1 51 . 65.075 25.669 -12.547 1 5.55 ? O PHE A-2 51 1 
ATOM 2305 C CB . PHE A-2 1 51 . 62.608 27.521 -13.62 1 7.14 ? CB PHE A-2 51 1 
ATOM 2306 C CG . PHE A-2 1 51 . 62.666 26.394 -14.686 1 7.22 ? CG PHE A-2 51 1 
ATOM 2307 C CD1 . PHE A-2 1 51 . 62.444 25.087 -14.315 1 7.41 ? CD1 PHE A-2 51 1 
ATOM 2308 C CD2 . PHE A-2 1 51 . 62.991 26.644 -16.013 1 9.04 ? CD2 PHE A-2 51 1 
ATOM 2309 C CE1 . PHE A-2 1 51 . 62.444 24.055 -15.257 1 8.62 ? CE1 PHE A-2 51 1 
ATOM 2310 C CE2 . PHE A-2 1 51 . 63.009 25.62 -16.947 1 9.33 ? CE2 PHE A-2 51 1 
ATOM 2311 C CZ . PHE A-2 1 51 . 62.729 24.342 -16.554 1 9.81 ? CZ PHE A-2 51 1 
ATOM 2312 N N . TYR A-2 1 52 . 63.764 26.379 -10.882 1 5.42 ? N TYR A-2 52 1 
ATOM 2313 C CA . TYR A-2 1 52 . 64.043 25.19 -10.099 1 5.74 ? CA TYR A-2 52 1 
ATOM 2314 C C . TYR A-2 1 52 . 63.568 23.965 -10.849 1 5.22 ? C TYR A-2 52 1 
ATOM 2315 O O . TYR A-2 1 52 . 62.387 23.891 -11.229 1 5.96 ? O TYR A-2 52 1 
ATOM 2316 C CB . TYR A-2 1 52 . 63.429 25.275 -8.691 1 5.87 ? CB TYR A-2 52 1 
ATOM 2317 C CG . TYR A-2 1 52 . 64.323 26.034 -7.761 1 5.84 ? CG TYR A-2 52 1 
ATOM 2318 C CD1 . TYR A-2 1 52 . 64.381 27.409 -7.759 1 6.03 ? CD1 TYR A-2 52 1 
ATOM 2319 C CD2 . TYR A-2 1 52 . 65.194 25.348 -6.889 1 7.15 ? CD2 TYR A-2 52 1 
ATOM 2320 C CE1 . TYR A-2 1 52 . 65.343 28.087 -6.987 1 7.03 ? CE1 TYR A-2 52 1 
ATOM 2321 C CE2 . TYR A-2 1 52 . 66.118 25.993 -6.122 1 7.62 ? CE2 TYR A-2 52 1 
ATOM 2322 C CZ . TYR A-2 1 52 . 66.194 27.345 -6.188 1 7.93 ? CZ TYR A-2 52 1 
ATOM 2323 O OH . TYR A-2 1 52 . 67.142 28.07 -5.461 1 9.99 ? OH TYR A-2 52 1 
ATOM 2324 N N . PRO A-2 1 53 . 64.416 22.951 -11.016 1 5.53 ? N PRO A-2 53 1 
ATOM 2325 C CA . PRO A-2 1 53 . 64.051 21.803 -11.868 1 5.57 ? CA PRO A-2 53 1 
ATOM 2326 C C . PRO A-2 1 53 . 63.256 20.736 -11.127 1 5.35 ? C PRO A-2 53 1 
ATOM 2327 O O . PRO A-2 1 53 . 62.876 19.721 -11.76 1 6.68 ? O PRO A-2 53 1 
ATOM 2328 C CB . PRO A-2 1 53 . 65.397 21.28 -12.348 1 6.23 ? CB PRO A-2 53 1 
ATOM 2329 C CG . PRO A-2 1 53 . 66.353 21.649 -11.228 1 6.11 ? CG PRO A-2 53 1 
ATOM 2330 C CD . PRO A-2 1 53 . 65.89 23.013 -10.781 1 6.01 ? CD PRO A-2 53 1 
ATOM 2331 N N . VAL A-2 1 54 . 63.087 20.9 -9.844 1 5.39 ? N VAL A-2 54 1 
ATOM 2332 C CA . VAL A-2 1 54 . 62.5 19.985 -8.877 1 5.44 ? CA VAL A-2 54 1 
ATOM 2333 C C . VAL A-2 1 54 . 61.639 20.783 -7.942 1 5.39 ? C VAL A-2 54 1 
ATOM 2334 O O . VAL A-2 1 54 . 61.832 22.002 -7.81 1 6.44 ? O VAL A-2 54 1 
ATOM 2335 C CB . VAL A-2 1 54 . 63.637 19.282 -8.071 1 6.82 ? CB VAL A-2 54 1 
ATOM 2336 C CG1 . VAL A-2 1 54 . 64.405 18.322 -8.975 1 9.09 ? CG1 VAL A-2 54 1 
ATOM 2337 C CG2 . VAL A-2 1 54 . 64.536 20.296 -7.392 1 8.42 ? CG2 VAL A-2 54 1 
ATOM 2338 N N . ASP A-2 1 55 . 60.709 20.136 -7.251 1 5.29 ? N ASP A-2 55 1 
ATOM 2339 C CA A ASP A-2 1 55 . 60.051 20.736 -6.101 0.78 4.96 ? CA ASP A-2 55 1 
ATOM 2340 C CA B ASP A-2 1 55 . 60.069 20.771 -6.142 0.22 6.41 ? CA ASP A-2 55 1 
ATOM 2341 C C . ASP A-2 1 55 . 61.091 20.748 -4.984 1 5.12 ? C ASP A-2 55 1 
ATOM 2342 O O . ASP A-2 1 55 . 61.703 19.704 -4.676 1 8.66 ? O ASP A-2 55 1 
ATOM 2343 C CB A ASP A-2 1 55 . 58.802 19.981 -5.7 0.78 5.2 ? CB ASP A-2 55 1 
ATOM 2344 C CB B ASP A-2 1 55 . 58.761 20.05 -5.881 0.22 9.13 ? CB ASP A-2 55 1 
ATOM 2345 C CG A ASP A-2 1 55 . 57.586 20.268 -6.599 0.78 4.81 ? CG ASP A-2 55 1 
ATOM 2346 C CG B ASP A-2 1 55 . 57.78 20.249 -7.007 0.22 11.3 ? CG ASP A-2 55 1 
ATOM 2347 O OD1 A ASP A-2 1 55 . 57.792 20.659 -7.803 0.78 5.48 ? OD1 ASP A-2 55 1 
ATOM 2348 O OD1 B ASP A-2 1 55 . 57.033 21.219 -6.978 0.22 10.07 ? OD1 ASP A-2 55 1 
ATOM 2349 O OD2 A ASP A-2 1 55 . 56.485 20.018 -6.12 0.78 7 ? OD2 ASP A-2 55 1 
ATOM 2350 O OD2 B ASP A-2 1 55 . 57.791 19.474 -7.968 0.22 12.83 ? OD2 ASP A-2 55 1 
ATOM 2351 N N . TYR A-2 1 56 . 61.34 21.873 -4.398 1 4.78 ? N TYR A-2 56 1 
ATOM 2352 C CA . TYR A-2 1 56 . 62.521 22.106 -3.572 1 4.68 ? CA TYR A-2 56 1 
ATOM 2353 C C . TYR A-2 1 56 . 62.098 22.528 -2.182 1 4.31 ? C TYR A-2 56 1 
ATOM 2354 O O . TYR A-2 1 56 . 61.252 23.42 -2.031 1 4.97 ? O TYR A-2 56 1 
ATOM 2355 C CB . TYR A-2 1 56 . 63.387 23.183 -4.241 1 4.94 ? CB TYR A-2 56 1 
ATOM 2356 C CG . TYR A-2 1 56 . 64.69 23.428 -3.601 1 4.86 ? CG TYR A-2 56 1 
ATOM 2357 C CD1 . TYR A-2 1 56 . 65.84 22.775 -4.015 1 5.72 ? CD1 TYR A-2 56 1 
ATOM 2358 C CD2 . TYR A-2 1 56 . 64.831 24.308 -2.519 1 5.33 ? CD2 TYR A-2 56 1 
ATOM 2359 C CE1 . TYR A-2 1 56 . 67.068 22.978 -3.364 1 6.02 ? CE1 TYR A-2 56 1 
ATOM 2360 C CE2 . TYR A-2 1 56 . 66.032 24.527 -1.88 1 5.41 ? CE2 TYR A-2 56 1 
ATOM 2361 C CZ . TYR A-2 1 56 . 67.162 23.828 -2.302 1 5.07 ? CZ TYR A-2 56 1 
ATOM 2362 O OH . TYR A-2 1 56 . 68.366 23.971 -1.676 1 5.73 ? OH TYR A-2 56 1 
ATOM 2363 N N . GLY A-2 1 57 . 62.684 21.936 -1.144 1 4.69 ? N GLY A-2 57 1 
ATOM 2364 C CA . GLY A-2 1 57 . 62.324 22.361 0.206 1 5.09 ? CA GLY A-2 57 1 
ATOM 2365 C C . GLY A-2 1 57 . 63.241 21.78 1.247 1 4.53 ? C GLY A-2 57 1 
ATOM 2366 O O . GLY A-2 1 57 . 64.461 21.698 1.036 1 4.87 ? O GLY A-2 57 1 
ATOM 2367 N N . ILE A-2 1 58 . 62.66 21.415 2.375 1 4.98 ? N ILE A-2 58 1 
ATOM 2368 C CA . ILE A-2 1 58 . 63.393 20.983 3.566 1 5.03 ? CA ILE A-2 58 1 
ATOM 2369 C C . ILE A-2 1 58 . 62.823 19.706 4.108 1 5.26 ? C ILE A-2 58 1 
ATOM 2370 O O . ILE A-2 1 58 . 61.646 19.358 3.913 1 5.72 ? O ILE A-2 58 1 
ATOM 2371 C CB . ILE A-2 1 58 . 63.373 22.057 4.674 1 5.51 ? CB ILE A-2 58 1 
ATOM 2372 C CG1 . ILE A-2 1 58 . 61.996 22.323 5.245 1 7.51 ? CG1 ILE A-2 58 1 
ATOM 2373 C CG2 . ILE A-2 1 58 . 64.042 23.312 4.162 1 6.69 ? CG2 ILE A-2 58 1 
ATOM 2374 C CD1 . ILE A-2 1 58 . 62.001 23.186 6.479 1 10.43 ? CD1 ILE A-2 58 1 
ATOM 2375 N N . ILE A-2 1 59 . 63.652 19.02 4.897 1 5.62 ? N ILE A-2 59 1 
ATOM 2376 C CA . ILE A-2 1 59 . 63.184 17.963 5.791 1 5.55 ? CA ILE A-2 59 1 
ATOM 2377 C C . ILE A-2 1 59 . 62.958 18.619 7.139 1 5.5 ? C ILE A-2 59 1 
ATOM 2378 O O . ILE A-2 1 59 . 63.862 19.276 7.683 1 6.11 ? O ILE A-2 59 1 
ATOM 2379 C CB . ILE A-2 1 59 . 64.147 16.796 5.865 1 5.91 ? CB ILE A-2 59 1 
ATOM 2380 C CG1 . ILE A-2 1 59 . 64.369 16.189 4.461 1 6.79 ? CG1 ILE A-2 59 1 
ATOM 2381 C CG2 . ILE A-2 1 59 . 63.609 15.758 6.868 1 6.66 ? CG2 ILE A-2 59 1 
ATOM 2382 C CD1 . ILE A-2 1 59 . 65.393 15.099 4.422 1 7.69 ? CD1 ILE A-2 59 1 
ATOM 2383 N N . PRO A-2 1 60 . 61.766 18.502 7.737 1 6.35 ? N PRO A-2 60 1 
ATOM 2384 C CA . PRO A-2 1 60 . 61.557 19.133 9.058 1 7.24 ? CA PRO A-2 60 1 
ATOM 2385 C C . PRO A-2 1 60 . 62.482 18.538 10.113 1 6.6 ? C PRO A-2 60 1 
ATOM 2386 O O . PRO A-2 1 60 . 62.939 17.406 10.015 1 6.97 ? O PRO A-2 60 1 
ATOM 2387 C CB . PRO A-2 1 60 . 60.076 18.799 9.391 1 9.61 ? CB PRO A-2 60 1 
ATOM 2388 C CG . PRO A-2 1 60 . 59.458 18.476 8.033 1 10.49 ? CG PRO A-2 60 1 
ATOM 2389 C CD . PRO A-2 1 60 . 60.552 17.829 7.256 1 7.12 ? CD PRO A-2 60 1 
ATOM 2390 N N . GLN A-2 1 61 . 62.741 19.348 11.157 1 6.87 ? N GLN A-2 61 1 
ATOM 2391 C CA A GLN A-2 1 61 . 63.571 18.884 12.291 0.64 7.58 ? CA GLN A-2 61 1 
ATOM 2392 C CA B GLN A-2 1 61 . 63.502 18.825 12.294 0.36 7.2 ? CA GLN A-2 61 1 
ATOM 2393 C C . GLN A-2 1 61 . 64.891 18.342 11.822 1 7 ? C GLN A-2 61 1 
ATOM 2394 O O . GLN A-2 1 61 . 65.422 17.358 12.323 1 7.54 ? O GLN A-2 61 1 
ATOM 2395 C CB A GLN A-2 1 61 . 62.818 17.951 13.227 0.64 7.99 ? CB GLN A-2 61 1 
ATOM 2396 C CB B GLN A-2 1 61 . 62.72 17.762 13.103 0.36 8.22 ? CB GLN A-2 61 1 
ATOM 2397 C CG A GLN A-2 1 61 . 61.657 18.676 13.931 0.64 9.71 ? CG GLN A-2 61 1 
ATOM 2398 C CG B GLN A-2 1 61 . 61.654 18.421 13.965 0.36 7.81 ? CG GLN A-2 61 1 
ATOM 2399 C CD A GLN A-2 1 61 . 61.077 17.821 15.001 0.64 11.76 ? CD GLN A-2 61 1 
ATOM 2400 C CD B GLN A-2 1 61 . 61.043 17.474 14.946 0.36 10.2 ? CD GLN A-2 61 1 
ATOM 2401 O OE1 A GLN A-2 1 61 . 61.806 17.367 15.9 0.64 14.59 ? OE1 GLN A-2 61 1 
ATOM 2402 O OE1 B GLN A-2 1 61 . 61.576 16.402 15.166 0.36 11 ? OE1 GLN A-2 61 1 
ATOM 2403 N NE2 A GLN A-2 1 61 . 59.809 17.445 14.89 0.64 13.79 ? NE2 GLN A-2 61 1 
ATOM 2404 N NE2 B GLN A-2 1 61 . 59.93 17.831 15.525 0.36 10.17 ? NE2 GLN A-2 61 1 
ATOM 2405 N N . THR A-2 1 62 . 65.493 19.071 10.879 1 6.69 ? N THR A-2 62 1 
ATOM 2406 C CA . THR A-2 1 62 . 66.867 18.869 10.453 1 6.47 ? CA THR A-2 62 1 
ATOM 2407 C C . THR A-2 1 62 . 67.585 20.209 10.517 1 6.75 ? C THR A-2 62 1 
ATOM 2408 O O . THR A-2 1 62 . 66.998 21.279 10.53 1 7.05 ? O THR A-2 62 1 
ATOM 2409 C CB . THR A-2 1 62 . 66.984 18.28 9.04 1 6.69 ? CB THR A-2 62 1 
ATOM 2410 O OG1 . THR A-2 1 62 . 66.54 19.218 8.073 1 6.43 ? OG1 THR A-2 62 1 
ATOM 2411 C CG2 . THR A-2 1 62 . 66.318 16.946 8.932 1 7.11 ? CG2 THR A-2 62 1 
ATOM 2412 N N . TRP A-2 1 63 . 68.932 20.107 10.498 1 7.15 ? N TRP A-2 63 1 
ATOM 2413 C CA . TRP A-2 1 63 . 69.802 21.273 10.41 1 6.75 ? CA TRP A-2 63 1 
ATOM 2414 C C . TRP A-2 1 63 . 70.996 20.894 9.589 1 6.5 ? C TRP A-2 63 1 
ATOM 2415 O O . TRP A-2 1 63 . 71.25 19.726 9.347 1 7.85 ? O TRP A-2 63 1 
ATOM 2416 C CB . TRP A-2 1 63 . 70.168 21.781 11.809 1 8.04 ? CB TRP A-2 63 1 
ATOM 2417 C CG . TRP A-2 1 63 . 70.674 23.171 11.864 1 8.78 ? CG TRP A-2 63 1 
ATOM 2418 C CD1 . TRP A-2 1 63 . 71.946 23.614 12.184 1 10.6 ? CD1 TRP A-2 63 1 
ATOM 2419 C CD2 . TRP A-2 1 63 . 69.899 24.356 11.621 1 9.48 ? CD2 TRP A-2 63 1 
ATOM 2420 N NE1 . TRP A-2 1 63 . 71.987 24.991 12.114 1 11.67 ? NE1 TRP A-2 63 1 
ATOM 2421 C CE2 . TRP A-2 1 63 . 70.745 25.467 11.814 1 10.29 ? CE2 TRP A-2 63 1 
ATOM 2422 C CE3 . TRP A-2 1 63 . 68.571 24.57 11.272 1 10.16 ? CE3 TRP A-2 63 1 
ATOM 2423 C CZ2 . TRP A-2 1 63 . 70.28 26.776 11.704 1 12.8 ? CZ2 TRP A-2 63 1 
ATOM 2424 C CZ3 . TRP A-2 1 63 . 68.114 25.832 11.185 1 11.15 ? CZ3 TRP A-2 63 1 
ATOM 2425 C CH2 . TRP A-2 1 63 . 68.976 26.962 11.418 1 12.69 ? CH2 TRP A-2 63 1 
ATOM 2426 N N . TYR A-2 1 64 . 71.744 21.872 9.141 1 6.79 ? N TYR A-2 64 1 
ATOM 2427 C CA . TYR A-2 1 64 . 72.824 21.586 8.187 1 7.2 ? CA TYR A-2 64 1 
ATOM 2428 C C . TYR A-2 1 64 . 73.874 22.674 8.233 1 6.84 ? C TYR A-2 64 1 
ATOM 2429 O O . TYR A-2 1 64 . 73.708 23.727 8.874 1 7.99 ? O TYR A-2 64 1 
ATOM 2430 C CB . TYR A-2 1 64 . 72.264 21.386 6.766 1 6.65 ? CB TYR A-2 64 1 
ATOM 2431 C CG . TYR A-2 1 64 . 73.087 20.406 5.996 1 6.51 ? CG TYR A-2 64 1 
ATOM 2432 C CD1 . TYR A-2 1 64 . 73.137 19.074 6.371 1 7.3 ? CD1 TYR A-2 64 1 
ATOM 2433 C CD2 . TYR A-2 1 64 . 73.869 20.768 4.893 1 6.84 ? CD2 TYR A-2 64 1 
ATOM 2434 C CE1 . TYR A-2 1 64 . 73.893 18.141 5.692 1 7.15 ? CE1 TYR A-2 64 1 
ATOM 2435 C CE2 . TYR A-2 1 64 . 74.653 19.875 4.257 1 6.98 ? CE2 TYR A-2 64 1 
ATOM 2436 C CZ . TYR A-2 1 64 . 74.628 18.542 4.609 1 7.13 ? CZ TYR A-2 64 1 
ATOM 2437 O OH . TYR A-2 1 64 . 75.375 17.646 3.88 1 7.61 ? OH TYR A-2 64 1 
ATOM 2438 N N . ASP A-2 1 65 . 74.962 22.434 7.523 1 7.16 ? N ASP A-2 65 1 
ATOM 2439 C CA . ASP A-2 1 65 . 76.175 23.249 7.627 1 7.38 ? CA ASP A-2 65 1 
ATOM 2440 C C . ASP A-2 1 65 . 75.999 24.665 7.148 1 7.67 ? C ASP A-2 65 1 
ATOM 2441 O O . ASP A-2 1 65 . 76.807 25.518 7.509 1 9.41 ? O ASP A-2 65 1 
ATOM 2442 C CB . ASP A-2 1 65 . 77.309 22.625 6.815 1 8.1 ? CB ASP A-2 65 1 
ATOM 2443 C CG . ASP A-2 1 65 . 77.642 21.217 7.276 1 9.92 ? CG ASP A-2 65 1 
ATOM 2444 O OD1 . ASP A-2 1 65 . 76.798 20.336 7.234 1 11.41 ? OD1 ASP A-2 65 1 
ATOM 2445 O OD2 . ASP A-2 1 65 . 78.78 20.99 7.657 1 18.8 ? OD2 ASP A-2 65 1 
ATOM 2446 N N . ASP A-2 1 66 . 75.004 24.93 6.291 1 7.9 ? N ASP A-2 66 1 
ATOM 2447 C CA . ASP A-2 1 66 . 74.724 26.281 5.833 1 7.53 ? CA ASP A-2 66 1 
ATOM 2448 C C . ASP A-2 1 66 . 73.799 27.028 6.758 1 8.33 ? C ASP A-2 66 1 
ATOM 2449 O O . ASP A-2 1 66 . 73.339 28.132 6.408 1 9.85 ? O ASP A-2 66 1 
ATOM 2450 C CB . ASP A-2 1 66 . 74.212 26.287 4.4 1 7.95 ? CB ASP A-2 66 1 
ATOM 2451 C CG . ASP A-2 1 66 . 72.864 25.592 4.221 1 6.05 ? CG ASP A-2 66 1 
ATOM 2452 O OD1 . ASP A-2 1 66 . 72.478 24.81 5.101 1 7.24 ? OD1 ASP A-2 66 1 
ATOM 2453 O OD2 . ASP A-2 1 66 . 72.246 25.837 3.139 1 5.76 ? OD2 ASP A-2 66 1 
ATOM 2454 N N . GLY A-2 1 67 . 73.574 26.529 7.963 1 8.42 ? N GLY A-2 67 1 
ATOM 2455 C CA . GLY A-2 1 67 . 72.797 27.304 8.91 1 9.79 ? CA GLY A-2 67 1 
ATOM 2456 C C . GLY A-2 1 67 . 71.326 27.358 8.596 1 8.76 ? C GLY A-2 67 1 
ATOM 2457 O O . GLY A-2 1 67 . 70.679 28.407 8.753 1 10.3 ? O GLY A-2 67 1 
ATOM 2458 N N . ASP A-2 1 68 . 70.781 26.244 8.126 1 7.79 ? N ASP A-2 68 1 
ATOM 2459 C CA . ASP A-2 1 68 . 69.375 26.15 7.772 1 7.88 ? CA ASP A-2 68 1 
ATOM 2460 C C . ASP A-2 1 68 . 69.04 24.656 7.71 1 6.69 ? C ASP A-2 68 1 
ATOM 2461 O O . ASP A-2 1 68 . 69.925 23.805 7.762 1 7.12 ? O ASP A-2 68 1 
ATOM 2462 C CB . ASP A-2 1 68 . 69.063 26.915 6.468 1 8.23 ? CB ASP A-2 68 1 
ATOM 2463 C CG . ASP A-2 1 68 . 68.375 28.253 6.727 1 9.4 ? CG ASP A-2 68 1 
ATOM 2464 O OD1 . ASP A-2 1 68 . 67.545 28.379 7.644 1 10.77 ? OD1 ASP A-2 68 1 
ATOM 2465 O OD2 . ASP A-2 1 68 . 68.678 29.187 5.923 1 11.24 ? OD2 ASP A-2 68 1 
ATOM 2466 N N . PRO A-2 1 69 . 67.74 24.331 7.561 1 6.47 ? N PRO A-2 69 1 
ATOM 2467 C CA . PRO A-2 1 69 . 67.357 22.936 7.471 1 6.24 ? CA PRO A-2 69 1 
ATOM 2468 C C . PRO A-2 1 69 . 67.983 22.249 6.265 1 5.4 ? C PRO A-2 69 1 
ATOM 2469 O O . PRO A-2 1 69 . 68.296 22.879 5.238 1 5.71 ? O PRO A-2 69 1 
ATOM 2470 C CB . PRO A-2 1 69 . 65.849 23.004 7.381 1 7.11 ? CB PRO A-2 69 1 
ATOM 2471 C CG . PRO A-2 1 69 . 65.476 24.316 8.036 1 8.02 ? CG PRO A-2 69 1 
ATOM 2472 C CD . PRO A-2 1 69 . 66.579 25.242 7.613 1 7.55 ? CD PRO A-2 69 1 
ATOM 2473 N N . PHE A-2 1 70 . 68.088 20.946 6.331 1 5.78 ? N PHE A-2 70 1 
ATOM 2474 C CA . PHE A-2 1 70 . 68.646 20.117 5.253 1 5.49 ? CA PHE A-2 70 1 
ATOM 2475 C C . PHE A-2 1 70 . 67.7 20.141 4.063 1 5.09 ? C PHE A-2 70 1 
ATOM 2476 O O . PHE A-2 1 70 . 66.484 19.998 4.171 1 5.57 ? O PHE A-2 70 1 
ATOM 2477 C CB . PHE A-2 1 70 . 68.85 18.721 5.831 1 6.16 ? CB PHE A-2 70 1 
ATOM 2478 C CG . PHE A-2 1 70 . 69.558 17.727 4.945 1 5.66 ? CG PHE A-2 70 1 
ATOM 2479 C CD1 . PHE A-2 1 70 . 69.175 16.386 4.968 1 6.83 ? CD1 PHE A-2 70 1 
ATOM 2480 C CD2 . PHE A-2 1 70 . 70.689 18.036 4.205 1 6.46 ? CD2 PHE A-2 70 1 
ATOM 2481 C CE1 . PHE A-2 1 70 . 69.875 15.436 4.257 1 7.3 ? CE1 PHE A-2 70 1 
ATOM 2482 C CE2 . PHE A-2 1 70 . 71.35 17.096 3.461 1 6.67 ? CE2 PHE A-2 70 1 
ATOM 2483 C CZ . PHE A-2 1 70 . 70.957 15.788 3.484 1 6.7 ? CZ PHE A-2 70 1 
ATOM 2484 N N . ASP A-2 1 71 . 68.308 20.301 2.885 1 4.86 ? N ASP A-2 71 1 
ATOM 2485 C CA . ASP A-2 1 71 . 67.597 20.503 1.646 0.93 4.19 ? CA ASP A-2 71 1 
ATOM 2486 C C . ASP A-2 1 71 . 67.198 19.18 0.972 1 4.9 ? C ASP A-2 71 1 
ATOM 2487 O O . ASP A-2 1 71 . 67.972 18.225 0.933 1 5.03 ? O ASP A-2 71 1 
ATOM 2488 C CB . ASP A-2 1 71 . 68.455 21.314 0.666 1 5.03 ? CB ASP A-2 71 1 
ATOM 2489 C CG . ASP A-2 1 71 . 68.789 22.684 1.181 1 4.56 ? CG ASP A-2 71 1 
ATOM 2490 O OD1 . ASP A-2 1 71 . 69.943 23.171 0.938 1 4.86 ? OD1 ASP A-2 71 1 
ATOM 2491 O OD2 . ASP A-2 1 71 . 67.906 23.296 1.814 1 4.97 ? OD2 ASP A-2 71 1 
ATOM 2492 N N . ILE A-2 1 72 . 65.992 19.187 0.41 1 4.9 ? N ILE A-2 72 1 
ATOM 2493 C CA . ILE A-2 1 72 . 65.468 18.05 -0.33 1 4.73 ? CA ILE A-2 72 1 
ATOM 2494 C C . ILE A-2 1 72 . 64.826 18.516 -1.604 1 4.8 ? C ILE A-2 72 1 
ATOM 2495 O O . ILE A-2 1 72 . 64.162 19.561 -1.669 1 5.94 ? O ILE A-2 72 1 
ATOM 2496 C CB . ILE A-2 1 72 . 64.519 17.22 0.566 1 5.17 ? CB ILE A-2 72 1 
ATOM 2497 C CG1 . ILE A-2 1 72 . 64.03 15.949 -0.161 1 5.54 ? CG1 ILE A-2 72 1 
ATOM 2498 C CG2 . ILE A-2 1 72 . 63.369 18.028 1.102 1 5.7 ? CG2 ILE A-2 72 1 
ATOM 2499 C CD1 . ILE A-2 1 72 . 63.507 14.869 0.796 1 6.31 ? CD1 ILE A-2 72 1 
ATOM 2500 N N . MET A-2 1 73 . 64.998 17.706 -2.619 1 4.76 ? N MET A-2 73 1 
ATOM 2501 C CA . MET A-2 1 73 . 64.509 17.893 -3.988 1 4.99 ? CA MET A-2 73 1 
ATOM 2502 C C . MET A-2 1 73 . 63.594 16.735 -4.313 1 5.58 ? C MET A-2 73 1 
ATOM 2503 O O . MET A-2 1 73 . 64.048 15.587 -4.282 1 7 ? O MET A-2 73 1 
ATOM 2504 C CB . MET A-2 1 73 . 65.707 17.899 -4.946 1 5.68 ? CB MET A-2 73 1 
ATOM 2505 C CG . MET A-2 1 73 . 66.781 18.922 -4.574 1 6.07 ? CG MET A-2 73 1 
ATOM 2506 S SD . MET A-2 1 73 . 68.122 19.078 -5.77 1 7.52 ? SD MET A-2 73 1 
ATOM 2507 C CE . MET A-2 1 73 . 68.883 17.441 -5.637 1 8.16 ? CE MET A-2 73 1 
ATOM 2508 N N . VAL A-2 1 74 . 62.321 17.005 -4.584 1 5.26 ? N VAL A-2 74 1 
ATOM 2509 C CA . VAL A-2 1 74 . 61.328 15.992 -4.878 1 5.11 ? CA VAL A-2 74 1 
ATOM 2510 C C . VAL A-2 1 74 . 60.929 16.116 -6.345 1 5.59 ? C VAL A-2 74 1 
ATOM 2511 O O . VAL A-2 1 74 . 60.579 17.19 -6.826 1 6.29 ? O VAL A-2 74 1 
ATOM 2512 C CB . VAL A-2 1 74 . 60.127 16.066 -3.978 1 5.78 ? CB VAL A-2 74 1 
ATOM 2513 C CG1 . VAL A-2 1 74 . 59.184 14.905 -4.296 1 6.92 ? CG1 VAL A-2 74 1 
ATOM 2514 C CG2 . VAL A-2 1 74 . 60.536 16.026 -2.515 1 6.87 ? CG2 VAL A-2 74 1 
ATOM 2515 N N . ILE A-2 1 75 . 60.971 14.988 -7.049 1 5.95 ? N ILE A-2 75 1 
ATOM 2516 C CA A ILE A-2 1 75 . 60.571 14.931 -8.408 0.24 6.15 ? CA ILE A-2 75 1 
ATOM 2517 C CA B ILE A-2 1 75 . 60.546 14.979 -8.459 0.76 6.32 ? CA ILE A-2 75 1 
ATOM 2518 C C . ILE A-2 1 75 . 59.018 14.781 -8.514 1 6.47 ? C ILE A-2 75 1 
ATOM 2519 O O . ILE A-2 1 75 . 58.512 13.714 -8.295 0.9 7.34 ? O ILE A-2 75 1 
ATOM 2520 C CB A ILE A-2 1 75 . 61.316 13.817 -9.118 0.24 9.65 ? CB ILE A-2 75 1 
ATOM 2521 C CB B ILE A-2 1 75 . 61.254 13.866 -9.235 0.76 6.06 ? CB ILE A-2 75 1 
ATOM 2522 C CG1 A ILE A-2 1 75 . 62.815 13.951 -8.784 0.24 8.58 ? CG1 ILE A-2 75 1 
ATOM 2523 C CG1 B ILE A-2 1 75 . 62.775 13.899 -9.054 0.76 8.44 ? CG1 ILE A-2 75 1 
ATOM 2524 C CG2 A ILE A-2 1 75 . 61.08 13.877 -10.647 0.24 14.17 ? CG2 ILE A-2 75 1 
ATOM 2525 C CG2 B ILE A-2 1 75 . 60.881 13.989 -10.706 0.76 7.07 ? CG2 ILE A-2 75 1 
ATOM 2526 C CD1 A ILE A-2 1 75 . 63.366 15.313 -9.092 0.24 8.05 ? CD1 ILE A-2 75 1 
ATOM 2527 C CD1 B ILE A-2 1 75 . 63.506 12.678 -9.654 0.76 9.61 ? CD1 ILE A-2 75 1 
ATOM 2528 N N . MET A-2 1 76 . 58.311 15.901 -8.755 1 7.14 ? N MET A-2 76 1 
ATOM 2529 C CA . MET A-2 1 76 . 56.85 15.939 -8.893 1 7.1 ? CA MET A-2 76 1 
ATOM 2530 C C . MET A-2 1 76 . 56.473 16.221 -10.369 1 7.57 ? C MET A-2 76 1 
ATOM 2531 O O . MET A-2 1 76 . 56.949 17.203 -10.923 1 9.76 ? O MET A-2 76 1 
ATOM 2532 C CB . MET A-2 1 76 . 56.17 16.962 -7.995 0.81 5.65 ? CB MET A-2 76 1 
ATOM 2533 C CG . MET A-2 1 76 . 56.194 16.612 -6.523 1 8.44 ? CG MET A-2 76 1 
ATOM 2534 S SD . MET A-2 1 76 . 55.159 15.133 -6.155 1 9.77 ? SD MET A-2 76 1 
ATOM 2535 C CE . MET A-2 1 76 . 53.532 15.771 -6.486 1 9.5 ? CE MET A-2 76 1 
ATOM 2536 N N . ARG A-2 1 77 . 55.58 15.439 -10.923 1 6.49 ? N ARG A-2 77 1 
ATOM 2537 C CA . ARG A-2 1 77 . 55.054 15.693 -12.247 1 6.33 ? CA ARG A-2 77 1 
ATOM 2538 C C . ARG A-2 1 77 . 54.23 16.974 -12.284 1 7.01 ? C ARG A-2 77 1 
ATOM 2539 O O . ARG A-2 1 77 . 54.497 17.861 -13.108 1 10.91 ? O ARG A-2 77 1 
ATOM 2540 C CB . ARG A-2 1 77 . 54.266 14.476 -12.772 1 7.12 ? CB ARG A-2 77 1 
ATOM 2541 C CG . ARG A-2 1 77 . 55.161 13.254 -12.94 1 7.08 ? CG ARG A-2 77 1 
ATOM 2542 C CD . ARG A-2 1 77 . 54.448 12.147 -13.678 1 7.8 ? CD ARG A-2 77 1 
ATOM 2543 N NE . ARG A-2 1 77 . 53.42 11.509 -12.859 1 7.04 ? NE ARG A-2 77 1 
ATOM 2544 C CZ . ARG A-2 1 77 . 52.407 10.791 -13.358 1 7.27 ? CZ ARG A-2 77 1 
ATOM 2545 N NH1 . ARG A-2 1 77 . 52.128 10.788 -14.663 1 7.82 ? NH1 ARG A-2 77 1 
ATOM 2546 N NH2 . ARG A-2 1 77 . 51.627 10.122 -12.519 1 7.52 ? NH2 ARG A-2 77 1 
ATOM 2547 N N . GLU A-2 1 78 . 53.246 17.108 -11.417 1 6.55 ? N GLU A-2 78 1 
ATOM 2548 C CA . GLU A-2 1 78 . 52.535 18.339 -11.204 1 6.08 ? CA GLU A-2 78 1 
ATOM 2549 C C . GLU A-2 1 78 . 53.16 18.993 -9.953 1 6.01 ? C GLU A-2 78 1 
ATOM 2550 O O . GLU A-2 1 78 . 53.1 18.366 -8.883 1 6.71 ? O GLU A-2 78 1 
ATOM 2551 C CB . GLU A-2 1 78 . 51.032 18.077 -10.954 1 6.87 ? CB GLU A-2 78 1 
ATOM 2552 C CG . GLU A-2 1 78 . 50.241 19.332 -10.685 1 7.07 ? CG GLU A-2 78 1 
ATOM 2553 C CD . GLU A-2 1 78 . 48.731 19.025 -10.529 1 7.94 ? CD GLU A-2 78 1 
ATOM 2554 O OE1 . GLU A-2 1 78 . 48.12 18.605 -11.497 1 8.79 ? OE1 GLU A-2 78 1 
ATOM 2555 O OE2 . GLU A-2 1 78 . 48.187 19.151 -9.416 1 8.75 ? OE2 GLU A-2 78 1 
ATOM 2556 N N . PRO A-2 1 79 . 53.746 20.154 -10.067 1 6.29 ? N PRO A-2 79 1 
ATOM 2557 C CA . PRO A-2 1 79 . 54.367 20.764 -8.866 1 7.4 ? CA PRO A-2 79 1 
ATOM 2558 C C . PRO A-2 1 79 . 53.322 21.013 -7.788 1 6.54 ? C PRO A-2 79 1 
ATOM 2559 O O . PRO A-2 1 79 . 52.166 21.276 -8.063 1 7.98 ? O PRO A-2 79 1 
ATOM 2560 C CB . PRO A-2 1 79 . 54.925 22.082 -9.408 1 9.58 ? CB PRO A-2 79 1 
ATOM 2561 C CG . PRO A-2 1 79 . 55.132 21.786 -10.891 1 11.99 ? CG PRO A-2 79 1 
ATOM 2562 C CD . PRO A-2 1 79 . 53.953 20.952 -11.27 1 9.34 ? CD PRO A-2 79 1 
ATOM 2563 N N . VAL A-2 1 80 . 53.793 20.937 -6.551 1 6.9 ? N VAL A-2 80 1 
ATOM 2564 C CA . VAL A-2 1 80 . 52.952 21.275 -5.431 1 6.39 ? CA VAL A-2 80 1 
ATOM 2565 C C . VAL A-2 1 80 . 53.022 22.732 -5.088 1 6.41 ? C VAL A-2 80 1 
ATOM 2566 O O . VAL A-2 1 80 . 53.926 23.423 -5.441 1 12.34 ? O VAL A-2 80 1 
ATOM 2567 C CB . VAL A-2 1 80 . 53.183 20.385 -4.185 1 7.07 ? CB VAL A-2 80 1 
ATOM 2568 C CG1 . VAL A-2 1 80 . 53.057 18.904 -4.532 1 7.7 ? CG1 VAL A-2 80 1 
ATOM 2569 C CG2 . VAL A-2 1 80 . 54.521 20.674 -3.478 1 7.07 ? CG2 VAL A-2 80 1 
ATOM 2570 N N . TYR A-2 1 81 . 52.131 23.19 -4.254 1 6.87 ? N TYR A-2 81 1 
ATOM 2571 C CA . TYR A-2 1 81 . 52.117 24.527 -3.729 1 6.61 ? CA TYR A-2 81 1 
ATOM 2572 C C . TYR A-2 1 81 . 53.142 24.666 -2.609 1 6.29 ? C TYR A-2 81 1 
ATOM 2573 O O . TYR A-2 1 81 . 53.389 23.682 -1.853 1 7.29 ? O TYR A-2 81 1 
ATOM 2574 C CB . TYR A-2 1 81 . 50.708 24.92 -3.232 1 6.91 ? CB TYR A-2 81 1 
ATOM 2575 C CG . TYR A-2 1 81 . 49.747 25.061 -4.345 1 6.95 ? CG TYR A-2 81 1 
ATOM 2576 C CD1 . TYR A-2 1 81 . 49.064 23.968 -4.886 1 7.61 ? CD1 TYR A-2 81 1 
ATOM 2577 C CD2 . TYR A-2 1 81 . 49.537 26.298 -4.949 1 6.69 ? CD2 TYR A-2 81 1 
ATOM 2578 C CE1 . TYR A-2 1 81 . 48.251 24.116 -5.975 1 8.61 ? CE1 TYR A-2 81 1 
ATOM 2579 C CE2 . TYR A-2 1 81 . 48.708 26.447 -6.047 1 7.91 ? CE2 TYR A-2 81 1 
ATOM 2580 C CZ . TYR A-2 1 81 . 48.075 25.315 -6.578 1 7.85 ? CZ TYR A-2 81 1 
ATOM 2581 O OH . TYR A-2 1 81 . 47.265 25.483 -7.663 1 9.9 ? OH TYR A-2 81 1 
ATOM 2582 N N . PRO A-2 1 82 . 53.7 25.843 -2.345 1 6.6 ? N PRO A-2 82 1 
ATOM 2583 C CA . PRO A-2 1 82 . 54.58 25.979 -1.189 1 6.49 ? CA PRO A-2 82 1 
ATOM 2584 C C . PRO A-2 1 82 . 53.866 25.609 0.094 1 6.38 ? C PRO A-2 82 1 
ATOM 2585 O O . PRO A-2 1 82 . 52.663 25.844 0.266 1 7.21 ? O PRO A-2 82 1 
ATOM 2586 C CB . PRO A-2 1 82 . 54.938 27.468 -1.195 1 8.01 ? CB PRO A-2 82 1 
ATOM 2587 C CG . PRO A-2 1 82 . 54.715 27.917 -2.622 1 8.51 ? CG PRO A-2 82 1 
ATOM 2588 C CD . PRO A-2 1 82 . 53.512 27.098 -3.089 1 7.51 ? CD PRO A-2 82 1 
ATOM 2589 N N . LEU A-2 1 83 . 54.658 25.049 1.012 1 6.31 ? N LEU A-2 83 1 
ATOM 2590 C CA . LEU A-2 1 83 . 54.254 24.593 2.322 1 6.74 ? CA LEU A-2 83 1 
ATOM 2591 C C . LEU A-2 1 83 . 53.422 23.334 2.3 1 6.65 ? C LEU A-2 83 1 
ATOM 2592 O O . LEU A-2 1 83 . 52.794 22.985 3.298 1 8.57 ? O LEU A-2 83 1 
ATOM 2593 C CB . LEU A-2 1 83 . 53.604 25.698 3.18 1 9.23 ? CB LEU A-2 83 1 
ATOM 2594 C CG . LEU A-2 1 83 . 54.392 26.981 3.26 1 13.43 ? CG LEU A-2 83 1 
ATOM 2595 C CD1 . LEU A-2 1 83 . 53.604 27.984 4.183 1 19.69 ? CD1 LEU A-2 83 1 
ATOM 2596 C CD2 . LEU A-2 1 83 . 55.758 26.754 3.751 1 16.76 ? CD2 LEU A-2 83 1 
ATOM 2597 N N . THR A-2 1 84 . 53.495 22.572 1.194 1 6.22 ? N THR A-2 84 1 
ATOM 2598 C CA . THR A-2 1 84 . 52.858 21.262 1.112 1 5.97 ? CA THR A-2 84 1 
ATOM 2599 C C . THR A-2 1 84 . 53.853 20.198 1.627 1 5.51 ? C THR A-2 84 1 
ATOM 2600 O O . THR A-2 1 84 . 55.035 20.197 1.244 1 6.08 ? O THR A-2 84 1 
ATOM 2601 C CB . THR A-2 1 84 . 52.465 20.949 -0.313 1 6.72 ? CB THR A-2 84 1 
ATOM 2602 O OG1 . THR A-2 1 84 . 51.608 21.96 -0.82 1 7.84 ? OG1 THR A-2 84 1 
ATOM 2603 C CG2 . THR A-2 1 84 . 51.725 19.624 -0.392 1 8.07 ? CG2 THR A-2 84 1 
ATOM 2604 N N . ILE A-2 1 85 . 53.333 19.257 2.403 1 5.46 ? N ILE A-2 85 1 
ATOM 2605 C CA . ILE A-2 1 85 . 54.069 18.086 2.852 1 5.41 ? CA ILE A-2 85 1 
ATOM 2606 C C . ILE A-2 1 85 . 53.957 16.974 1.837 1 5.24 ? C ILE A-2 85 1 
ATOM 2607 O O . ILE A-2 1 85 . 52.852 16.621 1.424 1 6.35 ? O ILE A-2 85 1 
ATOM 2608 C CB . ILE A-2 1 85 . 53.483 17.58 4.176 1 7.14 ? CB ILE A-2 85 1 
ATOM 2609 C CG1 . ILE A-2 1 85 . 53.473 18.624 5.271 1 8.97 ? CG1 ILE A-2 85 1 
ATOM 2610 C CG2 . ILE A-2 1 85 . 54.171 16.29 4.597 1 8.84 ? CG2 ILE A-2 85 1 
ATOM 2611 C CD1 . ILE A-2 1 85 . 52.422 18.266 6.37 1 12.02 ? CD1 ILE A-2 85 1 
ATOM 2612 N N . ILE A-2 1 86 . 55.079 16.39 1.463 1 5.24 ? N ILE A-2 86 1 
ATOM 2613 C CA . ILE A-2 1 86 . 55.112 15.236 0.576 1 5.71 ? CA ILE A-2 86 1 
ATOM 2614 C C . ILE A-2 1 86 . 55.833 14.094 1.311 1 5.48 ? C ILE A-2 86 1 
ATOM 2615 O O . ILE A-2 1 86 . 56.969 14.296 1.756 1 6.91 ? O ILE A-2 86 1 
ATOM 2616 C CB . ILE A-2 1 86 . 55.835 15.514 -0.754 1 5.78 ? CB ILE A-2 86 1 
ATOM 2617 C CG1 . ILE A-2 1 86 . 55.227 16.707 -1.488 1 6.45 ? CG1 ILE A-2 86 1 
ATOM 2618 C CG2 . ILE A-2 1 86 . 55.88 14.255 -1.635 1 6.8 ? CG2 ILE A-2 86 1 
ATOM 2619 C CD1 . ILE A-2 1 86 . 55.969 17.077 -2.744 1 6.96 ? CD1 ILE A-2 86 1 
ATOM 2620 N N . GLU A-2 1 87 . 55.261 12.91 1.386 1 5.35 ? N GLU A-2 87 1 
ATOM 2621 C CA B GLU A-2 1 87 . 55.971 11.716 1.813 0.52 5.91 ? CA GLU A-2 87 1 
ATOM 2622 C CA C GLU A-2 1 87 . 56.015 11.751 1.828 0.16 4.53 ? CA GLU A-2 87 1 
ATOM 2623 C CA D GLU A-2 1 87 . 55.968 11.726 1.831 0.32 6.15 ? CA GLU A-2 87 1 
ATOM 2624 C C . GLU A-2 1 87 . 56.899 11.279 0.68 1 5.44 ? C GLU A-2 87 1 
ATOM 2625 O O . GLU A-2 1 87 . 56.422 10.988 -0.421 1 6.38 ? O GLU A-2 87 1 
ATOM 2626 C CB B GLU A-2 1 87 . 54.977 10.599 2.104 0.52 6.91 ? CB GLU A-2 87 1 
ATOM 2627 C CB C GLU A-2 1 87 . 55.129 10.63 2.369 0.16 6 ? CB GLU A-2 87 1 
ATOM 2628 C CB D GLU A-2 1 87 . 54.956 10.631 2.206 0.32 6.84 ? CB GLU A-2 87 1 
ATOM 2629 C CG B GLU A-2 1 87 . 54.142 10.9 3.243 0.52 8.71 ? CG GLU A-2 87 1 
ATOM 2630 C CG C GLU A-2 1 87 . 54.376 11.009 3.625 0.16 8.87 ? CG GLU A-2 87 1 
ATOM 2631 C CG D GLU A-2 1 87 . 55.581 9.468 2.892 0.32 6.84 ? CG GLU A-2 87 1 
ATOM 2632 C CD B GLU A-2 1 87 . 52.682 10.264 3.152 0.52 13.19 ? CD GLU A-2 87 1 
ATOM 2633 C CD C GLU A-2 1 87 . 53.426 9.915 4.086 0.16 11.76 ? CD GLU A-2 87 1 
ATOM 2634 C CD D GLU A-2 1 87 . 54.57 8.383 3.337 0.32 10.09 ? CD GLU A-2 87 1 
ATOM 2635 O OE1 B GLU A-2 1 87 . 51.847 10.1 2.058 0.52 13.17 ? OE1 GLU A-2 87 1 
ATOM 2636 O OE1 C GLU A-2 1 87 . 53.447 8.807 3.509 0.16 14.6 ? OE1 GLU A-2 87 1 
ATOM 2637 O OE1 D GLU A-2 1 87 . 54.894 7.311 3.818 0.32 9.99 ? OE1 GLU A-2 87 1 
ATOM 2638 O OE2 B GLU A-2 1 87 . 52.147 10.041 4.28 0.52 17.98 ? OE2 GLU A-2 87 1 
ATOM 2639 O OE2 C GLU A-2 1 87 . 52.614 10.216 5.008 0.16 12.42 ? OE2 GLU A-2 87 1 
ATOM 2640 O OE2 D GLU A-2 1 87 . 53.348 8.59 3.232 0.32 16.66 ? OE2 GLU A-2 87 1 
ATOM 2641 N N . ALA A-2 1 88 . 58.187 11.252 0.958 1 5.58 ? N ALA A-2 88 1 
ATOM 2642 C CA . ALA A-2 1 88 . 59.213 11.151 -0.099 1 6.66 ? CA ALA A-2 88 1 
ATOM 2643 C C . ALA A-2 1 88 . 60.201 10.036 0.234 1 6.11 ? C ALA A-2 88 1 
ATOM 2644 O O . ALA A-2 1 88 . 60.623 9.857 1.365 1 6.89 ? O ALA A-2 88 1 
ATOM 2645 C CB . ALA A-2 1 88 . 59.925 12.473 -0.221 1 8.29 ? CB ALA A-2 88 1 
ATOM 2646 N N . ARG A-2 1 89 . 60.573 9.309 -0.826 1 5.79 ? N ARG A-2 89 1 
ATOM 2647 C CA . ARG A-2 1 89 . 61.569 8.255 -0.776 1 5.79 ? CA ARG A-2 89 1 
ATOM 2648 C C . ARG A-2 1 89 . 62.893 8.784 -1.322 1 5.55 ? C ARG A-2 89 1 
ATOM 2649 O O . ARG A-2 1 89 . 63.002 9.078 -2.507 1 5.94 ? O ARG A-2 89 1 
ATOM 2650 C CB . ARG A-2 1 89 . 61.111 7.041 -1.653 1 6.92 ? CB ARG A-2 89 1 
ATOM 2651 C CG . ARG A-2 1 89 . 62.165 6.018 -1.864 1 8.75 ? CG ARG A-2 89 1 
ATOM 2652 C CD . ARG A-2 1 89 . 61.654 4.728 -2.513 1 10.31 ? CD ARG A-2 89 1 
ATOM 2653 N NE . ARG A-2 1 89 . 61.079 4.915 -3.903 1 9.21 ? NE ARG A-2 89 1 
ATOM 2654 C CZ . ARG A-2 1 89 . 59.761 4.958 -4.145 1 8.44 ? CZ ARG A-2 89 1 
ATOM 2655 N NH1 . ARG A-2 1 89 . 59.343 5.042 -5.373 1 9.12 ? NH1 ARG A-2 89 1 
ATOM 2656 N NH2 . ARG A-2 1 89 . 58.876 4.941 -3.14 1 10.1 ? NH2 ARG A-2 89 1 
ATOM 2657 N N . PRO A-2 1 90 . 63.913 8.899 -0.46 1 5.88 ? N PRO A-2 90 1 
ATOM 2658 C CA . PRO A-2 1 90 . 65.256 9.29 -0.935 1 6.06 ? CA PRO A-2 90 1 
ATOM 2659 C C . PRO A-2 1 90 . 65.79 8.241 -1.912 1 6.19 ? C PRO A-2 90 1 
ATOM 2660 O O . PRO A-2 1 90 . 65.751 7.051 -1.601 1 7.13 ? O PRO A-2 90 1 
ATOM 2661 C CB . PRO A-2 1 90 . 66.086 9.334 0.356 1 6.57 ? CB PRO A-2 90 1 
ATOM 2662 C CG . PRO A-2 1 90 . 65.07 9.627 1.435 1 7.36 ? CG PRO A-2 90 1 
ATOM 2663 C CD . PRO A-2 1 90 . 63.874 8.797 1.01 1 7.96 ? CD PRO A-2 90 1 
ATOM 2664 N N . ILE A-2 1 91 . 66.338 8.731 -3.041 1 5.57 ? N ILE A-2 91 1 
ATOM 2665 C CA . ILE A-2 1 91 . 66.971 7.861 -4.028 1 6.35 ? CA ILE A-2 91 1 
ATOM 2666 C C . ILE A-2 1 91 . 68.399 8.241 -4.303 1 6.38 ? C ILE A-2 91 1 
ATOM 2667 O O . ILE A-2 1 91 . 69.087 7.494 -5.005 1 8.22 ? O ILE A-2 91 1 
ATOM 2668 C CB . ILE A-2 1 91 . 66.143 7.766 -5.337 1 6.85 ? CB ILE A-2 91 1 
ATOM 2669 C CG1 . ILE A-2 1 91 . 66.076 9.098 -6.078 1 7.48 ? CG1 ILE A-2 91 1 
ATOM 2670 C CG2 . ILE A-2 1 91 . 64.788 7.163 -5.022 1 7.64 ? CG2 ILE A-2 91 1 
ATOM 2671 C CD1 . ILE A-2 1 91 . 65.496 9.004 -7.452 1 8.92 ? CD1 ILE A-2 91 1 
ATOM 2672 N N . GLY A-2 1 92 . 68.904 9.373 -3.787 1 6.35 ? N GLY A-2 92 1 
ATOM 2673 C CA . GLY A-2 1 92 . 70.258 9.779 -4.064 1 6.45 ? CA GLY A-2 92 1 
ATOM 2674 C C . GLY A-2 1 92 . 70.486 11.132 -3.429 1 5.48 ? C GLY A-2 92 1 
ATOM 2675 O O . GLY A-2 1 92 . 69.616 11.668 -2.733 1 5.73 ? O GLY A-2 92 1 
ATOM 2676 N N . ILE A-2 1 93 . 71.665 11.689 -3.666 1 6.02 ? N ILE A-2 93 1 
ATOM 2677 C CA . ILE A-2 1 93 . 72.041 12.951 -3.021 1 5.79 ? CA ILE A-2 93 1 
ATOM 2678 C C . ILE A-2 1 93 . 72.999 13.711 -3.918 1 5.52 ? C ILE A-2 93 1 
ATOM 2679 O O . ILE A-2 1 93 . 73.982 13.157 -4.446 1 6.71 ? O ILE A-2 93 1 
ATOM 2680 C CB . ILE A-2 1 93 . 72.591 12.704 -1.587 1 6.21 ? CB ILE A-2 93 1 
ATOM 2681 C CG1 . ILE A-2 1 93 . 72.879 14.025 -0.865 1 6.27 ? CG1 ILE A-2 93 1 
ATOM 2682 C CG2 . ILE A-2 1 93 . 73.801 11.75 -1.557 1 7.06 ? CG2 ILE A-2 93 1 
ATOM 2683 C CD1 . ILE A-2 1 93 . 72.826 13.865 0.636 1 7.5 ? CD1 ILE A-2 93 1 
ATOM 2684 N N . MET A-2 1 94 . 72.754 14.999 -4.108 1 5.89 ? N MET A-2 94 1 
ATOM 2685 C CA . MET A-2 1 94 . 73.626 15.88 -4.851 1 5.75 ? CA MET A-2 94 1 
ATOM 2686 C C . MET A-2 1 94 . 74.661 16.461 -3.882 1 5.75 ? C MET A-2 94 1 
ATOM 2687 O O . MET A-2 1 94 . 74.318 17.071 -2.876 1 6.5 ? O MET A-2 94 1 
ATOM 2688 C CB . MET A-2 1 94 . 72.82 17.024 -5.473 1 6.27 ? CB MET A-2 94 1 
ATOM 2689 C CG . MET A-2 1 94 . 73.64 17.91 -6.311 1 7.85 ? CG MET A-2 94 1 
ATOM 2690 S SD . MET A-2 1 94 . 72.725 19.295 -7.029 1 8.32 ? SD MET A-2 94 1 
ATOM 2691 C CE . MET A-2 1 94 . 72.304 20.164 -5.51 1 8.11 ? CE MET A-2 94 1 
ATOM 2692 N N . LYS A-2 1 95 . 75.928 16.286 -4.237 1 5.93 ? N LYS A-2 95 1 
ATOM 2693 C CA . LYS A-2 1 95 . 77.038 16.737 -3.368 1 6.61 ? CA LYS A-2 95 1 
ATOM 2694 C C . LYS A-2 1 95 . 77.43 18.117 -3.84 1 6.55 ? C LYS A-2 95 1 
ATOM 2695 O O . LYS A-2 1 95 . 78.074 18.301 -4.871 1 11.84 ? O LYS A-2 95 1 
ATOM 2696 C CB . LYS A-2 1 95 . 78.192 15.743 -3.503 1 7.48 ? CB LYS A-2 95 1 
ATOM 2697 C CG . LYS A-2 1 95 . 77.83 14.344 -3.067 1 8.92 ? CG LYS A-2 95 1 
ATOM 2698 C CD . LYS A-2 1 95 . 78.976 13.388 -3.19 1 10.99 ? CD LYS A-2 95 1 
ATOM 2699 C CE . LYS A-2 1 95 . 78.546 11.999 -2.633 1 13.89 ? CE LYS A-2 95 1 
ATOM 2700 N NZ . LYS A-2 1 95 . 79.596 11.003 -2.698 1 16.81 ? NZ LYS A-2 95 1 
ATOM 2701 N N . MET A-2 1 96 . 76.984 19.12 -3.105 1 7.44 ? N MET A-2 96 1 
ATOM 2702 C CA . MET A-2 1 96 . 77.167 20.549 -3.403 1 7.88 ? CA MET A-2 96 1 
ATOM 2703 C C . MET A-2 1 96 . 77.839 21.246 -2.222 1 6.52 ? C MET A-2 96 1 
ATOM 2704 O O . MET A-2 1 96 . 77.415 21.067 -1.093 1 7.33 ? O MET A-2 96 1 
ATOM 2705 C CB . MET A-2 1 96 . 75.75 21.226 -3.632 1 6.95 ? CB MET A-2 96 1 
ATOM 2706 C CG . MET A-2 1 96 . 75.898 22.728 -3.878 1 7.55 ? CG MET A-2 96 1 
ATOM 2707 S SD . MET A-2 1 96 . 74.282 23.415 -4.214 1 8.41 ? SD MET A-2 96 1 
ATOM 2708 C CE . MET A-2 1 96 . 74.725 25.051 -4.75 1 8.51 ? CE MET A-2 96 1 
ATOM 2709 N N A GLU A-2 1 97 . 78.789 22.083 -2.571 0.51 6.35 ? N GLU A-2 97 1 
ATOM 2710 N N B GLU A-2 1 97 . 78.773 22.167 -2.489 0.49 6.46 ? N GLU A-2 97 1 
ATOM 2711 C CA A GLU A-2 1 97 . 79.254 23.105 -1.697 0.51 6.89 ? CA GLU A-2 97 1 
ATOM 2712 C CA B GLU A-2 1 97 . 79.307 23.153 -1.556 0.49 6.58 ? CA GLU A-2 97 1 
ATOM 2713 C C A GLU A-2 1 97 . 78.687 24.448 -2.185 0.51 6.23 ? C GLU A-2 97 1 
ATOM 2714 C C B GLU A-2 1 97 . 78.857 24.499 -2.087 0.49 6.42 ? C GLU A-2 97 1 
ATOM 2715 O O A GLU A-2 1 97 . 78.667 24.716 -3.376 0.51 6.9 ? O GLU A-2 97 1 
ATOM 2716 O O B GLU A-2 1 97 . 79.122 24.86 -3.226 0.49 7.9 ? O GLU A-2 97 1 
ATOM 2717 C CB A GLU A-2 1 97 . 80.779 23.098 -1.683 0.51 10.65 ? CB GLU A-2 97 1 
ATOM 2718 C CB B GLU A-2 1 97 . 80.85 23.123 -1.574 0.49 7.89 ? CB GLU A-2 97 1 
ATOM 2719 C CG A GLU A-2 1 97 . 81.392 23.85 -0.451 0.51 10.77 ? CG GLU A-2 97 1 
ATOM 2720 C CG B GLU A-2 1 97 . 81.432 21.956 -1.085 0.49 12.45 ? CG GLU A-2 97 1 
ATOM 2721 C CD A GLU A-2 1 97 . 82.837 23.833 -0.322 0.51 15.18 ? CD GLU A-2 97 1 
ATOM 2722 C CD B GLU A-2 1 97 . 81.636 21.967 0.345 0.49 14.09 ? CD GLU A-2 97 1 
ATOM 2723 O OE1 A GLU A-2 1 97 . 83.348 22.854 0.292 0.51 18.96 ? OE1 GLU A-2 97 1 
ATOM 2724 O OE1 B GLU A-2 1 97 . 82.036 23.013 0.9 0.49 17.04 ? OE1 GLU A-2 97 1 
ATOM 2725 O OE2 A GLU A-2 1 97 . 83.489 24.871 -0.641 0.51 18.85 ? OE2 GLU A-2 97 1 
ATOM 2726 O OE2 B GLU A-2 1 97 . 81.431 20.887 1.055 0.49 12.3 ? OE2 GLU A-2 97 1 
ATOM 2727 N N . ASP A-2 1 98 . 78.19 25.245 -1.239 1 5.71 ? N ASP A-2 98 1 
ATOM 2728 C CA . ASP A-2 1 98 . 77.52 26.495 -1.592 1 5.81 ? CA ASP A-2 98 1 
ATOM 2729 C C . ASP A-2 1 98 . 78.15 27.616 -0.779 1 5.82 ? C ASP A-2 98 1 
ATOM 2730 O O . ASP A-2 1 98 . 78.004 27.623 0.442 1 6.32 ? O ASP A-2 98 1 
ATOM 2731 C CB . ASP A-2 1 98 . 76.027 26.383 -1.3 1 6.38 ? CB ASP A-2 98 1 
ATOM 2732 C CG . ASP A-2 1 98 . 75.213 27.559 -1.732 1 6.82 ? CG ASP A-2 98 1 
ATOM 2733 O OD1 . ASP A-2 1 98 . 75.811 28.5 -2.319 1 12.86 ? OD1 ASP A-2 98 1 
ATOM 2734 O OD2 . ASP A-2 1 98 . 74.002 27.622 -1.513 1 6.32 ? OD2 ASP A-2 98 1 
ATOM 2735 N N . SER A-2 1 99 . 78.884 28.498 -1.414 1 6.27 ? N SER A-2 99 1 
ATOM 2736 C CA . SER A-2 1 99 . 79.514 29.629 -0.713 1 7.62 ? CA SER A-2 99 1 
ATOM 2737 C C . SER A-2 1 99 . 80.404 29.138 0.421 1 6.9 ? C SER A-2 99 1 
ATOM 2738 O O . SER A-2 1 99 . 80.555 29.808 1.445 1 8.04 ? O SER A-2 99 1 
ATOM 2739 C CB . SER A-2 1 99 . 78.415 30.61 -0.234 1 10.18 ? CB SER A-2 99 1 
ATOM 2740 O OG . SER A-2 1 99 . 77.636 31.079 -1.309 1 12.09 ? OG SER A-2 99 1 
ATOM 2741 N N . GLY A-2 1 100 . 81.047 27.989 0.23 1 6.27 ? N GLY A-2 100 1 
ATOM 2742 C CA . GLY A-2 1 100 . 81.939 27.444 1.231 1 7.13 ? CA GLY A-2 100 1 
ATOM 2743 C C . GLY A-2 1 100 . 81.317 26.497 2.238 1 6.42 ? C GLY A-2 100 1 
ATOM 2744 O O . GLY A-2 1 100 . 82.067 25.894 3.011 1 8.24 ? O GLY A-2 100 1 
ATOM 2745 N N . ASP A-2 1 101 . 80.007 26.35 2.262 1 6.03 ? N ASP A-2 101 1 
ATOM 2746 C CA . ASP A-2 1 101 . 79.334 25.454 3.182 1 6.22 ? CA ASP A-2 101 1 
ATOM 2747 C C . ASP A-2 1 101 . 78.958 24.159 2.484 1 6.02 ? C ASP A-2 101 1 
ATOM 2748 O O . ASP A-2 1 101 . 78.399 24.154 1.379 1 6.38 ? O ASP A-2 101 1 
ATOM 2749 C CB . ASP A-2 1 101 . 78.038 26.066 3.703 1 7.2 ? CB ASP A-2 101 1 
ATOM 2750 C CG . ASP A-2 1 101 . 78.196 27.335 4.445 1 8.76 ? CG ASP A-2 101 1 
ATOM 2751 O OD1 . ASP A-2 1 101 . 79.197 27.472 5.179 1 9.13 ? OD1 ASP A-2 101 1 
ATOM 2752 O OD2 . ASP A-2 1 101 . 77.231 28.165 4.318 1 10.67 ? OD2 ASP A-2 101 1 
ATOM 2753 N N . LYS A-2 1 102 . 79.122 23.045 3.188 1 6.36 ? N LYS A-2 102 1 
ATOM 2754 C CA . LYS A-2 1 102 . 78.486 21.811 2.734 1 6.02 ? CA LYS A-2 102 1 
ATOM 2755 C C . LYS A-2 1 102 . 76.98 22.106 2.64 1 5.48 ? C LYS A-2 102 1 
ATOM 2756 O O . LYS A-2 1 102 . 76.381 22.688 3.542 1 6.08 ? O LYS A-2 102 1 
ATOM 2757 C CB . LYS A-2 1 102 . 78.749 20.681 3.723 1 6.86 ? CB LYS A-2 102 1 
ATOM 2758 C CG . LYS A-2 1 102 . 78.539 19.311 3.15 1 6.63 ? CG LYS A-2 102 1 
ATOM 2759 C CD . LYS A-2 1 102 . 78.699 18.192 4.179 1 7.89 ? CD LYS A-2 102 1 
ATOM 2760 C CE . LYS A-2 1 102 . 78.69 16.832 3.526 1 8.66 ? CE LYS A-2 102 1 
ATOM 2761 N NZ . LYS A-2 1 102 . 78.705 15.736 4.54 1 9.62 ? NZ LYS A-2 102 1 
ATOM 2762 N N . ASP A-2 1 103 . 76.369 21.647 1.536 1 5.38 ? N ASP A-2 103 1 
ATOM 2763 C CA . ASP A-2 1 103 . 75.005 22.019 1.225 1 4.93 ? CA ASP A-2 103 1 
ATOM 2764 C C . ASP A-2 1 103 . 74.403 20.969 0.32 1 5.1 ? C ASP A-2 103 1 
ATOM 2765 O O . ASP A-2 1 103 . 73.685 21.257 -0.658 1 5.63 ? O ASP A-2 103 1 
ATOM 2766 C CB . ASP A-2 1 103 . 74.928 23.405 0.621 1 5.2 ? CB ASP A-2 103 1 
ATOM 2767 C CG . ASP A-2 1 103 . 73.579 24.089 0.62 1 4.98 ? CG ASP A-2 103 1 
ATOM 2768 O OD1 . ASP A-2 1 103 . 72.687 23.681 1.406 1 5.3 ? OD1 ASP A-2 103 1 
ATOM 2769 O OD2 . ASP A-2 1 103 . 73.446 25.037 -0.15 1 5.65 ? OD2 ASP A-2 103 1 
ATOM 2770 N N . TRP A-2 1 104 . 74.69 19.716 0.621 1 5.28 ? N TRP A-2 104 1 
ATOM 2771 C CA . TRP A-2 1 104 . 74.182 18.57 -0.113 1 5.36 ? CA TRP A-2 104 1 
ATOM 2772 C C . TRP A-2 1 104 . 72.663 18.545 -0.052 1 5.4 ? C TRP A-2 104 1 
ATOM 2773 O O . TRP A-2 1 104 . 72.068 19.034 0.875 1 5.88 ? O TRP A-2 104 1 
ATOM 2774 C CB . TRP A-2 1 104 . 74.759 17.25 0.471 1 5.75 ? CB TRP A-2 104 1 
ATOM 2775 C CG . TRP A-2 1 104 . 76.234 17.075 0.323 1 6.12 ? CG TRP A-2 104 1 
ATOM 2776 C CD1 . TRP A-2 1 104 . 77.2 18.006 0.002 1 6.05 ? CD1 TRP A-2 104 1 
ATOM 2777 C CD2 . TRP A-2 1 104 . 76.921 15.83 0.458 1 7.21 ? CD2 TRP A-2 104 1 
ATOM 2778 N NE1 . TRP A-2 1 104 . 78.42 17.395 -0.071 1 7.24 ? NE1 TRP A-2 104 1 
ATOM 2779 C CE2 . TRP A-2 1 104 . 78.286 16.066 0.208 1 7.44 ? CE2 TRP A-2 104 1 
ATOM 2780 C CE3 . TRP A-2 1 104 . 76.504 14.547 0.8 1 8.46 ? CE3 TRP A-2 104 1 
ATOM 2781 C CZ2 . TRP A-2 1 104 . 79.227 15.056 0.263 1 9.54 ? CZ2 TRP A-2 104 1 
ATOM 2782 C CZ3 . TRP A-2 1 104 . 77.463 13.533 0.864 1 10.02 ? CZ3 TRP A-2 104 1 
ATOM 2783 C CH2 . TRP A-2 1 104 . 78.787 13.8 0.587 1 10.56 ? CH2 TRP A-2 104 1 
ATOM 2784 N N . LYS A-2 1 105 . 72.073 17.891 -1.052 1 5.4 ? N LYS A-2 105 1 
ATOM 2785 C CA . LYS A-2 1 105 . 70.607 17.912 -1.183 1 5.79 ? CA LYS A-2 105 1 
ATOM 2786 C C . LYS A-2 1 105 . 70.102 16.56 -1.537 1 5.05 ? C LYS A-2 105 1 
ATOM 2787 O O . LYS A-2 1 105 . 70.531 15.936 -2.515 1 5.76 ? O LYS A-2 105 1 
ATOM 2788 C CB . LYS A-2 1 105 . 70.143 18.93 -2.199 1 5.85 ? CB LYS A-2 105 1 
ATOM 2789 C CG . LYS A-2 1 105 . 70.902 20.274 -2.059 1 6.04 ? CG LYS A-2 105 1 
ATOM 2790 C CD . LYS A-2 1 105 . 70.166 21.397 -2.749 1 5.87 ? CD LYS A-2 105 1 
ATOM 2791 C CE . LYS A-2 1 105 . 70.974 22.679 -2.825 1 5.53 ? CE LYS A-2 105 1 
ATOM 2792 N NZ . LYS A-2 1 105 . 71.5 23.078 -1.494 1 5.28 ? NZ LYS A-2 105 1 
ATOM 2793 N N . VAL A-2 1 106 . 69.171 16.013 -0.747 1 5.18 ? N VAL A-2 106 1 
ATOM 2794 C CA . VAL A-2 1 106 . 68.55 14.755 -1.067 1 5.46 ? CA VAL A-2 106 1 
ATOM 2795 C C . VAL A-2 1 106 . 67.769 14.872 -2.348 1 5.29 ? C VAL A-2 106 1 
ATOM 2796 O O . VAL A-2 1 106 . 67.064 15.867 -2.56 1 5.45 ? O VAL A-2 106 1 
ATOM 2797 C CB . VAL A-2 1 106 . 67.661 14.313 0.078 1 6 ? CB VAL A-2 106 1 
ATOM 2798 C CG1 . VAL A-2 1 106 . 66.819 13.076 -0.271 1 6.49 ? CG1 VAL A-2 106 1 
ATOM 2799 C CG2 . VAL A-2 1 106 . 68.428 14.102 1.377 1 7.83 ? CG2 VAL A-2 106 1 
ATOM 2800 N N . LEU A-2 1 107 . 67.842 13.845 -3.204 1 5.45 ? N LEU A-2 107 1 
ATOM 2801 C CA . LEU A-2 1 107 . 66.934 13.671 -4.345 1 5.03 ? CA LEU A-2 107 1 
ATOM 2802 C C . LEU A-2 1 107 . 65.957 12.576 -3.978 1 5.1 ? C LEU A-2 107 1 
ATOM 2803 O O . LEU A-2 1 107 . 66.384 11.489 -3.56 1 5.76 ? O LEU A-2 107 1 
ATOM 2804 C CB . LEU A-2 1 107 . 67.72 13.288 -5.605 1 6.15 ? CB LEU A-2 107 1 
ATOM 2805 C CG . LEU A-2 1 107 . 66.879 13.177 -6.866 1 6.87 ? CG LEU A-2 107 1 
ATOM 2806 C CD1 . LEU A-2 1 107 . 66.236 14.519 -7.279 1 9.06 ? CD1 LEU A-2 107 1 
ATOM 2807 C CD2 . LEU A-2 1 107 . 67.709 12.598 -7.989 1 9.34 ? CD2 LEU A-2 107 1 
ATOM 2808 N N . ALA A-2 1 108 . 64.664 12.848 -4.119 1 4.93 ? N ALA A-2 108 1 
ATOM 2809 C CA . ALA A-2 1 108 . 63.632 11.944 -3.69 1 5.09 ? CA ALA A-2 108 1 
ATOM 2810 C C . ALA A-2 1 108 . 62.492 11.922 -4.675 1 4.9 ? C ALA A-2 108 1 
ATOM 2811 O O . ALA A-2 1 108 . 62.314 12.852 -5.461 1 5.71 ? O ALA A-2 108 1 
ATOM 2812 C CB . ALA A-2 1 108 . 63.138 12.343 -2.317 1 6.16 ? CB ALA A-2 108 1 
ATOM 2813 N N . VAL A-2 1 109 . 61.674 10.872 -4.565 1 5.35 ? N VAL A-2 109 1 
ATOM 2814 C CA . VAL A-2 1 109 . 60.44 10.756 -5.335 1 5.67 ? CA VAL A-2 109 1 
ATOM 2815 C C . VAL A-2 1 109 . 59.274 10.632 -4.412 1 5.38 ? C VAL A-2 109 1 
ATOM 2816 O O . VAL A-2 1 109 . 59.393 10.114 -3.282 1 6.24 ? O VAL A-2 109 1 
ATOM 2817 C CB . VAL A-2 1 109 . 60.487 9.565 -6.333 1 6.31 ? CB VAL A-2 109 1 
ATOM 2818 C CG1 . VAL A-2 1 109 . 61.538 9.804 -7.432 1 7.55 ? CG1 VAL A-2 109 1 
ATOM 2819 C CG2 . VAL A-2 1 109 . 60.731 8.228 -5.628 1 6.79 ? CG2 VAL A-2 109 1 
ATOM 2820 N N . PRO A-2 1 110 . 58.085 11.054 -4.829 1 5.76 ? N PRO A-2 110 1 
ATOM 2821 C CA . PRO A-2 1 110 . 56.893 10.913 -3.981 1 5.83 ? CA PRO A-2 110 1 
ATOM 2822 C C . PRO A-2 1 110 . 56.515 9.458 -3.849 1 6.46 ? C PRO A-2 110 1 
ATOM 2823 O O . PRO A-2 1 110 . 56.358 8.756 -4.863 1 7.27 ? O PRO A-2 110 1 
ATOM 2824 C CB . PRO A-2 1 110 . 55.804 11.712 -4.742 1 6.89 ? CB PRO A-2 110 1 
ATOM 2825 C CG . PRO A-2 1 110 . 56.291 11.675 -6.186 1 7.94 ? CG PRO A-2 110 1 
ATOM 2826 C CD . PRO A-2 1 110 . 57.79 11.737 -6.106 1 6.7 ? CD PRO A-2 110 1 
ATOM 2827 N N . VAL A-2 1 111 . 56.259 9.012 -2.633 1 6.11 ? N VAL A-2 111 1 
ATOM 2828 C CA . VAL A-2 1 111 . 55.79 7.658 -2.394 1 7.1 ? CA VAL A-2 111 1 
ATOM 2829 C C . VAL A-2 1 111 . 54.443 7.437 -3.081 1 6.97 ? C VAL A-2 111 1 
ATOM 2830 O O . VAL A-2 1 111 . 54.182 6.294 -3.523 1 8.75 ? O VAL A-2 111 1 
ATOM 2831 C CB . VAL A-2 1 111 . 55.699 7.351 -0.886 1 10.46 ? CB VAL A-2 111 1 
ATOM 2832 C CG1 . VAL A-2 1 111 . 54.987 6.082 -0.549 1 14.55 ? CG1 VAL A-2 111 1 
ATOM 2833 C CG2 . VAL A-2 1 111 . 57.092 7.427 -0.266 1 11.66 ? CG2 VAL A-2 111 1 
ATOM 2834 N N A GLU A-2 1 112 . 53.608 8.429 -3.146 0.68 6.21 ? N GLU A-2 112 1 
ATOM 2835 N N B GLU A-2 1 112 . 53.58 8.502 -3.122 0.32 7.43 ? N GLU A-2 112 1 
ATOM 2836 C CA A GLU A-2 1 112 . 52.24 8.229 -3.574 0.68 6.76 ? CA GLU A-2 112 1 
ATOM 2837 C CA B GLU A-2 1 112 . 52.153 8.448 -3.63 0.32 7.98 ? CA GLU A-2 112 1 
ATOM 2838 C C A GLU A-2 1 112 . 51.994 8.767 -4.989 0.68 6.52 ? C GLU A-2 112 1 
ATOM 2839 C C B GLU A-2 1 112 . 51.972 8.512 -5.133 0.32 8.38 ? C GLU A-2 112 1 
ATOM 2840 O O A GLU A-2 1 112 . 50.877 9.118 -5.312 0.68 7.85 ? O GLU A-2 112 1 
ATOM 2841 O O B GLU A-2 1 112 . 50.859 8.381 -5.636 0.32 10.31 ? O GLU A-2 112 1 
ATOM 2842 C CB A GLU A-2 1 112 . 51.3 8.878 -2.567 0.68 7.42 ? CB GLU A-2 112 1 
ATOM 2843 C CB B GLU A-2 1 112 . 51.266 9.592 -3.091 0.32 9.3 ? CB GLU A-2 112 1 
ATOM 2844 C CG A GLU A-2 1 112 . 51.407 8.246 -1.196 0.68 9.27 ? CG GLU A-2 112 1 
ATOM 2845 C CG B GLU A-2 1 112 . 51.091 9.581 -1.598 0.32 10.72 ? CG GLU A-2 112 1 
ATOM 2846 C CD A GLU A-2 1 112 . 51.036 6.814 -1.087 0.68 12.08 ? CD GLU A-2 112 1 
ATOM 2847 C CD B GLU A-2 1 112 . 50.422 8.341 -1.038 0.32 11.17 ? CD GLU A-2 112 1 
ATOM 2848 O OE1 A GLU A-2 1 112 . 50.426 6.26 -2.006 0.68 14.63 ? OE1 GLU A-2 112 1 
ATOM 2849 O OE1 B GLU A-2 1 112 . 49.728 7.582 -1.803 0.32 13.11 ? OE1 GLU A-2 112 1 
ATOM 2850 O OE2 A GLU A-2 1 112 . 51.324 6.162 -0.05 0.68 17.51 ? OE2 GLU A-2 112 1 
ATOM 2851 O OE2 B GLU A-2 1 112 . 50.464 8.094 0.165 0.32 12.44 ? OE2 GLU A-2 112 1 
ATOM 2852 N N . ASP A-2 1 113 . 53.013 8.73 -5.877 1 6.66 ? N ASP A-2 113 1 
ATOM 2853 C CA . ASP A-2 1 113 . 52.843 8.797 -7.323 1 6.75 ? CA ASP A-2 113 1 
ATOM 2854 C C . ASP A-2 1 113 . 53.343 7.489 -7.915 1 6.26 ? C ASP A-2 113 1 
ATOM 2855 O O . ASP A-2 1 113 . 54.555 7.251 -7.901 1 6.64 ? O ASP A-2 113 1 
ATOM 2856 C CB . ASP A-2 1 113 . 53.565 9.97 -7.932 1 6.88 ? CB ASP A-2 113 1 
ATOM 2857 C CG . ASP A-2 1 113 . 53.31 10.12 -9.413 1 6.94 ? CG ASP A-2 113 1 
ATOM 2858 O OD1 . ASP A-2 1 113 . 52.679 9.22 -10.006 1 7.21 ? OD1 ASP A-2 113 1 
ATOM 2859 O OD2 . ASP A-2 1 113 . 53.736 11.18 -9.987 1 7.37 ? OD2 ASP A-2 113 1 
ATOM 2860 N N . PRO A-2 1 114 . 52.459 6.653 -8.452 1 6.94 ? N PRO A-2 114 1 
ATOM 2861 C CA . PRO A-2 1 114 . 52.883 5.366 -8.954 1 7.18 ? CA PRO A-2 114 1 
ATOM 2862 C C . PRO A-2 1 114 . 53.802 5.458 -10.144 1 6.53 ? C PRO A-2 114 1 
ATOM 2863 O O . PRO A-2 1 114 . 54.532 4.485 -10.438 1 7.21 ? O PRO A-2 114 1 
ATOM 2864 C CB . PRO A-2 1 114 . 51.546 4.649 -9.28 1 8.19 ? CB PRO A-2 114 1 
ATOM 2865 C CG . PRO A-2 1 114 . 50.619 5.783 -9.661 1 9.14 ? CG PRO A-2 114 1 
ATOM 2866 C CD . PRO A-2 1 114 . 50.97 6.89 -8.656 1 8.43 ? CD PRO A-2 114 1 
ATOM 2867 N N . TYR A-2 1 115 . 53.866 6.592 -10.819 1 6.45 ? N TYR A-2 115 1 
ATOM 2868 C CA . TYR A-2 1 115 . 54.849 6.8 -11.906 1 6.22 ? CA TYR A-2 115 1 
ATOM 2869 C C . TYR A-2 1 115 . 56.24 6.435 -11.437 1 6.34 ? C TYR A-2 115 1 
ATOM 2870 O O . TYR A-2 1 115 . 57.045 5.943 -12.222 1 7.45 ? O TYR A-2 115 1 
ATOM 2871 C CB . TYR A-2 1 115 . 54.775 8.257 -12.345 1 6.58 ? CB TYR A-2 115 1 
ATOM 2872 C CG . TYR A-2 1 115 . 55.631 8.569 -13.545 1 6.3 ? CG TYR A-2 115 1 
ATOM 2873 C CD1 . TYR A-2 1 115 . 56.956 8.935 -13.384 1 7.18 ? CD1 TYR A-2 115 1 
ATOM 2874 C CD2 . TYR A-2 1 115 . 55.094 8.559 -14.821 1 6.78 ? CD2 TYR A-2 115 1 
ATOM 2875 C CE1 . TYR A-2 1 115 . 57.736 9.236 -14.499 1 8.14 ? CE1 TYR A-2 115 1 
ATOM 2876 C CE2 . TYR A-2 1 115 . 55.859 8.901 -15.91 1 8.1 ? CE2 TYR A-2 115 1 
ATOM 2877 C CZ . TYR A-2 1 115 . 57.199 9.193 -15.744 1 8.5 ? CZ TYR A-2 115 1 
ATOM 2878 O OH . TYR A-2 1 115 . 57.965 9.467 -16.864 1 11.03 ? OH TYR A-2 115 1 
ATOM 2879 N N . PHE A-2 1 116 . 56.559 6.75 -10.169 1 6.4 ? N PHE A-2 116 1 
ATOM 2880 C CA . PHE A-2 1 116 . 57.911 6.605 -9.631 1 6.99 ? CA PHE A-2 116 1 
ATOM 2881 C C . PHE A-2 1 116 . 58.116 5.303 -8.852 1 7.8 ? C PHE A-2 116 1 
ATOM 2882 O O . PHE A-2 1 116 . 59.149 5.157 -8.202 1 8.48 ? O PHE A-2 116 1 
ATOM 2883 C CB . PHE A-2 1 116 . 58.293 7.828 -8.782 1 7.8 ? CB PHE A-2 116 1 
ATOM 2884 C CG . PHE A-2 1 116 . 58.31 9.091 -9.565 1 6.87 ? CG PHE A-2 116 1 
ATOM 2885 C CD1 . PHE A-2 1 116 . 57.275 9.993 -9.476 1 7.33 ? CD1 PHE A-2 116 1 
ATOM 2886 C CD2 . PHE A-2 1 116 . 59.369 9.381 -10.416 1 7.83 ? CD2 PHE A-2 116 1 
ATOM 2887 C CE1 . PHE A-2 1 116 . 57.28 11.169 -10.223 1 8.12 ? CE1 PHE A-2 116 1 
ATOM 2888 C CE2 . PHE A-2 1 116 . 59.384 10.583 -11.181 1 7.83 ? CE2 PHE A-2 116 1 
ATOM 2889 C CZ . PHE A-2 1 116 . 58.33 11.44 -11.058 1 8.23 ? CZ PHE A-2 116 1 
ATOM 2890 N N . ASN A-2 1 117 . 57.188 4.354 -8.94 1 8.52 ? N ASN A-2 117 1 
ATOM 2891 C CA . ASN A-2 1 117 . 57.249 3.166 -8.089 1 9.83 ? CA ASN A-2 117 1 
ATOM 2892 C C . ASN A-2 1 117 . 58.575 2.435 -8.238 1 11.44 ? C ASN A-2 117 1 
ATOM 2893 O O . ASN A-2 1 117 . 59.04 1.855 -7.242 1 13.82 ? O ASN A-2 117 1 
ATOM 2894 C CB . ASN A-2 1 117 . 56.103 2.2 -8.385 1 11.42 ? CB ASN A-2 117 1 
ATOM 2895 C CG . ASN A-2 1 117 . 54.803 2.61 -7.736 1 12.81 ? CG ASN A-2 117 1 
ATOM 2896 O OD1 . ASN A-2 1 117 . 54.747 3.449 -6.832 1 14.65 ? OD1 ASN A-2 117 1 
ATOM 2897 N ND2 . ASN A-2 1 117 . 53.715 1.986 -8.227 1 16.66 ? ND2 ASN A-2 117 1 
ATOM 2898 N N . ASP A-2 1 118 . 59.136 2.389 -9.428 0.85 9.6 ? N ASP A-2 118 1 
ATOM 2899 C CA . ASP A-2 1 118 . 60.352 1.662 -9.684 0.85 11.44 ? CA ASP A-2 118 1 
ATOM 2900 C C . ASP A-2 1 118 . 61.627 2.537 -9.564 0.85 12.72 ? C ASP A-2 118 1 
ATOM 2901 O O . ASP A-2 1 118 . 62.705 2.071 -9.833 0.85 15.86 ? O ASP A-2 118 1 
ATOM 2902 C CB . ASP A-2 1 118 . 60.27 0.908 -10.992 0.85 13.44 ? CB ASP A-2 118 1 
ATOM 2903 C CG . ASP A-2 1 118 . 59.085 -0.096 -11.001 0.85 18.97 ? CG ASP A-2 118 1 
ATOM 2904 O OD1 . ASP A-2 1 118 . 58.821 -0.81 -10.007 0.85 24.02 ? OD1 ASP A-2 118 1 
ATOM 2905 O OD2 . ASP A-2 1 118 . 58.285 -0.136 -11.926 0.85 23.93 ? OD2 ASP A-2 118 1 
ATOM 2906 N N . TRP A-2 1 119 . 61.502 3.774 -9.13 1 11.67 ? N TRP A-2 119 1 
ATOM 2907 C CA . TRP A-2 1 119 . 62.639 4.671 -8.867 1 11.02 ? CA TRP A-2 119 1 
ATOM 2908 C C . TRP A-2 1 119 . 63.05 4.487 -7.446 1 9.51 ? C TRP A-2 119 1 
ATOM 2909 O O . TRP A-2 1 119 . 62.351 4.95 -6.555 1 9.97 ? O TRP A-2 119 1 
ATOM 2910 C CB . TRP A-2 1 119 . 62.333 6.128 -9.156 1 10.49 ? CB TRP A-2 119 1 
ATOM 2911 C CG . TRP A-2 1 119 . 62.07 6.503 -10.579 1 13.41 ? CG TRP A-2 119 1 
ATOM 2912 C CD1 . TRP A-2 1 119 . 61.359 5.771 -11.474 1 18.44 ? CD1 TRP A-2 119 1 
ATOM 2913 C CD2 . TRP A-2 1 119 . 62.487 7.679 -11.237 1 13.33 ? CD2 TRP A-2 119 1 
ATOM 2914 N NE1 . TRP A-2 1 119 . 61.268 6.51 -12.671 1 20.76 ? NE1 TRP A-2 119 1 
ATOM 2915 C CE2 . TRP A-2 1 119 . 62.027 7.642 -12.586 1 17.13 ? CE2 TRP A-2 119 1 
ATOM 2916 C CE3 . TRP A-2 1 119 . 63.183 8.749 -10.833 1 12.72 ? CE3 TRP A-2 119 1 
ATOM 2917 C CZ2 . TRP A-2 1 119 . 62.141 8.733 -13.427 1 18.76 ? CZ2 TRP A-2 119 1 
ATOM 2918 C CZ3 . TRP A-2 1 119 . 63.373 9.782 -11.691 1 13.99 ? CZ3 TRP A-2 119 1 
ATOM 2919 C CH2 . TRP A-2 1 119 . 62.886 9.769 -12.979 1 15.54 ? CH2 TRP A-2 119 1 
ATOM 2920 N N . LYS A-2 1 120 . 64.198 3.823 -7.247 0.85 8.86 ? N LYS A-2 120 1 
ATOM 2921 C CA . LYS A-2 1 120 . 64.681 3.46 -5.914 1 9.93 ? CA LYS A-2 120 1 
ATOM 2922 C C . LYS A-2 1 120 . 66.126 3.863 -5.667 1 8.83 ? C LYS A-2 120 1 
ATOM 2923 O O . LYS A-2 1 120 . 66.567 3.873 -4.502 0.87 8.69 ? O LYS A-2 120 1 
ATOM 2924 C CB . LYS A-2 1 120 . 64.529 1.963 -5.723 1 12.63 ? CB LYS A-2 120 1 
ATOM 2925 C CG . LYS A-2 1 120 . 63.025 1.573 -5.76 1 15.58 ? CG LYS A-2 120 1 
ATOM 2926 C CD . LYS A-2 1 120 . 62.851 0.178 -5.668 1 21.8 ? CD LYS A-2 120 1 
ATOM 2927 C CE . LYS A-2 1 120 . 61.342 -0.221 -5.8 0.8 37.82 ? CE LYS A-2 120 1 
ATOM 2928 N NZ . LYS A-2 1 120 . 61.124 -1.701 -5.969 1 50.17 ? NZ LYS A-2 120 1 
ATOM 2929 N N . ASP A-2 1 121 . 66.865 4.211 -6.669 1 8.97 ? N ASP A-2 121 1 
ATOM 2930 C CA . ASP A-2 1 121 . 68.27 4.59 -6.495 1 8.83 ? CA ASP A-2 121 1 
ATOM 2931 C C . ASP A-2 1 121 . 68.678 5.508 -7.618 1 8.95 ? C ASP A-2 121 1 
ATOM 2932 O O . ASP A-2 1 121 . 67.914 5.714 -8.606 1 8.9 ? O ASP A-2 121 1 
ATOM 2933 C CB . ASP A-2 1 121 . 69.181 3.352 -6.354 0.84 8.97 ? CB ASP A-2 121 1 
ATOM 2934 C CG . ASP A-2 1 121 . 70.432 3.562 -5.477 0.89 10.23 ? CG ASP A-2 121 1 
ATOM 2935 O OD1 . ASP A-2 1 121 . 70.815 4.663 -5.196 0.96 9.73 ? OD1 ASP A-2 121 1 
ATOM 2936 O OD2 . ASP A-2 1 121 . 70.97 2.549 -5.01 0.74 12.37 ? OD2 ASP A-2 121 1 
ATOM 2937 N N . ILE A-2 1 122 . 69.871 6.054 -7.493 1 8.9 ? N ILE A-2 122 1 
ATOM 2938 C CA . ILE A-2 1 122 . 70.305 7.116 -8.356 1 9.96 ? CA ILE A-2 122 1 
ATOM 2939 C C . ILE A-2 1 122 . 70.425 6.665 -9.807 1 9.77 ? C ILE A-2 122 1 
ATOM 2940 O O . ILE A-2 1 122 . 70.218 7.439 -10.717 1 11.34 ? O ILE A-2 122 1 
ATOM 2941 C CB . ILE A-2 1 122 . 71.619 7.716 -7.759 1 11.1 ? CB ILE A-2 122 1 
ATOM 2942 C CG1 . ILE A-2 1 122 . 71.995 9.044 -8.39 1 14.03 ? CG1 ILE A-2 122 1 
ATOM 2943 C CG2 . ILE A-2 1 122 . 72.782 6.799 -7.784 1 12.56 ? CG2 ILE A-2 122 1 
ATOM 2944 C CD1 . ILE A-2 1 122 . 71.022 10.112 -8.165 1 15.59 ? CD1 ILE A-2 122 1 
ATOM 2945 N N . SER A-2 1 123 . 70.68 5.363 -10.03 1 10.45 ? N SER A-2 123 1 
ATOM 2946 C CA . SER A-2 1 123 . 70.725 4.76 -11.368 1 11.92 ? CA SER A-2 123 1 
ATOM 2947 C C . SER A-2 1 123 . 69.388 4.69 -12.046 1 11.31 ? C SER A-2 123 1 
ATOM 2948 O O . SER A-2 1 123 . 69.39 4.439 -13.28 1 13.56 ? O SER A-2 123 1 
ATOM 2949 C CB . SER A-2 1 123 . 71.341 3.344 -11.286 1 15.55 ? CB SER A-2 123 1 
ATOM 2950 O OG . SER A-2 1 123 . 70.637 2.577 -10.341 1 21.22 ? OG SER A-2 123 1 
ATOM 2951 N N . ASP A-2 1 124 . 68.291 4.906 -11.398 1 8.95 ? N ASP A-2 124 1 
ATOM 2952 C CA . ASP A-2 1 124 . 66.998 4.881 -12.009 1 9.27 ? CA ASP A-2 124 1 
ATOM 2953 C C . ASP A-2 1 124 . 66.621 6.219 -12.678 1 9.42 ? C ASP A-2 124 1 
ATOM 2954 O O . ASP A-2 1 124 . 65.605 6.293 -13.366 1 11.43 ? O ASP A-2 124 1 
ATOM 2955 C CB . ASP A-2 1 124 . 65.967 4.514 -10.968 1 9.94 ? CB ASP A-2 124 1 
ATOM 2956 C CG . ASP A-2 1 124 . 66.128 3.112 -10.434 1 10.3 ? CG ASP A-2 124 1 
ATOM 2957 O OD1 . ASP A-2 1 124 . 66.403 2.206 -11.272 1 12.9 ? OD1 ASP A-2 124 1 
ATOM 2958 O OD2 . ASP A-2 1 124 . 66.031 2.914 -9.231 1 9.65 ? OD2 ASP A-2 124 1 
ATOM 2959 N N . VAL A-2 1 125 . 67.396 7.251 -12.415 1 8.97 ? N VAL A-2 125 1 
ATOM 2960 C CA . VAL A-2 1 125 . 67.076 8.572 -12.934 1 8.19 ? CA VAL A-2 125 1 
ATOM 2961 C C . VAL A-2 1 125 . 67.745 8.77 -14.305 1 8.89 ? C VAL A-2 125 1 
ATOM 2962 O O . VAL A-2 1 125 . 68.915 8.423 -14.491 1 9.9 ? O VAL A-2 125 1 
ATOM 2963 C CB . VAL A-2 1 125 . 67.65 9.649 -11.973 1 8.33 ? CB VAL A-2 125 1 
ATOM 2964 C CG1 . VAL A-2 1 125 . 67.22 11.033 -12.481 1 8.14 ? CG1 VAL A-2 125 1 
ATOM 2965 C CG2 . VAL A-2 1 125 . 67.158 9.39 -10.545 1 9.03 ? CG2 VAL A-2 125 1 
ATOM 2966 N N . PRO A-2 1 126 . 67.042 9.361 -15.281 1 9.05 ? N PRO A-2 126 1 
ATOM 2967 C CA . PRO A-2 1 126 . 67.722 9.672 -16.556 1 9.13 ? CA PRO A-2 126 1 
ATOM 2968 C C . PRO A-2 1 126 . 68.982 10.492 -16.328 1 8.47 ? C PRO A-2 126 1 
ATOM 2969 O O . PRO A-2 1 126 . 68.983 11.478 -15.61 1 8.06 ? O PRO A-2 126 1 
ATOM 2970 C CB . PRO A-2 1 126 . 66.697 10.426 -17.332 1 10.28 ? CB PRO A-2 126 1 
ATOM 2971 C CG . PRO A-2 1 126 . 65.412 9.873 -16.838 1 12.04 ? CG PRO A-2 126 1 
ATOM 2972 C CD . PRO A-2 1 126 . 65.613 9.731 -15.325 1 10.15 ? CD PRO A-2 126 1 
ATOM 2973 N N . LYS A-2 1 127 . 70.089 10.084 -16.977 1 9.37 ? N LYS A-2 127 1 
ATOM 2974 C CA . LYS A-2 1 127 . 71.351 10.776 -16.762 1 10.12 ? CA LYS A-2 127 1 
ATOM 2975 C C . LYS A-2 1 127 . 71.248 12.261 -17.093 1 8.05 ? C LYS A-2 127 1 
ATOM 2976 O O . LYS A-2 1 127 . 71.823 13.11 -16.383 1 8.74 ? O LYS A-2 127 1 
ATOM 2977 C CB . LYS A-2 1 127 . 72.455 10.115 -17.648 1 19.4 ? CB LYS A-2 127 1 
ATOM 2978 C CG . LYS A-2 1 127 . 73.824 10.675 -17.366 1 55.16 ? CG LYS A-2 127 1 
ATOM 2979 C CD . LYS A-2 1 127 . 74.127 10.701 -15.856 1 90.61 ? CD LYS A-2 127 1 
ATOM 2980 C CE . LYS A-2 1 127 . 75.548 11.15 -15.543 1 122.15 ? CE LYS A-2 127 1 
ATOM 2981 N NZ . LYS A-2 1 127 . 75.829 11.027 -14.091 1 151.23 ? NZ LYS A-2 127 1 
ATOM 2982 N N . ALA A-2 1 128 . 70.523 12.605 -18.18 1 6.97 ? N ALA A-2 128 1 
ATOM 2983 C CA . ALA A-2 1 128 . 70.433 13.981 -18.552 1 6.77 ? CA ALA A-2 128 1 
ATOM 2984 C C . ALA A-2 1 128 . 69.701 14.806 -17.484 1 6.08 ? C ALA A-2 128 1 
ATOM 2985 O O . ALA A-2 1 128 . 69.956 16.026 -17.379 1 6.5 ? O ALA A-2 128 1 
ATOM 2986 C CB . ALA A-2 1 128 . 69.741 14.143 -19.876 1 7.98 ? CB ALA A-2 128 1 
ATOM 2987 N N . PHE A-2 1 129 . 68.822 14.206 -16.732 1 5.95 ? N PHE A-2 129 1 
ATOM 2988 C CA . PHE A-2 1 129 . 68.106 14.898 -15.692 1 5.88 ? CA PHE A-2 129 1 
ATOM 2989 C C . PHE A-2 1 129 . 69.038 15.202 -14.507 1 5.89 ? C PHE A-2 129 1 
ATOM 2990 O O . PHE A-2 1 129 . 69.022 16.314 -13.973 1 5.78 ? O PHE A-2 129 1 
ATOM 2991 C CB . PHE A-2 1 129 . 66.867 14.108 -15.255 1 6.44 ? CB PHE A-2 129 1 
ATOM 2992 C CG . PHE A-2 1 129 . 65.941 14.855 -14.341 1 6.34 ? CG PHE A-2 129 1 
ATOM 2993 C CD1 . PHE A-2 1 129 . 65.336 16.035 -14.726 1 7.99 ? CD1 PHE A-2 129 1 
ATOM 2994 C CD2 . PHE A-2 1 129 . 65.676 14.394 -13.079 1 7.95 ? CD2 PHE A-2 129 1 
ATOM 2995 C CE1 . PHE A-2 1 129 . 64.492 16.708 -13.859 1 8.99 ? CE1 PHE A-2 129 1 
ATOM 2996 C CE2 . PHE A-2 1 129 . 64.796 15.061 -12.226 1 10.32 ? CE2 PHE A-2 129 1 
ATOM 2997 C CZ . PHE A-2 1 129 . 64.201 16.227 -12.652 1 9.68 ? CZ PHE A-2 129 1 
ATOM 2998 N N . LEU A-2 1 130 . 69.835 14.22 -14.095 1 5.84 ? N LEU A-2 130 1 
ATOM 2999 C CA . LEU A-2 1 130 . 70.844 14.518 -13.081 1 5.78 ? CA LEU A-2 130 1 
ATOM 3000 C C . LEU A-2 1 130 . 71.754 15.616 -13.531 1 5.7 ? C LEU A-2 130 1 
ATOM 3001 O O . LEU A-2 1 130 . 72.102 16.522 -12.772 1 6.45 ? O LEU A-2 130 1 
ATOM 3002 C CB . LEU A-2 1 130 . 71.63 13.25 -12.757 1 6.96 ? CB LEU A-2 130 1 
ATOM 3003 C CG . LEU A-2 1 130 . 70.85 12.116 -12.116 1 7.2 ? CG LEU A-2 130 1 
ATOM 3004 C CD1 . LEU A-2 1 130 . 71.765 10.954 -11.823 1 9.8 ? CD1 LEU A-2 130 1 
ATOM 3005 C CD2 . LEU A-2 1 130 . 70.138 12.545 -10.841 1 8.35 ? CD2 LEU A-2 130 1 
ATOM 3006 N N . ASP A-2 1 131 . 72.172 15.598 -14.799 1 6.12 ? N ASP A-2 131 1 
ATOM 3007 C CA . ASP A-2 1 131 . 73.044 16.639 -15.318 1 6.35 ? CA ASP A-2 131 1 
ATOM 3008 C C . ASP A-2 1 131 . 72.363 18.007 -15.289 1 5.75 ? C ASP A-2 131 1 
ATOM 3009 O O . ASP A-2 1 131 . 73.015 19 -14.983 1 6.12 ? O ASP A-2 131 1 
ATOM 3010 C CB . ASP A-2 1 131 . 73.481 16.315 -16.74 1 8.56 ? CB ASP A-2 131 1 
ATOM 3011 C CG . ASP A-2 1 131 . 74.411 15.195 -16.854 1 14.46 ? CG ASP A-2 131 1 
ATOM 3012 O OD1 . ASP A-2 1 131 . 74.93 14.656 -15.877 1 15.16 ? OD1 ASP A-2 131 1 
ATOM 3013 O OD2 . ASP A-2 1 131 . 74.545 14.74 -18.032 1 20.29 ? OD2 ASP A-2 131 1 
ATOM 3014 N N . GLU A-2 1 132 . 71.073 18.061 -15.618 1 5.63 ? N GLU A-2 132 1 
ATOM 3015 C CA . GLU A-2 1 132 . 70.369 19.329 -15.652 1 5.6 ? CA GLU A-2 132 1 
ATOM 3016 C C . GLU A-2 1 132 . 70.293 19.926 -14.238 1 5.33 ? C GLU A-2 132 1 
ATOM 3017 O O . GLU A-2 1 132 . 70.412 21.16 -14.055 1 5.66 ? O GLU A-2 132 1 
ATOM 3018 C CB . GLU A-2 1 132 . 68.98 19.214 -16.301 1 6.15 ? CB GLU A-2 132 1 
ATOM 3019 C CG . GLU A-2 1 132 . 67.792 19.074 -15.375 1 6.84 ? CG GLU A-2 132 1 
ATOM 3020 C CD . GLU A-2 1 132 . 66.49 19.142 -16.157 1 6.48 ? CD GLU A-2 132 1 
ATOM 3021 O OE1 . GLU A-2 1 132 . 66.39 18.453 -17.209 1 6.69 ? OE1 GLU A-2 132 1 
ATOM 3022 O OE2 . GLU A-2 1 132 . 65.555 19.86 -15.706 1 6.97 ? OE2 GLU A-2 132 1 
ATOM 3023 N N . ILE A-2 1 133 . 70.065 19.084 -13.244 1 5.42 ? N ILE A-2 133 1 
ATOM 3024 C CA . ILE A-2 1 133 . 69.97 19.554 -11.872 1 5.34 ? CA ILE A-2 133 1 
ATOM 3025 C C . ILE A-2 1 133 . 71.344 20.072 -11.424 1 5.33 ? C ILE A-2 133 1 
ATOM 3026 O O . ILE A-2 1 133 . 71.452 21.177 -10.88 1 5.65 ? O ILE A-2 133 1 
ATOM 3027 C CB . ILE A-2 1 133 . 69.441 18.458 -10.915 1 5.79 ? CB ILE A-2 133 1 
ATOM 3028 C CG1 . ILE A-2 1 133 . 68.024 18.038 -11.291 1 6.07 ? CG1 ILE A-2 133 1 
ATOM 3029 C CG2 . ILE A-2 1 133 . 69.528 18.935 -9.489 1 7.06 ? CG2 ILE A-2 133 1 
ATOM 3030 C CD1 . ILE A-2 1 133 . 67.576 16.758 -10.577 1 7.92 ? CD1 ILE A-2 133 1 
ATOM 3031 N N . ALA A-2 1 134 . 72.375 19.287 -11.639 1 5.41 ? N ALA A-2 134 1 
ATOM 3032 C CA . ALA A-2 1 134 . 73.719 19.713 -11.238 1 5.92 ? CA ALA A-2 134 1 
ATOM 3033 C C . ALA A-2 1 134 . 74.093 21.02 -11.925 1 5.6 ? C ALA A-2 134 1 
ATOM 3034 O O . ALA A-2 1 134 . 74.704 21.884 -11.307 1 6.1 ? O ALA A-2 134 1 
ATOM 3035 C CB . ALA A-2 1 134 . 74.712 18.6 -11.553 1 7.1 ? CB ALA A-2 134 1 
ATOM 3036 N N . HIS A-2 1 135 . 73.792 21.141 -13.23 1 5.58 ? N HIS A-2 135 1 
ATOM 3037 C CA . HIS A-2 1 135 . 74.168 22.333 -13.964 1 5.72 ? CA HIS A-2 135 1 
ATOM 3038 C C . HIS A-2 1 135 . 73.473 23.589 -13.413 1 5.59 ? C HIS A-2 135 1 
ATOM 3039 O O . HIS A-2 1 135 . 74.064 24.659 -13.293 1 5.62 ? O HIS A-2 135 1 
ATOM 3040 C CB . HIS A-2 1 135 . 73.894 22.158 -15.438 1 6.16 ? CB HIS A-2 135 1 
ATOM 3041 C CG . HIS A-2 1 135 . 74.452 23.234 -16.287 1 5.81 ? CG HIS A-2 135 1 
ATOM 3042 N ND1 . HIS A-2 1 135 . 73.709 23.87 -17.238 1 6.31 ? ND1 HIS A-2 135 1 
ATOM 3043 C CD2 . HIS A-2 1 135 . 75.707 23.731 -16.321 1 7.03 ? CD2 HIS A-2 135 1 
ATOM 3044 C CE1 . HIS A-2 1 135 . 74.508 24.749 -17.809 1 6.99 ? CE1 HIS A-2 135 1 
ATOM 3045 N NE2 . HIS A-2 1 135 . 75.72 24.685 -17.274 1 7.1 ? NE2 HIS A-2 135 1 
ATOM 3046 N N . PHE A-2 1 136 . 72.179 23.437 -13.091 1 5.36 ? N PHE A-2 136 1 
ATOM 3047 C CA . PHE A-2 1 136 . 71.472 24.531 -12.433 1 5.33 ? CA PHE A-2 136 1 
ATOM 3048 C C . PHE A-2 1 136 . 72.215 25.014 -11.19 1 5.22 ? C PHE A-2 136 1 
ATOM 3049 O O . PHE A-2 1 136 . 72.461 26.212 -11.027 1 5.59 ? O PHE A-2 136 1 
ATOM 3050 C CB . PHE A-2 1 136 . 70.048 24.038 -12.092 1 5.6 ? CB PHE A-2 136 1 
ATOM 3051 C CG . PHE A-2 1 136 . 69.232 25.007 -11.264 1 5.68 ? CG PHE A-2 136 1 
ATOM 3052 C CD1 . PHE A-2 1 136 . 68.54 26.074 -11.849 1 6.1 ? CD1 PHE A-2 136 1 
ATOM 3053 C CD2 . PHE A-2 1 136 . 69.141 24.839 -9.903 1 6.18 ? CD2 PHE A-2 136 1 
ATOM 3054 C CE1 . PHE A-2 1 136 . 67.792 26.92 -11.027 1 6.38 ? CE1 PHE A-2 136 1 
ATOM 3055 C CE2 . PHE A-2 1 136 . 68.404 25.709 -9.105 1 7.41 ? CE2 PHE A-2 136 1 
ATOM 3056 C CZ . PHE A-2 1 136 . 67.723 26.745 -9.704 1 6.09 ? CZ PHE A-2 136 1 
ATOM 3057 N N . PHE A-2 1 137 . 72.573 24.075 -10.308 1 5.22 ? N PHE A-2 137 1 
ATOM 3058 C CA . PHE A-2 1 137 . 73.258 24.477 -9.077 1 5.53 ? CA PHE A-2 137 1 
ATOM 3059 C C . PHE A-2 1 137 . 74.675 24.956 -9.346 1 5.81 ? C PHE A-2 137 1 
ATOM 3060 O O . PHE A-2 1 137 . 75.194 25.754 -8.554 1 6.75 ? O PHE A-2 137 1 
ATOM 3061 C CB . PHE A-2 1 137 . 73.165 23.366 -8.037 1 6.28 ? CB PHE A-2 137 1 
ATOM 3062 C CG . PHE A-2 1 137 . 71.761 23.194 -7.467 1 5.99 ? CG PHE A-2 137 1 
ATOM 3063 C CD1 . PHE A-2 1 137 . 71.276 24.137 -6.591 1 6.04 ? CD1 PHE A-2 137 1 
ATOM 3064 C CD2 . PHE A-2 1 137 . 70.909 22.204 -7.893 1 6.63 ? CD2 PHE A-2 137 1 
ATOM 3065 C CE1 . PHE A-2 1 137 . 69.99 24.044 -6.078 1 6.64 ? CE1 PHE A-2 137 1 
ATOM 3066 C CE2 . PHE A-2 1 137 . 69.604 22.108 -7.413 1 6.81 ? CE2 PHE A-2 137 1 
ATOM 3067 C CZ . PHE A-2 1 137 . 69.146 23.037 -6.489 1 7.09 ? CZ PHE A-2 137 1 
ATOM 3068 N N . GLN A-2 1 138 . 75.299 24.529 -10.417 1 5.69 ? N GLN A-2 138 1 
ATOM 3069 C CA A GLN A-2 1 138 . 76.604 24.997 -10.805 0.58 5.18 ? CA GLN A-2 138 1 
ATOM 3070 C CA B GLN A-2 1 138 . 76.621 25.016 -10.763 0.42 8.58 ? CA GLN A-2 138 1 
ATOM 3071 C C . GLN A-2 1 138 . 76.585 26.473 -11.227 1 5.78 ? C GLN A-2 138 1 
ATOM 3072 O O . GLN A-2 1 138 . 77.58 27.163 -11.006 1 6.9 ? O GLN A-2 138 1 
ATOM 3073 C CB A GLN A-2 1 138 . 77.149 24.133 -11.969 0.58 5 ? CB GLN A-2 138 1 
ATOM 3074 C CB B GLN A-2 1 138 . 77.238 24.213 -11.895 0.42 12.08 ? CB GLN A-2 138 1 
ATOM 3075 C CG A GLN A-2 1 138 . 78.565 24.39 -12.334 0.58 7.28 ? CG GLN A-2 138 1 
ATOM 3076 C CG B GLN A-2 1 138 . 77.702 22.891 -11.49 0.42 12.47 ? CG GLN A-2 138 1 
ATOM 3077 C CD A GLN A-2 1 138 . 79.12 23.58 -13.43 0.58 11.27 ? CD GLN A-2 138 1 
ATOM 3078 C CD B GLN A-2 1 138 . 78.295 22.104 -12.629 0.42 15.04 ? CD GLN A-2 138 1 
ATOM 3079 O OE1 A GLN A-2 1 138 . 80.339 23.404 -13.474 0.58 18.8 ? OE1 GLN A-2 138 1 
ATOM 3080 O OE1 B GLN A-2 1 138 . 79.349 21.454 -12.457 0.42 18.94 ? OE1 GLN A-2 138 1 
ATOM 3081 N NE2 A GLN A-2 1 138 . 78.357 23.137 -14.275 0.58 12.35 ? NE2 GLN A-2 138 1 
ATOM 3082 N NE2 B GLN A-2 1 138 . 77.702 22.166 -13.787 0.42 14.43 ? NE2 GLN A-2 138 1 
ATOM 3083 N N . ARG A-2 1 139 . 75.529 26.915 -11.905 1 5.69 ? N ARG A-2 139 1 
ATOM 3084 C CA A ARG A-2 1 139 . 75.512 28.208 -12.628 0.57 5.65 ? CA ARG A-2 139 1 
ATOM 3085 C CA B ARG A-2 1 139 . 75.542 28.239 -12.508 0.43 7.1 ? CA ARG A-2 139 1 
ATOM 3086 C C . ARG A-2 1 139 . 74.55 29.232 -12.01 1 5.81 ? C ARG A-2 139 1 
ATOM 3087 O O . ARG A-2 1 139 . 74.681 30.439 -12.325 1 6.48 ? O ARG A-2 139 1 
ATOM 3088 C CB A ARG A-2 1 139 . 75.349 28.043 -14.152 0.57 5.73 ? CB ARG A-2 139 1 
ATOM 3089 C CB B ARG A-2 1 139 . 75.251 28.099 -14.001 0.43 7.85 ? CB ARG A-2 139 1 
ATOM 3090 C CG A ARG A-2 1 139 . 76.403 27.177 -14.802 0.57 6.63 ? CG ARG A-2 139 1 
ATOM 3091 C CG B ARG A-2 1 139 . 76.365 27.399 -14.814 0.43 9.66 ? CG ARG A-2 139 1 
ATOM 3092 C CD A ARG A-2 1 139 . 77.804 27.756 -14.613 0.57 8.67 ? CD ARG A-2 139 1 
ATOM 3093 C CD B ARG A-2 1 139 . 77.737 28.004 -14.586 0.43 8.53 ? CD ARG A-2 139 1 
ATOM 3094 N NE A ARG A-2 1 139 . 78.77 26.943 -15.329 0.57 9.6 ? NE ARG A-2 139 1 
ATOM 3095 N NE B ARG A-2 1 139 . 78.712 27.55 -15.565 0.43 7.91 ? NE ARG A-2 139 1 
ATOM 3096 C CZ A ARG A-2 1 139 . 80.019 26.814 -14.986 0.57 12.06 ? CZ ARG A-2 139 1 
ATOM 3097 C CZ B ARG A-2 1 139 . 79.973 27.908 -15.522 0.43 8.48 ? CZ ARG A-2 139 1 
ATOM 3098 N NH1 A ARG A-2 1 139 . 80.489 27.399 -13.894 0.57 14.03 ? NH1 ARG A-2 139 1 
ATOM 3099 N NH1 B ARG A-2 1 139 . 80.435 28.726 -14.561 0.43 11.47 ? NH1 ARG A-2 139 1 
ATOM 3100 N NH2 A ARG A-2 1 139 . 80.791 26.053 -15.76 0.57 14.24 ? NH2 ARG A-2 139 1 
ATOM 3101 N NH2 B ARG A-2 1 139 . 80.815 27.532 -16.49 0.43 10.75 ? NH2 ARG A-2 139 1 
ATOM 3102 N N . TYR A-2 1 140 . 73.553 28.827 -11.239 1 5.75 ? N TYR A-2 140 1 
ATOM 3103 C CA . TYR A-2 1 140 . 72.484 29.748 -10.9 1 6.16 ? CA TYR A-2 140 1 
ATOM 3104 C C . TYR A-2 1 140 . 72.885 30.943 -10.026 1 6.02 ? C TYR A-2 140 1 
ATOM 3105 O O . TYR A-2 1 140 . 72.131 31.921 -10.034 1 7.17 ? O TYR A-2 140 1 
ATOM 3106 C CB . TYR A-2 1 140 . 71.282 29.021 -10.248 1 6.11 ? CB TYR A-2 140 1 
ATOM 3107 C CG . TYR A-2 1 140 . 71.441 28.602 -8.81 1 5.87 ? CG TYR A-2 140 1 
ATOM 3108 C CD1 . TYR A-2 1 140 . 72.631 28.013 -8.334 1 5.89 ? CD1 TYR A-2 140 1 
ATOM 3109 C CD2 . TYR A-2 1 140 . 70.368 28.706 -7.934 1 7.11 ? CD2 TYR A-2 140 1 
ATOM 3110 C CE1 . TYR A-2 1 140 . 72.685 27.583 -7.001 1 6.5 ? CE1 TYR A-2 140 1 
ATOM 3111 C CE2 . TYR A-2 1 140 . 70.419 28.275 -6.641 1 7.2 ? CE2 TYR A-2 140 1 
ATOM 3112 C CZ . TYR A-2 1 140 . 71.594 27.685 -6.174 1 6.47 ? CZ TYR A-2 140 1 
ATOM 3113 O OH . TYR A-2 1 140 . 71.678 27.197 -4.897 1 7.76 ? OH TYR A-2 140 1 
ATOM 3114 N N A LYS A-2 1 141 . 74.066 30.877 -9.444 0.65 6.54 ? N LYS A-2 141 1 
ATOM 3115 N N B LYS A-2 1 141 . 73.941 30.88 -9.156 0.35 4.65 ? N LYS A-2 141 1 
ATOM 3116 C CA A LYS A-2 1 141 . 74.535 32.009 -8.617 0.65 6.74 ? CA LYS A-2 141 1 
ATOM 3117 C CA B LYS A-2 1 141 . 74.371 31.982 -8.275 0.35 4.38 ? CA LYS A-2 141 1 
ATOM 3118 C C A LYS A-2 1 141 . 75.661 32.745 -9.305 0.65 5.45 ? C LYS A-2 141 1 
ATOM 3119 C C B LYS A-2 1 141 . 75.547 32.786 -8.894 0.35 4.67 ? C LYS A-2 141 1 
ATOM 3120 O O A LYS A-2 1 141 . 76.263 33.639 -8.722 0.65 6.34 ? O LYS A-2 141 1 
ATOM 3121 O O B LYS A-2 1 141 . 76.105 33.684 -8.235 0.35 4.3 ? O LYS A-2 141 1 
ATOM 3122 C CB A LYS A-2 1 141 . 74.985 31.546 -7.208 0.65 7.81 ? CB LYS A-2 141 1 
ATOM 3123 C CB B LYS A-2 1 141 . 74.764 31.459 -6.893 0.35 5.84 ? CB LYS A-2 141 1 
ATOM 3124 C CG A LYS A-2 1 141 . 73.85 31.071 -6.324 0.65 8.83 ? CG LYS A-2 141 1 
ATOM 3125 C CG B LYS A-2 1 141 . 73.551 31.019 -6.182 0.35 6.48 ? CG LYS A-2 141 1 
ATOM 3126 C CD A LYS A-2 1 141 . 74.322 30.777 -4.846 0.65 11.13 ? CD LYS A-2 141 1 
ATOM 3127 C CD B LYS A-2 1 141 . 73.867 30.395 -4.837 0.35 5.7 ? CD LYS A-2 141 1 
ATOM 3128 C CE A LYS A-2 1 141 . 73.165 30.19 -4.021 0.65 12.78 ? CE LYS A-2 141 1 
ATOM 3129 C CE B LYS A-2 1 141 . 74.793 31.258 -3.992 0.35 8 ? CE LYS A-2 141 1 
ATOM 3130 N NZ A LYS A-2 1 141 . 73.46 30.319 -2.52 0.65 12.01 ? NZ LYS A-2 141 1 
ATOM 3131 N NZ B LYS A-2 1 141 . 74.971 30.582 -2.662 0.35 6.96 ? NZ LYS A-2 141 1 
ATOM 3132 N N A GLU A-2 1 142 . 75.95 32.444 -10.549 0.65 6.12 ? N GLU A-2 142 1 
ATOM 3133 N N B GLU A-2 1 142 . 75.882 32.509 -10.151 0.35 4.14 ? N GLU A-2 142 1 
ATOM 3134 C CA A GLU A-2 1 142 . 77.127 33.073 -11.168 0.65 6.63 ? CA GLU A-2 142 1 
ATOM 3135 C CA B GLU A-2 1 142 . 76.989 33.188 -10.799 0.35 5.65 ? CA GLU A-2 142 1 
ATOM 3136 C C A GLU A-2 1 142 . 76.97 34.613 -11.171 0.65 5.71 ? C GLU A-2 142 1 
ATOM 3137 C C B GLU A-2 1 142 . 76.889 34.699 -10.792 0.35 7.42 ? C GLU A-2 142 1 
ATOM 3138 O O A GLU A-2 1 142 . 77.912 35.336 -10.86 0.65 6.22 ? O GLU A-2 142 1 
ATOM 3139 O O B GLU A-2 1 142 . 77.889 35.425 -10.44 0.35 14.7 ? O GLU A-2 142 1 
ATOM 3140 C CB A GLU A-2 1 142 . 77.365 32.507 -12.518 0.65 6.24 ? CB GLU A-2 142 1 
ATOM 3141 C CB B GLU A-2 1 142 . 77.12 32.695 -12.25 0.35 8.82 ? CB GLU A-2 142 1 
ATOM 3142 C CG A GLU A-2 1 142 . 78.54 32.94 -13.091 0.65 8.74 ? CG GLU A-2 142 1 
ATOM 3143 C CG B GLU A-2 1 142 . 77.978 31.39 -12.357 0.35 14.22 ? CG GLU A-2 142 1 
ATOM 3144 C CD A GLU A-2 1 142 . 78.918 32.219 -14.407 0.65 9.36 ? CD GLU A-2 142 1 
ATOM 3145 C CD B GLU A-2 1 142 . 78.549 30.977 -13.749 0.35 13.68 ? CD GLU A-2 142 1 
ATOM 3146 O OE1 A GLU A-2 1 142 . 78.063 31.381 -14.965 0.65 7.7 ? OE1 GLU A-2 142 1 
ATOM 3147 O OE1 B GLU A-2 1 142 . 78.17 31.486 -14.811 0.35 16.25 ? OE1 GLU A-2 142 1 
ATOM 3148 O OE2 A GLU A-2 1 142 . 80.065 32.454 -14.822 0.65 15.28 ? OE2 GLU A-2 142 1 
ATOM 3149 O OE2 B GLU A-2 1 142 . 79.559 30.236 -13.677 0.35 15.47 ? OE2 GLU A-2 142 1 
ATOM 3150 N N . LEU A-2 1 143 . 75.776 35.187 -11.379 1 7.31 ? N LEU A-2 143 1 
ATOM 3151 C CA . LEU A-2 1 143 . 75.621 36.63 -11.442 1 7.31 ? CA LEU A-2 143 1 
ATOM 3152 C C . LEU A-2 1 143 . 75.574 37.278 -10.059 1 8.47 ? C LEU A-2 143 1 
ATOM 3153 O O . LEU A-2 1 143 . 75.727 38.5 -9.951 1 10.57 ? O LEU A-2 143 1 
ATOM 3154 C CB . LEU A-2 1 143 . 74.372 37.034 -12.225 1 7.31 ? CB LEU A-2 143 1 
ATOM 3155 C CG . LEU A-2 1 143 . 74.409 36.713 -13.736 1 8.14 ? CG LEU A-2 143 1 
ATOM 3156 C CD1 . LEU A-2 1 143 . 73.11 37.243 -14.346 1 7.91 ? CD1 LEU A-2 143 1 
ATOM 3157 C CD2 . LEU A-2 1 143 . 75.62 37.324 -14.399 1 11.51 ? CD2 LEU A-2 143 1 
ATOM 3158 N N . GLN A-2 1 144 . 75.365 36.491 -9.019 1 8.41 ? N GLN A-2 144 1 
ATOM 3159 C CA . GLN A-2 1 144 . 75.533 36.993 -7.665 1 10.9 ? CA GLN A-2 144 1 
ATOM 3160 C C . GLN A-2 1 144 . 76.962 37.037 -7.199 1 11.54 ? C GLN A-2 144 1 
ATOM 3161 O O . GLN A-2 1 144 . 77.273 37.565 -6.141 1 14.83 ? O GLN A-2 144 1 
ATOM 3162 C CB . GLN A-2 1 144 . 74.772 36.145 -6.681 1 10.83 ? CB GLN A-2 144 1 
ATOM 3163 C CG . GLN A-2 1 144 . 73.287 36.13 -6.898 1 11.64 ? CG GLN A-2 144 1 
ATOM 3164 C CD . GLN A-2 1 144 . 72.525 35.204 -5.914 1 12.36 ? CD GLN A-2 144 1 
ATOM 3165 O OE1 . GLN A-2 1 144 . 71.836 34.218 -6.267 1 13.75 ? OE1 GLN A-2 144 1 
ATOM 3166 N NE2 . GLN A-2 1 144 . 72.615 35.561 -4.661 1 15.89 ? NE2 GLN A-2 144 1 
ATOM 3167 N N . GLY A-2 1 145 . 77.861 36.471 -7.959 1 11.6 ? N GLY A-2 145 1 
ATOM 3168 C CA . GLY A-2 1 145 . 79.264 36.454 -7.547 1 13.97 ? CA GLY A-2 145 1 
ATOM 3169 C C . GLY A-2 1 145 . 79.498 35.49 -6.393 1 14.34 ? C GLY A-2 145 1 
ATOM 3170 O O . GLY A-2 1 145 . 80.446 35.705 -5.668 1 20.37 ? O GLY A-2 145 1 
ATOM 3171 N N . LYS A-2 1 146 . 78.712 34.445 -6.265 1 10.17 ? N LYS A-2 146 1 
ATOM 3172 C CA . LYS A-2 1 146 . 78.868 33.479 -5.206 1 10 ? CA LYS A-2 146 1 
ATOM 3173 C C . LYS A-2 1 146 . 79.306 32.158 -5.786 1 11.72 ? C LYS A-2 146 1 
ATOM 3174 O O . LYS A-2 1 146 . 78.794 31.747 -6.792 1 22.27 ? O LYS A-2 146 1 
ATOM 3175 C CB . LYS A-2 1 146 . 77.63 33.324 -4.403 1 12.21 ? CB LYS A-2 146 1 
ATOM 3176 C CG . LYS A-2 1 146 . 77.267 34.653 -3.684 1 22.54 ? CG LYS A-2 146 1 
ATOM 3177 C CD . LYS A-2 1 146 . 76.038 34.544 -2.824 1 52.94 ? CD LYS A-2 146 1 
ATOM 3178 C CE . LYS A-2 1 146 . 75.89 35.746 -1.958 1 80.4 ? CE LYS A-2 146 1 
ATOM 3179 N NZ . LYS A-2 1 146 . 74.732 35.617 -1.041 1 103.43 ? NZ LYS A-2 146 1 
ATOM 3180 N N . THR A-2 1 147 . 80.206 31.478 -5.159 1 7.27 ? N THR A-2 147 1 
ATOM 3181 C CA . THR A-2 1 147 . 80.772 30.23 -5.672 1 6.89 ? CA THR A-2 147 1 
ATOM 3182 C C . THR A-2 1 147 . 79.988 29.031 -5.212 1 6.26 ? C THR A-2 147 1 
ATOM 3183 O O . THR A-2 1 147 . 79.687 28.88 -4.054 1 8.18 ? O THR A-2 147 1 
ATOM 3184 C CB . THR A-2 1 147 . 82.224 30.117 -5.174 1 7.69 ? CB THR A-2 147 1 
ATOM 3185 O OG1 . THR A-2 1 147 . 82.936 31.205 -5.803 1 9.78 ? OG1 THR A-2 147 1 
ATOM 3186 C CG2 . THR A-2 1 147 . 82.846 28.794 -5.476 1 9.33 ? CG2 THR A-2 147 1 
ATOM 3187 N N . THR A-2 1 148 . 79.728 28.144 -6.174 1 6.5 ? N THR A-2 148 1 
ATOM 3188 C CA . THR A-2 1 148 . 79.19 26.829 -5.859 1 6.74 ? CA THR A-2 148 1 
ATOM 3189 C C . THR A-2 1 148 . 80.089 25.779 -6.508 1 6.73 ? C THR A-2 148 1 
ATOM 3190 O O . THR A-2 1 148 . 80.757 26.041 -7.529 1 8.17 ? O THR A-2 148 1 
ATOM 3191 C CB . THR A-2 1 148 . 77.748 26.641 -6.352 1 7.06 ? CB THR A-2 148 1 
ATOM 3192 O OG1 . THR A-2 1 148 . 77.782 26.575 -7.788 1 8.84 ? OG1 THR A-2 148 1 
ATOM 3193 C CG2 . THR A-2 1 148 . 76.835 27.751 -5.875 1 7.62 ? CG2 THR A-2 148 1 
ATOM 3194 N N . LYS A-2 1 149 . 80.098 24.599 -5.929 1 7.22 ? N LYS A-2 149 1 
ATOM 3195 C CA . LYS A-2 1 149 . 80.856 23.477 -6.478 1 8.59 ? CA LYS A-2 149 1 
ATOM 3196 C C . LYS A-2 1 149 . 79.982 22.242 -6.382 1 8.3 ? C LYS A-2 149 1 
ATOM 3197 O O . LYS A-2 1 149 . 79.474 21.93 -5.312 1 9.71 ? O LYS A-2 149 1 
ATOM 3198 C CB . LYS A-2 1 149 . 82.143 23.246 -5.726 1 11.47 ? CB LYS A-2 149 1 
ATOM 3199 C CG . LYS A-2 1 149 . 83.035 22.238 -6.312 1 18.91 ? CG LYS A-2 149 1 
ATOM 3200 C CD . LYS A-2 1 149 . 84.441 22.159 -5.635 1 24.49 ? CD LYS A-2 149 1 
ATOM 3201 C CE . LYS A-2 1 149 . 85.174 23.492 -5.606 1 27.79 ? CE LYS A-2 149 1 
ATOM 3202 N NZ . LYS A-2 1 149 . 86.666 23.161 -5.268 1 30.16 ? NZ LYS A-2 149 1 
ATOM 3203 N N . ILE A-2 1 150 . 79.845 21.512 -7.489 1 8.1 ? N ILE A-2 150 1 
ATOM 3204 C CA . ILE A-2 1 150 . 79.092 20.296 -7.503 1 8.49 ? CA ILE A-2 150 1 
ATOM 3205 C C . ILE A-2 1 150 . 80.069 19.138 -7.712 1 9.29 ? C ILE A-2 150 1 
ATOM 3206 O O . ILE A-2 1 150 . 80.74 19.077 -8.738 1 14.86 ? O ILE A-2 150 1 
ATOM 3207 C CB . ILE A-2 1 150 . 77.972 20.306 -8.6 1 12.17 ? CB ILE A-2 150 1 
ATOM 3208 C CG1 . ILE A-2 1 150 . 77.218 21.616 -8.63 1 16.32 ? CG1 ILE A-2 150 1 
ATOM 3209 C CG2 . ILE A-2 1 150 . 77.1 19.007 -8.45 1 15.08 ? CG2 ILE A-2 150 1 
ATOM 3210 C CD1 . ILE A-2 1 150 . 76.49 21.88 -7.421 1 20.28 ? CD1 ILE A-2 150 1 
ATOM 3211 N N . GLU A-2 1 151 . 80.163 18.291 -6.762 0.79 7.82 ? N GLU A-2 151 1 
ATOM 3212 C CA . GLU A-2 1 151 . 81.072 17.141 -6.806 0.79 10.79 ? CA GLU A-2 151 1 
ATOM 3213 C C . GLU A-2 1 151 . 80.585 15.972 -7.557 0.79 13.76 ? C GLU A-2 151 1 
ATOM 3214 O O . GLU A-2 1 151 . 81.399 15.317 -8.279 0.79 17.94 ? O GLU A-2 151 1 
ATOM 3215 C CB . GLU A-2 1 151 . 81.555 16.8 -5.384 0.79 14.75 ? CB GLU A-2 151 1 
ATOM 3216 C CG . GLU A-2 1 151 . 82.222 15.492 -5.246 0.79 27.48 ? CG GLU A-2 151 1 
ATOM 3217 C CD . GLU A-2 1 151 . 82.373 14.994 -3.751 0.79 29.46 ? CD GLU A-2 151 1 
ATOM 3218 O OE1 . GLU A-2 1 151 . 82.755 13.819 -3.633 0.79 29.14 ? OE1 GLU A-2 151 1 
ATOM 3219 O OE2 . GLU A-2 1 151 . 82.177 15.702 -2.671 0.79 29.71 ? OE2 GLU A-2 151 1 
ATOM 3220 N N . GLY A-2 1 152 . 79.334 15.79 -7.617 1 11.58 ? N GLY A-2 152 1 
ATOM 3221 C CA . GLY A-2 1 152 . 78.63 14.652 -8.239 1 11.7 ? CA GLY A-2 152 1 
ATOM 3222 C C . GLY A-2 1 152 . 77.474 14.212 -7.34 1 8.45 ? C GLY A-2 152 1 
ATOM 3223 O O . GLY A-2 1 152 . 76.937 15.002 -6.593 1 9.67 ? O GLY A-2 152 1 
ATOM 3224 N N . TRP A-2 1 153 . 77.114 12.947 -7.537 1 8.01 ? N TRP A-2 153 1 
ATOM 3225 C CA . TRP A-2 1 153 . 75.94 12.364 -6.921 1 8.04 ? CA TRP A-2 153 1 
ATOM 3226 C C . TRP A-2 1 153 . 76.346 11.17 -6.07 1 8.17 ? C TRP A-2 153 1 
ATOM 3227 O O . TRP A-2 1 153 . 77.198 10.371 -6.475 1 12.71 ? O TRP A-2 153 1 
ATOM 3228 C CB . TRP A-2 1 153 . 74.921 11.9 -7.991 1 8.95 ? CB TRP A-2 153 1 
ATOM 3229 C CG . TRP A-2 1 153 . 74.375 13.003 -8.801 1 8.38 ? CG TRP A-2 153 1 
ATOM 3230 C CD1 . TRP A-2 1 153 . 74.905 13.55 -9.915 1 8.87 ? CD1 TRP A-2 153 1 
ATOM 3231 C CD2 . TRP A-2 1 153 . 73.203 13.756 -8.494 1 7.11 ? CD2 TRP A-2 153 1 
ATOM 3232 N NE1 . TRP A-2 1 153 . 74.131 14.609 -10.346 1 9.09 ? NE1 TRP A-2 153 1 
ATOM 3233 C CE2 . TRP A-2 1 153 . 73.083 14.752 -9.482 1 7.9 ? CE2 TRP A-2 153 1 
ATOM 3234 C CE3 . TRP A-2 1 153 . 72.227 13.703 -7.489 1 7.32 ? CE3 TRP A-2 153 1 
ATOM 3235 C CZ2 . TRP A-2 1 153 . 72.029 15.65 -9.495 1 8.09 ? CZ2 TRP A-2 153 1 
ATOM 3236 C CZ3 . TRP A-2 1 153 . 71.179 14.582 -7.533 1 7.54 ? CZ3 TRP A-2 153 1 
ATOM 3237 C CH2 . TRP A-2 1 153 . 71.098 15.556 -8.54 1 7.81 ? CH2 TRP A-2 153 1 
ATOM 3238 N N . GLY A-2 1 154 . 75.699 11.015 -4.968 1 7.35 ? N GLY A-2 154 1 
ATOM 3239 C CA . GLY A-2 1 154 . 75.726 9.806 -4.172 1 7.77 ? CA GLY A-2 154 1 
ATOM 3240 C C . GLY A-2 1 154 . 74.447 9.005 -4.288 1 6.88 ? C GLY A-2 154 1 
ATOM 3241 O O . GLY A-2 1 154 . 73.402 9.531 -4.717 1 7.17 ? O GLY A-2 154 1 
ATOM 3242 N N . ASN A-2 1 155 . 74.518 7.743 -3.912 1 7.28 ? N ASN A-2 155 1 
ATOM 3243 C CA . ASN A-2 1 155 . 73.422 6.855 -4.011 1 7.43 ? CA ASN A-2 155 1 
ATOM 3244 C C . ASN A-2 1 155 . 72.46 6.973 -2.841 1 6.97 ? C ASN A-2 155 1 
ATOM 3245 O O . ASN A-2 1 155 . 72.607 7.815 -1.927 1 7.57 ? O ASN A-2 155 1 
ATOM 3246 C CB . ASN A-2 1 155 . 73.916 5.419 -4.222 1 8.61 ? CB ASN A-2 155 1 
ATOM 3247 C CG . ASN A-2 1 155 . 74.655 4.836 -3.054 1 10.04 ? CG ASN A-2 155 1 
ATOM 3248 O OD1 . ASN A-2 1 155 . 75.345 3.772 -3.29 1 14.72 ? OD1 ASN A-2 155 1 
ATOM 3249 N ND2 . ASN A-2 1 155 . 74.559 5.324 -1.926 1 8.45 ? ND2 ASN A-2 155 1 
ATOM 3250 N N . ALA A-2 1 156 . 71.43 6.169 -2.85 1 7.3 ? N ALA A-2 156 1 
ATOM 3251 C CA . ALA A-2 1 156 . 70.384 6.27 -1.844 1 7.65 ? CA ALA A-2 156 1 
ATOM 3252 C C . ALA A-2 1 156 . 70.923 5.986 -0.466 1 7.83 ? C ALA A-2 156 1 
ATOM 3253 O O . ALA A-2 1 156 . 70.474 6.595 0.531 1 8.21 ? O ALA A-2 156 1 
ATOM 3254 C CB . ALA A-2 1 156 . 69.234 5.305 -2.192 1 9.3 ? CB ALA A-2 156 1 
ATOM 3255 N N A GLU A-2 1 157 . 71.81 5.019 -0.274 0.56 8.06 ? N GLU A-2 157 1 
ATOM 3256 N N B GLU A-2 1 157 . 71.886 5.086 -0.401 0.44 7.89 ? N GLU A-2 157 1 
ATOM 3257 C CA A GLU A-2 1 157 . 72.408 4.788 1.041 0.56 9.17 ? CA GLU A-2 157 1 
ATOM 3258 C CA B GLU A-2 1 157 . 72.45 4.751 0.882 0.44 8.8 ? CA GLU A-2 157 1 
ATOM 3259 C C A GLU A-2 1 157 . 73.149 6.033 1.505 0.56 8.6 ? C GLU A-2 157 1 
ATOM 3260 C C B GLU A-2 1 157 . 73.24 5.899 1.495 0.44 8.83 ? C GLU A-2 157 1 
ATOM 3261 O O A GLU A-2 1 157 . 73.013 6.411 2.677 0.56 8.06 ? O GLU A-2 157 1 
ATOM 3262 O O B GLU A-2 1 157 . 73.197 6.142 2.707 0.44 9.77 ? O GLU A-2 157 1 
ATOM 3263 C CB A GLU A-2 1 157 . 73.336 3.554 0.984 0.56 10.69 ? CB GLU A-2 157 1 
ATOM 3264 C CB B GLU A-2 1 157 . 73.345 3.54 0.769 0.44 10.6 ? CB GLU A-2 157 1 
ATOM 3265 C CG A GLU A-2 1 157 . 72.583 2.237 0.677 0.56 14.71 ? CG GLU A-2 157 1 
ATOM 3266 C CG B GLU A-2 1 157 . 74.01 3.286 2.076 0.44 11.73 ? CG GLU A-2 157 1 
ATOM 3267 C CD A GLU A-2 1 157 . 71.521 1.762 1.74 0.56 18.56 ? CD GLU A-2 157 1 
ATOM 3268 C CD B GLU A-2 1 157 . 73.099 2.853 3.194 0.44 15.17 ? CD GLU A-2 157 1 
ATOM 3269 O OE1 A GLU A-2 1 157 . 70.346 1.284 1.428 0.56 19.99 ? OE1 GLU A-2 157 1 
ATOM 3270 O OE1 B GLU A-2 1 157 . 73.631 2.704 4.364 0.44 21.23 ? OE1 GLU A-2 157 1 
ATOM 3271 O OE2 A GLU A-2 1 157 . 71.822 1.722 2.929 0.56 22.25 ? OE2 GLU A-2 157 1 
ATOM 3272 O OE2 B GLU A-2 1 157 . 71.906 2.599 3.004 0.44 17.97 ? OE2 GLU A-2 157 1 
ATOM 3273 N N . GLU A-2 1 158 . 73.951 6.651 0.668 1 8.26 ? N GLU A-2 158 1 
ATOM 3274 C CA . GLU A-2 1 158 . 74.657 7.821 1.127 1 8.54 ? CA GLU A-2 158 1 
ATOM 3275 C C . GLU A-2 1 158 . 73.679 8.938 1.508 1 8.14 ? C GLU A-2 158 1 
ATOM 3276 O O . GLU A-2 1 158 . 73.901 9.688 2.463 1 8.62 ? O GLU A-2 158 1 
ATOM 3277 C CB . GLU A-2 1 158 . 75.627 8.318 0.032 1 9.5 ? CB GLU A-2 158 1 
ATOM 3278 C CG . GLU A-2 1 158 . 76.614 9.304 0.551 1 10.88 ? CG GLU A-2 158 1 
ATOM 3279 C CD . GLU A-2 1 158 . 77.819 9.584 -0.329 1 11.68 ? CD GLU A-2 158 1 
ATOM 3280 O OE1 . GLU A-2 1 158 . 77.877 9.112 -1.508 1 12.82 ? OE1 GLU A-2 158 1 
ATOM 3281 O OE2 . GLU A-2 1 158 . 78.741 10.263 0.185 1 14.3 ? OE2 GLU A-2 158 1 
ATOM 3282 N N . ALA A-2 1 159 . 72.581 9.049 0.748 1 6.98 ? N ALA A-2 159 1 
ATOM 3283 C CA . ALA A-2 1 159 . 71.555 10.036 1.082 1 7.04 ? CA ALA A-2 159 1 
ATOM 3284 C C . ALA A-2 1 159 . 70.951 9.781 2.447 1 7.02 ? C ALA A-2 159 1 
ATOM 3285 O O . ALA A-2 1 159 . 70.769 10.695 3.258 1 7.41 ? O ALA A-2 159 1 
ATOM 3286 C CB . ALA A-2 1 159 . 70.451 9.982 0.02 1 7.75 ? CB ALA A-2 159 1 
ATOM 3287 N N . LYS A-2 1 160 . 70.59 8.519 2.706 1 6.96 ? N LYS A-2 160 1 
ATOM 3288 C CA . LYS A-2 1 160 . 70 8.136 3.976 1 7.49 ? CA LYS A-2 160 1 
ATOM 3289 C C . LYS A-2 1 160 . 70.938 8.414 5.146 1 7.88 ? C LYS A-2 160 1 
ATOM 3290 O O . LYS A-2 1 160 . 70.503 8.894 6.193 1 8.26 ? O LYS A-2 160 1 
ATOM 3291 C CB . LYS A-2 1 160 . 69.527 6.703 3.942 1 8.24 ? CB LYS A-2 160 1 
ATOM 3292 C CG . LYS A-2 1 160 . 68.324 6.521 3.008 1 9 ? CG LYS A-2 160 1 
ATOM 3293 C CD . LYS A-2 1 160 . 67.81 5.113 2.959 1 11.31 ? CD LYS A-2 160 1 
ATOM 3294 C CE . LYS A-2 1 160 . 68.756 4.16 2.445 1 14.26 ? CE LYS A-2 160 1 
ATOM 3295 N NZ . LYS A-2 1 160 . 68.161 2.767 2.396 1 17.19 ? NZ LYS A-2 160 1 
ATOM 3296 N N . ARG A-2 1 161 . 72.231 8.112 4.969 1 7.94 ? N ARG A-2 161 1 
ATOM 3297 C CA . ARG A-2 1 161 . 73.181 8.438 6.035 1 9.02 ? CA ARG A-2 161 1 
ATOM 3298 C C . ARG A-2 1 161 . 73.221 9.927 6.301 1 7.95 ? C ARG A-2 161 1 
ATOM 3299 O O . ARG A-2 1 161 . 73.343 10.371 7.46 1 8.5 ? O ARG A-2 161 1 
ATOM 3300 C CB . ARG A-2 1 161 . 74.549 7.903 5.658 1 10.76 ? CB ARG A-2 161 1 
ATOM 3301 C CG . ARG A-2 1 161 . 74.638 6.394 5.689 1 15.91 ? CG ARG A-2 161 1 
ATOM 3302 C CD . ARG A-2 1 161 . 76.111 5.85 5.636 1 26.83 ? CD ARG A-2 161 1 
ATOM 3303 N NE . ARG A-2 1 161 . 76.823 6.172 4.376 1 35.18 ? NE ARG A-2 161 1 
ATOM 3304 C CZ . ARG A-2 1 161 . 76.826 5.411 3.259 1 46.06 ? CZ ARG A-2 161 1 
ATOM 3305 N NH1 . ARG A-2 1 161 . 76.224 4.224 3.274 1 61.49 ? NH1 ARG A-2 161 1 
ATOM 3306 N NH2 . ARG A-2 1 161 . 77.479 5.812 2.18 1 51.06 ? NH2 ARG A-2 161 1 
ATOM 3307 N N . GLU A-2 1 162 . 73.142 10.759 5.26 1 7.13 ? N GLU A-2 162 1 
ATOM 3308 C CA . GLU A-2 1 162 . 73.184 12.179 5.444 1 7.33 ? CA GLU A-2 162 1 
ATOM 3309 C C . GLU A-2 1 162 . 71.926 12.709 6.128 1 6.76 ? C GLU A-2 162 1 
ATOM 3310 O O . GLU A-2 1 162 . 71.999 13.638 6.943 1 7.13 ? O GLU A-2 162 1 
ATOM 3311 C CB . GLU A-2 1 162 . 73.476 12.918 4.155 1 7.46 ? CB GLU A-2 162 1 
ATOM 3312 C CG . GLU A-2 1 162 . 74.07 14.313 4.368 1 7.52 ? CG GLU A-2 162 1 
ATOM 3313 C CD . GLU A-2 1 162 . 75.476 14.325 4.929 1 8.3 ? CD GLU A-2 162 1 
ATOM 3314 O OE1 . GLU A-2 1 162 . 76.092 13.226 5.018 1 10.45 ? OE1 GLU A-2 162 1 
ATOM 3315 O OE2 . GLU A-2 1 162 . 75.966 15.433 5.201 1 8.26 ? OE2 GLU A-2 162 1 
ATOM 3316 N N . ILE A-2 1 163 . 70.774 12.126 5.812 1 6.57 ? N ILE A-2 163 1 
ATOM 3317 C CA . ILE A-2 1 163 . 69.544 12.474 6.512 1 6.37 ? CA ILE A-2 163 1 
ATOM 3318 C C . ILE A-2 1 163 . 69.725 12.218 8.012 1 6.92 ? C ILE A-2 163 1 
ATOM 3319 O O . ILE A-2 1 163 . 69.359 13.066 8.835 1 7.33 ? O ILE A-2 163 1 
ATOM 3320 C CB . ILE A-2 1 163 . 68.371 11.667 5.945 1 7.08 ? CB ILE A-2 163 1 
ATOM 3321 C CG1 . ILE A-2 1 163 . 68.024 12.118 4.521 1 6.6 ? CG1 ILE A-2 163 1 
ATOM 3322 C CG2 . ILE A-2 1 163 . 67.16 11.724 6.865 1 7.57 ? CG2 ILE A-2 163 1 
ATOM 3323 C CD1 . ILE A-2 1 163 . 67.149 11.181 3.741 1 7.43 ? CD1 ILE A-2 163 1 
ATOM 3324 N N . LEU A-2 1 164 . 70.276 11.072 8.382 1 7.17 ? N LEU A-2 164 1 
ATOM 3325 C CA . LEU A-2 1 164 . 70.464 10.798 9.818 1 7.92 ? CA LEU A-2 164 1 
ATOM 3326 C C . LEU A-2 1 164 . 71.383 11.806 10.424 1 7.73 ? C LEU A-2 164 1 
ATOM 3327 O O . LEU A-2 1 164 . 71.09 12.26 11.572 1 8.39 ? O LEU A-2 164 1 
ATOM 3328 C CB . LEU A-2 1 164 . 71.021 9.382 9.972 1 9.68 ? CB LEU A-2 164 1 
ATOM 3329 C CG . LEU A-2 1 164 . 70.067 8.277 9.57 1 10.69 ? CG LEU A-2 164 1 
ATOM 3330 C CD1 . LEU A-2 1 164 . 70.785 6.93 9.67 1 14.89 ? CD1 LEU A-2 164 1 
ATOM 3331 C CD2 . LEU A-2 1 164 . 68.798 8.259 10.36 1 13.66 ? CD2 LEU A-2 164 1 
ATOM 3332 N N . ARG A-2 1 165 . 72.439 12.227 9.767 1 7.53 ? N ARG A-2 165 1 
ATOM 3333 C CA . ARG A-2 1 165 . 73.327 13.272 10.299 1 7.54 ? CA ARG A-2 165 1 
ATOM 3334 C C . ARG A-2 1 165 . 72.561 14.56 10.515 1 7.52 ? C ARG A-2 165 1 
ATOM 3335 O O . ARG A-2 1 165 . 72.714 15.205 11.577 1 8.14 ? O ARG A-2 165 1 
ATOM 3336 C CB . ARG A-2 1 165 . 74.468 13.501 9.324 1 8.17 ? CB ARG A-2 165 1 
ATOM 3337 C CG . ARG A-2 1 165 . 75.324 14.7 9.687 1 9.58 ? CG ARG A-2 165 1 
ATOM 3338 C CD . ARG A-2 1 165 . 76.534 14.843 8.793 1 10.42 ? CD ARG A-2 165 1 
ATOM 3339 N NE . ARG A-2 1 165 . 77.32 16.031 9.203 0.93 10.16 ? NE ARG A-2 165 1 
ATOM 3340 C CZ . ARG A-2 1 165 . 77.332 17.239 8.61 0.88 8.73 ? CZ ARG A-2 165 1 
ATOM 3341 N NH1 . ARG A-2 1 165 . 77.99 18.236 9.161 1 10.57 ? NH1 ARG A-2 165 1 
ATOM 3342 N NH2 . ARG A-2 1 165 . 76.758 17.41 7.426 1 10.08 ? NH2 ARG A-2 165 1 
ATOM 3343 N N . ALA A-2 1 166 . 71.773 14.989 9.539 1 7.02 ? N ALA A-2 166 1 
ATOM 3344 C CA . ALA A-2 1 166 . 71.069 16.271 9.613 1 6.68 ? CA ALA A-2 166 1 
ATOM 3345 C C . ALA A-2 1 166 . 70.043 16.277 10.744 1 6.82 ? C ALA A-2 166 1 
ATOM 3346 O O . ALA A-2 1 166 . 69.806 17.308 11.382 1 7.05 ? O ALA A-2 166 1 
ATOM 3347 C CB . ALA A-2 1 166 . 70.448 16.576 8.275 1 7.28 ? CB ALA A-2 166 1 
ATOM 3348 N N . ILE A-2 1 167 . 69.395 15.126 10.975 1 7.08 ? N ILE A-2 167 1 
ATOM 3349 C CA . ILE A-2 1 167 . 68.464 14.984 12.079 1 7.36 ? CA ILE A-2 167 1 
ATOM 3350 C C . ILE A-2 1 167 . 69.201 15.194 13.431 1 7.73 ? C ILE A-2 167 1 
ATOM 3351 O O . ILE A-2 1 167 . 68.677 15.885 14.31 1 8.71 ? O ILE A-2 167 1 
ATOM 3352 C CB . ILE A-2 1 167 . 67.793 13.614 12.026 1 8 ? CB ILE A-2 167 1 
ATOM 3353 C CG1 . ILE A-2 1 167 . 66.805 13.61 10.843 1 8.5 ? CG1 ILE A-2 167 1 
ATOM 3354 C CG2 . ILE A-2 1 167 . 67.141 13.208 13.321 1 9.65 ? CG2 ILE A-2 167 1 
ATOM 3355 C CD1 . ILE A-2 1 167 . 66.181 12.283 10.573 1 10.01 ? CD1 ILE A-2 167 1 
ATOM 3356 N N . GLU A-2 1 168 . 70.4 14.633 13.553 1 8.34 ? N GLU A-2 168 1 
ATOM 3357 C CA . GLU A-2 1 168 . 71.167 14.831 14.788 1 8.74 ? CA GLU A-2 168 1 
ATOM 3358 C C . GLU A-2 1 168 . 71.66 16.279 14.915 1 8.52 ? C GLU A-2 168 1 
ATOM 3359 O O . GLU A-2 1 168 . 71.728 16.785 16.046 1 10.05 ? O GLU A-2 168 1 
ATOM 3360 C CB . GLU A-2 1 168 . 72.347 13.869 14.847 1 9.72 ? CB GLU A-2 168 1 
ATOM 3361 C CG . GLU A-2 1 168 . 71.898 12.419 14.893 1 11.73 ? CG GLU A-2 168 1 
ATOM 3362 C CD . GLU A-2 1 168 . 70.919 12.113 16.014 1 12.77 ? CD GLU A-2 168 1 
ATOM 3363 O OE1 . GLU A-2 1 168 . 69.857 11.429 15.764 1 16.08 ? OE1 GLU A-2 168 1 
ATOM 3364 O OE2 . GLU A-2 1 168 . 71.086 12.637 17.135 1 12.98 ? OE2 GLU A-2 168 1 
ATOM 3365 N N . MET A-2 1 169 . 71.96 16.933 13.813 1 8.29 ? N MET A-2 169 1 
ATOM 3366 C CA . MET A-2 1 169 . 72.38 18.346 13.884 1 8.29 ? CA MET A-2 169 1 
ATOM 3367 C C . MET A-2 1 169 . 71.276 19.232 14.43 1 8.32 ? C MET A-2 169 1 
ATOM 3368 O O . MET A-2 1 169 . 71.525 20.168 15.191 1 9.23 ? O MET A-2 169 1 
ATOM 3369 C CB . MET A-2 1 169 . 72.868 18.849 12.522 1 8.62 ? CB MET A-2 169 1 
ATOM 3370 C CG . MET A-2 1 169 . 74.136 18.187 12.025 1 10.2 ? CG MET A-2 169 1 
ATOM 3371 S SD . MET A-2 1 169 . 74.658 18.676 10.387 1 11.37 ? SD MET A-2 169 1 
ATOM 3372 C CE . MET A-2 1 169 . 75.146 20.288 10.709 1 14.74 ? CE MET A-2 169 1 
ATOM 3373 N N . TYR A-2 1 170 . 70.027 18.949 14.068 1 7.89 ? N TYR A-2 170 1 
ATOM 3374 C CA . TYR A-2 1 170 . 68.908 19.673 14.647 1 7.78 ? CA TYR A-2 170 1 
ATOM 3375 C C . TYR A-2 1 170 . 68.78 19.445 16.131 1 9.1 ? C TYR A-2 170 1 
ATOM 3376 O O . TYR A-2 1 170 . 68.564 20.366 16.904 1 10.18 ? O TYR A-2 170 1 
ATOM 3377 C CB . TYR A-2 1 170 . 67.603 19.246 13.924 1 8.41 ? CB TYR A-2 170 1 
ATOM 3378 C CG . TYR A-2 1 170 . 66.352 19.886 14.505 1 8.3 ? CG TYR A-2 170 1 
ATOM 3379 C CD1 . TYR A-2 1 170 . 65.713 19.326 15.594 1 9.52 ? CD1 TYR A-2 170 1 
ATOM 3380 C CD2 . TYR A-2 1 170 . 65.846 21.062 13.988 1 8.66 ? CD2 TYR A-2 170 1 
ATOM 3381 C CE1 . TYR A-2 1 170 . 64.574 19.922 16.122 1 10.76 ? CE1 TYR A-2 170 1 
ATOM 3382 C CE2 . TYR A-2 1 170 . 64.708 21.657 14.525 1 9.44 ? CE2 TYR A-2 170 1 
ATOM 3383 C CZ . TYR A-2 1 170 . 64.12 21.121 15.638 1 10.21 ? CZ TYR A-2 170 1 
ATOM 3384 O OH . TYR A-2 1 170 . 63.008 21.66 16.222 1 12.23 ? OH TYR A-2 170 1 
ATOM 3385 N N . LYS A-2 1 171 . 68.889 18.169 16.578 1 10 ? N LYS A-2 171 1 
ATOM 3386 C CA . LYS A-2 1 171 . 68.797 17.879 18.009 1 12.97 ? CA LYS A-2 171 1 
ATOM 3387 C C . LYS A-2 1 171 . 69.865 18.645 18.782 1 14.25 ? C LYS A-2 171 1 
ATOM 3388 O O . LYS A-2 1 171 . 69.562 19.119 19.871 1 16.52 ? O LYS A-2 171 1 
ATOM 3389 C CB . LYS A-2 1 171 . 68.882 16.38 18.226 1 13.85 ? CB LYS A-2 171 1 
ATOM 3390 C CG . LYS A-2 1 171 . 67.735 15.608 17.723 1 14.74 ? CG LYS A-2 171 1 
ATOM 3391 C CD . LYS A-2 1 171 . 67.972 14.105 17.865 1 24.07 ? CD LYS A-2 171 1 
ATOM 3392 C CE . LYS A-2 1 171 . 66.914 13.271 17.224 1 44.24 ? CE LYS A-2 171 1 
ATOM 3393 N NZ . LYS A-2 1 171 . 67.245 11.834 17.292 1 60.91 ? NZ LYS A-2 171 1 
ATOM 3394 N N . GLU A-2 1 172 . 71.06 18.71 18.226 1 13.58 ? N GLU A-2 172 1 
ATOM 3395 C CA . GLU A-2 1 172 . 72.132 19.355 18.915 1 14.99 ? CA GLU A-2 172 1 
ATOM 3396 C C . GLU A-2 1 172 . 71.893 20.826 18.969 1 17.08 ? C GLU A-2 172 1 
ATOM 3397 O O . GLU A-2 1 172 . 72.102 21.497 20.012 1 22.94 ? O GLU A-2 172 1 
ATOM 3398 C CB . GLU A-2 1 172 . 73.434 18.987 18.235 1 14.62 ? CB GLU A-2 172 1 
ATOM 3399 C CG . GLU A-2 1 172 . 74.631 19.605 18.857 1 14.81 ? CG GLU A-2 172 1 
ATOM 3400 C CD . GLU A-2 1 172 . 74.839 19.226 20.367 1 15.18 ? CD GLU A-2 172 1 
ATOM 3401 O OE1 . GLU A-2 1 172 . 75.549 20.047 21.005 1 18.01 ? OE1 GLU A-2 172 1 
ATOM 3402 O OE2 . GLU A-2 1 172 . 74.333 18.153 20.788 1 18.82 ? OE2 GLU A-2 172 1 
ATOM 3403 N N . LYS A-2 1 173 . 71.386 21.417 17.873 1 16.19 ? N LYS A-2 173 1 
ATOM 3404 C CA . LYS A-2 1 173 . 71.169 22.84 17.841 1 19.04 ? CA LYS A-2 173 1 
ATOM 3405 C C . LYS A-2 1 173 . 69.985 23.332 18.707 1 18.27 ? C LYS A-2 173 1 
ATOM 3406 O O . LYS A-2 1 173 . 70.071 24.307 19.439 1 24.3 ? O LYS A-2 173 1 
ATOM 3407 C CB . LYS A-2 1 173 . 70.979 23.366 16.424 1 30.69 ? CB LYS A-2 173 1 
ATOM 3408 C CG . LYS A-2 1 173 . 70.621 24.85 16.353 1 54.54 ? CG LYS A-2 173 1 
ATOM 3409 C CD . LYS A-2 1 173 . 71.292 25.599 15.282 1 76.44 ? CD LYS A-2 173 1 
ATOM 3410 C CE . LYS A-2 1 173 . 70.955 27.05 15.365 1 97.97 ? CE LYS A-2 173 1 
ATOM 3411 N NZ . LYS A-2 1 173 . 72.104 27.855 15.771 1 119.88 ? NZ LYS A-2 173 1 
ATOM 3412 N N . PHE A-2 1 174 . 68.894 22.645 18.582 1 15.43 ? N PHE A-2 174 1 
ATOM 3413 C CA . PHE A-2 1 174 . 67.636 23.073 19.193 1 18.59 ? CA PHE A-2 174 1 
ATOM 3414 C C . PHE A-2 1 174 . 67.364 22.169 20.437 1 27.35 ? C PHE A-2 174 1 
ATOM 3415 C CB . PHE A-2 1 174 . 66.52 23.007 18.216 1 16.46 ? CB PHE A-2 174 1 
ATOM 3416 C CG . PHE A-2 1 174 . 66.71 23.979 17.114 1 15.09 ? CG PHE A-2 174 1 
ATOM 3417 C CD1 . PHE A-2 1 174 . 66.406 25.344 17.257 1 16.67 ? CD1 PHE A-2 174 1 
ATOM 3418 C CD2 . PHE A-2 1 174 . 67.194 23.538 15.865 1 15.63 ? CD2 PHE A-2 174 1 
ATOM 3419 C CE1 . PHE A-2 1 174 . 66.607 26.214 16.274 1 18.55 ? CE1 PHE A-2 174 1 
ATOM 3420 C CE2 . PHE A-2 1 174 . 67.328 24.416 14.815 1 16.2 ? CE2 PHE A-2 174 1 
ATOM 3421 C CZ . PHE A-2 1 174 . 67.077 25.781 14.956 1 18.16 ? CZ PHE A-2 174 1 
ATOM 3422 N N . GLY A-2 1 175 . 68.328 21.427 20.969 1 29.76 ? N GLY A-2 175 1 
ATOM 3423 C CA . GLY A-2 1 175 . 68.177 20.912 22.356 1 29.86 ? CA GLY A-2 175 1 
ATOM 3424 C C . GLY A-2 1 175 . 68.548 22.081 23.265 1 30.3 ? C GLY A-2 175 1 
ATOM 3425 O O . GLY A-2 1 175 . 67.962 22.323 24.358 1 30.14 ? O GLY A-2 175 1 
ATOM 3426 N N . LYS A-2 1 176 . 69.556 22.865 22.859 0.82 37.57 ? N LYS A-2 176 1 
ATOM 3427 C CA . LYS A-2 1 176 . 69.943 24.082 23.582 0.85 33.27 ? CA LYS A-2 176 1 
ATOM 3428 C C . LYS A-2 1 176 . 69.175 25.268 22.992 0.84 33.34 ? C LYS A-2 176 1 
ATOM 3429 O O . LYS A-2 1 176 . 68.554 26.039 23.757 0.73 34.6 ? O LYS A-2 176 1 
ATOM 3430 C CB . LYS A-2 1 176 . 71.453 24.318 23.537 0.85 30.77 ? CB LYS A-2 176 1 
ATOM 3431 C CG . LYS A-2 1 176 . 72.338 23.108 23.274 0.87 28.43 ? CG LYS A-2 176 1 
ATOM 3432 C CD . LYS A-2 1 176 . 72.619 23.07 21.825 0.83 27.66 ? CD LYS A-2 176 1 
ATOM 3433 C CE . LYS A-2 1 176 . 74.081 23.288 21.553 0.81 27.26 ? CE LYS A-2 176 1 
ATOM 3434 N NZ . LYS A-2 1 176 . 74.81 22.618 22.714 0.85 28.19 ? NZ LYS A-2 176 1 
ATOM 3435 N N . GLU A-2 1 177 . 69.167 25.407 21.644 0.81 33.42 ? N GLU A-2 177 1 
ATOM 3436 C CA . GLU A-2 1 177 . 68.42 26.556 21.02 0.85 31.59 ? CA GLU A-2 177 1 
ATOM 3437 C C . GLU A-2 1 177 . 66.933 26.399 21.36 0.83 32.11 ? C GLU A-2 177 1 
ATOM 3438 O O . GLU A-2 1 177 . 66.536 26.526 22.535 0.69 34.38 ? O GLU A-2 177 1 
ATOM 3439 C CB . GLU A-2 1 177 . 68.563 26.622 19.512 0.85 28.63 ? CB GLU A-2 177 1 
ATOM 3440 C CG . GLU A-2 1 177 . 69.53 27.621 18.873 0.89 29.06 ? CG GLU A-2 177 1 
ATOM 3441 C CD . GLU A-2 1 177 . 68.794 28.914 18.496 0.85 30.59 ? CD GLU A-2 177 1 
ATOM 3442 O OE1 . GLU A-2 1 177 . 69.393 30.006 18.423 0.7 33.43 ? OE1 GLU A-2 177 1 
ATOM 3443 O OE2 . GLU A-2 1 177 . 67.542 28.883 18.283 0.73 32.65 ? OE2 GLU A-2 177 1 
ATOM 3444 N N . GLU A-2 1 178 . 66.124 26.103 20.349 0.74 30.04 ? N GLU A-2 178 1 
ATOM 3445 C CA . GLU A-2 1 178 . 64.702 25.868 20.552 0.87 29.37 ? CA GLU A-2 178 1 
ATOM 3446 C C . GLU A-2 1 178 . 64.452 24.441 21.033 0.81 29.87 ? C GLU A-2 178 1 
ATOM 3447 O O . GLU A-2 1 178 . 63.391 23.867 20.787 0.7 29.95 ? O GLU A-2 178 1 
ATOM 3448 C CB . GLU A-2 1 178 . 63.928 26.143 19.261 0.54 20.61 ? CB GLU A-2 178 1 
ATOM 3449 C CG . GLU A-2 1 178 . 62.805 25.162 18.981 0.63 20.13 ? CG GLU A-2 178 1 
ATOM 3450 C CD . GLU A-2 1 178 . 61.457 25.698 19.405 0.56 20.13 ? CD GLU A-2 178 1 
ATOM 3451 O OE1 . GLU A-2 1 178 . 60.911 25.202 20.412 0.2 20.18 ? OE1 GLU A-2 178 1 
ATOM 3452 O OE2 . GLU A-2 1 178 . 60.948 26.62 18.736 0.25 20.19 ? OE2 GLU A-2 178 1 
ATOM 3453 N N A MET A-3 1 1 . 52.539 31.541 13.387 0.36 40.14 ? N MET A-3 1 1 
ATOM 3454 N N B MET A-3 1 1 . 52.945 31.833 13.468 0.25 40.26 ? N MET A-3 1 1 
ATOM 3455 C CA A MET A-3 1 1 . 52.351 32.855 13.97 0.36 35.49 ? CA MET A-3 1 1 
ATOM 3456 C CA B MET A-3 1 1 . 52.489 33.101 14.015 0.25 35.98 ? CA MET A-3 1 1 
ATOM 3457 C CA C MET A-3 1 1 . 50.363 33.601 15.416 0.28 34.51 ? CA MET A-3 1 1 
ATOM 3458 C CA D MET A-3 1 1 . 50.423 33.698 15.468 0.11 34.38 ? CA MET A-3 1 1 
ATOM 3459 C C A MET A-3 1 1 . 51.614 33.729 12.99 0.36 32.17 ? C MET A-3 1 1 
ATOM 3460 C C B MET A-3 1 1 . 51.441 33.686 13.09 0.25 32.13 ? C MET A-3 1 1 
ATOM 3461 C C C MET A-3 1 1 . 49.986 34.386 14.178 0.28 32.62 ? C MET A-3 1 1 
ATOM 3462 C C D MET A-3 1 1 . 50.008 34.393 14.179 0.11 32.43 ? C MET A-3 1 1 
ATOM 3463 O O A MET A-3 1 1 . 51.887 33.667 11.848 0.36 29.44 ? O MET A-3 1 1 
ATOM 3464 O O B MET A-3 1 1 . 51.673 33.687 11.916 0.25 29.37 ? O MET A-3 1 1 
ATOM 3465 O O C MET A-3 1 1 . 50.857 34.77 13.384 0.28 31.69 ? O MET A-3 1 1 
ATOM 3466 O O D MET A-3 1 1 . 50.853 34.741 13.353 0.11 31.49 ? O MET A-3 1 1 
ATOM 3467 C CB A MET A-3 1 1 . 53.704 33.482 14.248 0.36 34.98 ? CB MET A-3 1 1 
ATOM 3468 C CB B MET A-3 1 1 . 53.665 34.081 14.099 0.25 35.51 ? CB MET A-3 1 1 
ATOM 3469 C CB C MET A-3 1 1 . 49.324 33.866 16.495 0.28 34.42 ? CB MET A-3 1 1 
ATOM 3470 C CB D MET A-3 1 1 . 50.418 34.718 16.607 0.11 34.16 ? CB MET A-3 1 1 
ATOM 3471 C CG A MET A-3 1 1 . 54.655 32.505 14.924 0.36 34.12 ? CG MET A-3 1 1 
ATOM 3472 C CG B MET A-3 1 1 . 54.787 33.607 15.005 0.25 35.7 ? CG MET A-3 1 1 
ATOM 3473 C CG C MET A-3 1 1 . 49.674 33.264 17.829 0.28 33.1 ? CG MET A-3 1 1 
ATOM 3474 C CG D MET A-3 1 1 . 51.75 35.406 16.819 0.11 32.87 ? CG MET A-3 1 1 
ATOM 3475 S SD A MET A-3 1 1 . 55.948 33.443 15.737 0.36 36.19 ? SD MET A-3 1 1 
ATOM 3476 S SD B MET A-3 1 1 . 56.145 34.787 15.103 0.25 35.99 ? SD MET A-3 1 1 
ATOM 3477 S SD C MET A-3 1 1 . 49.207 34.367 19.162 0.28 33.31 ? SD MET A-3 1 1 
ATOM 3478 S SD D MET A-3 1 1 . 51.786 37.142 16.313 0.11 31.06 ? SD MET A-3 1 1 
ATOM 3479 C CE A MET A-3 1 1 . 54.997 34.74 16.5 0.36 35.71 ? CE MET A-3 1 1 
ATOM 3480 C CE B MET A-3 1 1 . 57.066 34.171 16.502 0.25 37.61 ? CE MET A-3 1 1 
ATOM 3481 C CE C MET A-3 1 1 . 50.631 34.313 20.209 0.28 34.8 ? CE MET A-3 1 1 
ATOM 3482 C CE D MET A-3 1 1 . 51.343 37.967 17.832 0.11 34.52 ? CE MET A-3 1 1 
ATOM 3483 N N A ASN A-3 1 2 . 50.711 34.572 13.515 0.36 33.6 ? N ASN A-3 2 1 
ATOM 3484 N N B ASN A-3 1 2 . 50.312 34.175 13.649 0.25 32.8 ? N ASN A-3 2 1 
ATOM 3485 N N C ASN A-3 1 2 . 48.695 34.608 14.004 0.28 32.44 ? N ASN A-3 2 1 
ATOM 3486 N N D ASN A-3 1 2 . 48.706 34.583 14.012 0.11 31.64 ? N ASN A-3 2 1 
ATOM 3487 C CA A ASN A-3 1 2 . 49.842 35.443 12.71 0.36 34.36 ? CA ASN A-3 2 1 
ATOM 3488 C CA B ASN A-3 1 2 . 49.292 34.954 12.9 0.25 33.95 ? CA ASN A-3 2 1 
ATOM 3489 C CA C ASN A-3 1 2 . 48.21 35.488 12.924 0.28 33.7 ? CA ASN A-3 2 1 
ATOM 3490 C CA D ASN A-3 1 2 . 48.161 35.395 12.914 0.11 33.1 ? CA ASN A-3 2 1 
ATOM 3491 C C A ASN A-3 1 2 . 50.671 36.441 11.942 0.36 26.62 ? C ASN A-3 2 1 
ATOM 3492 C C B ASN A-3 1 2 . 49.89 36.162 12.24 0.25 25.14 ? C ASN A-3 2 1 
ATOM 3493 C C C ASN A-3 1 2 . 49.317 36.369 12.315 0.28 24.9 ? C ASN A-3 2 1 
ATOM 3494 C C D ASN A-3 1 2 . 49.159 36.405 12.319 0.11 25.36 ? C ASN A-3 2 1 
ATOM 3495 O O A ASN A-3 1 2 . 51.459 37.204 12.513 0.36 28.36 ? O ASN A-3 2 1 
ATOM 3496 O O B ASN A-3 1 2 . 50.268 37.077 12.945 0.25 23.83 ? O ASN A-3 2 1 
ATOM 3497 O O C ASN A-3 1 2 . 49.888 37.179 13.025 0.28 24.62 ? O ASN A-3 2 1 
ATOM 3498 O O D ASN A-3 1 2 . 49.719 37.212 13.05 0.11 23.05 ? O ASN A-3 2 1 
ATOM 3499 C CB A ASN A-3 1 2 . 48.83 36.139 13.621 0.36 44.1 ? CB ASN A-3 2 1 
ATOM 3500 C CB B ASN A-3 1 2 . 48.177 35.439 13.831 0.25 43.76 ? CB ASN A-3 2 1 
ATOM 3501 C CB C ASN A-3 1 2 . 47.062 36.375 13.435 0.28 43.96 ? CB ASN A-3 2 1 
ATOM 3502 C CB D ASN A-3 1 2 . 46.908 36.134 13.401 0.11 43.6 ? CB ASN A-3 2 1 
ATOM 3503 C CG A ASN A-3 1 2 . 47.69 36.821 12.855 0.36 49.12 ? CG ASN A-3 2 1 
ATOM 3504 C CG B ASN A-3 1 2 . 47.308 36.551 13.206 0.25 48.37 ? CG ASN A-3 2 1 
ATOM 3505 C CG C ASN A-3 1 2 . 46.287 37.04 12.314 0.28 48.56 ? CG ASN A-3 2 1 
ATOM 3506 C CG D ASN A-3 1 2 . 46.234 36.944 12.309 0.11 48.28 ? CG ASN A-3 2 1 
ATOM 3507 O OD1 A ASN A-3 1 2 . 47.897 37.756 12.108 0.36 42.33 ? OD1 ASN A-3 2 1 
ATOM 3508 O OD1 B ASN A-3 1 2 . 47.807 37.579 12.703 0.25 42.07 ? OD1 ASN A-3 2 1 
ATOM 3509 O OD1 C ASN A-3 1 2 . 46.845 37.429 11.298 0.28 40.84 ? OD1 ASN A-3 2 1 
ATOM 3510 O OD1 D ASN A-3 1 2 . 46.863 37.368 11.343 0.11 40.32 ? OD1 ASN A-3 2 1 
ATOM 3511 N ND2 A ASN A-3 1 2 . 46.482 36.351 13.067 0.36 59.17 ? ND2 ASN A-3 2 1 
ATOM 3512 N ND2 B ASN A-3 1 2 . 46.011 36.351 13.234 0.25 59.12 ? ND2 ASN A-3 2 1 
ATOM 3513 N ND2 C ASN A-3 1 2 . 44.983 37.184 12.509 0.28 59.36 ? ND2 ASN A-3 2 1 
ATOM 3514 N ND2 D ASN A-3 1 2 . 44.938 37.181 12.473 0.11 59.28 ? ND2 ASN A-3 2 1 
ATOM 3515 N N A PRO A-3 1 3 . 50.489 36.471 10.619 0.36 21.88 ? N PRO A-3 3 1 
ATOM 3516 N N B PRO A-3 1 3 . 49.905 36.162 10.913 0.25 19.02 ? N PRO A-3 3 1 
ATOM 3517 N N C PRO A-3 1 3 . 49.606 36.171 11.03 0.28 19.35 ? N PRO A-3 3 1 
ATOM 3518 C CA A PRO A-3 1 3 . 51.412 37.31 9.836 0.36 22.47 ? CA PRO A-3 3 1 
ATOM 3519 C CA B PRO A-3 1 3 . 50.821 37.038 10.192 0.25 18.02 ? CA PRO A-3 3 1 
ATOM 3520 C CA C PRO A-3 1 3 . 50.69 36.916 10.388 0.28 19.53 ? CA PRO A-3 3 1 
ATOM 3521 C C A PRO A-3 1 3 . 50.955 38.757 9.778 0.36 20.39 ? C PRO A-3 3 1 
ATOM 3522 C C B PRO A-3 1 3 . 50.643 38.502 10.479 0.25 11.06 ? C PRO A-3 3 1 
ATOM 3523 C C C PRO A-3 1 3 . 50.597 38.422 10.548 0.28 14.57 ? C PRO A-3 3 1 
ATOM 3524 O O A PRO A-3 1 3 . 51.559 39.512 9.091 0.36 22.55 ? O PRO A-3 3 1 
ATOM 3525 O O B PRO A-3 1 3 . 51.593 39.206 10.631 0.25 10.59 ? O PRO A-3 3 1 
ATOM 3526 O O C PRO A-3 1 3 . 51.581 39.149 10.657 0.28 14.5 ? O PRO A-3 3 1 
ATOM 3527 C CB A PRO A-3 1 3 . 51.289 36.727 8.457 0.36 23.61 ? CB PRO A-3 3 1 
ATOM 3528 C CB B PRO A-3 1 3 . 50.508 36.692 8.709 0.25 21.61 ? CB PRO A-3 3 1 
ATOM 3529 C CB C PRO A-3 1 3 . 50.527 36.512 8.894 0.28 22.9 ? CB PRO A-3 3 1 
ATOM 3530 C CG A PRO A-3 1 3 . 49.918 36.056 8.454 0.36 23.1 ? CG PRO A-3 3 1 
ATOM 3531 C CG B PRO A-3 1 3 . 49.777 35.449 8.725 0.25 22.53 ? CG PRO A-3 3 1 
ATOM 3532 C CG C PRO A-3 1 3 . 49.758 35.258 8.902 0.28 23.91 ? CG PRO A-3 3 1 
ATOM 3533 C CD A PRO A-3 1 3 . 49.726 35.499 9.774 0.36 21.97 ? CD PRO A-3 3 1 
ATOM 3534 C CD B PRO A-3 1 3 . 49.098 35.306 10.007 0.25 17.71 ? CD PRO A-3 3 1 
ATOM 3535 C CD C PRO A-3 1 3 . 48.88 35.287 10.08 0.28 20.95 ? CD PRO A-3 3 1 
ATOM 3536 N N A PHE A-3 1 4 . 49.89 39.068 10.513 0.36 17.27 ? N PHE A-3 4 1 
ATOM 3537 N N B PHE A-3 1 4 . 49.408 38.956 10.45 0.25 9.76 ? N PHE A-3 4 1 
ATOM 3538 N N C PHE A-3 1 4 . 49.376 38.914 10.485 0.28 10.24 ? N PHE A-3 4 1 
ATOM 3539 C CA A PHE A-3 1 4 . 49.418 40.449 10.621 0.36 13.99 ? CA PHE A-3 4 1 
ATOM 3540 C CA B PHE A-3 1 4 . 49.128 40.367 10.607 0.25 9.85 ? CA PHE A-3 4 1 
ATOM 3541 C CA C PHE A-3 1 4 . 49.138 40.361 10.609 0.28 10.21 ? CA PHE A-3 4 1 
ATOM 3542 C C A PHE A-3 1 4 . 49.707 41.015 12.032 0.36 12.25 ? C PHE A-3 4 1 
ATOM 3543 C C B PHE A-3 1 4 . 49.69 40.924 11.95 0.25 9.54 ? C PHE A-3 4 1 
ATOM 3544 C C C PHE A-3 1 4 . 49.664 40.951 11.962 0.28 10.14 ? C PHE A-3 4 1 
ATOM 3545 O O A PHE A-3 1 4 . 50.083 42.177 12.201 0.36 18.17 ? O PHE A-3 4 1 
ATOM 3546 O O B PHE A-3 1 4 . 50.283 41.983 11.986 0.25 6.57 ? O PHE A-3 4 1 
ATOM 3547 O O C PHE A-3 1 4 . 50.204 42.074 12.01 0.28 8.76 ? O PHE A-3 4 1 
ATOM 3548 C CB A PHE A-3 1 4 . 47.934 40.44 10.348 0.36 15.15 ? CB PHE A-3 4 1 
ATOM 3549 C CB B PHE A-3 1 4 . 47.642 40.498 10.459 0.25 11.01 ? CB PHE A-3 4 1 
ATOM 3550 C CB C PHE A-3 1 4 . 47.664 40.553 10.377 0.28 11.46 ? CB PHE A-3 4 1 
ATOM 3551 C CG A PHE A-3 1 4 . 47.215 41.693 10.816 0.36 14.46 ? CG PHE A-3 4 1 
ATOM 3552 C CG B PHE A-3 1 4 . 47.089 41.84 10.893 0.25 10.49 ? CG PHE A-3 4 1 
ATOM 3553 C CG C PHE A-3 1 4 . 47.105 41.884 10.881 0.28 11.5 ? CG PHE A-3 4 1 
ATOM 3554 C CD1 A PHE A-3 1 4 . 47.647 42.963 10.425 0.36 15 ? CD1 PHE A-3 4 1 
ATOM 3555 C CD1 B PHE A-3 1 4 . 45.993 41.893 11.773 0.25 13.65 ? CD1 PHE A-3 4 1 
ATOM 3556 C CD1 C PHE A-3 1 4 . 47.711 43.096 10.607 0.28 13.71 ? CD1 PHE A-3 4 1 
ATOM 3557 C CD2 A PHE A-3 1 4 . 46.125 41.579 11.699 0.36 17.16 ? CD2 PHE A-3 4 1 
ATOM 3558 C CD2 B PHE A-3 1 4 . 47.683 43.024 10.527 0.25 8.78 ? CD2 PHE A-3 4 1 
ATOM 3559 C CD2 C PHE A-3 1 4 . 45.971 41.888 11.712 0.28 11.9 ? CD2 PHE A-3 4 1 
ATOM 3560 C CE1 A PHE A-3 1 4 . 46.974 44.118 10.873 0.36 16.5 ? CE1 PHE A-3 4 1 
ATOM 3561 C CE1 B PHE A-3 1 4 . 45.458 43.097 12.199 0.25 13.74 ? CE1 PHE A-3 4 1 
ATOM 3562 C CE1 C PHE A-3 1 4 . 47.158 44.293 11.088 0.28 13.78 ? CE1 PHE A-3 4 1 
ATOM 3563 C CE2 A PHE A-3 1 4 . 45.455 42.706 12.154 0.36 18.34 ? CE2 PHE A-3 4 1 
ATOM 3564 C CE2 B PHE A-3 1 4 . 47.171 44.258 10.974 0.25 9.68 ? CE2 PHE A-3 4 1 
ATOM 3565 C CE2 C PHE A-3 1 4 . 45.409 43.048 12.169 0.28 12.79 ? CE2 PHE A-3 4 1 
ATOM 3566 C CZ A PHE A-3 1 4 . 45.893 43.988 11.739 0.36 16.8 ? CZ PHE A-3 4 1 
ATOM 3567 C CZ B PHE A-3 1 4 . 46.075 44.258 11.823 0.25 11.74 ? CZ PHE A-3 4 1 
ATOM 3568 C CZ C PHE A-3 1 4 . 46.039 44.236 11.88 0.28 12.79 ? CZ PHE A-3 4 1 
ATOM 3569 N N . HIS A-3 1 5 . 49.472 40.178 13.04 0.88 10.61 ? N HIS A-3 5 1 
ATOM 3570 C CA . HIS A-3 1 5 . 49.879 40.597 14.388 0.88 10.48 ? CA HIS A-3 5 1 
ATOM 3571 C C . HIS A-3 1 5 . 51.294 40.193 14.732 0.88 11.8 ? C HIS A-3 5 1 
ATOM 3572 O O . HIS A-3 1 5 . 51.947 40.859 15.526 0.88 14.12 ? O HIS A-3 5 1 
ATOM 3573 C CB . HIS A-3 1 5 . 48.899 40.023 15.436 0.88 11.97 ? CB HIS A-3 5 1 
ATOM 3574 C CG . HIS A-3 1 5 . 47.524 40.581 15.301 0.88 12.95 ? CG HIS A-3 5 1 
ATOM 3575 N ND1 . HIS A-3 1 5 . 47.272 41.921 15.492 0.88 13.88 ? ND1 HIS A-3 5 1 
ATOM 3576 C CD2 . HIS A-3 1 5 . 46.318 39.956 15.075 0.88 13.3 ? CD2 HIS A-3 5 1 
ATOM 3577 C CE1 . HIS A-3 1 5 . 45.963 42.093 15.386 0.88 13.77 ? CE1 HIS A-3 5 1 
ATOM 3578 N NE2 . HIS A-3 1 5 . 45.347 40.931 15.095 0.88 15.05 ? NE2 HIS A-3 5 1 
ATOM 3579 N N A GLU A-3 1 6 . 51.808 39.127 14.188 0.62 11.43 ? N GLU A-3 6 1 
ATOM 3580 N N B GLU A-3 1 6 . 51.767 39.087 14.169 0.38 12.39 ? N GLU A-3 6 1 
ATOM 3581 C CA A GLU A-3 1 6 . 53.033 38.648 14.721 0.62 15.19 ? CA GLU A-3 6 1 
ATOM 3582 C CA B GLU A-3 1 6 . 53.067 38.519 14.515 0.38 15.6 ? CA GLU A-3 6 1 
ATOM 3583 C C A GLU A-3 1 6 . 54.246 38.959 13.897 0.62 13.6 ? C GLU A-3 6 1 
ATOM 3584 C C B GLU A-3 1 6 . 54.224 39.161 13.785 0.38 15.58 ? C GLU A-3 6 1 
ATOM 3585 O O A GLU A-3 1 6 . 55.202 38.967 14.57 0.62 18.14 ? O GLU A-3 6 1 
ATOM 3586 O O B GLU A-3 1 6 . 55.287 39.295 14.366 0.38 18.6 ? O GLU A-3 6 1 
ATOM 3587 C CB A GLU A-3 1 6 . 52.839 37.129 14.998 0.62 18.67 ? CB GLU A-3 6 1 
ATOM 3588 C CB B GLU A-3 1 6 . 53.02 36.98 14.176 0.38 18.73 ? CB GLU A-3 6 1 
ATOM 3589 N N A LEU A-3 1 7 . 54.148 39.321 12.618 0.62 13.54 ? N LEU A-3 7 1 
ATOM 3590 N N B LEU A-3 1 7 . 54.019 39.558 12.558 0.38 16.64 ? N LEU A-3 7 1 
ATOM 3591 C CA A LEU A-3 1 7 . 55.237 39.951 11.884 0.62 13.63 ? CA LEU A-3 7 1 
ATOM 3592 C CA B LEU A-3 1 7 . 55.121 40.132 11.828 0.38 20.47 ? CA LEU A-3 7 1 
ATOM 3593 C C A LEU A-3 1 7 . 55.394 41.425 12.232 0.62 12.89 ? C LEU A-3 7 1 
ATOM 3594 C C B LEU A-3 1 7 . 55.286 41.582 12.297 0.38 15.58 ? C LEU A-3 7 1 
ATOM 3595 O O A LEU A-3 1 7 . 54.475 42.092 12.213 0.62 11.25 ? O LEU A-3 7 1 
ATOM 3596 O O B LEU A-3 1 7 . 54.309 42.168 12.659 0.38 13.67 ? O LEU A-3 7 1 
ATOM 3597 C CB A LEU A-3 1 7 . 55.017 39.823 10.423 0.62 18.62 ? CB LEU A-3 7 1 
ATOM 3598 C CB B LEU A-3 1 7 . 54.778 40.091 10.351 0.38 32.14 ? CB LEU A-3 7 1 
ATOM 3599 C CG A LEU A-3 1 7 . 55.186 38.511 9.723 0.62 39.31 ? CG LEU A-3 7 1 
ATOM 3600 C CG B LEU A-3 1 7 . 55.669 39.399 9.321 0.38 47.02 ? CG LEU A-3 7 1 
ATOM 3601 C CD1 A LEU A-3 1 7 . 54.665 38.608 8.304 0.62 46.43 ? CD1 LEU A-3 7 1 
ATOM 3602 C CD1 B LEU A-3 1 7 . 56.672 38.441 9.954 0.38 52.14 ? CD1 LEU A-3 7 1 
ATOM 3603 C CD2 A LEU A-3 1 7 . 56.681 38.143 9.724 0.62 52.8 ? CD2 LEU A-3 7 1 
ATOM 3604 C CD2 B LEU A-3 1 7 . 54.822 38.7 8.268 0.38 56.97 ? CD2 LEU A-3 7 1 
ATOM 3605 N N A GLU A-3 1 8 . 56.617 41.938 12.38 0.62 13.39 ? N GLU A-3 8 1 
ATOM 3606 N N B GLU A-3 1 8 . 56.517 42.12 12.166 0.38 17.54 ? N GLU A-3 8 1 
ATOM 3607 C CA A GLU A-3 1 8 . 56.837 43.4 12.471 0.62 14.22 ? CA GLU A-3 8 1 
ATOM 3608 C CA B GLU A-3 1 8 . 56.837 43.495 12.589 0.38 17.23 ? CA GLU A-3 8 1 
ATOM 3609 C C A GLU A-3 1 8 . 56.481 44.132 11.155 0.62 8.36 ? C GLU A-3 8 1 
ATOM 3610 C C B GLU A-3 1 8 . 56.842 44.256 11.267 0.38 14.86 ? C GLU A-3 8 1 
ATOM 3611 O O A GLU A-3 1 8 . 56.438 43.499 10.107 0.62 7.86 ? O GLU A-3 8 1 
ATOM 3612 O O B GLU A-3 1 8 . 57.295 43.713 10.36 0.38 20.08 ? O GLU A-3 8 1 
ATOM 3613 C CB A GLU A-3 1 8 . 58.293 43.706 12.839 0.62 18.66 ? CB GLU A-3 8 1 
ATOM 3614 C CB B GLU A-3 1 8 . 58.226 43.552 13.253 0.38 22.1 ? CB GLU A-3 8 1 
ATOM 3615 C CG A GLU A-3 1 8 . 58.701 43.261 14.231 0.62 22.7 ? CG GLU A-3 8 1 
ATOM 3616 C CG B GLU A-3 1 8 . 59.382 43.151 12.394 0.38 26.07 ? CG GLU A-3 8 1 
ATOM 3617 C CD A GLU A-3 1 8 . 57.799 43.824 15.306 0.62 24.7 ? CD GLU A-3 8 1 
ATOM 3618 C CD B GLU A-3 1 8 . 60.675 43.836 12.836 0.38 28.27 ? CD GLU A-3 8 1 
ATOM 3619 O OE1 A GLU A-3 1 8 . 57.266 43.025 16.105 0.62 25.67 ? OE1 GLU A-3 8 1 
ATOM 3620 O OE1 B GLU A-3 1 8 . 60.632 44.668 13.782 0.38 29.43 ? OE1 GLU A-3 8 1 
ATOM 3621 O OE2 A GLU A-3 1 8 . 57.622 45.058 15.353 0.62 26.17 ? OE2 GLU A-3 8 1 
ATOM 3622 O OE2 B GLU A-3 1 8 . 61.766 43.542 12.285 0.38 29.5 ? OE2 GLU A-3 8 1 
ATOM 3623 N N . PRO A-3 1 9 . 56.318 45.463 11.19 1 10.23 ? N PRO A-3 9 1 
ATOM 3624 C CA . PRO A-3 1 9 . 56.055 46.133 9.883 1 9.19 ? CA PRO A-3 9 1 
ATOM 3625 C C . PRO A-3 1 9 . 57.19 45.971 8.919 1 8.97 ? C PRO A-3 9 1 
ATOM 3626 O O . PRO A-3 1 9 . 56.94 46.065 7.694 1 9.65 ? O PRO A-3 9 1 
ATOM 3627 C CB . PRO A-3 1 9 . 55.74 47.556 10.287 1 10.04 ? CB PRO A-3 9 1 
ATOM 3628 C CG . PRO A-3 1 9 . 55.267 47.507 11.693 1 11.28 ? CG PRO A-3 9 1 
ATOM 3629 C CD . PRO A-3 1 9 . 56.119 46.393 12.311 1 12.21 ? CD PRO A-3 9 1 
ATOM 3630 N N . GLY A-3 1 10 . 58.429 45.832 9.349 1 8.68 ? N GLY A-3 10 1 
ATOM 3631 C CA . GLY A-3 1 10 . 59.502 45.768 8.425 1 9.71 ? CA GLY A-3 10 1 
ATOM 3632 C C . GLY A-3 1 10 . 60.825 45.614 9.178 1 9.57 ? C GLY A-3 10 1 
ATOM 3633 O O . GLY A-3 1 10 . 60.915 45.83 10.388 1 11.97 ? O GLY A-3 10 1 
ATOM 3634 N N . PRO A-3 1 11 . 61.899 45.327 8.438 1 10.16 ? N PRO A-3 11 1 
ATOM 3635 C CA . PRO A-3 1 11 . 63.229 45.228 9.026 1 12.01 ? CA PRO A-3 11 1 
ATOM 3636 C C . PRO A-3 1 11 . 63.916 46.545 9.153 1 11.05 ? C PRO A-3 11 1 
ATOM 3637 O O . PRO A-3 1 11 . 64.881 46.653 9.956 1 14.23 ? O PRO A-3 11 1 
ATOM 3638 C CB . PRO A-3 1 11 . 63.937 44.274 8.082 1 12.83 ? CB PRO A-3 11 1 
ATOM 3639 C CG . PRO A-3 1 11 . 63.344 44.629 6.753 1 12.81 ? CG PRO A-3 11 1 
ATOM 3640 C CD . PRO A-3 1 11 . 61.851 44.81 7.04 1 11 ? CD PRO A-3 11 1 
ATOM 3641 N N . GLU A-3 1 12 . 63.534 47.552 8.369 1 10.84 ? N GLU A-3 12 1 
ATOM 3642 C CA . GLU A-3 1 12 . 64.199 48.89 8.459 1 11.83 ? CA GLU A-3 12 1 
ATOM 3643 C C . GLU A-3 1 12 . 63.128 49.971 8.144 1 9.88 ? C GLU A-3 12 1 
ATOM 3644 O O . GLU A-3 1 12 . 63.214 50.689 7.162 1 10.77 ? O GLU A-3 12 1 
ATOM 3645 C CB . GLU A-3 1 12 . 65.332 49.036 7.476 1 13.11 ? CB GLU A-3 12 1 
ATOM 3646 C CG . GLU A-3 1 12 . 66.389 48.116 7.491 1 21.98 ? CG GLU A-3 12 1 
ATOM 3647 C CD . GLU A-3 1 12 . 67.45 48.388 6.402 1 25.94 ? CD GLU A-3 12 1 
ATOM 3648 O OE1 . GLU A-3 1 12 . 67.794 49.616 6.085 1 27.73 ? OE1 GLU A-3 12 1 
ATOM 3649 O OE2 . GLU A-3 1 12 . 67.847 47.385 5.835 1 31.25 ? OE2 GLU A-3 12 1 
ATOM 3650 N N . VAL A-3 1 13 . 62.114 50.026 8.994 1 9.87 ? N VAL A-3 13 1 
ATOM 3651 C CA . VAL A-3 1 13 . 60.988 50.886 8.734 1 9.74 ? CA VAL A-3 13 1 
ATOM 3652 C C . VAL A-3 1 13 . 61.416 52.314 8.733 1 9.69 ? C VAL A-3 13 1 
ATOM 3653 O O . VAL A-3 1 13 . 62.162 52.733 9.645 1 10.53 ? O VAL A-3 13 1 
ATOM 3654 C CB . VAL A-3 1 13 . 59.933 50.625 9.814 1 11.11 ? CB VAL A-3 13 1 
ATOM 3655 C CG1 . VAL A-3 1 13 . 58.822 51.677 9.824 1 13.51 ? CG1 VAL A-3 13 1 
ATOM 3656 C CG2 . VAL A-3 1 13 . 59.302 49.202 9.694 1 13.73 ? CG2 VAL A-3 13 1 
ATOM 3657 N N . PRO A-3 1 14 . 60.918 53.155 7.814 1 9.3 ? N PRO A-3 14 1 
ATOM 3658 C CA . PRO A-3 1 14 . 59.985 52.894 6.724 1 9.51 ? CA PRO A-3 14 1 
ATOM 3659 C C . PRO A-3 1 14 . 60.69 52.665 5.383 1 9.02 ? C PRO A-3 14 1 
ATOM 3660 O O . PRO A-3 1 14 . 59.979 52.533 4.373 1 10.43 ? O PRO A-3 14 1 
ATOM 3661 C CB . PRO A-3 1 14 . 59.131 54.141 6.704 1 9.81 ? CB PRO A-3 14 1 
ATOM 3662 C CG . PRO A-3 1 14 . 60.143 55.24 6.983 1 10.63 ? CG PRO A-3 14 1 
ATOM 3663 C CD . PRO A-3 1 14 . 61.086 54.612 8.048 1 9.98 ? CD PRO A-3 14 1 
ATOM 3664 N N . GLU A-3 1 15 . 62.025 52.655 5.358 1 9.93 ? N GLU A-3 15 1 
ATOM 3665 C CA . GLU A-3 1 15 . 62.725 52.454 4.073 1 12.14 ? CA GLU A-3 15 1 
ATOM 3666 C C . GLU A-3 1 15 . 62.624 51.066 3.519 1 10.18 ? C GLU A-3 15 1 
ATOM 3667 O O . GLU A-3 1 15 . 62.665 50.913 2.271 1 10.58 ? O GLU A-3 15 1 
ATOM 3668 C CB . GLU A-3 1 15 . 64.217 52.81 4.214 1 14.92 ? CB GLU A-3 15 1 
ATOM 3669 C CG . GLU A-3 1 15 . 64.466 54.324 4.514 1 19.13 ? CG GLU A-3 15 1 
ATOM 3670 C CD . GLU A-3 1 15 . 64.366 54.553 5.926 1 16.96 ? CD GLU A-3 15 1 
ATOM 3671 O OE1 . GLU A-3 1 15 . 64.086 55.678 6.21 1 21.22 ? OE1 GLU A-3 15 1 
ATOM 3672 O OE2 . GLU A-3 1 15 . 64.544 53.613 6.666 1 20.35 ? OE2 GLU A-3 15 1 
ATOM 3673 N N . VAL A-3 1 16 . 62.504 50.046 4.362 1 9.52 ? N VAL A-3 16 1 
ATOM 3674 C CA . VAL A-3 1 16 . 62.288 48.66 3.96 1 9.2 ? CA VAL A-3 16 1 
ATOM 3675 C C . VAL A-3 1 16 . 61.206 48.127 4.847 1 8.11 ? C VAL A-3 16 1 
ATOM 3676 O O . VAL A-3 1 16 . 61.36 48.16 6.092 1 10.13 ? O VAL A-3 16 1 
ATOM 3677 C CB . VAL A-3 1 16 . 63.528 47.785 4.037 1 11.17 ? CB VAL A-3 16 1 
ATOM 3678 C CG1 . VAL A-3 1 16 . 63.186 46.412 3.545 1 12.09 ? CG1 VAL A-3 16 1 
ATOM 3679 C CG2 . VAL A-3 1 16 . 64.704 48.405 3.221 1 13.96 ? CG2 VAL A-3 16 1 
ATOM 3680 N N . VAL A-3 1 17 . 60.144 47.66 4.273 1 6.81 ? N VAL A-3 17 1 
ATOM 3681 C CA . VAL A-3 1 17 . 59.031 47.085 4.975 1 6.7 ? CA VAL A-3 17 1 
ATOM 3682 C C . VAL A-3 1 17 . 58.85 45.639 4.558 1 6.82 ? C VAL A-3 17 1 
ATOM 3683 O O . VAL A-3 1 17 . 59.337 45.199 3.505 1 7.92 ? O VAL A-3 17 1 
ATOM 3684 C CB . VAL A-3 1 17 . 57.734 47.882 4.759 1 7.7 ? CB VAL A-3 17 1 
ATOM 3685 C CG1 . VAL A-3 1 17 . 57.901 49.301 5.346 1 9.56 ? CG1 VAL A-3 17 1 
ATOM 3686 C CG2 . VAL A-3 1 17 . 57.245 47.879 3.351 1 8.28 ? CG2 VAL A-3 17 1 
ATOM 3687 N N . TYR A-3 1 18 . 58.068 44.893 5.334 1 7.2 ? N TYR A-3 18 1 
ATOM 3688 C CA . TYR A-3 1 18 . 57.52 43.61 4.884 1 7.62 ? CA TYR A-3 18 1 
ATOM 3689 C C . TYR A-3 1 18 . 56.2 43.827 4.196 1 7.56 ? C TYR A-3 18 1 
ATOM 3690 O O . TYR A-3 1 18 . 55.286 44.517 4.723 1 9.26 ? O TYR A-3 18 1 
ATOM 3691 C CB . TYR A-3 1 18 . 57.333 42.639 6.035 1 8.7 ? CB TYR A-3 18 1 
ATOM 3692 C CG . TYR A-3 1 18 . 58.562 42.21 6.668 1 9.74 ? CG TYR A-3 18 1 
ATOM 3693 C CD1 . TYR A-3 1 18 . 58.723 42.321 8.063 1 12.56 ? CD1 TYR A-3 18 1 
ATOM 3694 C CD2 . TYR A-3 1 18 . 59.643 41.729 5.993 1 10.23 ? CD2 TYR A-3 18 1 
ATOM 3695 C CE1 . TYR A-3 1 18 . 59.948 41.989 8.733 1 15.07 ? CE1 TYR A-3 18 1 
ATOM 3696 C CE2 . TYR A-3 1 18 . 60.789 41.255 6.623 1 13.52 ? CE2 TYR A-3 18 1 
ATOM 3697 C CZ . TYR A-3 1 18 . 60.949 41.4 7.97 1 14.9 ? CZ TYR A-3 18 1 
ATOM 3698 O OH . TYR A-3 1 18 . 62.107 41.061 8.601 1 19.53 ? OH TYR A-3 18 1 
ATOM 3699 N N . ALA A-3 1 19 . 56.062 43.245 3.046 1 6.71 ? N ALA A-3 19 1 
ATOM 3700 C CA . ALA A-3 1 19 . 54.775 43.099 2.385 1 6.98 ? CA ALA A-3 19 1 
ATOM 3701 C C . ALA A-3 1 19 . 54.331 41.664 2.555 1 6.79 ? C ALA A-3 19 1 
ATOM 3702 O O . ALA A-3 1 19 . 55.049 40.74 2.14 1 9.69 ? O ALA A-3 19 1 
ATOM 3703 C CB . ALA A-3 1 19 . 54.872 43.445 0.936 1 7.22 ? CB ALA A-3 19 1 
ATOM 3704 N N . LEU A-3 1 20 . 53.179 41.453 3.113 1 5.56 ? N LEU A-3 20 1 
ATOM 3705 C CA . LEU A-3 1 20 . 52.533 40.123 3.19 1 5.58 ? CA LEU A-3 20 1 
ATOM 3706 C C . LEU A-3 1 20 . 51.549 40.107 2.038 1 5.22 ? C LEU A-3 20 1 
ATOM 3707 O O . LEU A-3 1 20 . 50.517 40.81 2.073 1 5.58 ? O LEU A-3 20 1 
ATOM 3708 C CB . LEU A-3 1 20 . 51.897 39.934 4.521 1 6.33 ? CB LEU A-3 20 1 
ATOM 3709 C CG . LEU A-3 1 20 . 51.245 38.551 4.701 1 8.44 ? CG LEU A-3 20 1 
ATOM 3710 C CD1 . LEU A-3 1 20 . 52.286 37.447 4.728 1 9.53 ? CD1 LEU A-3 20 1 
ATOM 3711 C CD2 . LEU A-3 1 20 . 50.427 38.566 5.98 1 15.85 ? CD2 LEU A-3 20 1 
ATOM 3712 N N . ILE A-3 1 21 . 51.851 39.344 0.994 1 5.48 ? N ILE A-3 21 1 
ATOM 3713 C CA . ILE A-3 1 21 . 51.011 39.336 -0.203 1 5.2 ? CA ILE A-3 21 1 
ATOM 3714 C C . ILE A-3 1 21 . 49.778 38.529 0.013 1 5.21 ? C ILE A-3 21 1 
ATOM 3715 O O . ILE A-3 1 21 . 49.816 37.411 0.543 1 7.29 ? O ILE A-3 21 1 
ATOM 3716 C CB . ILE A-3 1 21 . 51.832 38.862 -1.429 1 5.8 ? CB ILE A-3 21 1 
ATOM 3717 C CG1 . ILE A-3 1 21 . 53.022 39.793 -1.657 1 6.59 ? CG1 ILE A-3 21 1 
ATOM 3718 C CG2 . ILE A-3 1 21 . 50.952 38.714 -2.647 1 6.11 ? CG2 ILE A-3 21 1 
ATOM 3719 C CD1 . ILE A-3 1 21 . 52.697 41.28 -1.756 1 7.65 ? CD1 ILE A-3 21 1 
ATOM 3720 N N . GLU A-3 1 22 . 48.649 39.085 -0.391 1 5.02 ? N GLU A-3 22 1 
ATOM 3721 C CA . GLU A-3 1 22 . 47.343 38.405 -0.422 1 5.03 ? CA GLU A-3 22 1 
ATOM 3722 C C . GLU A-3 1 22 . 46.96 37.948 -1.826 1 5.04 ? C GLU A-3 22 1 
ATOM 3723 O O . GLU A-3 1 22 . 46.348 36.903 -1.979 1 5.87 ? O GLU A-3 22 1 
ATOM 3724 C CB . GLU A-3 1 22 . 46.266 39.339 0.156 1 5.37 ? CB GLU A-3 22 1 
ATOM 3725 C CG . GLU A-3 1 22 . 46.45 39.663 1.63 1 5.95 ? CG GLU A-3 22 1 
ATOM 3726 C CD . GLU A-3 1 22 . 45.672 40.862 2.089 1 5.27 ? CD GLU A-3 22 1 
ATOM 3727 O OE1 . GLU A-3 1 22 . 45.681 41.893 1.368 1 5.65 ? OE1 GLU A-3 22 1 
ATOM 3728 O OE2 . GLU A-3 1 22 . 45.081 40.8 3.206 1 6.15 ? OE2 GLU A-3 22 1 
ATOM 3729 N N . ILE A-3 1 23 . 47.252 38.778 -2.821 1 4.85 ? N ILE A-3 23 1 
ATOM 3730 C CA . ILE A-3 1 23 . 46.772 38.597 -4.179 1 4.97 ? CA ILE A-3 23 1 
ATOM 3731 C C . ILE A-3 1 23 . 47.958 38.611 -5.136 1 4.87 ? C ILE A-3 23 1 
ATOM 3732 O O . ILE A-3 1 23 . 48.591 39.653 -5.337 1 5.92 ? O ILE A-3 23 1 
ATOM 3733 C CB . ILE A-3 1 23 . 45.78 39.657 -4.637 1 5.14 ? CB ILE A-3 23 1 
ATOM 3734 C CG1 . ILE A-3 1 23 . 44.698 39.902 -3.594 1 6.35 ? CG1 ILE A-3 23 1 
ATOM 3735 C CG2 . ILE A-3 1 23 . 45.192 39.269 -5.984 1 6.16 ? CG2 ILE A-3 23 1 
ATOM 3736 C CD1 . ILE A-3 1 23 . 43.723 41.016 -3.991 1 6.53 ? CD1 ILE A-3 23 1 
ATOM 3737 N N . PRO A-3 1 24 . 48.269 37.505 -5.792 1 5.11 ? N PRO A-3 24 1 
ATOM 3738 C CA . PRO A-3 1 24 . 49.318 37.527 -6.837 1 5.7 ? CA PRO A-3 24 1 
ATOM 3739 C C . PRO A-3 1 24 . 48.856 38.369 -8.026 1 5.52 ? C PRO A-3 24 1 
ATOM 3740 O O . PRO A-3 1 24 . 47.702 38.315 -8.432 1 5.71 ? O PRO A-3 24 1 
ATOM 3741 C CB . PRO A-3 1 24 . 49.471 36.054 -7.221 1 6.68 ? CB PRO A-3 24 1 
ATOM 3742 C CG . PRO A-3 1 24 . 48.899 35.276 -6.014 1 7.48 ? CG PRO A-3 24 1 
ATOM 3743 C CD . PRO A-3 1 24 . 47.733 36.131 -5.567 1 6.62 ? CD PRO A-3 24 1 
ATOM 3744 N N . LYS A-3 1 25 . 49.796 39.084 -8.647 1 5.89 ? N LYS A-3 25 1 
ATOM 3745 C CA A LYS A-3 1 25 . 49.457 39.781 -9.861 0.44 5.63 ? CA LYS A-3 25 1 
ATOM 3746 C CA B LYS A-3 1 25 . 49.533 39.747 -9.941 0.56 5.33 ? CA LYS A-3 25 1 
ATOM 3747 C C . LYS A-3 1 25 . 48.861 38.756 -10.864 1 5.44 ? C LYS A-3 25 1 
ATOM 3748 O O . LYS A-3 1 25 . 49.316 37.621 -10.983 1 5.97 ? O LYS A-3 25 1 
ATOM 3749 C CB A LYS A-3 1 25 . 50.742 40.398 -10.442 0.44 7.25 ? CB LYS A-3 25 1 
ATOM 3750 C CB B LYS A-3 1 25 . 50.843 40.252 -10.622 0.56 7.17 ? CB LYS A-3 25 1 
ATOM 3751 C CG A LYS A-3 1 25 . 50.581 41.115 -11.793 0.44 8.32 ? CG LYS A-3 25 1 
ATOM 3752 C CG B LYS A-3 1 25 . 50.722 40.673 -12.03 0.56 6.78 ? CG LYS A-3 25 1 
ATOM 3753 C CD A LYS A-3 1 25 . 50.915 40.231 -12.985 0.44 10.38 ? CD LYS A-3 25 1 
ATOM 3754 C CD B LYS A-3 1 25 . 52.023 41.137 -12.562 0.56 7.51 ? CD LYS A-3 25 1 
ATOM 3755 C CE A LYS A-3 1 25 . 51.052 40.972 -14.276 0.44 15.53 ? CE LYS A-3 25 1 
ATOM 3756 C CE B LYS A-3 1 25 . 53.071 40.04 -12.672 0.56 10.42 ? CE LYS A-3 25 1 
ATOM 3757 N NZ A LYS A-3 1 25 . 51.405 39.98 -15.349 0.44 27.79 ? NZ LYS A-3 25 1 
ATOM 3758 N NZ B LYS A-3 1 25 . 54.354 40.356 -13.448 0.56 9.27 ? NZ LYS A-3 25 1 
ATOM 3759 N N . GLY A-3 1 26 . 47.834 39.229 -11.574 1 5.55 ? N GLY A-3 26 1 
ATOM 3760 C CA . GLY A-3 1 26 . 47.149 38.423 -12.552 1 5.49 ? CA GLY A-3 26 1 
ATOM 3761 C C . GLY A-3 1 26 . 45.868 37.786 -12.051 1 5.73 ? C GLY A-3 26 1 
ATOM 3762 O O . GLY A-3 1 26 . 45.145 37.193 -12.829 1 7.67 ? O GLY A-3 26 1 
ATOM 3763 N N . SER A-3 1 27 . 45.567 37.92 -10.762 1 5.42 ? N SER A-3 27 1 
ATOM 3764 C CA A SER A-3 1 27 . 44.368 37.329 -10.16 0.74 5.55 ? CA SER A-3 27 1 
ATOM 3765 C CA B SER A-3 1 27 . 44.38 37.328 -10.226 0.26 4.82 ? CA SER A-3 27 1 
ATOM 3766 C C . SER A-3 1 27 . 43.159 38.269 -10.332 1 4.77 ? C SER A-3 27 1 
ATOM 3767 O O . SER A-3 1 27 . 43.287 39.466 -10.146 1 5.65 ? O SER A-3 27 1 
ATOM 3768 C CB A SER A-3 1 27 . 44.551 37.17 -8.658 0.74 6.56 ? CB SER A-3 27 1 
ATOM 3769 C CB B SER A-3 1 27 . 44.641 36.958 -8.744 0.26 5.87 ? CB SER A-3 27 1 
ATOM 3770 O OG A SER A-3 1 27 . 45.756 36.389 -8.408 0.74 6.87 ? OG SER A-3 27 1 
ATOM 3771 O OG B SER A-3 1 27 . 43.478 36.545 -8.1 0.26 7.98 ? OG SER A-3 27 1 
ATOM 3772 N N . ARG A-3 1 28 . 42.016 37.666 -10.574 1 5.09 ? N ARG A-3 28 1 
ATOM 3773 C CA . ARG A-3 1 28 . 40.718 38.304 -10.48 1 5.37 ? CA ARG A-3 28 1 
ATOM 3774 C C . ARG A-3 1 28 . 40.038 38.065 -9.142 1 5.59 ? C ARG A-3 28 1 
ATOM 3775 O O . ARG A-3 1 28 . 39.095 38.779 -8.755 1 6.91 ? O ARG A-3 28 1 
ATOM 3776 C CB . ARG A-3 1 28 . 39.843 37.841 -11.627 1 6.42 ? CB ARG A-3 28 1 
ATOM 3777 C CG . ARG A-3 1 28 . 38.446 38.439 -11.652 1 6.95 ? CG ARG A-3 28 1 
ATOM 3778 C CD . ARG A-3 1 28 . 37.655 37.942 -12.821 1 7.78 ? CD ARG A-3 28 1 
ATOM 3779 N NE . ARG A-3 1 28 . 36.279 38.405 -12.737 1 6.37 ? NE ARG A-3 28 1 
ATOM 3780 C CZ . ARG A-3 1 28 . 35.43 38.371 -13.741 1 5.64 ? CZ ARG A-3 28 1 
ATOM 3781 N NH1 . ARG A-3 1 28 . 35.714 37.666 -14.836 1 7.13 ? NH1 ARG A-3 28 1 
ATOM 3782 N NH2 . ARG A-3 1 28 . 34.294 39.044 -13.659 1 5.92 ? NH2 ARG A-3 28 1 
ATOM 3783 N N . ASN A-3 1 29 . 40.457 37.053 -8.402 1 5.68 ? N ASN A-3 29 1 
ATOM 3784 C CA . ASN A-3 1 29 . 39.945 36.791 -7.055 1 6.22 ? CA ASN A-3 29 1 
ATOM 3785 C C . ASN A-3 1 29 . 40.593 37.77 -6.065 1 5.91 ? C ASN A-3 29 1 
ATOM 3786 O O . ASN A-3 1 29 . 41.801 37.872 -5.983 1 7.08 ? O ASN A-3 29 1 
ATOM 3787 C CB . ASN A-3 1 29 . 40.223 35.372 -6.641 1 5.89 ? CB ASN A-3 29 1 
ATOM 3788 C CG . ASN A-3 1 29 . 39.423 34.336 -7.402 1 6.16 ? CG ASN A-3 29 1 
ATOM 3789 O OD1 . ASN A-3 1 29 . 38.387 34.65 -8.018 1 7.04 ? OD1 ASN A-3 29 1 
ATOM 3790 N ND2 . ASN A-3 1 29 . 39.843 33.105 -7.288 1 6.83 ? ND2 ASN A-3 29 1 
ATOM 3791 N N A LYS A-3 1 30 . 39.735 38.471 -5.321 0.73 5.89 ? N LYS A-3 30 1 
ATOM 3792 N N B LYS A-3 1 30 . 39.735 38.521 -5.38 0.27 5.78 ? N LYS A-3 30 1 
ATOM 3793 C CA A LYS A-3 1 30 . 40.189 39.409 -4.298 0.73 5.88 ? CA LYS A-3 30 1 
ATOM 3794 C CA B LYS A-3 1 30 . 40.171 39.41 -4.306 0.27 5.82 ? CA LYS A-3 30 1 
ATOM 3795 C C A LYS A-3 1 30 . 40.308 38.705 -2.952 0.73 5.33 ? C LYS A-3 30 1 
ATOM 3796 C C B LYS A-3 1 30 . 40.285 38.663 -2.978 0.27 5.44 ? C LYS A-3 30 1 
ATOM 3797 O O A LYS A-3 1 30 . 39.333 38.565 -2.217 0.73 8.13 ? O LYS A-3 30 1 
ATOM 3798 O O B LYS A-3 1 30 . 39.384 38.738 -2.141 0.27 8.04 ? O LYS A-3 30 1 
ATOM 3799 C CB A LYS A-3 1 30 . 39.242 40.614 -4.205 0.73 7.06 ? CB LYS A-3 30 1 
ATOM 3800 C CB B LYS A-3 1 30 . 39.2 40.585 -4.158 0.27 7.08 ? CB LYS A-3 30 1 
ATOM 3801 C CG A LYS A-3 1 30 . 39.169 41.296 -2.828 0.73 10.97 ? CG LYS A-3 30 1 
ATOM 3802 C CG B LYS A-3 1 30 . 39.877 41.928 -3.945 0.27 9.72 ? CG LYS A-3 30 1 
ATOM 3803 C CD A LYS A-3 1 30 . 40.477 41.978 -2.449 0.73 5.69 ? CD LYS A-3 30 1 
ATOM 3804 C CD B LYS A-3 1 30 . 40.512 42.027 -2.57 0.27 8.17 ? CD LYS A-3 30 1 
ATOM 3805 C CE A LYS A-3 1 30 . 40.26 43.183 -1.532 0.73 10.85 ? CE LYS A-3 30 1 
ATOM 3806 C CE B LYS A-3 1 30 . 41.03 43.433 -2.314 0.27 9.73 ? CE LYS A-3 30 1 
ATOM 3807 N NZ A LYS A-3 1 30 . 41.537 43.724 -0.983 0.73 7.38 ? NZ LYS A-3 30 1 
ATOM 3808 N NZ B LYS A-3 1 30 . 41.633 43.576 -0.96 0.27 7.75 ? NZ LYS A-3 30 1 
ATOM 3809 N N . TYR A-3 1 31 . 41.472 38.126 -2.712 1 5.95 ? N TYR A-3 31 1 
ATOM 3810 C CA . TYR A-3 1 31 . 41.779 37.477 -1.435 1 6.3 ? CA TYR A-3 31 1 
ATOM 3811 C C . TYR A-3 1 31 . 42.145 38.519 -0.401 1 6.04 ? C TYR A-3 31 1 
ATOM 3812 O O . TYR A-3 1 31 . 42.765 39.515 -0.736 1 6.73 ? O TYR A-3 31 1 
ATOM 3813 C CB . TYR A-3 1 31 . 42.962 36.556 -1.601 1 6.66 ? CB TYR A-3 31 1 
ATOM 3814 C CG . TYR A-3 1 31 . 42.824 35.527 -2.698 1 6.12 ? CG TYR A-3 31 1 
ATOM 3815 C CD1 . TYR A-3 1 31 . 43.63 35.55 -3.818 1 6.39 ? CD1 TYR A-3 31 1 
ATOM 3816 C CD2 . TYR A-3 1 31 . 41.898 34.491 -2.596 1 7.17 ? CD2 TYR A-3 31 1 
ATOM 3817 C CE1 . TYR A-3 1 31 . 43.523 34.638 -4.825 1 6.75 ? CE1 TYR A-3 31 1 
ATOM 3818 C CE2 . TYR A-3 1 31 . 41.783 33.558 -3.6 1 7.68 ? CE2 TYR A-3 31 1 
ATOM 3819 C CZ . TYR A-3 1 31 . 42.601 33.644 -4.714 1 7.11 ? CZ TYR A-3 31 1 
ATOM 3820 O OH . TYR A-3 1 31 . 42.424 32.695 -5.704 1 8.29 ? OH TYR A-3 31 1 
ATOM 3821 N N . GLU A-3 1 32 . 41.818 38.238 0.852 1 6.11 ? N GLU A-3 32 1 
ATOM 3822 C CA . GLU A-3 1 32 . 42.254 39.034 1.977 1 6.34 ? CA GLU A-3 32 1 
ATOM 3823 C C . GLU A-3 1 32 . 42.637 38.093 3.104 1 7 ? C GLU A-3 32 1 
ATOM 3824 O O . GLU A-3 1 32 . 42.056 37.045 3.279 1 8.98 ? O GLU A-3 32 1 
ATOM 3825 C CB . GLU A-3 1 32 . 41.178 39.979 2.504 1 7.23 ? CB GLU A-3 32 1 
ATOM 3826 C CG . GLU A-3 1 32 . 40.828 41.092 1.507 1 7.38 ? CG GLU A-3 32 1 
ATOM 3827 C CD . GLU A-3 1 32 . 39.822 42.1 2.018 1 7.62 ? CD GLU A-3 32 1 
ATOM 3828 O OE1 . GLU A-3 1 32 . 39.874 43.261 1.535 1 9.9 ? OE1 GLU A-3 32 1 
ATOM 3829 O OE2 . GLU A-3 1 32 . 38.973 41.769 2.886 1 9.21 ? OE2 GLU A-3 32 1 
ATOM 3830 N N A LEU A-3 1 33 . 43.547 38.603 3.945 0.13 8.75 ? N LEU A-3 33 1 
ATOM 3831 N N B LEU A-3 1 33 . 43.609 38.511 3.922 0.87 7.07 ? N LEU A-3 33 1 
ATOM 3832 C CA A LEU A-3 1 33 . 43.902 37.97 5.216 0.13 13.4 ? CA LEU A-3 33 1 
ATOM 3833 C CA B LEU A-3 1 33 . 43.866 37.792 5.155 0.87 8.33 ? CA LEU A-3 33 1 
ATOM 3834 C C A LEU A-3 1 33 . 42.817 38.176 6.275 0.13 13.71 ? C LEU A-3 33 1 
ATOM 3835 C C B LEU A-3 1 33 . 42.648 37.909 6.041 0.87 11.32 ? C LEU A-3 33 1 
ATOM 3836 O O A LEU A-3 1 33 . 42.67 39.249 6.861 0.13 11.04 ? O LEU A-3 33 1 
ATOM 3837 O O B LEU A-3 1 33 . 42.009 38.98 6.215 0.87 12.93 ? O LEU A-3 33 1 
ATOM 3838 C CB A LEU A-3 1 33 . 45.235 38.558 5.702 0.13 18 ? CB LEU A-3 33 1 
ATOM 3839 C CB B LEU A-3 1 33 . 45.146 38.435 5.819 0.87 9.47 ? CB LEU A-3 33 1 
ATOM 3840 C CG A LEU A-3 1 33 . 45.716 38.335 7.138 0.13 24.71 ? CG LEU A-3 33 1 
ATOM 3841 C CG B LEU A-3 1 33 . 45.574 37.704 7.099 0.87 11.47 ? CG LEU A-3 33 1 
ATOM 3842 C CD1 A LEU A-3 1 33 . 47.158 38.81 7.251 0.13 26.72 ? CD1 LEU A-3 33 1 
ATOM 3843 C CD1 B LEU A-3 1 33 . 46.259 36.375 6.641 0.87 15.16 ? CD1 LEU A-3 33 1 
ATOM 3844 C CD2 A LEU A-3 1 33 . 44.847 39.067 8.155 0.13 29.05 ? CD2 LEU A-3 33 1 
ATOM 3845 C CD2 B LEU A-3 1 33 . 46.705 38.387 7.694 0.87 16.24 ? CD2 LEU A-3 33 1 
ATOM 3846 N N A ASP A-3 1 34 . 42.073 37.117 6.56 0.13 18.46 ? N ASP A-3 34 1 
ATOM 3847 N N B ASP A-3 1 34 . 42.285 36.749 6.622 0.87 13.67 ? N ASP A-3 34 1 
ATOM 3848 C CA A ASP A-3 1 34 . 41.065 37.202 7.609 0.13 23.8 ? CA ASP A-3 34 1 
ATOM 3849 C CA B ASP A-3 1 34 . 41.217 36.748 7.643 0.87 16.96 ? CA ASP A-3 34 1 
ATOM 3850 C C A ASP A-3 1 34 . 41.731 37.656 8.908 0.13 25.77 ? C ASP A-3 34 1 
ATOM 3851 C C B ASP A-3 1 34 . 41.821 37.274 8.943 0.87 21.25 ? C ASP A-3 34 1 
ATOM 3852 O O A ASP A-3 1 34 . 42.775 37.154 9.281 0.13 24.05 ? O ASP A-3 34 1 
ATOM 3853 O O B ASP A-3 1 34 . 42.607 36.595 9.443 0.87 25.41 ? O ASP A-3 34 1 
ATOM 3854 C CB A ASP A-3 1 34 . 40.399 35.84 7.793 0.13 26.59 ? CB ASP A-3 34 1 
ATOM 3855 C CB B ASP A-3 1 34 . 40.631 35.275 7.74 0.87 18.99 ? CB ASP A-3 34 1 
ATOM 3856 C CG A ASP A-3 1 34 . 39.186 35.901 8.697 0.13 25.83 ? CG ASP A-3 34 1 
ATOM 3857 C CG B ASP A-3 1 34 . 39.549 35.144 8.807 0.87 25.66 ? CG ASP A-3 34 1 
ATOM 3858 O OD1 A ASP A-3 1 34 . 39.361 36.116 9.919 0.13 24.87 ? OD1 ASP A-3 34 1 
ATOM 3859 O OD1 B ASP A-3 1 34 . 39.693 34.216 9.621 0.87 27.67 ? OD1 ASP A-3 34 1 
ATOM 3860 O OD2 A ASP A-3 1 34 . 38.057 35.722 8.197 0.13 25.29 ? OD2 ASP A-3 34 1 
ATOM 3861 O OD2 B ASP A-3 1 34 . 38.644 35.984 8.833 0.87 30.06 ? OD2 ASP A-3 34 1 
ATOM 3862 N N A LYS A-3 1 35 . 41.125 38.623 9.591 0.13 31.19 ? N LYS A-3 35 1 
ATOM 3863 N N B LYS A-3 1 35 . 41.319 38.389 9.477 0.87 23.84 ? N LYS A-3 35 1 
ATOM 3864 C CA A LYS A-3 1 35 . 41.67 39.106 10.85 0.13 38.08 ? CA LYS A-3 35 1 
ATOM 3865 C CA B LYS A-3 1 35 . 41.853 39.013 10.661 0.87 32.14 ? CA LYS A-3 35 1 
ATOM 3866 C C A LYS A-3 1 35 . 41.458 38.069 11.958 0.13 35.69 ? C LYS A-3 35 1 
ATOM 3867 C C B LYS A-3 1 35 . 41.637 38.017 11.874 0.87 32.28 ? C LYS A-3 35 1 
ATOM 3868 O O A LYS A-3 1 35 . 42.31 37.891 12.822 0.13 33.54 ? O LYS A-3 35 1 
ATOM 3869 O O B LYS A-3 1 35 . 42.54 37.788 12.613 0.87 32.37 ? O LYS A-3 35 1 
ATOM 3870 C CB A LYS A-3 1 35 . 41.018 40.434 11.235 0.13 48.24 ? CB LYS A-3 35 1 
ATOM 3871 C CB B LYS A-3 1 35 . 41.14 40.322 10.977 0.87 45.29 ? CB LYS A-3 35 1 
ATOM 3872 C CG A LYS A-3 1 35 . 41.826 41.664 10.853 0.13 56.16 ? CG LYS A-3 35 1 
ATOM 3873 C CG B LYS A-3 1 35 . 41.831 41.57 10.462 0.87 54.48 ? CG LYS A-3 35 1 
ATOM 3874 C CD A LYS A-3 1 35 . 40.981 42.701 10.129 0.13 62.07 ? CD LYS A-3 35 1 
ATOM 3875 C CD B LYS A-3 1 35 . 40.814 42.668 10.263 0.87 60.05 ? CD LYS A-3 35 1 
ATOM 3876 C CE A LYS A-3 1 35 . 39.623 42.883 10.777 0.13 67.75 ? CE LYS A-3 35 1 
ATOM 3877 C CE B LYS A-3 1 35 . 39.888 42.263 9.146 0.87 66.06 ? CE LYS A-3 35 1 
ATOM 3878 N NZ A LYS A-3 1 35 . 38.909 44.068 10.229 0.13 72.93 ? NZ LYS A-3 35 1 
ATOM 3879 N NZ B LYS A-3 1 35 . 38.803 43.203 9 0.87 71.33 ? NZ LYS A-3 35 1 
ATOM 3880 N N A ALA A-3 1 36 . 40.32 37.382 11.909 0.13 38.02 ? N ALA A-3 36 1 
ATOM 3881 N N B ALA A-3 1 36 . 40.474 37.361 11.944 0.87 35.81 ? N ALA A-3 36 1 
ATOM 3882 C CA A ALA A-3 1 36 . 39.961 36.388 12.923 0.13 41.53 ? CA ALA A-3 36 1 
ATOM 3883 C CA B ALA A-3 1 36 . 40.171 36.481 13.112 0.87 41.15 ? CA ALA A-3 36 1 
ATOM 3884 C C A ALA A-3 1 36 . 41.046 35.344 13.109 0.13 38.04 ? C ALA A-3 36 1 
ATOM 3885 C C B ALA A-3 1 36 . 41.115 35.34 13.158 0.87 37.73 ? C ALA A-3 36 1 
ATOM 3886 O O A ALA A-3 1 36 . 41.548 35.137 14.211 0.13 36.07 ? O ALA A-3 36 1 
ATOM 3887 O O B ALA A-3 1 36 . 41.547 34.951 14.257 0.87 36.23 ? O ALA A-3 36 1 
ATOM 3888 C CB A ALA A-3 1 36 . 38.642 35.703 12.54 0.13 48.73 ? CB ALA A-3 36 1 
ATOM 3889 C CB B ALA A-3 1 36 . 38.706 35.969 13.036 0.87 48.66 ? CB ALA A-3 36 1 
ATOM 3890 N N . THR A-3 1 37 . 41.383 34.685 12.01 1 39.66 ? N THR A-3 37 1 
ATOM 3891 C CA . THR A-3 1 37 . 42.235 33.515 12.011 1 34.01 ? CA THR A-3 37 1 
ATOM 3892 C C . THR A-3 1 37 . 43.581 33.508 11.435 1 30.32 ? C THR A-3 37 1 
ATOM 3893 O O . THR A-3 1 37 . 44.26 32.493 11.537 1 29.69 ? O THR A-3 37 1 
ATOM 3894 C CB . THR A-3 1 37 . 41.617 32.36 11.23 1 33.29 ? CB THR A-3 37 1 
ATOM 3895 O OG1 . THR A-3 1 37 . 41.691 32.606 9.807 1 28.71 ? OG1 THR A-3 37 1 
ATOM 3896 C CG2 . THR A-3 1 37 . 40.149 32.069 11.711 1 37.3 ? CG2 THR A-3 37 1 
ATOM 3897 N N . GLY A-3 1 38 . 43.94 34.436 10.545 1 27.54 ? N GLY A-3 38 1 
ATOM 3898 C CA . GLY A-3 1 38 . 45.24 34.239 9.902 1 30.59 ? CA GLY A-3 38 1 
ATOM 3899 C C . GLY A-3 1 38 . 45.221 33.573 8.518 1 24.91 ? C GLY A-3 38 1 
ATOM 3900 O O . GLY A-3 1 38 . 46.231 33.51 7.785 1 28.51 ? O GLY A-3 38 1 
ATOM 3901 N N . LEU A-3 1 39 . 44.07 33.008 8.141 1 18.54 ? N LEU A-3 39 1 
ATOM 3902 C CA . LEU A-3 1 39 . 43.986 32.237 6.871 1 15.79 ? CA LEU A-3 39 1 
ATOM 3903 C C . LEU A-3 1 39 . 43.666 33.177 5.716 1 12.44 ? C LEU A-3 39 1 
ATOM 3904 O O . LEU A-3 1 39 . 43.075 34.273 5.945 1 15.33 ? O LEU A-3 39 1 
ATOM 3905 C CB . LEU A-3 1 39 . 42.916 31.232 6.968 1 18.53 ? CB LEU A-3 39 1 
ATOM 3906 C CG . LEU A-3 1 39 . 43.194 30.071 7.949 1 48.12 ? CG LEU A-3 39 1 
ATOM 3907 C CD1 . LEU A-3 1 39 . 41.89 29.301 8.218 1 64.95 ? CD1 LEU A-3 39 1 
ATOM 3908 C CD2 . LEU A-3 1 39 . 44.252 29.184 7.416 1 67.63 ? CD2 LEU A-3 39 1 
ATOM 3909 N N . LEU A-3 1 40 . 43.961 32.797 4.507 1 10.69 ? N LEU A-3 40 1 
ATOM 3910 C CA . LEU A-3 1 40 . 43.486 33.515 3.322 1 8.78 ? CA LEU A-3 40 1 
ATOM 3911 C C . LEU A-3 1 40 . 41.982 33.277 3.151 1 7.17 ? C LEU A-3 40 1 
ATOM 3912 O O . LEU A-3 1 40 . 41.525 32.16 3.255 1 6.72 ? O LEU A-3 40 1 
ATOM 3913 C CB . LEU A-3 1 40 . 44.253 33.062 2.084 1 9.06 ? CB LEU A-3 40 1 
ATOM 3914 C CG . LEU A-3 1 40 . 44.234 34.022 0.901 1 9.95 ? CG LEU A-3 40 1 
ATOM 3915 C CD1 . LEU A-3 1 40 . 45.108 35.27 1.225 1 9.81 ? CD1 LEU A-3 40 1 
ATOM 3916 C CD2 . LEU A-3 1 40 . 44.656 33.344 -0.376 1 10.28 ? CD2 LEU A-3 40 1 
ATOM 3917 N N . LYS A-3 1 41 . 41.267 34.332 2.785 1 7.49 ? N LYS A-3 41 1 
ATOM 3918 C CA . LYS A-3 1 41 . 39.832 34.266 2.543 1 7.14 ? CA LYS A-3 41 1 
ATOM 3919 C C . LYS A-3 1 41 . 39.538 34.934 1.2 1 6.45 ? C LYS A-3 41 1 
ATOM 3920 O O . LYS A-3 1 41 . 40.151 35.945 0.823 1 8.05 ? O LYS A-3 41 1 
ATOM 3921 C CB . LYS A-3 1 41 . 39.082 34.912 3.631 1 9.51 ? CB LYS A-3 41 1 
ATOM 3922 C CG . LYS A-3 1 41 . 37.59 34.836 3.546 1 15.34 ? CG LYS A-3 41 1 
ATOM 3923 C CD . LYS A-3 1 41 . 36.974 35.317 4.872 1 48.26 ? CD LYS A-3 41 1 
ATOM 3924 C CE . LYS A-3 1 41 . 35.436 35.411 4.79 1 80.95 ? CE LYS A-3 41 1 
ATOM 3925 N NZ . LYS A-3 1 41 . 34.855 35.729 6.119 1 108.74 ? NZ LYS A-3 41 1 
ATOM 3926 N N . LEU A-3 1 42 . 38.571 34.398 0.454 1 6.14 ? N LEU A-3 42 1 
ATOM 3927 C CA . LEU A-3 1 42 . 38.038 35.078 -0.696 1 6.13 ? CA LEU A-3 42 1 
ATOM 3928 C C . LEU A-3 1 42 . 37.124 36.193 -0.218 1 6.32 ? C LEU A-3 42 1 
ATOM 3929 O O . LEU A-3 1 42 . 36.046 35.925 0.319 1 8.31 ? O LEU A-3 42 1 
ATOM 3930 C CB . LEU A-3 1 42 . 37.264 34.091 -1.576 1 6.73 ? CB LEU A-3 42 1 
ATOM 3931 C CG . LEU A-3 1 42 . 36.716 34.676 -2.839 1 7.26 ? CG LEU A-3 42 1 
ATOM 3932 C CD1 . LEU A-3 1 42 . 37.841 34.988 -3.874 1 8.59 ? CD1 LEU A-3 42 1 
ATOM 3933 C CD2 . LEU A-3 1 42 . 35.678 33.739 -3.462 1 8.3 ? CD2 LEU A-3 42 1 
ATOM 3934 N N . ASP A-3 1 43 . 37.516 37.438 -0.396 0.91 5.74 ? N ASP A-3 43 1 
ATOM 3935 C CA . ASP A-3 1 43 . 36.622 38.576 -0.08 0.91 6.25 ? CA ASP A-3 43 1 
ATOM 3936 C C . ASP A-3 1 43 . 35.552 38.701 -1.138 0.91 7.16 ? C ASP A-3 43 1 
ATOM 3937 O O . ASP A-3 1 43 . 34.342 38.712 -0.833 0.91 9.66 ? O ASP A-3 43 1 
ATOM 3938 C CB . ASP A-3 1 43 . 37.44 39.87 -0.021 0.91 8.57 ? CB ASP A-3 43 1 
ATOM 3939 C CG . ASP A-3 1 43 . 36.596 41.15 0.079 0.91 13.17 ? CG ASP A-3 43 1 
ATOM 3940 O OD1 . ASP A-3 1 43 . 35.704 41.084 0.969 0.91 19.08 ? OD1 ASP A-3 43 1 
ATOM 3941 O OD2 . ASP A-3 1 43 . 36.896 42.193 -0.537 0.91 13.49 ? OD2 ASP A-3 43 1 
ATOM 3942 N N A ARG A-3 1 44 . 35.953 38.735 -2.432 0.88 7.5 ? N ARG A-3 44 1 
ATOM 3943 N N B ARG A-3 1 44 . 36.005 38.386 -2.334 0.12 10.17 ? N ARG A-3 44 1 
ATOM 3944 C CA A ARG A-3 1 44 . 34.927 38.593 -3.531 0.88 9.02 ? CA ARG A-3 44 1 
ATOM 3945 C CA B ARG A-3 1 44 . 35.35 38.786 -3.559 0.12 10.27 ? CA ARG A-3 44 1 
ATOM 3946 C C A ARG A-3 1 44 . 35.759 38.345 -4.78 0.88 6.96 ? C ARG A-3 44 1 
ATOM 3947 C C B ARG A-3 1 44 . 35.575 37.721 -4.69 0.12 8.97 ? C ARG A-3 44 1 
ATOM 3948 O O A ARG A-3 1 44 . 36.963 38.258 -4.785 0.88 7.94 ? O ARG A-3 44 1 
ATOM 3949 O O B ARG A-3 1 44 . 36.028 36.622 -4.434 0.12 11 ? O ARG A-3 44 1 
ATOM 3950 C CB A ARG A-3 1 44 . 34.061 39.852 -3.756 0.88 10.81 ? CB ARG A-3 44 1 
ATOM 3951 C CB B ARG A-3 1 44 . 36.099 40.021 -3.932 0.12 12.35 ? CB ARG A-3 44 1 
ATOM 3952 C CG A ARG A-3 1 44 . 35.135 40.932 -4.028 0.88 16.06 ? CG ARG A-3 44 1 
ATOM 3953 C CG B ARG A-3 1 44 . 35.357 41.353 -3.815 0.12 15.56 ? CG ARG A-3 44 1 
ATOM 3954 C CD A ARG A-3 1 44 . 34.574 42.204 -3.813 0.88 19.5 ? CD ARG A-3 44 1 
ATOM 3955 C CD B ARG A-3 1 44 . 35.045 41.77 -2.4 0.12 17.61 ? CD ARG A-3 44 1 
ATOM 3956 N NE A ARG A-3 1 44 . 35.232 43.309 -4.561 0.88 17.14 ? NE ARG A-3 44 1 
ATOM 3957 N NE B ARG A-3 1 44 . 33.621 42.041 -2.249 0.12 17.66 ? NE ARG A-3 44 1 
ATOM 3958 C CZ A ARG A-3 1 44 . 36.218 44.08 -4.122 0.88 12.3 ? CZ ARG A-3 44 1 
ATOM 3959 C CZ B ARG A-3 1 44 . 33.064 42.655 -1.209 0.12 14.5 ? CZ ARG A-3 44 1 
ATOM 3960 N NH1 A ARG A-3 1 44 . 36.934 43.77 -3.067 0.88 14.44 ? NH1 ARG A-3 44 1 
ATOM 3961 N NH1 B ARG A-3 1 44 . 33.799 43.076 -0.193 0.12 14.11 ? NH1 ARG A-3 44 1 
ATOM 3962 N NH2 A ARG A-3 1 44 . 36.571 45.055 -4.98 0.88 13.08 ? NH2 ARG A-3 44 1 
ATOM 3963 N NH2 B ARG A-3 1 44 . 31.759 42.849 -1.204 0.12 14.3 ? NH2 ARG A-3 44 1 
ATOM 3964 N N . VAL A-3 1 45 . 34.975 37.99 -5.834 1 7.95 ? N VAL A-3 45 1 
ATOM 3965 C CA . VAL A-3 1 45 . 35.474 37.905 -7.191 1 6.98 ? CA VAL A-3 45 1 
ATOM 3966 C C . VAL A-3 1 45 . 35.207 39.258 -7.865 1 5.99 ? C VAL A-3 45 1 
ATOM 3967 O O . VAL A-3 1 45 . 34.1 39.754 -7.791 1 6.51 ? O VAL A-3 45 1 
ATOM 3968 C CB . VAL A-3 1 45 . 34.793 36.764 -7.96 1 8.01 ? CB VAL A-3 45 1 
ATOM 3969 C CG1 . VAL A-3 1 45 . 35.26 36.679 -9.391 1 8.04 ? CG1 VAL A-3 45 1 
ATOM 3970 C CG2 . VAL A-3 1 45 . 35.052 35.409 -7.228 1 8.74 ? CG2 VAL A-3 45 1 
ATOM 3971 N N . LEU A-3 1 46 . 36.212 39.865 -8.515 1 5.69 ? N LEU A-3 46 1 
ATOM 3972 C CA . LEU A-3 1 46 . 35.944 41.134 -9.16 1 5.49 ? CA LEU A-3 46 1 
ATOM 3973 C C . LEU A-3 1 46 . 34.811 40.97 -10.156 1 5.41 ? C LEU A-3 46 1 
ATOM 3974 O O . LEU A-3 1 46 . 34.722 39.966 -10.884 1 5.8 ? O LEU A-3 46 1 
ATOM 3975 C CB . LEU A-3 1 46 . 37.155 41.724 -9.845 1 6.35 ? CB LEU A-3 46 1 
ATOM 3976 C CG . LEU A-3 1 46 . 38.36 42.008 -8.963 1 6.78 ? CG LEU A-3 46 1 
ATOM 3977 C CD1 . LEU A-3 1 46 . 39.465 42.662 -9.819 1 7.51 ? CD1 LEU A-3 46 1 
ATOM 3978 C CD2 . LEU A-3 1 46 . 38.018 42.909 -7.79 1 7.52 ? CD2 LEU A-3 46 1 
ATOM 3979 N N A TYR A-3 1 47 . 34.025 42.015 -10.31 0.58 5.39 ? N TYR A-3 47 1 
ATOM 3980 N N B TYR A-3 1 47 . 33.876 41.903 -10.203 0.42 6.2 ? N TYR A-3 47 1 
ATOM 3981 C CA A TYR A-3 1 47 . 32.802 41.924 -11.04 0.58 5.76 ? CA TYR A-3 47 1 
ATOM 3982 C CA B TYR A-3 1 47 . 32.685 41.819 -11.139 0.42 6.19 ? CA TYR A-3 47 1 
ATOM 3983 C C A TYR A-3 1 47 . 33.044 42.162 -12.502 0.58 5.11 ? C TYR A-3 47 1 
ATOM 3984 C C B TYR A-3 1 47 . 33.088 41.905 -12.636 0.42 5.23 ? C TYR A-3 47 1 
ATOM 3985 O O A TYR A-3 1 47 . 32.148 41.962 -13.32 0.58 5.35 ? O TYR A-3 47 1 
ATOM 3986 O O B TYR A-3 1 47 . 32.316 41.566 -13.512 0.42 5.77 ? O TYR A-3 47 1 
ATOM 3987 C CB A TYR A-3 1 47 . 31.731 42.924 -10.531 0.58 5.3 ? CB TYR A-3 47 1 
ATOM 3988 C CB B TYR A-3 1 47 . 31.677 42.988 -10.875 0.42 6.51 ? CB TYR A-3 47 1 
ATOM 3989 C CG A TYR A-3 1 47 . 31.022 42.589 -9.261 0.58 5.44 ? CG TYR A-3 47 1 
ATOM 3990 C CG B TYR A-3 1 47 . 30.748 42.775 -9.689 0.42 6.61 ? CG TYR A-3 47 1 
ATOM 3991 C CD1 A TYR A-3 1 47 . 29.723 43.029 -9.092 0.58 5.84 ? CD1 TYR A-3 47 1 
ATOM 3992 C CD1 B TYR A-3 1 47 . 29.447 43.084 -9.773 0.42 7.13 ? CD1 TYR A-3 47 1 
ATOM 3993 C CD2 A TYR A-3 1 47 . 31.625 41.84 -8.226 0.58 6.24 ? CD2 TYR A-3 47 1 
ATOM 3994 C CD2 B TYR A-3 1 47 . 31.167 42.095 -8.577 0.42 8.83 ? CD2 TYR A-3 47 1 
ATOM 3995 C CE1 A TYR A-3 1 47 . 29.021 42.735 -7.973 0.58 6.41 ? CE1 TYR A-3 47 1 
ATOM 3996 C CE1 B TYR A-3 1 47 . 28.539 42.817 -8.729 0.42 10.16 ? CE1 TYR A-3 47 1 
ATOM 3997 C CE2 A TYR A-3 1 47 . 30.921 41.586 -7.07 0.58 7.02 ? CE2 TYR A-3 47 1 
ATOM 3998 C CE2 B TYR A-3 1 47 . 30.256 41.822 -7.438 0.42 9.94 ? CE2 TYR A-3 47 1 
ATOM 3999 C CZ A TYR A-3 1 47 . 29.609 42.006 -6.97 0.58 7.68 ? CZ TYR A-3 47 1 
ATOM 4000 C CZ B TYR A-3 1 47 . 28.955 42.198 -7.573 0.42 9.86 ? CZ TYR A-3 47 1 
ATOM 4001 O OH A TYR A-3 1 47 . 28.848 41.742 -5.857 0.58 10.27 ? OH TYR A-3 47 1 
ATOM 4002 O OH B TYR A-3 1 47 . 28.02 41.947 -6.596 0.42 14.03 ? OH TYR A-3 47 1 
ATOM 4003 N N . SER A-3 1 48 . 34.248 42.518 -12.88 1 5.85 ? N SER A-3 48 1 
ATOM 4004 C CA . SER A-3 1 48 . 34.71 42.808 -14.237 1 5.71 ? CA SER A-3 48 1 
ATOM 4005 C C . SER A-3 1 48 . 35.912 41.927 -14.54 1 5.4 ? C SER A-3 48 1 
ATOM 4006 O O . SER A-3 1 48 . 36.616 41.507 -13.611 1 5.44 ? O SER A-3 48 1 
ATOM 4007 C CB . SER A-3 1 48 . 35.086 44.271 -14.328 1 6.22 ? CB SER A-3 48 1 
ATOM 4008 O OG . SER A-3 1 48 . 33.96 45.052 -14.027 1 6.9 ? OG SER A-3 48 1 
ATOM 4009 N N . PRO A-3 1 49 . 36.232 41.703 -15.828 1 5.28 ? N PRO A-3 49 1 
ATOM 4010 C CA . PRO A-3 1 49 . 37.367 40.841 -16.205 1 5.38 ? CA PRO A-3 49 1 
ATOM 4011 C C . PRO A-3 1 49 . 38.661 41.638 -16.187 1 4.94 ? C PRO A-3 49 1 
ATOM 4012 O O . PRO A-3 1 49 . 39.289 41.949 -17.196 1 5.7 ? O PRO A-3 49 1 
ATOM 4013 C CB . PRO A-3 1 49 . 36.989 40.376 -17.603 1 5.93 ? CB PRO A-3 49 1 
ATOM 4014 C CG . PRO A-3 1 49 . 36.205 41.529 -18.157 1 6.3 ? CG PRO A-3 49 1 
ATOM 4015 C CD . PRO A-3 1 49 . 35.444 42.093 -17.003 1 6.46 ? CD PRO A-3 49 1 
ATOM 4016 N N . PHE A-3 1 50 . 39.018 42.041 -14.966 1 5.13 ? N PHE A-3 50 1 
ATOM 4017 C CA . PHE A-3 1 50 . 40.187 42.792 -14.643 1 5.13 ? CA PHE A-3 50 1 
ATOM 4018 C C . PHE A-3 1 50 . 41.059 41.951 -13.717 1 5.39 ? C PHE A-3 50 1 
ATOM 4019 O O . PHE A-3 1 50 . 40.536 41.068 -13.012 0.89 5.68 ? O PHE A-3 50 1 
ATOM 4020 C CB . PHE A-3 1 50 . 39.828 44.12 -13.956 1 5.97 ? CB PHE A-3 50 1 
ATOM 4021 C CG . PHE A-3 1 50 . 38.846 45.035 -14.692 1 5.75 ? CG PHE A-3 50 1 
ATOM 4022 C CD1 . PHE A-3 1 50 . 38.329 46.087 -13.985 1 6.42 ? CD1 PHE A-3 50 1 
ATOM 4023 C CD2 . PHE A-3 1 50 . 38.502 44.899 -16.024 1 5.44 ? CD2 PHE A-3 50 1 
ATOM 4024 C CE1 . PHE A-3 1 50 . 37.473 46.993 -14.604 1 6.95 ? CE1 PHE A-3 50 1 
ATOM 4025 C CE2 . PHE A-3 1 50 . 37.622 45.793 -16.629 0.94 5.48 ? CE2 PHE A-3 50 1 
ATOM 4026 C CZ . PHE A-3 1 50 . 37.108 46.863 -15.898 1 6.74 ? CZ PHE A-3 50 1 
ATOM 4027 N N . PHE A-3 1 51 . 42.354 42.215 -13.708 1 5.53 ? N PHE A-3 51 1 
ATOM 4028 C CA . PHE A-3 1 51 . 43.246 41.502 -12.863 1 5.8 ? CA PHE A-3 51 1 
ATOM 4029 C C . PHE A-3 1 51 . 44.141 42.451 -12.091 1 4.96 ? C PHE A-3 51 1 
ATOM 4030 O O . PHE A-3 1 51 . 44.486 43.522 -12.547 1 5.55 ? O PHE A-3 51 1 
ATOM 4031 C CB . PHE A-3 1 51 . 44.115 40.46 -13.62 1 7.14 ? CB PHE A-3 51 1 
ATOM 4032 C CG . PHE A-3 1 51 . 45.062 41.074 -14.686 1 7.22 ? CG PHE A-3 51 1 
ATOM 4033 C CD1 . PHE A-3 1 51 . 46.305 41.534 -14.315 1 7.41 ? CD1 PHE A-3 51 1 
ATOM 4034 C CD2 . PHE A-3 1 51 . 44.683 41.229 -16.013 1 9.04 ? CD2 PHE A-3 51 1 
ATOM 4035 C CE1 . PHE A-3 1 51 . 47.199 42.05 -15.257 1 8.62 ? CE1 PHE A-3 51 1 
ATOM 4036 C CE2 . PHE A-3 1 51 . 45.561 41.757 -16.947 1 9.33 ? CE2 PHE A-3 51 1 
ATOM 4037 C CZ . PHE A-3 1 51 . 46.808 42.154 -16.554 1 9.81 ? CZ PHE A-3 51 1 
ATOM 4038 N N . TYR A-3 1 52 . 44.526 42.031 -10.882 1 5.42 ? N TYR A-3 52 1 
ATOM 4039 C CA . TYR A-3 1 52 . 45.417 42.868 -10.099 1 5.74 ? CA TYR A-3 52 1 
ATOM 4040 C C . TYR A-3 1 52 . 46.714 43.069 -10.849 1 5.22 ? C TYR A-3 52 1 
ATOM 4041 O O . TYR A-3 1 52 . 47.369 42.084 -11.229 1 5.96 ? O TYR A-3 52 1 
ATOM 4042 C CB . TYR A-3 1 52 . 45.65 42.293 -8.691 1 5.87 ? CB TYR A-3 52 1 
ATOM 4043 C CG . TYR A-3 1 52 . 44.545 42.689 -7.761 1 5.84 ? CG TYR A-3 52 1 
ATOM 4044 C CD1 . TYR A-3 1 52 . 43.325 42.051 -7.759 1 6.03 ? CD1 TYR A-3 52 1 
ATOM 4045 C CD2 . TYR A-3 1 52 . 44.704 43.785 -6.889 1 7.15 ? CD2 TYR A-3 52 1 
ATOM 4046 C CE1 . TYR A-3 1 52 . 42.258 42.545 -6.987 1 7.03 ? CE1 TYR A-3 52 1 
ATOM 4047 C CE2 . TYR A-3 1 52 . 43.683 44.264 -6.122 1 7.62 ? CE2 TYR A-3 52 1 
ATOM 4048 C CZ . TYR A-3 1 52 . 42.474 43.653 -6.188 1 7.93 ? CZ TYR A-3 52 1 
ATOM 4049 O OH . TYR A-3 1 52 . 41.373 44.112 -5.461 1 9.99 ? OH TYR A-3 52 1 
ATOM 4050 N N . PRO A-3 1 53 . 47.168 44.31 -11.016 1 5.53 ? N PRO A-3 53 1 
ATOM 4051 C CA . PRO A-3 1 53 . 48.345 44.568 -11.868 1 5.57 ? CA PRO A-3 53 1 
ATOM 4052 C C . PRO A-3 1 53 . 49.667 44.414 -11.127 1 5.35 ? C PRO A-3 53 1 
ATOM 4053 O O . PRO A-3 1 53 . 50.736 44.591 -11.76 1 6.68 ? O PRO A-3 53 1 
ATOM 4054 C CB . PRO A-3 1 53 . 48.125 45.996 -12.348 1 6.23 ? CB PRO A-3 53 1 
ATOM 4055 C CG . PRO A-3 1 53 . 47.328 46.638 -11.228 1 6.11 ? CG PRO A-3 53 1 
ATOM 4056 C CD . PRO A-3 1 53 . 46.379 45.556 -10.781 1 6.01 ? CD PRO A-3 53 1 
ATOM 4057 N N . VAL A-3 1 54 . 49.61 44.185 -9.844 1 5.39 ? N VAL A-3 54 1 
ATOM 4058 C CA . VAL A-3 1 54 . 50.696 44.134 -8.877 1 5.44 ? CA VAL A-3 54 1 
ATOM 4059 C C . VAL A-3 1 54 . 50.435 42.989 -7.942 1 5.39 ? C VAL A-3 54 1 
ATOM 4060 O O . VAL A-3 1 54 . 49.282 42.547 -7.81 1 6.44 ? O VAL A-3 54 1 
ATOM 4061 C CB . VAL A-3 1 54 . 50.735 45.47 -8.071 1 6.82 ? CB VAL A-3 54 1 
ATOM 4062 C CG1 . VAL A-3 1 54 . 51.183 46.616 -8.975 1 9.09 ? CG1 VAL A-3 54 1 
ATOM 4063 C CG2 . VAL A-3 1 54 . 49.408 45.741 -7.392 1 8.42 ? CG2 VAL A-3 54 1 
ATOM 4064 N N . ASP A-3 1 55 . 51.46 42.508 -7.251 1 5.29 ? N ASP A-3 55 1 
ATOM 4065 C CA A ASP A-3 1 55 . 51.27 41.638 -6.101 0.78 4.96 ? CA ASP A-3 55 1 
ATOM 4066 C CA B ASP A-3 1 55 . 51.231 41.636 -6.142 0.22 6.41 ? CA ASP A-3 55 1 
ATOM 4067 C C . ASP A-3 1 55 . 50.739 42.533 -4.984 1 5.12 ? C ASP A-3 55 1 
ATOM 4068 O O . ASP A-3 1 55 . 51.337 43.585 -4.676 1 8.66 ? O ASP A-3 55 1 
ATOM 4069 C CB A ASP A-3 1 55 . 52.548 40.934 -5.7 0.78 5.2 ? CB ASP A-3 55 1 
ATOM 4070 C CB B ASP A-3 1 55 . 52.509 40.863 -5.881 0.22 9.13 ? CB ASP A-3 55 1 
ATOM 4071 C CG A ASP A-3 1 55 . 52.908 39.737 -6.599 0.78 4.81 ? CG ASP A-3 55 1 
ATOM 4072 C CG B ASP A-3 1 55 . 52.827 39.915 -7.007 0.22 11.3 ? CG ASP A-3 55 1 
ATOM 4073 O OD1 A ASP A-3 1 55 . 52.466 39.719 -7.803 0.78 5.48 ? OD1 ASP A-3 55 1 
ATOM 4074 O OD1 B ASP A-3 1 55 . 52.36 38.783 -6.978 0.22 10.07 ? OD1 ASP A-3 55 1 
ATOM 4075 O OD2 A ASP A-3 1 55 . 53.674 38.909 -6.12 0.78 7 ? OD2 ASP A-3 55 1 
ATOM 4076 O OD2 B ASP A-3 1 55 . 53.492 40.312 -7.968 0.22 12.83 ? OD2 ASP A-3 55 1 
ATOM 4077 N N . TYR A-3 1 56 . 49.64 42.186 -4.398 1 4.78 ? N TYR A-3 56 1 
ATOM 4078 C CA . TYR A-3 1 56 . 48.848 43.092 -3.572 1 4.68 ? CA TYR A-3 56 1 
ATOM 4079 C C . TYR A-3 1 56 . 48.694 42.515 -2.182 1 4.31 ? C TYR A-3 56 1 
ATOM 4080 O O . TYR A-3 1 56 . 48.345 41.336 -2.031 1 4.97 ? O TYR A-3 56 1 
ATOM 4081 C CB . TYR A-3 1 56 . 47.482 43.303 -4.241 1 4.94 ? CB TYR A-3 56 1 
ATOM 4082 C CG . TYR A-3 1 56 . 46.618 44.309 -3.601 1 4.86 ? CG TYR A-3 56 1 
ATOM 4083 C CD1 . TYR A-3 1 56 . 46.609 45.632 -4.015 1 5.72 ? CD1 TYR A-3 56 1 
ATOM 4084 C CD2 . TYR A-3 1 56 . 45.786 43.992 -2.519 1 5.33 ? CD2 TYR A-3 56 1 
ATOM 4085 C CE1 . TYR A-3 1 56 . 45.819 46.594 -3.364 1 6.02 ? CE1 TYR A-3 56 1 
ATOM 4086 C CE2 . TYR A-3 1 56 . 44.996 44.921 -1.88 1 5.41 ? CE2 TYR A-3 56 1 
ATOM 4087 C CZ . TYR A-3 1 56 . 45.037 46.25 -2.302 1 5.07 ? CZ TYR A-3 56 1 
ATOM 4088 O OH . TYR A-3 1 56 . 44.311 47.221 -1.676 1 5.73 ? OH TYR A-3 56 1 
ATOM 4089 N N . GLY A-3 1 57 . 48.914 43.317 -1.144 1 4.69 ? N GLY A-3 57 1 
ATOM 4090 C CA . GLY A-3 1 57 . 48.726 42.793 0.206 1 5.09 ? CA GLY A-3 57 1 
ATOM 4091 C C . GLY A-3 1 57 . 48.77 43.878 1.247 1 4.53 ? C GLY A-3 57 1 
ATOM 4092 O O . GLY A-3 1 57 . 48.232 44.976 1.036 1 4.87 ? O GLY A-3 57 1 
ATOM 4093 N N . ILE A-3 1 58 . 49.377 43.558 2.375 1 4.98 ? N ILE A-3 58 1 
ATOM 4094 C CA . ILE A-3 1 58 . 49.384 44.408 3.566 1 5.03 ? CA ILE A-3 58 1 
ATOM 4095 C C . ILE A-3 1 58 . 50.775 44.553 4.108 1 5.26 ? C ILE A-3 58 1 
ATOM 4096 O O . ILE A-3 1 58 . 51.666 43.708 3.913 1 5.72 ? O ILE A-3 58 1 
ATOM 4097 C CB . ILE A-3 1 58 . 48.465 43.854 4.674 1 5.51 ? CB ILE A-3 58 1 
ATOM 4098 C CG1 . ILE A-3 1 58 . 48.923 42.528 5.245 1 7.51 ? CG1 ILE A-3 58 1 
ATOM 4099 C CG2 . ILE A-3 1 58 . 47.044 43.806 4.162 1 6.69 ? CG2 ILE A-3 58 1 
ATOM 4100 C CD1 . ILE A-3 1 58 . 48.173 42.102 6.479 1 10.43 ? CD1 ILE A-3 58 1 
ATOM 4101 N N . ILE A-3 1 59 . 50.955 45.615 4.897 1 5.62 ? N ILE A-3 59 1 
ATOM 4102 C CA . ILE A-3 1 59 . 52.104 45.737 5.791 1 5.55 ? CA ILE A-3 59 1 
ATOM 4103 C C . ILE A-3 1 59 . 51.65 45.214 7.139 1 5.5 ? C ILE A-3 59 1 
ATOM 4104 O O . ILE A-3 1 59 . 50.628 45.668 7.683 1 6.11 ? O ILE A-3 59 1 
ATOM 4105 C CB . ILE A-3 1 59 . 52.634 47.155 5.865 1 5.91 ? CB ILE A-3 59 1 
ATOM 4106 C CG1 . ILE A-3 1 59 . 53.049 47.651 4.461 1 6.79 ? CG1 ILE A-3 59 1 
ATOM 4107 C CG2 . ILE A-3 1 59 . 53.802 47.208 6.868 1 6.66 ? CG2 ILE A-3 59 1 
ATOM 4108 C CD1 . ILE A-3 1 59 . 53.48 49.083 4.422 1 7.69 ? CD1 ILE A-3 59 1 
ATOM 4109 N N . PRO A-3 1 60 . 52.347 44.24 7.737 1 6.35 ? N PRO A-3 60 1 
ATOM 4110 C CA . PRO A-3 1 60 . 51.905 43.743 9.058 1 7.24 ? CA PRO A-3 60 1 
ATOM 4111 C C . PRO A-3 1 60 . 51.957 44.842 10.113 1 6.6 ? C PRO A-3 60 1 
ATOM 4112 O O . PRO A-3 1 60 . 52.71 45.804 10.015 1 6.97 ? O PRO A-3 60 1 
ATOM 4113 C CB . PRO A-3 1 60 . 52.935 42.628 9.391 1 9.61 ? CB PRO A-3 60 1 
ATOM 4114 C CG . PRO A-3 1 60 . 53.524 42.254 8.033 1 10.49 ? CG PRO A-3 60 1 
ATOM 4115 C CD . PRO A-3 1 60 . 53.537 43.525 7.256 1 7.12 ? CD PRO A-3 60 1 
ATOM 4116 N N . GLN A-3 1 61 . 51.126 44.661 11.157 1 6.87 ? N GLN A-3 61 1 
ATOM 4117 C CA A GLN A-3 1 61 . 51.114 45.612 12.291 0.64 7.58 ? CA GLN A-3 61 1 
ATOM 4118 C CA B GLN A-3 1 61 . 51.199 45.582 12.294 0.36 7.2 ? CA GLN A-3 61 1 
ATOM 4119 C C . GLN A-3 1 61 . 50.922 47.026 11.822 1 7 ? C GLN A-3 61 1 
ATOM 4120 O O . GLN A-3 1 61 . 51.509 47.978 12.323 1 7.54 ? O GLN A-3 61 1 
ATOM 4121 C CB A GLN A-3 1 61 . 52.298 45.426 13.227 0.64 7.99 ? CB GLN A-3 61 1 
ATOM 4122 C CB B GLN A-3 1 61 . 52.51 45.436 13.103 0.36 8.22 ? CB GLN A-3 61 1 
ATOM 4123 C CG A GLN A-3 1 61 . 52.25 44.058 13.931 0.64 9.71 ? CG GLN A-3 61 1 
ATOM 4124 C CG B GLN A-3 1 61 . 52.473 44.184 13.965 0.36 7.81 ? CG GLN A-3 61 1 
ATOM 4125 C CD A GLN A-3 1 61 . 53.281 43.983 15.001 0.64 11.76 ? CD GLN A-3 61 1 
ATOM 4126 C CD B GLN A-3 1 61 . 53.599 44.128 14.946 0.36 10.2 ? CD GLN A-3 61 1 
ATOM 4127 O OE1 A GLN A-3 1 61 . 53.309 44.842 15.9 0.64 14.59 ? OE1 GLN A-3 61 1 
ATOM 4128 O OE1 B GLN A-3 1 61 . 54.26 45.126 15.166 0.36 11 ? OE1 GLN A-3 61 1 
ATOM 4129 N NE2 A GLN A-3 1 61 . 54.241 43.073 14.89 0.64 13.79 ? NE2 GLN A-3 61 1 
ATOM 4130 N NE2 B GLN A-3 1 61 . 53.846 42.986 15.525 0.36 10.17 ? NE2 GLN A-3 61 1 
ATOM 4131 N N . THR A-3 1 62 . 49.991 47.183 10.879 1 6.69 ? N THR A-3 62 1 
ATOM 4132 C CA . THR A-3 1 62 . 49.479 48.474 10.453 1 6.47 ? CA THR A-3 62 1 
ATOM 4133 C C . THR A-3 1 62 . 47.959 48.425 10.517 1 6.75 ? C THR A-3 62 1 
ATOM 4134 O O . THR A-3 1 62 . 47.326 47.382 10.53 1 7.05 ? O THR A-3 62 1 
ATOM 4135 C CB . THR A-3 1 62 . 49.93 48.87 9.04 1 6.69 ? CB THR A-3 62 1 
ATOM 4136 O OG1 . THR A-3 1 62 . 49.339 48.016 8.073 1 6.43 ? OG1 THR A-3 62 1 
ATOM 4137 C CG2 . THR A-3 1 62 . 51.419 48.96 8.932 1 7.11 ? CG2 THR A-3 62 1 
ATOM 4138 N N . TRP A-3 1 63 . 47.373 49.643 10.498 1 7.15 ? N TRP A-3 63 1 
ATOM 4139 C CA . TRP A-3 1 63 . 45.929 49.814 10.41 1 6.75 ? CA TRP A-3 63 1 
ATOM 4140 C C . TRP A-3 1 63 . 45.66 51.038 9.589 1 6.5 ? C TRP A-3 63 1 
ATOM 4141 O O . TRP A-3 1 63 . 46.544 51.841 9.347 1 7.85 ? O TRP A-3 63 1 
ATOM 4142 C CB . TRP A-3 1 63 . 45.306 49.876 11.809 1 8.04 ? CB TRP A-3 63 1 
ATOM 4143 C CG . TRP A-3 1 63 . 43.85 49.62 11.864 1 8.78 ? CG TRP A-3 63 1 
ATOM 4144 C CD1 . TRP A-3 1 63 . 42.83 50.5 12.184 1 10.6 ? CD1 TRP A-3 63 1 
ATOM 4145 C CD2 . TRP A-3 1 63 . 43.21 48.356 11.621 1 9.48 ? CD2 TRP A-3 63 1 
ATOM 4146 N NE1 . TRP A-3 1 63 . 41.617 49.847 12.114 1 11.67 ? NE1 TRP A-3 63 1 
ATOM 4147 C CE2 . TRP A-3 1 63 . 41.825 48.534 11.814 1 10.29 ? CE2 TRP A-3 63 1 
ATOM 4148 C CE3 . TRP A-3 1 63 . 43.689 47.1 11.272 1 10.16 ? CE3 TRP A-3 63 1 
ATOM 4149 C CZ2 . TRP A-3 1 63 . 40.924 47.477 11.704 1 12.8 ? CZ2 TRP A-3 63 1 
ATOM 4150 C CZ3 . TRP A-3 1 63 . 42.825 46.073 11.185 1 11.15 ? CZ3 TRP A-3 63 1 
ATOM 4151 C CH2 . TRP A-3 1 63 . 41.416 46.254 11.418 1 12.69 ? CH2 TRP A-3 63 1 
ATOM 4152 N N . TYR A-3 1 64 . 44.44 51.196 9.141 1 6.79 ? N TYR A-3 64 1 
ATOM 4153 C CA . TYR A-3 1 64 . 44.147 52.275 8.187 1 7.2 ? CA TYR A-3 64 1 
ATOM 4154 C C . TYR A-3 1 64 . 42.68 52.639 8.233 1 6.84 ? C TYR A-3 64 1 
ATOM 4155 O O . TYR A-3 1 64 . 41.851 51.969 8.874 1 7.99 ? O TYR A-3 64 1 
ATOM 4156 C CB . TYR A-3 1 64 . 44.6 51.89 6.766 1 6.65 ? CB TYR A-3 64 1 
ATOM 4157 C CG . TYR A-3 1 64 . 45.037 53.093 5.996 1 6.51 ? CG TYR A-3 64 1 
ATOM 4158 C CD1 . TYR A-3 1 64 . 46.166 53.802 6.371 1 7.3 ? CD1 TYR A-3 64 1 
ATOM 4159 C CD2 . TYR A-3 1 64 . 44.333 53.589 4.893 1 6.84 ? CD2 TYR A-3 64 1 
ATOM 4160 C CE1 . TYR A-3 1 64 . 46.596 54.922 5.692 1 7.15 ? CE1 TYR A-3 64 1 
ATOM 4161 C CE2 . TYR A-3 1 64 . 44.715 54.714 4.257 1 6.98 ? CE2 TYR A-3 64 1 
ATOM 4162 C CZ . TYR A-3 1 64 . 45.881 55.359 4.609 1 7.13 ? CZ TYR A-3 64 1 
ATOM 4163 O OH . TYR A-3 1 64 . 46.284 56.454 3.88 1 7.61 ? OH TYR A-3 64 1 
ATOM 4164 N N . ASP A-3 1 65 . 42.343 53.702 7.523 1 7.16 ? N ASP A-3 65 1 
ATOM 4165 C CA . ASP A-3 1 65 . 41.032 54.345 7.627 1 7.38 ? CA ASP A-3 65 1 
ATOM 4166 C C . ASP A-3 1 65 . 39.893 53.485 7.148 1 7.67 ? C ASP A-3 65 1 
ATOM 4167 O O . ASP A-3 1 65 . 38.751 53.758 7.509 1 9.41 ? O ASP A-3 65 1 
ATOM 4168 C CB . ASP A-3 1 65 . 41.005 55.639 6.815 1 8.1 ? CB ASP A-3 65 1 
ATOM 4169 C CG . ASP A-3 1 65 . 42.057 56.631 7.276 1 9.92 ? CG ASP A-3 65 1 
ATOM 4170 O OD1 . ASP A-3 1 65 . 43.243 56.341 7.234 1 11.41 ? OD1 ASP A-3 65 1 
ATOM 4171 O OD2 . ASP A-3 1 65 . 41.685 57.731 7.657 1 18.8 ? OD2 ASP A-3 65 1 
ATOM 4172 N N . ASP A-3 1 66 . 40.161 52.491 6.291 1 7.9 ? N ASP A-3 66 1 
ATOM 4173 C CA . ASP A-3 1 66 . 39.131 51.573 5.833 1 7.53 ? CA ASP A-3 66 1 
ATOM 4174 C C . ASP A-3 1 66 . 38.947 50.398 6.758 1 8.33 ? C ASP A-3 66 1 
ATOM 4175 O O . ASP A-3 1 66 . 38.22 49.448 6.408 1 9.85 ? O ASP A-3 66 1 
ATOM 4176 C CB . ASP A-3 1 66 . 39.382 51.126 4.4 1 7.95 ? CB ASP A-3 66 1 
ATOM 4177 C CG . ASP A-3 1 66 . 40.658 50.306 4.221 1 6.05 ? CG ASP A-3 66 1 
ATOM 4178 O OD1 . ASP A-3 1 66 . 41.528 50.362 5.101 1 7.24 ? OD1 ASP A-3 66 1 
ATOM 4179 O OD2 . ASP A-3 1 66 . 40.754 49.648 3.139 1 5.76 ? OD2 ASP A-3 66 1 
ATOM 4180 N N . GLY A-3 1 67 . 39.491 50.453 7.963 1 8.42 ? N GLY A-3 67 1 
ATOM 4181 C CA . GLY A-3 1 67 . 39.209 49.392 8.91 1 9.79 ? CA GLY A-3 67 1 
ATOM 4182 C C . GLY A-3 1 67 . 39.898 48.091 8.596 1 8.76 ? C GLY A-3 67 1 
ATOM 4183 O O . GLY A-3 1 67 . 39.312 47.007 8.753 1 10.3 ? O GLY A-3 67 1 
ATOM 4184 N N . ASP A-3 1 68 . 41.135 48.176 8.126 1 7.79 ? N ASP A-3 68 1 
ATOM 4185 C CA . ASP A-3 1 68 . 41.919 47.005 7.772 1 7.88 ? CA ASP A-3 68 1 
ATOM 4186 C C . ASP A-3 1 68 . 43.38 47.463 7.71 1 6.69 ? C ASP A-3 68 1 
ATOM 4187 O O . ASP A-3 1 68 . 43.674 48.654 7.762 1 7.12 ? O ASP A-3 68 1 
ATOM 4188 C CB . ASP A-3 1 68 . 41.413 46.353 6.468 1 8.23 ? CB ASP A-3 68 1 
ATOM 4189 C CG . ASP A-3 1 68 . 40.598 45.088 6.727 1 9.4 ? CG ASP A-3 68 1 
ATOM 4190 O OD1 . ASP A-3 1 68 . 40.903 44.306 7.644 1 10.77 ? OD1 ASP A-3 68 1 
ATOM 4191 O OD2 . ASP A-3 1 68 . 39.637 44.884 5.923 1 11.24 ? OD2 ASP A-3 68 1 
ATOM 4192 N N . PRO A-3 1 69 . 44.311 46.499 7.561 1 6.47 ? N PRO A-3 69 1 
ATOM 4193 C CA . PRO A-3 1 69 . 45.712 46.865 7.471 1 6.24 ? CA PRO A-3 69 1 
ATOM 4194 C C . PRO A-3 1 69 . 45.993 47.751 6.265 1 5.4 ? C PRO A-3 69 1 
ATOM 4195 O O . PRO A-3 1 69 . 45.291 47.707 5.238 1 5.71 ? O PRO A-3 69 1 
ATOM 4196 C CB . PRO A-3 1 69 . 46.407 45.525 7.381 1 7.11 ? CB PRO A-3 69 1 
ATOM 4197 C CG . PRO A-3 1 69 . 45.457 44.546 8.036 1 8.02 ? CG PRO A-3 69 1 
ATOM 4198 C CD . PRO A-3 1 69 . 44.104 45.038 7.613 1 7.55 ? CD PRO A-3 69 1 
ATOM 4199 N N . PHE A-3 1 70 . 47.07 48.493 6.331 1 5.78 ? N PHE A-3 70 1 
ATOM 4200 C CA . PHE A-3 1 70 . 47.508 49.391 5.253 1 5.49 ? CA PHE A-3 70 1 
ATOM 4201 C C . PHE A-3 1 70 . 47.96 48.56 4.063 1 5.09 ? C PHE A-3 70 1 
ATOM 4202 O O . PHE A-3 1 70 . 48.693 47.578 4.171 1 5.57 ? O PHE A-3 70 1 
ATOM 4203 C CB . PHE A-3 1 70 . 48.615 50.266 5.831 1 6.16 ? CB PHE A-3 70 1 
ATOM 4204 C CG . PHE A-3 1 70 . 49.122 51.376 4.945 1 5.66 ? CG PHE A-3 70 1 
ATOM 4205 C CD1 . PHE A-3 1 70 . 50.474 51.714 4.968 1 6.83 ? CD1 PHE A-3 70 1 
ATOM 4206 C CD2 . PHE A-3 1 70 . 48.289 52.201 4.205 1 6.46 ? CD2 PHE A-3 70 1 
ATOM 4207 C CE1 . PHE A-3 1 70 . 50.947 52.796 4.257 1 7.3 ? CE1 PHE A-3 70 1 
ATOM 4208 C CE2 . PHE A-3 1 70 . 48.773 53.243 3.461 1 6.67 ? CE2 PHE A-3 70 1 
ATOM 4209 C CZ . PHE A-3 1 70 . 50.102 53.556 3.484 1 6.7 ? CZ PHE A-3 70 1 
ATOM 4210 N N . ASP A-3 1 71 . 47.518 49.006 2.885 1 4.86 ? N ASP A-3 71 1 
ATOM 4211 C CA . ASP A-3 1 71 . 47.698 48.29 1.646 0.93 4.19 ? CA ASP A-3 71 1 
ATOM 4212 C C . ASP A-3 1 71 . 49.043 48.605 0.972 1 4.9 ? C ASP A-3 71 1 
ATOM 4213 O O . ASP A-3 1 71 . 49.483 49.753 0.933 1 5.03 ? O ASP A-3 71 1 
ATOM 4214 C CB . ASP A-3 1 71 . 46.567 48.627 0.666 1 5.03 ? CB ASP A-3 71 1 
ATOM 4215 C CG . ASP A-3 1 71 . 45.214 48.231 1.181 1 4.56 ? CG ASP A-3 71 1 
ATOM 4216 O OD1 . ASP A-3 1 71 . 44.215 48.986 0.938 1 4.86 ? OD1 ASP A-3 71 1 
ATOM 4217 O OD2 . ASP A-3 1 71 . 45.125 47.161 1.814 1 4.97 ? OD2 ASP A-3 71 1 
ATOM 4218 N N . ILE A-3 1 72 . 49.64 47.557 0.41 1 4.9 ? N ILE A-3 72 1 
ATOM 4219 C CA . ILE A-3 1 72 . 50.888 47.672 -0.33 1 4.73 ? CA ILE A-3 72 1 
ATOM 4220 C C . ILE A-3 1 72 . 50.805 46.883 -1.604 1 4.8 ? C ILE A-3 72 1 
ATOM 4221 O O . ILE A-3 1 72 . 50.231 45.785 -1.669 1 5.94 ? O ILE A-3 72 1 
ATOM 4222 C CB . ILE A-3 1 72 . 52.081 47.265 0.566 1 5.17 ? CB ILE A-3 72 1 
ATOM 4223 C CG1 . ILE A-3 1 72 . 53.425 47.477 -0.161 1 5.54 ? CG1 ILE A-3 72 1 
ATOM 4224 C CG2 . ILE A-3 1 72 . 51.955 45.865 1.102 1 5.7 ? CG2 ILE A-3 72 1 
ATOM 4225 C CD1 . ILE A-3 1 72 . 54.622 47.564 0.796 1 6.31 ? CD1 ILE A-3 72 1 
ATOM 4226 N N . MET A-3 1 73 . 51.421 47.437 -2.619 1 4.76 ? N MET A-3 73 1 
ATOM 4227 C CA . MET A-3 1 73 . 51.503 46.92 -3.988 1 4.99 ? CA MET A-3 73 1 
ATOM 4228 C C . MET A-3 1 73 . 52.963 46.707 -4.313 1 5.58 ? C MET A-3 73 1 
ATOM 4229 O O . MET A-3 1 73 . 53.73 47.674 -4.282 1 7 ? O MET A-3 73 1 
ATOM 4230 C CB . MET A-3 1 73 . 50.898 47.955 -4.946 1 5.68 ? CB MET A-3 73 1 
ATOM 4231 C CG . MET A-3 1 73 . 49.476 48.373 -4.574 1 6.07 ? CG MET A-3 73 1 
ATOM 4232 S SD . MET A-3 1 73 . 48.67 49.457 -5.77 1 7.52 ? SD MET A-3 73 1 
ATOM 4233 C CE . MET A-3 1 73 . 49.708 50.934 -5.637 1 8.16 ? CE MET A-3 73 1 
ATOM 4234 N N . VAL A-3 1 74 . 53.365 45.469 -4.584 1 5.26 ? N VAL A-3 74 1 
ATOM 4235 C CA . VAL A-3 1 74 . 54.739 45.116 -4.878 1 5.11 ? CA VAL A-3 74 1 
ATOM 4236 C C . VAL A-3 1 74 . 54.831 44.708 -6.345 1 5.59 ? C VAL A-3 74 1 
ATOM 4237 O O . VAL A-3 1 74 . 54.077 43.868 -6.826 1 6.29 ? O VAL A-3 74 1 
ATOM 4238 C CB . VAL A-3 1 74 . 55.276 44.038 -3.978 1 5.78 ? CB VAL A-3 74 1 
ATOM 4239 C CG1 . VAL A-3 1 74 . 56.752 43.802 -4.296 1 6.92 ? CG1 VAL A-3 74 1 
ATOM 4240 C CG2 . VAL A-3 1 74 . 55.106 44.412 -2.515 1 6.87 ? CG2 VAL A-3 74 1 
ATOM 4241 N N . ILE A-3 1 75 . 55.787 45.309 -7.049 1 5.95 ? N ILE A-3 75 1 
ATOM 4242 C CA A ILE A-3 1 75 . 56.037 44.99 -8.408 0.24 6.15 ? CA ILE A-3 75 1 
ATOM 4243 C CA B ILE A-3 1 75 . 56.008 44.944 -8.459 0.76 6.32 ? CA ILE A-3 75 1 
ATOM 4244 C C . ILE A-3 1 75 . 56.943 43.721 -8.514 1 6.47 ? C ILE A-3 75 1 
ATOM 4245 O O . ILE A-3 1 75 . 58.121 43.816 -8.295 0.9 7.34 ? O ILE A-3 75 1 
ATOM 4246 C CB A ILE A-3 1 75 . 56.629 46.192 -9.118 0.24 9.65 ? CB ILE A-3 75 1 
ATOM 4247 C CB B ILE A-3 1 75 . 56.618 46.114 -9.235 0.76 6.06 ? CB ILE A-3 75 1 
ATOM 4248 C CG1 A ILE A-3 1 75 . 55.764 47.424 -8.784 0.24 8.58 ? CG1 ILE A-3 75 1 
ATOM 4249 C CG1 B ILE A-3 1 75 . 55.828 47.415 -9.054 0.76 8.44 ? CG1 ILE A-3 75 1 
ATOM 4250 C CG2 A ILE A-3 1 75 . 56.695 45.959 -10.647 0.24 14.17 ? CG2 ILE A-3 75 1 
ATOM 4251 C CG2 B ILE A-3 1 75 . 56.697 45.73 -10.706 0.76 7.07 ? CG2 ILE A-3 75 1 
ATOM 4252 C CD1 A ILE A-3 1 75 . 54.308 47.22 -9.092 0.24 8.05 ? CD1 ILE A-3 75 1 
ATOM 4253 C CD1 B ILE A-3 1 75 . 56.521 48.659 -9.654 0.76 9.61 ? CD1 ILE A-3 75 1 
ATOM 4254 N N . MET A-3 1 76 . 56.326 42.548 -8.755 1 7.14 ? N MET A-3 76 1 
ATOM 4255 C CA . MET A-3 1 76 . 57.025 41.264 -8.893 1 7.1 ? CA MET A-3 76 1 
ATOM 4256 C C . MET A-3 1 76 . 56.969 40.796 -10.369 1 7.57 ? C MET A-3 76 1 
ATOM 4257 O O . MET A-3 1 76 . 55.881 40.718 -10.923 1 9.76 ? O MET A-3 76 1 
ATOM 4258 C CB . MET A-3 1 76 . 56.479 40.164 -7.995 0.81 5.65 ? CB MET A-3 76 1 
ATOM 4259 C CG . MET A-3 1 76 . 56.769 40.359 -6.523 1 8.44 ? CG MET A-3 76 1 
ATOM 4260 S SD . MET A-3 1 76 . 58.568 40.203 -6.155 1 9.77 ? SD MET A-3 76 1 
ATOM 4261 C CE . MET A-3 1 76 . 58.829 38.475 -6.486 1 9.5 ? CE MET A-3 76 1 
ATOM 4262 N N . ARG A-3 1 77 . 58.093 40.414 -10.923 1 6.49 ? N ARG A-3 77 1 
ATOM 4263 C CA . ARG A-3 1 77 . 58.136 39.832 -12.247 1 6.33 ? CA ARG A-3 77 1 
ATOM 4264 C C . ARG A-3 1 77 . 57.438 38.478 -12.284 1 7.01 ? C ARG A-3 77 1 
ATOM 4265 O O . ARG A-3 1 77 . 56.536 38.266 -13.108 1 10.91 ? O ARG A-3 77 1 
ATOM 4266 C CB . ARG A-3 1 77 . 59.584 39.758 -12.772 1 7.12 ? CB ARG A-3 77 1 
ATOM 4267 C CG . ARG A-3 1 77 . 60.195 41.144 -12.94 1 7.08 ? CG ARG A-3 77 1 
ATOM 4268 C CD . ARG A-3 1 77 . 61.51 41.08 -13.678 1 7.8 ? CD ARG A-3 77 1 
ATOM 4269 N NE . ARG A-3 1 77 . 62.576 40.508 -12.859 1 7.04 ? NE ARG A-3 77 1 
ATOM 4270 C CZ . ARG A-3 1 77 . 63.704 39.991 -13.358 1 7.27 ? CZ ARG A-3 77 1 
ATOM 4271 N NH1 . ARG A-3 1 77 . 63.846 39.751 -14.663 1 7.82 ? NH1 ARG A-3 77 1 
ATOM 4272 N NH2 . ARG A-3 1 77 . 64.673 39.649 -12.519 1 7.52 ? NH2 ARG A-3 77 1 
ATOM 4273 N N . GLU A-3 1 78 . 57.814 37.559 -11.417 1 6.55 ? N GLU A-3 78 1 
ATOM 4274 C CA . GLU A-3 1 78 . 57.103 36.327 -11.204 1 6.08 ? CA GLU A-3 78 1 
ATOM 4275 C C . GLU A-3 1 78 . 56.224 36.541 -9.953 1 6.01 ? C GLU A-3 78 1 
ATOM 4276 O O . GLU A-3 1 78 . 56.798 36.803 -8.883 1 6.71 ? O GLU A-3 78 1 
ATOM 4277 C CB . GLU A-3 1 78 . 58.082 35.156 -10.954 1 6.87 ? CB GLU A-3 78 1 
ATOM 4278 C CG . GLU A-3 1 78 . 57.391 33.844 -10.685 1 7.07 ? CG GLU A-3 78 1 
ATOM 4279 C CD . GLU A-3 1 78 . 58.412 32.69 -10.529 1 7.94 ? CD GLU A-3 78 1 
ATOM 4280 O OE1 . GLU A-3 1 78 . 59.081 32.371 -11.497 1 8.79 ? OE1 GLU A-3 78 1 
ATOM 4281 O OE2 . GLU A-3 1 78 . 58.574 32.156 -9.416 1 8.75 ? OE2 GLU A-3 78 1 
ATOM 4282 N N . PRO A-3 1 79 . 54.926 36.469 -10.067 1 6.29 ? N PRO A-3 79 1 
ATOM 4283 C CA . PRO A-3 1 79 . 54.088 36.701 -8.866 1 7.4 ? CA PRO A-3 79 1 
ATOM 4284 C C . PRO A-3 1 79 . 54.394 35.672 -7.788 1 6.54 ? C PRO A-3 79 1 
ATOM 4285 O O . PRO A-3 1 79 . 54.744 34.539 -8.063 1 7.98 ? O PRO A-3 79 1 
ATOM 4286 C CB . PRO A-3 1 79 . 52.667 36.525 -9.408 1 9.58 ? CB PRO A-3 79 1 
ATOM 4287 C CG . PRO A-3 1 79 . 52.82 36.852 -10.891 1 11.99 ? CG PRO A-3 79 1 
ATOM 4288 C CD . PRO A-3 1 79 . 54.132 36.249 -11.27 1 9.34 ? CD PRO A-3 79 1 
ATOM 4289 N N . VAL A-3 1 80 . 54.224 36.118 -6.551 1 6.9 ? N VAL A-3 80 1 
ATOM 4290 C CA . VAL A-3 1 80 . 54.352 35.221 -5.431 1 6.39 ? CA VAL A-3 80 1 
ATOM 4291 C C . VAL A-3 1 80 . 53.055 34.553 -5.088 1 6.41 ? C VAL A-3 80 1 
ATOM 4292 O O . VAL A-3 1 80 . 52.005 34.99 -5.441 1 12.34 ? O VAL A-3 80 1 
ATOM 4293 C CB . VAL A-3 1 80 . 55.007 35.865 -4.185 1 7.07 ? CB VAL A-3 80 1 
ATOM 4294 C CG1 . VAL A-3 1 80 . 56.353 36.497 -4.532 1 7.7 ? CG1 VAL A-3 80 1 
ATOM 4295 C CG2 . VAL A-3 1 80 . 54.088 36.88 -3.478 1 7.07 ? CG2 VAL A-3 80 1 
ATOM 4296 N N . TYR A-3 1 81 . 53.105 33.552 -4.254 1 6.87 ? N TYR A-3 81 1 
ATOM 4297 C CA . TYR A-3 1 81 . 51.953 32.871 -3.729 1 6.61 ? CA TYR A-3 81 1 
ATOM 4298 C C . TYR A-3 1 81 . 51.32 33.689 -2.609 1 6.29 ? C TYR A-3 81 1 
ATOM 4299 O O . TYR A-3 1 81 . 52.05 34.395 -1.853 1 7.29 ? O TYR A-3 81 1 
ATOM 4300 C CB . TYR A-3 1 81 . 52.317 31.454 -3.232 1 6.91 ? CB TYR A-3 81 1 
ATOM 4301 C CG . TYR A-3 1 81 . 52.676 30.551 -4.345 1 6.95 ? CG TYR A-3 81 1 
ATOM 4302 C CD1 . TYR A-3 1 81 . 53.964 30.507 -4.886 1 7.61 ? CD1 TYR A-3 81 1 
ATOM 4303 C CD2 . TYR A-3 1 81 . 51.709 29.751 -4.949 1 6.69 ? CD2 TYR A-3 81 1 
ATOM 4304 C CE1 . TYR A-3 1 81 . 54.242 29.729 -5.975 1 8.61 ? CE1 TYR A-3 81 1 
ATOM 4305 C CE2 . TYR A-3 1 81 . 51.996 28.959 -6.047 1 7.91 ? CE2 TYR A-3 81 1 
ATOM 4306 C CZ . TYR A-3 1 81 . 53.292 28.976 -6.578 1 7.85 ? CZ TYR A-3 81 1 
ATOM 4307 O OH . TYR A-3 1 81 . 53.551 28.191 -7.663 1 9.9 ? OH TYR A-3 81 1 
ATOM 4308 N N . PRO A-3 1 82 . 50.023 33.584 -2.345 1 6.6 ? N PRO A-3 82 1 
ATOM 4309 C CA . PRO A-3 1 82 . 49.465 34.278 -1.189 1 6.49 ? CA PRO A-3 82 1 
ATOM 4310 C C . PRO A-3 1 82 . 50.142 33.844 0.094 1 6.38 ? C PRO A-3 82 1 
ATOM 4311 O O . PRO A-3 1 82 . 50.54 32.685 0.266 1 7.21 ? O PRO A-3 82 1 
ATOM 4312 C CB . PRO A-3 1 82 . 47.996 33.843 -1.195 1 8.01 ? CB PRO A-3 82 1 
ATOM 4313 C CG . PRO A-3 1 82 . 47.719 33.426 -2.622 1 8.51 ? CG PRO A-3 82 1 
ATOM 4314 C CD . PRO A-3 1 82 . 49.03 32.794 -3.089 1 7.51 ? CD PRO A-3 82 1 
ATOM 4315 N N . LEU A-3 1 83 . 50.231 34.81 1.012 1 6.31 ? N LEU A-3 83 1 
ATOM 4316 C CA . LEU A-3 1 83 . 50.828 34.688 2.322 1 6.74 ? CA LEU A-3 83 1 
ATOM 4317 C C . LEU A-3 1 83 . 52.334 34.598 2.3 1 6.65 ? C LEU A-3 83 1 
ATOM 4318 O O . LEU A-3 1 83 . 52.95 34.229 3.298 1 8.57 ? O LEU A-3 83 1 
ATOM 4319 C CB . LEU A-3 1 83 . 50.196 33.574 3.18 1 9.23 ? CB LEU A-3 83 1 
ATOM 4320 C CG . LEU A-3 1 83 . 48.69 33.614 3.26 1 13.43 ? CG LEU A-3 83 1 
ATOM 4321 C CD1 . LEU A-3 1 83 . 48.216 32.431 4.183 1 19.69 ? CD1 LEU A-3 83 1 
ATOM 4322 C CD2 . LEU A-3 1 83 . 48.205 34.911 3.751 1 16.76 ? CD2 LEU A-3 83 1 
ATOM 4323 N N . THR A-3 1 84 . 52.957 35.042 1.194 1 6.22 ? N THR A-3 84 1 
ATOM 4324 C CA . THR A-3 1 84 . 54.41 35.145 1.112 1 5.97 ? CA THR A-3 84 1 
ATOM 4325 C C . THR A-3 1 84 . 54.834 36.539 1.627 1 5.51 ? C THR A-3 84 1 
ATOM 4326 O O . THR A-3 1 84 . 54.244 37.564 1.244 1 6.08 ? O THR A-3 84 1 
ATOM 4327 C CB . THR A-3 1 84 . 54.878 34.962 -0.313 1 6.72 ? CB THR A-3 84 1 
ATOM 4328 O OG1 . THR A-3 1 84 . 54.431 33.714 -0.82 1 7.84 ? OG1 THR A-3 84 1 
ATOM 4329 C CG2 . THR A-3 1 84 . 56.395 34.983 -0.392 1 8.07 ? CG2 THR A-3 84 1 
ATOM 4330 N N . ILE A-3 1 85 . 55.909 36.559 2.403 1 5.46 ? N ILE A-3 85 1 
ATOM 4331 C CA . ILE A-3 1 85 . 56.555 37.782 2.852 1 5.41 ? CA ILE A-3 85 1 
ATOM 4332 C C . ILE A-3 1 85 . 57.575 38.241 1.837 1 5.24 ? C ILE A-3 85 1 
ATOM 4333 O O . ILE A-3 1 85 . 58.433 37.46 1.424 1 6.35 ? O ILE A-3 85 1 
ATOM 4334 C CB . ILE A-3 1 85 . 57.287 37.527 4.176 1 7.14 ? CB ILE A-3 85 1 
ATOM 4335 C CG1 . ILE A-3 1 85 . 56.388 36.997 5.271 1 8.97 ? CG1 ILE A-3 85 1 
ATOM 4336 C CG2 . ILE A-3 1 85 . 58.06 38.769 4.597 1 8.84 ? CG2 ILE A-3 85 1 
ATOM 4337 C CD1 . ILE A-3 1 85 . 57.223 36.266 6.37 1 12.02 ? CD1 ILE A-3 85 1 
ATOM 4338 N N . ILE A-3 1 86 . 57.52 39.505 1.463 1 5.24 ? N ILE A-3 86 1 
ATOM 4339 C CA . ILE A-3 1 86 . 58.502 40.111 0.576 1 5.71 ? CA ILE A-3 86 1 
ATOM 4340 C C . ILE A-3 1 86 . 59.131 41.306 1.311 1 5.48 ? C ILE A-3 86 1 
ATOM 4341 O O . ILE A-3 1 86 . 58.388 42.188 1.756 1 6.91 ? O ILE A-3 86 1 
ATOM 4342 C CB . ILE A-3 1 86 . 57.9 40.598 -0.754 1 5.78 ? CB ILE A-3 86 1 
ATOM 4343 C CG1 . ILE A-3 1 86 . 57.171 39.474 -1.488 1 6.45 ? CG1 ILE A-3 86 1 
ATOM 4344 C CG2 . ILE A-3 1 86 . 58.968 41.266 -1.635 1 6.8 ? CG2 ILE A-3 86 1 
ATOM 4345 C CD1 . ILE A-3 1 86 . 56.48 39.932 -2.744 1 6.96 ? CD1 ILE A-3 86 1 
ATOM 4346 N N . GLU A-3 1 87 . 60.442 41.403 1.386 1 5.35 ? N GLU A-3 87 1 
ATOM 4347 C CA B GLU A-3 1 87 . 61.121 42.615 1.813 0.52 5.91 ? CA GLU A-3 87 1 
ATOM 4348 C CA C GLU A-3 1 87 . 61.069 42.634 1.828 0.16 4.53 ? CA GLU A-3 87 1 
ATOM 4349 C CA D GLU A-3 1 87 . 61.114 42.606 1.831 0.32 6.15 ? CA GLU A-3 87 1 
ATOM 4350 C C . GLU A-3 1 87 . 61.035 43.636 0.68 1 5.44 ? C GLU A-3 87 1 
ATOM 4351 O O . GLU A-3 1 87 . 61.527 43.369 -0.421 1 6.38 ? O GLU A-3 87 1 
ATOM 4352 C CB B GLU A-3 1 87 . 62.586 42.312 2.104 0.52 6.91 ? CB GLU A-3 87 1 
ATOM 4353 C CB C GLU A-3 1 87 . 62.482 42.428 2.369 0.16 6 ? CB GLU A-3 87 1 
ATOM 4354 C CB D GLU A-3 1 87 . 62.569 42.278 2.206 0.32 6.84 ? CB GLU A-3 87 1 
ATOM 4355 C CG B GLU A-3 1 87 . 62.742 41.439 3.243 0.52 8.71 ? CG GLU A-3 87 1 
ATOM 4356 C CG C GLU A-3 1 87 . 62.531 41.586 3.625 0.16 8.87 ? CG GLU A-3 87 1 
ATOM 4357 C CG D GLU A-3 1 87 . 63.263 43.4 2.892 0.32 6.84 ? CG GLU A-3 87 1 
ATOM 4358 C CD B GLU A-3 1 87 . 64.024 40.492 3.152 0.52 13.19 ? CD GLU A-3 87 1 
ATOM 4359 C CD C GLU A-3 1 87 . 63.954 41.311 4.086 0.16 11.76 ? CD GLU A-3 87 1 
ATOM 4360 C CD D GLU A-3 1 87 . 64.708 43.068 3.337 0.32 10.09 ? CD GLU A-3 87 1 
ATOM 4361 O OE1 B GLU A-3 1 87 . 64.583 39.851 2.058 0.52 13.17 ? OE1 GLU A-3 87 1 
ATOM 4362 O OE1 C GLU A-3 1 87 . 64.903 41.883 3.509 0.16 14.6 ? OE1 GLU A-3 87 1 
ATOM 4363 O OE1 D GLU A-3 1 87 . 65.475 43.884 3.818 0.32 9.99 ? OE1 GLU A-3 87 1 
ATOM 4364 O OE2 B GLU A-3 1 87 . 64.483 40.14 4.28 0.52 17.98 ? OE2 GLU A-3 87 1 
ATOM 4365 O OE2 C GLU A-3 1 87 . 64.098 40.457 5.008 0.16 12.42 ? OE2 GLU A-3 87 1 
ATOM 4366 O OE2 D GLU A-3 1 87 . 65.14 41.905 3.232 0.32 16.66 ? OE2 GLU A-3 87 1 
ATOM 4367 N N . ALA A-3 1 88 . 60.415 44.766 0.958 1 5.58 ? N ALA A-3 88 1 
ATOM 4368 C CA . ALA A-3 1 88 . 59.989 45.705 -0.099 1 6.66 ? CA ALA A-3 88 1 
ATOM 4369 C C . ALA A-3 1 88 . 60.461 47.118 0.234 1 6.11 ? C ALA A-3 88 1 
ATOM 4370 O O . ALA A-3 1 88 . 60.405 47.573 1.365 1 6.89 ? O ALA A-3 88 1 
ATOM 4371 C CB . ALA A-3 1 88 . 58.488 45.66 -0.221 1 8.29 ? CB ALA A-3 88 1 
ATOM 4372 N N . ARG A-3 1 89 . 60.904 47.803 -0.826 1 5.79 ? N ARG A-3 89 1 
ATOM 4373 C CA . ARG A-3 1 89 . 61.32 49.193 -0.776 1 5.79 ? CA ARG A-3 89 1 
ATOM 4374 C C . ARG A-3 1 89 . 60.2 50.075 -1.322 1 5.55 ? C ARG A-3 89 1 
ATOM 4375 O O . ARG A-3 1 89 . 59.89 50.023 -2.507 1 5.94 ? O ARG A-3 89 1 
ATOM 4376 C CB . ARG A-3 1 89 . 62.599 49.403 -1.653 1 6.92 ? CB ARG A-3 89 1 
ATOM 4377 C CG . ARG A-3 1 89 . 62.958 50.827 -1.864 1 8.75 ? CG ARG A-3 89 1 
ATOM 4378 C CD . ARG A-3 1 89 . 64.332 51.03 -2.513 1 10.31 ? CD ARG A-3 89 1 
ATOM 4379 N NE . ARG A-3 1 89 . 64.457 50.438 -3.903 1 9.21 ? NE ARG A-3 89 1 
ATOM 4380 C CZ . ARG A-3 1 89 . 65.079 49.275 -4.145 1 8.44 ? CZ ARG A-3 89 1 
ATOM 4381 N NH1 . ARG A-3 1 89 . 65.215 48.872 -5.373 1 9.12 ? NH1 ARG A-3 89 1 
ATOM 4382 N NH2 . ARG A-3 1 89 . 65.536 48.517 -3.14 1 10.1 ? NH2 ARG A-3 89 1 
ATOM 4383 N N . PRO A-3 1 90 . 59.59 50.9 -0.46 1 5.88 ? N PRO A-3 90 1 
ATOM 4384 C CA . PRO A-3 1 90 . 58.579 51.868 -0.935 1 6.06 ? CA PRO A-3 90 1 
ATOM 4385 C C . PRO A-3 1 90 . 59.221 52.856 -1.912 1 6.19 ? C PRO A-3 90 1 
ATOM 4386 O O . PRO A-3 1 90 . 60.271 53.417 -1.601 1 7.13 ? O PRO A-3 90 1 
ATOM 4387 C CB . PRO A-3 1 90 . 58.127 52.565 0.356 1 6.57 ? CB PRO A-3 90 1 
ATOM 4388 C CG . PRO A-3 1 90 . 58.381 51.538 1.435 1 7.36 ? CG PRO A-3 90 1 
ATOM 4389 C CD . PRO A-3 1 90 . 59.698 50.918 1.01 1 7.96 ? CD PRO A-3 90 1 
ATOM 4390 N N . ILE A-3 1 91 . 58.523 53.085 -3.041 1 5.57 ? N ILE A-3 91 1 
ATOM 4391 C CA . ILE A-3 1 91 . 58.959 54.068 -4.028 1 6.35 ? CA ILE A-3 91 1 
ATOM 4392 C C . ILE A-3 1 91 . 57.917 55.115 -4.303 1 6.38 ? C ILE A-3 91 1 
ATOM 4393 O O . ILE A-3 1 91 . 58.219 56.084 -5.005 1 8.22 ? O ILE A-3 91 1 
ATOM 4394 C CB . ILE A-3 1 91 . 59.456 53.399 -5.337 1 6.85 ? CB ILE A-3 91 1 
ATOM 4395 C CG1 . ILE A-3 1 91 . 58.336 52.675 -6.078 1 7.48 ? CG1 ILE A-3 91 1 
ATOM 4396 C CG2 . ILE A-3 1 91 . 60.656 52.526 -5.022 1 7.64 ? CG2 ILE A-3 91 1 
ATOM 4397 C CD1 . ILE A-3 1 91 . 58.707 52.22 -7.452 1 8.92 ? CD1 ILE A-3 91 1 
ATOM 4398 N N . GLY A-3 1 92 . 56.683 54.986 -3.787 1 6.35 ? N GLY A-3 92 1 
ATOM 4399 C CA . GLY A-3 1 92 . 55.655 55.956 -4.064 1 6.45 ? CA GLY A-3 92 1 
ATOM 4400 C C . GLY A-3 1 92 . 54.369 55.477 -3.429 1 5.48 ? C GLY A-3 92 1 
ATOM 4401 O O . GLY A-3 1 92 . 54.34 54.456 -2.733 1 5.73 ? O GLY A-3 92 1 
ATOM 4402 N N . ILE A-3 1 93 . 53.297 56.219 -3.666 1 6.02 ? N ILE A-3 93 1 
ATOM 4403 C CA . ILE A-3 1 93 . 52.017 55.914 -3.021 1 5.79 ? CA ILE A-3 93 1 
ATOM 4404 C C . ILE A-3 1 93 . 50.879 56.364 -3.918 1 5.52 ? C ILE A-3 93 1 
ATOM 4405 O O . ILE A-3 1 93 . 50.868 57.492 -4.446 1 6.71 ? O ILE A-3 93 1 
ATOM 4406 C CB . ILE A-3 1 93 . 51.956 56.514 -1.587 1 6.21 ? CB ILE A-3 93 1 
ATOM 4407 C CG1 . ILE A-3 1 93 . 50.667 56.103 -0.865 1 6.27 ? CG1 ILE A-3 93 1 
ATOM 4408 C CG2 . ILE A-3 1 93 . 52.177 58.038 -1.557 1 7.06 ? CG2 ILE A-3 93 1 
ATOM 4409 C CD1 . ILE A-3 1 93 . 50.833 56.137 0.636 1 7.5 ? CD1 ILE A-3 93 1 
ATOM 4410 N N . MET A-3 1 94 . 49.886 55.507 -4.108 1 5.89 ? N MET A-3 94 1 
ATOM 4411 C CA . MET A-3 1 94 . 48.688 55.822 -4.851 1 5.75 ? CA MET A-3 94 1 
ATOM 4412 C C . MET A-3 1 94 . 47.667 56.427 -3.882 1 5.75 ? C MET A-3 94 1 
ATOM 4413 O O . MET A-3 1 94 . 47.31 55.826 -2.876 1 6.5 ? O MET A-3 94 1 
ATOM 4414 C CB . MET A-3 1 94 . 48.1 54.552 -5.473 1 6.27 ? CB MET A-3 94 1 
ATOM 4415 C CG . MET A-3 1 94 . 46.923 54.819 -6.311 1 7.85 ? CG MET A-3 94 1 
ATOM 4416 S SD . MET A-3 1 94 . 46.18 53.334 -7.029 1 8.32 ? SD MET A-3 94 1 
ATOM 4417 C CE . MET A-3 1 94 . 45.639 52.535 -5.51 1 8.11 ? CE MET A-3 94 1 
ATOM 4418 N N . LYS A-3 1 95 . 47.185 57.613 -4.237 1 5.93 ? N LYS A-3 95 1 
ATOM 4419 C CA . LYS A-3 1 95 . 46.239 58.349 -3.368 1 6.61 ? CA LYS A-3 95 1 
ATOM 4420 C C . LYS A-3 1 95 . 44.849 57.998 -3.84 1 6.55 ? C LYS A-3 95 1 
ATOM 4421 O O . LYS A-3 1 95 . 44.367 58.463 -4.871 1 11.84 ? O LYS A-3 95 1 
ATOM 4422 C CB . LYS A-3 1 95 . 46.523 59.845 -3.503 1 7.48 ? CB LYS A-3 95 1 
ATOM 4423 C CG . LYS A-3 1 95 . 47.916 60.23 -3.067 1 8.92 ? CG LYS A-3 95 1 
ATOM 4424 C CD . LYS A-3 1 95 . 48.17 61.701 -3.19 1 10.99 ? CD LYS A-3 95 1 
ATOM 4425 C CE . LYS A-3 1 95 . 49.588 62.023 -2.633 1 13.89 ? CE LYS A-3 95 1 
ATOM 4426 N NZ . LYS A-3 1 95 . 49.926 63.431 -2.698 1 16.81 ? NZ LYS A-3 95 1 
ATOM 4427 N N . MET A-3 1 96 . 44.202 57.11 -3.105 1 7.44 ? N MET A-3 96 1 
ATOM 4428 C CA . MET A-3 1 96 . 42.874 56.554 -3.403 1 7.88 ? CA MET A-3 96 1 
ATOM 4429 C C . MET A-3 1 96 . 41.934 56.787 -2.222 1 6.52 ? C MET A-3 96 1 
ATOM 4430 O O . MET A-3 1 96 . 42.301 56.509 -1.093 1 7.33 ? O MET A-3 96 1 
ATOM 4431 C CB . MET A-3 1 96 . 42.995 54.988 -3.632 1 6.95 ? CB MET A-3 96 1 
ATOM 4432 C CG . MET A-3 1 96 . 41.621 54.366 -3.878 1 7.55 ? CG MET A-3 96 1 
ATOM 4433 S SD . MET A-3 1 96 . 41.834 52.622 -4.214 1 8.41 ? SD MET A-3 96 1 
ATOM 4434 C CE . MET A-3 1 96 . 40.195 52.188 -4.75 1 8.51 ? CE MET A-3 96 1 
ATOM 4435 N N A GLU A-3 1 97 . 40.734 57.192 -2.571 0.51 6.35 ? N GLU A-3 97 1 
ATOM 4436 N N B GLU A-3 1 97 . 40.67 57.136 -2.489 0.49 6.46 ? N GLU A-3 97 1 
ATOM 4437 C CA A GLU A-3 1 97 . 39.616 57.084 -1.697 0.51 6.89 ? CA GLU A-3 97 1 
ATOM 4438 C CA B GLU A-3 1 97 . 39.548 57.106 -1.556 0.49 6.58 ? CA GLU A-3 97 1 
ATOM 4439 C C A GLU A-3 1 97 . 38.737 55.92 -2.185 0.51 6.23 ? C GLU A-3 97 1 
ATOM 4440 C C B GLU A-3 1 97 . 38.608 56.042 -2.087 0.49 6.42 ? C GLU A-3 97 1 
ATOM 4441 O O A GLU A-3 1 97 . 38.515 55.769 -3.376 0.51 6.9 ? O GLU A-3 97 1 
ATOM 4442 O O B GLU A-3 1 97 . 38.163 56.092 -3.226 0.49 7.9 ? O GLU A-3 97 1 
ATOM 4443 C CB A GLU A-3 1 97 . 38.86 58.408 -1.683 0.51 10.65 ? CB GLU A-3 97 1 
ATOM 4444 C CB B GLU A-3 1 97 . 38.803 58.456 -1.574 0.49 7.89 ? CB GLU A-3 97 1 
ATOM 4445 C CG A GLU A-3 1 97 . 37.902 58.563 -0.451 0.51 10.77 ? CG GLU A-3 97 1 
ATOM 4446 C CG B GLU A-3 1 97 . 39.522 59.544 -1.085 0.49 12.45 ? CG GLU A-3 97 1 
ATOM 4447 C CD A GLU A-3 1 97 . 37.194 59.823 -0.322 0.51 15.18 ? CD GLU A-3 97 1 
ATOM 4448 C CD B GLU A-3 1 97 . 39.411 59.716 0.345 0.49 14.09 ? CD GLU A-3 97 1 
ATOM 4449 O OE1 A GLU A-3 1 97 . 37.787 60.754 0.292 0.51 18.96 ? OE1 GLU A-3 97 1 
ATOM 4450 O OE1 B GLU A-3 1 97 . 38.305 59.538 0.9 0.49 17.04 ? OE1 GLU A-3 97 1 
ATOM 4451 O OE2 A GLU A-3 1 97 . 35.969 59.868 -0.641 0.51 18.85 ? OE2 GLU A-3 97 1 
ATOM 4452 O OE2 B GLU A-3 1 97 . 40.449 60.077 1.055 0.49 12.3 ? OE2 GLU A-3 97 1 
ATOM 4453 N N . ASP A-3 1 98 . 38.296 55.092 -1.239 1 5.71 ? N ASP A-3 98 1 
ATOM 4454 C CA . ASP A-3 1 98 . 37.548 53.887 -1.592 1 5.81 ? CA ASP A-3 98 1 
ATOM 4455 C C . ASP A-3 1 98 . 36.262 53.871 -0.779 1 5.82 ? C ASP A-3 98 1 
ATOM 4456 O O . ASP A-3 1 98 . 36.329 53.742 0.442 1 6.32 ? O ASP A-3 98 1 
ATOM 4457 C CB . ASP A-3 1 98 . 38.391 52.65 -1.3 1 6.38 ? CB ASP A-3 98 1 
ATOM 4458 C CG . ASP A-3 1 98 . 37.78 51.357 -1.732 1 6.82 ? CG ASP A-3 98 1 
ATOM 4459 O OD1 . ASP A-3 1 98 . 36.665 51.404 -2.319 1 12.86 ? OD1 ASP A-3 98 1 
ATOM 4460 O OD2 . ASP A-3 1 98 . 38.331 50.276 -1.513 1 6.32 ? OD2 ASP A-3 98 1 
ATOM 4461 N N . SER A-3 1 99 . 35.131 54.066 -1.414 1 6.27 ? N SER A-3 99 1 
ATOM 4462 C CA . SER A-3 1 99 . 33.837 54.047 -0.713 1 7.62 ? CA SER A-3 99 1 
ATOM 4463 C C . SER A-3 1 99 . 33.817 55.063 0.421 1 6.9 ? C SER A-3 99 1 
ATOM 4464 O O . SER A-3 1 99 . 33.161 54.858 1.445 1 8.04 ? O SER A-3 99 1 
ATOM 4465 C CB . SER A-3 1 99 . 33.536 52.605 -0.234 1 10.18 ? CB SER A-3 99 1 
ATOM 4466 O OG . SER A-3 1 99 . 33.519 51.695 -1.309 1 12.09 ? OG SER A-3 99 1 
ATOM 4467 N N . GLY A-3 1 100 . 34.491 56.194 0.23 1 6.27 ? N GLY A-3 100 1 
ATOM 4468 C CA . GLY A-3 1 100 . 34.517 57.239 1.231 1 7.13 ? CA GLY A-3 100 1 
ATOM 4469 C C . GLY A-3 1 100 . 35.647 57.174 2.238 1 6.42 ? C GLY A-3 100 1 
ATOM 4470 O O . GLY A-3 1 100 . 35.794 58.125 3.011 1 8.24 ? O GLY A-3 100 1 
ATOM 4471 N N . ASP A-3 1 101 . 36.429 56.113 2.262 1 6.03 ? N ASP A-3 101 1 
ATOM 4472 C CA . ASP A-3 1 101 . 37.542 55.979 3.182 1 6.22 ? CA ASP A-3 101 1 
ATOM 4473 C C . ASP A-3 1 101 . 38.851 56.3 2.484 1 6.02 ? C ASP A-3 101 1 
ATOM 4474 O O . ASP A-3 1 101 . 39.135 55.819 1.379 1 6.38 ? O ASP A-3 101 1 
ATOM 4475 C CB . ASP A-3 1 101 . 37.661 54.55 3.703 1 7.2 ? CB ASP A-3 101 1 
ATOM 4476 C CG . ASP A-3 1 101 . 36.482 54.053 4.445 1 8.76 ? CG ASP A-3 101 1 
ATOM 4477 O OD1 . ASP A-3 1 101 . 35.863 54.851 5.179 1 9.13 ? OD1 ASP A-3 101 1 
ATOM 4478 O OD2 . ASP A-3 1 101 . 36.246 52.801 4.318 1 10.67 ? OD2 ASP A-3 101 1 
ATOM 4479 N N . LYS A-3 1 102 . 39.735 56.999 3.188 1 6.36 ? N LYS A-3 102 1 
ATOM 4480 C CA . LYS A-3 1 102 . 41.121 57.066 2.734 1 6.02 ? CA LYS A-3 102 1 
ATOM 4481 C C . LYS A-3 1 102 . 41.619 55.614 2.64 1 5.48 ? C LYS A-3 102 1 
ATOM 4482 O O . LYS A-3 1 102 . 41.415 54.804 3.542 1 6.08 ? O LYS A-3 102 1 
ATOM 4483 C CB . LYS A-3 1 102 . 41.969 57.858 3.723 1 6.86 ? CB LYS A-3 102 1 
ATOM 4484 C CG . LYS A-3 1 102 . 43.259 58.361 3.15 1 6.63 ? CG LYS A-3 102 1 
ATOM 4485 C CD . LYS A-3 1 102 . 44.148 59.059 4.179 1 7.89 ? CD LYS A-3 102 1 
ATOM 4486 C CE . LYS A-3 1 102 . 45.331 59.732 3.526 1 8.66 ? CE LYS A-3 102 1 
ATOM 4487 N NZ . LYS A-3 1 102 . 46.273 60.292 4.54 1 9.62 ? NZ LYS A-3 102 1 
ATOM 4488 N N . ASP A-3 1 103 . 42.321 55.314 1.536 1 5.38 ? N ASP A-3 103 1 
ATOM 4489 C CA . ASP A-3 1 103 . 42.682 53.947 1.225 1 4.93 ? CA ASP A-3 103 1 
ATOM 4490 C C . ASP A-3 1 103 . 43.891 53.95 0.32 1 5.1 ? C ASP A-3 103 1 
ATOM 4491 O O . ASP A-3 1 103 . 44.001 53.185 -0.658 1 5.63 ? O ASP A-3 103 1 
ATOM 4492 C CB . ASP A-3 1 103 . 41.519 53.187 0.621 1 5.2 ? CB ASP A-3 103 1 
ATOM 4493 C CG . ASP A-3 1 103 . 41.602 51.676 0.62 1 4.98 ? CG ASP A-3 103 1 
ATOM 4494 O OD1 . ASP A-3 1 103 . 42.401 51.109 1.406 1 5.3 ? OD1 ASP A-3 103 1 
ATOM 4495 O OD2 . ASP A-3 1 103 . 40.847 51.088 -0.15 1 5.65 ? OD2 ASP A-3 103 1 
ATOM 4496 N N . TRP A-3 1 104 . 44.833 54.826 0.621 1 5.28 ? N TRP A-3 104 1 
ATOM 4497 C CA . TRP A-3 1 104 . 46.08 54.958 -0.113 1 5.36 ? CA TRP A-3 104 1 
ATOM 4498 C C . TRP A-3 1 104 . 46.861 53.656 -0.052 1 5.4 ? C TRP A-3 104 1 
ATOM 4499 O O . TRP A-3 1 104 . 46.735 52.895 0.875 1 5.88 ? O TRP A-3 104 1 
ATOM 4500 C CB . TRP A-3 1 104 . 46.934 56.118 0.471 1 5.75 ? CB TRP A-3 104 1 
ATOM 4501 C CG . TRP A-3 1 104 . 46.349 57.483 0.323 1 6.12 ? CG TRP A-3 104 1 
ATOM 4502 C CD1 . TRP A-3 1 104 . 45.06 57.854 0.002 1 6.05 ? CD1 TRP A-3 104 1 
ATOM 4503 C CD2 . TRP A-3 1 104 . 47.083 58.701 0.458 1 7.21 ? CD2 TRP A-3 104 1 
ATOM 4504 N NE1 . TRP A-3 1 104 . 44.978 59.216 -0.071 1 7.24 ? NE1 TRP A-3 104 1 
ATOM 4505 C CE2 . TRP A-3 1 104 . 46.197 59.765 0.208 1 7.44 ? CE2 TRP A-3 104 1 
ATOM 4506 C CE3 . TRP A-3 1 104 . 48.403 58.98 0.8 1 8.46 ? CE3 TRP A-3 104 1 
ATOM 4507 C CZ2 . TRP A-3 1 104 . 46.601 61.085 0.263 1 9.54 ? CZ2 TRP A-3 104 1 
ATOM 4508 C CZ3 . TRP A-3 1 104 . 48.801 60.318 0.864 1 10.02 ? CZ3 TRP A-3 104 1 
ATOM 4509 C CH2 . TRP A-3 1 104 . 47.908 61.332 0.587 1 10.56 ? CH2 TRP A-3 104 1 
ATOM 4510 N N . LYS A-3 1 105 . 47.722 53.472 -1.052 1 5.4 ? N LYS A-3 105 1 
ATOM 4511 C CA . LYS A-3 1 105 . 48.437 52.192 -1.183 1 5.79 ? CA LYS A-3 105 1 
ATOM 4512 C C . LYS A-3 1 105 . 49.861 52.43 -1.537 1 5.05 ? C LYS A-3 105 1 
ATOM 4513 O O . LYS A-3 1 105 . 50.187 53.114 -2.515 1 5.76 ? O LYS A-3 105 1 
ATOM 4514 C CB . LYS A-3 1 105 . 47.788 51.28 -2.199 1 5.85 ? CB LYS A-3 105 1 
ATOM 4515 C CG . LYS A-3 1 105 . 46.245 51.266 -2.059 1 6.04 ? CG LYS A-3 105 1 
ATOM 4516 C CD . LYS A-3 1 105 . 45.639 50.067 -2.749 1 5.87 ? CD LYS A-3 105 1 
ATOM 4517 C CE . LYS A-3 1 105 . 44.126 50.126 -2.825 1 5.53 ? CE LYS A-3 105 1 
ATOM 4518 N NZ . LYS A-3 1 105 . 43.517 50.381 -1.494 1 5.28 ? NZ LYS A-3 105 1 
ATOM 4519 N N . VAL A-3 1 106 . 50.799 51.897 -0.747 1 5.18 ? N VAL A-3 106 1 
ATOM 4520 C CA . VAL A-3 1 106 . 52.2 51.988 -1.067 1 5.46 ? CA VAL A-3 106 1 
ATOM 4521 C C . VAL A-3 1 106 . 52.489 51.254 -2.348 1 5.29 ? C VAL A-3 106 1 
ATOM 4522 O O . VAL A-3 1 106 . 51.98 50.145 -2.56 1 5.45 ? O VAL A-3 106 1 
ATOM 4523 C CB . VAL A-3 1 106 . 53.027 51.439 0.078 1 6 ? CB VAL A-3 106 1 
ATOM 4524 C CG1 . VAL A-3 1 106 . 54.52 51.329 -0.271 1 6.49 ? CG1 VAL A-3 106 1 
ATOM 4525 C CG2 . VAL A-3 1 106 . 52.826 52.21 1.377 1 7.83 ? CG2 VAL A-3 106 1 
ATOM 4526 N N . LEU A-3 1 107 . 53.341 51.83 -3.204 1 5.45 ? N LEU A-3 107 1 
ATOM 4527 C CA . LEU A-3 1 107 . 53.947 51.131 -4.345 1 5.03 ? CA LEU A-3 107 1 
ATOM 4528 C C . LEU A-3 1 107 . 55.383 50.833 -3.978 1 5.1 ? C LEU A-3 107 1 
ATOM 4529 O O . LEU A-3 1 107 . 56.111 51.746 -3.56 1 5.76 ? O LEU A-3 107 1 
ATOM 4530 C CB . LEU A-3 1 107 . 53.885 52.004 -5.605 1 6.15 ? CB LEU A-3 107 1 
ATOM 4531 C CG . LEU A-3 1 107 . 54.402 51.33 -6.866 1 6.87 ? CG LEU A-3 107 1 
ATOM 4532 C CD1 . LEU A-3 1 107 . 53.561 50.103 -7.279 1 9.06 ? CD1 LEU A-3 107 1 
ATOM 4533 C CD2 . LEU A-3 1 107 . 54.488 52.339 -7.989 1 9.34 ? CD2 LEU A-3 107 1 
ATOM 4534 N N . ALA A-3 1 108 . 55.794 49.577 -4.119 1 4.93 ? N ALA A-3 108 1 
ATOM 4535 C CA . ALA A-3 1 108 . 57.094 49.135 -3.69 1 5.09 ? CA ALA A-3 108 1 
ATOM 4536 C C . ALA A-3 1 108 . 57.682 48.159 -4.675 1 4.9 ? C ALA A-3 108 1 
ATOM 4537 O O . ALA A-3 1 108 . 56.966 47.539 -5.461 1 5.71 ? O ALA A-3 108 1 
ATOM 4538 C CB . ALA A-3 1 108 . 56.995 48.507 -2.317 1 6.16 ? CB ALA A-3 108 1 
ATOM 4539 N N . VAL A-3 1 109 . 59 47.975 -4.565 1 5.35 ? N VAL A-3 109 1 
ATOM 4540 C CA . VAL A-3 1 109 . 59.718 46.965 -5.335 1 5.67 ? CA VAL A-3 109 1 
ATOM 4541 C C . VAL A-3 1 109 . 60.409 46.017 -4.412 1 5.38 ? C VAL A-3 109 1 
ATOM 4542 O O . VAL A-3 1 109 . 60.798 46.379 -3.282 1 6.24 ? O VAL A-3 109 1 
ATOM 4543 C CB . VAL A-3 1 109 . 60.726 47.6 -6.333 1 6.31 ? CB VAL A-3 109 1 
ATOM 4544 C CG1 . VAL A-3 1 109 . 59.993 48.392 -7.432 1 7.55 ? CG1 VAL A-3 109 1 
ATOM 4545 C CG2 . VAL A-3 1 109 . 61.762 48.48 -5.628 1 6.79 ? CG2 VAL A-3 109 1 
ATOM 4546 N N . PRO A-3 1 110 . 60.638 44.776 -4.829 1 5.76 ? N PRO A-3 110 1 
ATOM 4547 C CA . PRO A-3 1 110 . 61.355 43.814 -3.981 1 5.83 ? CA PRO A-3 110 1 
ATOM 4548 C C . PRO A-3 1 110 . 62.804 44.214 -3.849 1 6.46 ? C PRO A-3 110 1 
ATOM 4549 O O . PRO A-3 1 110 . 63.491 44.43 -4.863 1 7.27 ? O PRO A-3 110 1 
ATOM 4550 C CB . PRO A-3 1 110 . 61.208 42.472 -4.742 1 6.89 ? CB PRO A-3 110 1 
ATOM 4551 C CG . PRO A-3 1 110 . 60.997 42.912 -6.186 1 7.94 ? CG PRO A-3 110 1 
ATOM 4552 C CD . PRO A-3 1 110 . 60.193 44.179 -6.106 1 6.7 ? CD PRO A-3 110 1 
ATOM 4553 N N . VAL A-3 1 111 . 63.319 44.215 -2.633 1 6.11 ? N VAL A-3 111 1 
ATOM 4554 C CA . VAL A-3 1 111 . 64.726 44.486 -2.394 1 7.1 ? CA VAL A-3 111 1 
ATOM 4555 C C . VAL A-3 1 111 . 65.591 43.431 -3.081 1 6.97 ? C VAL A-3 111 1 
ATOM 4556 O O . VAL A-3 1 111 . 66.712 43.776 -3.523 1 8.75 ? O VAL A-3 111 1 
ATOM 4557 C CB . VAL A-3 1 111 . 65.037 44.562 -0.886 1 10.46 ? CB VAL A-3 111 1 
ATOM 4558 C CG1 . VAL A-3 1 111 . 66.492 44.58 -0.549 1 14.55 ? CG1 VAL A-3 111 1 
ATOM 4559 C CG2 . VAL A-3 1 111 . 64.275 45.73 -0.266 1 11.66 ? CG2 VAL A-3 111 1 
ATOM 4560 N N A GLU A-3 1 112 . 65.149 42.212 -3.146 0.68 6.21 ? N GLU A-3 112 1 
ATOM 4561 N N B GLU A-3 1 112 . 65.1 42.151 -3.122 0.32 7.43 ? N GLU A-3 112 1 
ATOM 4562 C CA A GLU A-3 1 112 . 66.007 41.127 -3.574 0.68 6.76 ? CA GLU A-3 112 1 
ATOM 4563 C CA B GLU A-3 1 112 . 65.861 40.942 -3.63 0.32 7.98 ? CA GLU A-3 112 1 
ATOM 4564 C C A GLU A-3 1 112 . 65.664 40.645 -4.989 0.68 6.52 ? C GLU A-3 112 1 
ATOM 4565 C C B GLU A-3 1 112 . 65.896 40.753 -5.133 0.32 8.38 ? C GLU A-3 112 1 
ATOM 4566 O O A GLU A-3 1 112 . 65.918 39.502 -5.312 0.68 7.85 ? O GLU A-3 112 1 
ATOM 4567 O O B GLU A-3 1 112 . 66.565 39.855 -5.636 0.32 10.31 ? O GLU A-3 112 1 
ATOM 4568 C CB A GLU A-3 1 112 . 65.915 39.988 -2.567 0.68 7.42 ? CB GLU A-3 112 1 
ATOM 4569 C CB B GLU A-3 1 112 . 65.313 39.602 -3.091 0.32 9.3 ? CB GLU A-3 112 1 
ATOM 4570 C CG A GLU A-3 1 112 . 66.409 40.397 -1.196 0.68 9.27 ? CG GLU A-3 112 1 
ATOM 4571 C CG B GLU A-3 1 112 . 65.41 39.456 -1.598 0.32 10.72 ? CG GLU A-3 112 1 
ATOM 4572 C CD A GLU A-3 1 112 . 67.834 40.791 -1.087 0.68 12.08 ? CD GLU A-3 112 1 
ATOM 4573 C CD B GLU A-3 1 112 . 66.818 39.496 -1.038 0.32 11.17 ? CD GLU A-3 112 1 
ATOM 4574 O OE1 A GLU A-3 1 112 . 68.618 40.54 -2.006 0.68 14.63 ? OE1 GLU A-3 112 1 
ATOM 4575 O OE1 B GLU A-3 1 112 . 67.823 39.274 -1.803 0.32 13.11 ? OE1 GLU A-3 112 1 
ATOM 4576 O OE2 A GLU A-3 1 112 . 68.255 41.367 -0.05 0.68 17.51 ? OE2 GLU A-3 112 1 
ATOM 4577 O OE2 B GLU A-3 1 112 . 67.012 39.656 0.165 0.32 12.44 ? OE2 GLU A-3 112 1 
ATOM 4578 N N . ASP A-3 1 113 . 65.186 41.546 -5.877 1 6.66 ? N ASP A-3 113 1 
ATOM 4579 C CA . ASP A-3 1 113 . 65.214 41.365 -7.323 1 6.75 ? CA ASP A-3 113 1 
ATOM 4580 C C . ASP A-3 1 113 . 66.096 42.451 -7.915 1 6.26 ? C ASP A-3 113 1 
ATOM 4581 O O . ASP A-3 1 113 . 65.696 43.62 -7.901 1 6.64 ? O ASP A-3 113 1 
ATOM 4582 C CB . ASP A-3 1 113 . 63.836 41.404 -7.932 1 6.88 ? CB ASP A-3 113 1 
ATOM 4583 C CG . ASP A-3 1 113 . 63.834 41.107 -9.413 1 6.94 ? CG ASP A-3 113 1 
ATOM 4584 O OD1 . ASP A-3 1 113 . 64.928 41.011 -10.006 1 7.21 ? OD1 ASP A-3 113 1 
ATOM 4585 O OD2 . ASP A-3 1 113 . 62.703 40.946 -9.987 1 7.37 ? OD2 ASP A-3 113 1 
ATOM 4586 N N . PRO A-3 1 114 . 67.261 42.104 -8.452 1 6.94 ? N PRO A-3 114 1 
ATOM 4587 C CA . PRO A-3 1 114 . 68.165 43.115 -8.954 1 7.18 ? CA PRO A-3 114 1 
ATOM 4588 C C . PRO A-3 1 114 . 67.626 43.865 -10.144 1 6.53 ? C PRO A-3 114 1 
ATOM 4589 O O . PRO A-3 1 114 . 68.103 44.983 -10.438 1 7.21 ? O PRO A-3 114 1 
ATOM 4590 C CB . PRO A-3 1 114 . 69.454 42.315 -9.28 1 8.19 ? CB PRO A-3 114 1 
ATOM 4591 C CG . PRO A-3 1 114 . 68.936 40.946 -9.661 1 9.14 ? CG PRO A-3 114 1 
ATOM 4592 C CD . PRO A-3 1 114 . 67.801 40.697 -8.656 1 8.43 ? CD PRO A-3 114 1 
ATOM 4593 N N . TYR A-3 1 115 . 66.611 43.354 -10.819 1 6.45 ? N TYR A-3 115 1 
ATOM 4594 C CA . TYR A-3 1 115 . 65.94 44.101 -11.906 1 6.22 ? CA TYR A-3 115 1 
ATOM 4595 C C . TYR A-3 1 115 . 65.56 45.488 -11.437 1 6.34 ? C TYR A-3 115 1 
ATOM 4596 O O . TYR A-3 1 115 . 65.584 46.431 -12.222 1 7.45 ? O TYR A-3 115 1 
ATOM 4597 C CB . TYR A-3 1 115 . 64.714 43.308 -12.345 1 6.58 ? CB TYR A-3 115 1 
ATOM 4598 C CG . TYR A-3 1 115 . 64.016 43.893 -13.545 1 6.3 ? CG TYR A-3 115 1 
ATOM 4599 C CD1 . TYR A-3 1 115 . 63.037 44.858 -13.384 1 7.18 ? CD1 TYR A-3 115 1 
ATOM 4600 C CD2 . TYR A-3 1 115 . 64.293 43.433 -14.821 1 6.78 ? CD2 TYR A-3 115 1 
ATOM 4601 C CE1 . TYR A-3 1 115 . 62.387 45.383 -14.499 1 8.14 ? CE1 TYR A-3 115 1 
ATOM 4602 C CE2 . TYR A-3 1 115 . 63.615 43.924 -15.91 1 8.1 ? CE2 TYR A-3 115 1 
ATOM 4603 C CZ . TYR A-3 1 115 . 62.692 44.94 -15.744 1 8.5 ? CZ TYR A-3 115 1 
ATOM 4604 O OH . TYR A-3 1 115 . 62.072 45.465 -16.864 1 11.03 ? OH TYR A-3 115 1 
ATOM 4605 N N . PHE A-3 1 116 . 65.128 45.606 -10.169 1 6.4 ? N PHE A-3 116 1 
ATOM 4606 C CA . PHE A-3 1 116 . 64.578 46.85 -9.631 1 6.99 ? CA PHE A-3 116 1 
ATOM 4607 C C . PHE A-3 1 116 . 65.602 47.679 -8.852 1 7.8 ? C PHE A-3 116 1 
ATOM 4608 O O . PHE A-3 1 116 . 65.213 48.646 -8.202 1 8.48 ? O PHE A-3 116 1 
ATOM 4609 C CB . PHE A-3 1 116 . 63.327 46.57 -8.782 1 7.8 ? CB PHE A-3 116 1 
ATOM 4610 C CG . PHE A-3 1 116 . 62.225 45.953 -9.565 1 6.87 ? CG PHE A-3 116 1 
ATOM 4611 C CD1 . PHE A-3 1 116 . 61.962 44.605 -9.476 1 7.33 ? CD1 PHE A-3 116 1 
ATOM 4612 C CD2 . PHE A-3 1 116 . 61.444 46.725 -10.416 1 7.83 ? CD2 PHE A-3 116 1 
ATOM 4613 C CE1 . PHE A-3 1 116 . 60.94 44.022 -10.223 1 8.12 ? CE1 PHE A-3 116 1 
ATOM 4614 C CE2 . PHE A-3 1 116 . 60.396 46.136 -11.181 1 7.83 ? CE2 PHE A-3 116 1 
ATOM 4615 C CZ . PHE A-3 1 116 . 60.18 44.795 -11.058 1 8.23 ? CZ PHE A-3 116 1 
ATOM 4616 N N . ASN A-3 1 117 . 66.889 47.349 -8.94 1 8.52 ? N ASN A-3 117 1 
ATOM 4617 C CA . ASN A-3 1 117 . 67.886 47.996 -8.089 1 9.83 ? CA ASN A-3 117 1 
ATOM 4618 C C . ASN A-3 1 117 . 67.857 49.51 -8.238 1 11.44 ? C ASN A-3 117 1 
ATOM 4619 O O . ASN A-3 1 117 . 68.127 50.203 -7.242 1 13.82 ? O ASN A-3 117 1 
ATOM 4620 C CB . ASN A-3 1 117 . 69.296 47.487 -8.385 1 11.42 ? CB ASN A-3 117 1 
ATOM 4621 C CG . ASN A-3 1 117 . 69.591 46.155 -7.736 1 12.81 ? CG ASN A-3 117 1 
ATOM 4622 O OD1 . ASN A-3 1 117 . 68.893 45.688 -6.832 1 14.65 ? OD1 ASN A-3 117 1 
ATOM 4623 N ND2 . ASN A-3 1 117 . 70.675 45.526 -8.227 1 16.66 ? ND2 ASN A-3 117 1 
ATOM 4624 N N . ASP A-3 1 118 . 67.616 50.019 -9.428 0.85 9.6 ? N ASP A-3 118 1 
ATOM 4625 C CA . ASP A-3 1 118 . 67.637 51.435 -9.684 0.85 11.44 ? CA ASP A-3 118 1 
ATOM 4626 C C . ASP A-3 1 118 . 66.243 52.102 -9.564 0.85 12.72 ? C ASP A-3 118 1 
ATOM 4627 O O . ASP A-3 1 118 . 66.107 53.268 -9.833 0.85 15.86 ? O ASP A-3 118 1 
ATOM 4628 C CB . ASP A-3 1 118 . 68.331 51.741 -10.992 0.85 13.44 ? CB ASP A-3 118 1 
ATOM 4629 C CG . ASP A-3 1 118 . 69.794 51.217 -11.001 0.85 18.97 ? CG ASP A-3 118 1 
ATOM 4630 O OD1 . ASP A-3 1 118 . 70.544 51.345 -10.007 0.85 24.02 ? OD1 ASP A-3 118 1 
ATOM 4631 O OD2 . ASP A-3 1 118 . 70.228 50.545 -11.926 0.85 23.93 ? OD2 ASP A-3 118 1 
ATOM 4632 N N . TRP A-3 1 119 . 65.233 51.375 -9.13 1 11.67 ? N TRP A-3 119 1 
ATOM 4633 C CA . TRP A-3 1 119 . 63.888 51.912 -8.867 1 11.02 ? CA TRP A-3 119 1 
ATOM 4634 C C . TRP A-3 1 119 . 63.842 52.36 -7.446 1 9.51 ? C TRP A-3 119 1 
ATOM 4635 O O . TRP A-3 1 119 . 63.791 51.522 -6.555 1 9.97 ? O TRP A-3 119 1 
ATOM 4636 C CB . TRP A-3 1 119 . 62.78 50.918 -9.156 1 10.49 ? CB TRP A-3 119 1 
ATOM 4637 C CG . TRP A-3 1 119 . 62.586 50.503 -10.579 1 13.41 ? CG TRP A-3 119 1 
ATOM 4638 C CD1 . TRP A-3 1 119 . 63.576 50.253 -11.474 1 18.44 ? CD1 TRP A-3 119 1 
ATOM 4639 C CD2 . TRP A-3 1 119 . 61.36 50.276 -11.237 1 13.33 ? CD2 TRP A-3 119 1 
ATOM 4640 N NE1 . TRP A-3 1 119 . 62.981 49.805 -12.671 1 20.76 ? NE1 TRP A-3 119 1 
ATOM 4641 C CE2 . TRP A-3 1 119 . 61.622 49.896 -12.586 1 17.13 ? CE2 TRP A-3 119 1 
ATOM 4642 C CE3 . TRP A-3 1 119 . 60.085 50.343 -10.833 1 12.72 ? CE3 TRP A-3 119 1 
ATOM 4643 C CZ2 . TRP A-3 1 119 . 60.619 49.449 -13.427 1 18.76 ? CZ2 TRP A-3 119 1 
ATOM 4644 C CZ3 . TRP A-3 1 119 . 59.095 49.992 -11.691 1 13.99 ? CZ3 TRP A-3 119 1 
ATOM 4645 C CH2 . TRP A-3 1 119 . 59.349 49.576 -12.979 1 15.54 ? CH2 TRP A-3 119 1 
ATOM 4646 N N . LYS A-3 1 120 . 63.843 53.686 -7.247 0.85 8.86 ? N LYS A-3 120 1 
ATOM 4647 C CA . LYS A-3 1 120 . 63.916 54.286 -5.914 1 9.93 ? CA LYS A-3 120 1 
ATOM 4648 C C . LYS A-3 1 120 . 62.844 55.335 -5.667 1 8.83 ? C LYS A-3 120 1 
ATOM 4649 O O . LYS A-3 1 120 . 62.616 55.712 -4.502 0.87 8.69 ? O LYS A-3 120 1 
ATOM 4650 C CB . LYS A-3 1 120 . 65.288 54.902 -5.723 1 12.63 ? CB LYS A-3 120 1 
ATOM 4651 C CG . LYS A-3 1 120 . 66.378 53.795 -5.76 1 15.58 ? CG LYS A-3 120 1 
ATOM 4652 C CD . LYS A-3 1 120 . 67.673 54.342 -5.668 1 21.8 ? CD LYS A-3 120 1 
ATOM 4653 C CE . LYS A-3 1 120 . 68.773 53.235 -5.8 0.8 37.82 ? CE LYS A-3 120 1 
ATOM 4654 N NZ . LYS A-3 1 120 . 70.164 53.786 -5.969 1 50.17 ? NZ LYS A-3 120 1 
ATOM 4655 N N . ASP A-3 1 121 . 62.173 55.801 -6.669 1 8.97 ? N ASP A-3 121 1 
ATOM 4656 C CA . ASP A-3 1 121 . 61.143 56.828 -6.495 1 8.83 ? CA ASP A-3 121 1 
ATOM 4657 C C . ASP A-3 1 121 . 60.144 56.722 -7.618 1 8.95 ? C ASP A-3 121 1 
ATOM 4658 O O . ASP A-3 1 121 . 60.347 55.958 -8.606 1 8.9 ? O ASP A-3 121 1 
ATOM 4659 C CB . ASP A-3 1 121 . 61.759 58.236 -6.354 0.84 8.97 ? CB ASP A-3 121 1 
ATOM 4660 C CG . ASP A-3 1 121 . 60.953 59.215 -5.477 0.89 10.23 ? CG ASP A-3 121 1 
ATOM 4661 O OD1 . ASP A-3 1 121 . 59.808 58.996 -5.196 0.96 9.73 ? OD1 ASP A-3 121 1 
ATOM 4662 O OD2 . ASP A-3 1 121 . 61.56 60.187 -5.01 0.74 12.37 ? OD2 ASP A-3 121 1 
ATOM 4663 N N . ILE A-3 1 122 . 59.075 57.483 -7.493 1 8.9 ? N ILE A-3 122 1 
ATOM 4664 C CA . ILE A-3 1 122 . 57.938 57.327 -8.356 1 9.96 ? CA ILE A-3 122 1 
ATOM 4665 C C . ILE A-3 1 122 . 58.268 57.658 -9.807 1 9.77 ? C ILE A-3 122 1 
ATOM 4666 O O . ILE A-3 1 122 . 57.701 57.091 -10.717 1 11.34 ? O ILE A-3 122 1 
ATOM 4667 C CB . ILE A-3 1 122 . 56.762 58.166 -7.759 1 11.1 ? CB ILE A-3 122 1 
ATOM 4668 C CG1 . ILE A-3 1 122 . 55.423 57.828 -8.39 1 14.03 ? CG1 ILE A-3 122 1 
ATOM 4669 C CG2 . ILE A-3 1 122 . 56.974 59.632 -7.784 1 12.56 ? CG2 ILE A-3 122 1 
ATOM 4670 C CD1 . ILE A-3 1 122 . 54.985 56.451 -8.165 1 15.59 ? CD1 ILE A-3 122 1 
ATOM 4671 N N . SER A-3 1 123 . 59.268 58.529 -10.03 1 10.45 ? N SER A-3 123 1 
ATOM 4672 C CA . SER A-3 1 123 . 59.768 58.87 -11.368 1 11.92 ? CA SER A-3 123 1 
ATOM 4673 C C . SER A-3 1 123 . 60.498 57.747 -12.046 1 11.31 ? C SER A-3 123 1 
ATOM 4674 O O . SER A-3 1 123 . 60.713 57.874 -13.28 1 13.56 ? O SER A-3 123 1 
ATOM 4675 C CB . SER A-3 1 123 . 60.686 60.111 -11.286 1 15.55 ? CB SER A-3 123 1 
ATOM 4676 O OG . SER A-3 1 123 . 61.703 59.885 -10.341 1 21.22 ? OG SER A-3 123 1 
ATOM 4677 N N . ASP A-3 1 124 . 60.859 56.688 -11.398 1 8.95 ? N ASP A-3 124 1 
ATOM 4678 C CA . ASP A-3 1 124 . 61.527 55.581 -12.009 1 9.27 ? CA ASP A-3 124 1 
ATOM 4679 C C . ASP A-3 1 124 . 60.556 54.586 -12.678 1 9.42 ? C ASP A-3 124 1 
ATOM 4680 O O . ASP A-3 1 124 . 61.001 53.669 -13.366 1 11.43 ? O ASP A-3 124 1 
ATOM 4681 C CB . ASP A-3 1 124 . 62.361 54.872 -10.968 1 9.94 ? CB ASP A-3 124 1 
ATOM 4682 C CG . ASP A-3 1 124 . 63.494 55.712 -10.434 1 10.3 ? CG ASP A-3 124 1 
ATOM 4683 O OD1 . ASP A-3 1 124 . 64.141 56.403 -11.272 1 12.9 ? OD1 ASP A-3 124 1 
ATOM 4684 O OD2 . ASP A-3 1 124 . 63.714 55.727 -9.231 1 9.65 ? OD2 ASP A-3 124 1 
ATOM 4685 N N . VAL A-3 1 125 . 59.275 54.741 -12.415 1 8.97 ? N VAL A-3 125 1 
ATOM 4686 C CA . VAL A-3 1 125 . 58.291 53.804 -12.934 1 8.19 ? CA VAL A-3 125 1 
ATOM 4687 C C . VAL A-3 1 125 . 57.786 54.284 -14.305 1 8.89 ? C VAL A-3 125 1 
ATOM 4688 O O . VAL A-3 1 125 . 57.501 55.471 -14.491 1 9.9 ? O VAL A-3 125 1 
ATOM 4689 C CB . VAL A-3 1 125 . 57.071 53.762 -11.973 1 8.33 ? CB VAL A-3 125 1 
ATOM 4690 C CG1 . VAL A-3 1 125 . 56.088 52.698 -12.481 1 8.14 ? CG1 VAL A-3 125 1 
ATOM 4691 C CG2 . VAL A-3 1 125 . 57.542 53.465 -10.545 1 9.03 ? CG2 VAL A-3 125 1 
ATOM 4692 N N . PRO A-3 1 126 . 57.625 53.38 -15.281 1 9.05 ? N PRO A-3 126 1 
ATOM 4693 C CA . PRO A-3 1 126 . 57.016 53.813 -16.556 1 9.13 ? CA PRO A-3 126 1 
ATOM 4694 C C . PRO A-3 1 126 . 55.675 54.494 -16.328 1 8.47 ? C PRO A-3 126 1 
ATOM 4695 O O . PRO A-3 1 126 . 54.822 54.002 -15.61 1 8.06 ? O PRO A-3 126 1 
ATOM 4696 C CB . PRO A-3 1 126 . 56.875 52.549 -17.332 1 10.28 ? CB PRO A-3 126 1 
ATOM 4697 C CG . PRO A-3 1 126 . 57.997 51.712 -16.838 1 12.04 ? CG PRO A-3 126 1 
ATOM 4698 C CD . PRO A-3 1 126 . 58.02 51.957 -15.325 1 10.15 ? CD PRO A-3 126 1 
ATOM 4699 N N . LYS A-3 1 127 . 55.476 55.657 -16.977 1 9.37 ? N LYS A-3 127 1 
ATOM 4700 C CA . LYS A-3 1 127 . 54.245 56.404 -16.762 1 10.12 ? CA LYS A-3 127 1 
ATOM 4701 C C . LYS A-3 1 127 . 53.011 55.572 -17.093 1 8.05 ? C LYS A-3 127 1 
ATOM 4702 O O . LYS A-3 1 127 . 51.988 55.645 -16.383 1 8.74 ? O LYS A-3 127 1 
ATOM 4703 C CB . LYS A-3 1 127 . 54.265 57.69 -17.648 1 19.4 ? CB LYS A-3 127 1 
ATOM 4704 C CG . LYS A-3 1 127 . 53.097 58.596 -17.366 1 55.16 ? CG LYS A-3 127 1 
ATOM 4705 C CD . LYS A-3 1 127 . 52.922 58.846 -15.856 1 90.61 ? CD LYS A-3 127 1 
ATOM 4706 C CE . LYS A-3 1 127 . 51.823 59.851 -15.543 1 122.15 ? CE LYS A-3 127 1 
ATOM 4707 N NZ . LYS A-3 1 127 . 51.788 60.156 -14.091 1 151.23 ? NZ LYS A-3 127 1 
ATOM 4708 N N . ALA A-3 1 128 . 53.075 54.773 -18.18 1 6.97 ? N ALA A-3 128 1 
ATOM 4709 C CA . ALA A-3 1 128 . 51.928 54.006 -18.552 1 6.77 ? CA ALA A-3 128 1 
ATOM 4710 C C . ALA A-3 1 128 . 51.58 52.959 -17.484 1 6.08 ? C ALA A-3 128 1 
ATOM 4711 O O . ALA A-3 1 128 . 50.396 52.571 -17.379 1 6.5 ? O ALA A-3 128 1 
ATOM 4712 C CB . ALA A-3 1 128 . 52.135 53.326 -19.876 1 7.98 ? CB ALA A-3 128 1 
ATOM 4713 N N . PHE A-3 1 129 . 52.539 52.499 -16.732 1 5.95 ? N PHE A-3 129 1 
ATOM 4714 C CA . PHE A-3 1 129 . 52.298 51.532 -15.692 1 5.88 ? CA PHE A-3 129 1 
ATOM 4715 C C . PHE A-3 1 129 . 51.569 52.187 -14.507 1 5.89 ? C PHE A-3 129 1 
ATOM 4716 O O . PHE A-3 1 129 . 50.614 51.618 -13.973 1 5.78 ? O PHE A-3 129 1 
ATOM 4717 C CB . PHE A-3 1 129 . 53.601 50.854 -15.255 1 6.44 ? CB PHE A-3 129 1 
ATOM 4718 C CG . PHE A-3 1 129 . 53.418 49.679 -14.341 1 6.34 ? CG PHE A-3 129 1 
ATOM 4719 C CD1 . PHE A-3 1 129 . 52.699 48.565 -14.726 1 7.99 ? CD1 PHE A-3 129 1 
ATOM 4720 C CD2 . PHE A-3 1 129 . 53.95 49.68 -13.079 1 7.95 ? CD2 PHE A-3 129 1 
ATOM 4721 C CE1 . PHE A-3 1 129 . 52.538 47.498 -13.859 1 8.99 ? CE1 PHE A-3 129 1 
ATOM 4722 C CE2 . PHE A-3 1 129 . 53.812 48.584 -12.226 1 10.32 ? CE2 PHE A-3 129 1 
ATOM 4723 C CZ . PHE A-3 1 129 . 53.1 47.486 -12.652 1 9.68 ? CZ PHE A-3 129 1 
ATOM 4724 N N . LEU A-3 1 130 . 52.021 53.369 -14.095 1 5.84 ? N LEU A-3 130 1 
ATOM 4725 C CA . LEU A-3 1 130 . 51.258 54.094 -13.081 1 5.78 ? CA LEU A-3 130 1 
ATOM 4726 C C . LEU A-3 1 130 . 49.852 54.333 -13.531 1 5.7 ? C LEU A-3 130 1 
ATOM 4727 O O . LEU A-3 1 130 . 48.893 54.181 -12.772 1 6.45 ? O LEU A-3 130 1 
ATOM 4728 C CB . LEU A-3 1 130 . 51.963 55.409 -12.757 1 6.96 ? CB LEU A-3 130 1 
ATOM 4729 C CG . LEU A-3 1 130 . 53.336 55.3 -12.116 1 7.2 ? CG LEU A-3 130 1 
ATOM 4730 C CD1 . LEU A-3 1 130 . 53.884 56.674 -11.823 1 9.8 ? CD1 LEU A-3 130 1 
ATOM 4731 C CD2 . LEU A-3 1 130 . 53.32 54.469 -10.841 1 8.35 ? CD2 LEU A-3 130 1 
ATOM 4732 N N . ASP A-3 1 131 . 49.659 54.703 -14.799 1 6.12 ? N ASP A-3 131 1 
ATOM 4733 C CA . ASP A-3 1 131 . 48.321 54.939 -15.318 1 6.35 ? CA ASP A-3 131 1 
ATOM 4734 C C . ASP A-3 1 131 . 47.477 53.665 -15.289 1 5.75 ? C ASP A-3 131 1 
ATOM 4735 O O . ASP A-3 1 131 . 46.291 53.732 -14.983 1 6.12 ? O ASP A-3 131 1 
ATOM 4736 C CB . ASP A-3 1 131 . 48.384 55.479 -16.74 1 8.56 ? CB ASP A-3 131 1 
ATOM 4737 C CG . ASP A-3 1 131 . 48.888 56.845 -16.854 1 14.46 ? CG ASP A-3 131 1 
ATOM 4738 O OD1 . ASP A-3 1 131 . 49.095 57.563 -15.877 1 15.16 ? OD1 ASP A-3 131 1 
ATOM 4739 O OD2 . ASP A-3 1 131 . 49.216 57.188 -18.032 1 20.29 ? OD2 ASP A-3 131 1 
ATOM 4740 N N . GLU A-3 1 132 . 48.075 52.521 -15.618 1 5.63 ? N GLU A-3 132 1 
ATOM 4741 C CA . GLU A-3 1 132 . 47.329 51.277 -15.652 1 5.6 ? CA GLU A-3 132 1 
ATOM 4742 C C . GLU A-3 1 132 . 46.85 50.913 -14.238 1 5.33 ? C GLU A-3 132 1 
ATOM 4743 O O . GLU A-3 1 132 . 45.722 50.398 -14.055 1 5.66 ? O GLU A-3 132 1 
ATOM 4744 C CB . GLU A-3 1 132 . 48.123 50.132 -16.301 1 6.15 ? CB GLU A-3 132 1 
ATOM 4745 C CG . GLU A-3 1 132 . 48.838 49.173 -15.375 1 6.84 ? CG GLU A-3 132 1 
ATOM 4746 C CD . GLU A-3 1 132 . 49.431 48.011 -16.157 1 6.48 ? CD GLU A-3 132 1 
ATOM 4747 O OE1 . GLU A-3 1 132 . 50.078 48.269 -17.209 1 6.69 ? OE1 GLU A-3 132 1 
ATOM 4748 O OE2 . GLU A-3 1 132 . 49.276 46.843 -15.706 1 6.97 ? OE2 GLU A-3 132 1 
ATOM 4749 N N . ILE A-3 1 133 . 47.694 51.136 -13.244 1 5.42 ? N ILE A-3 133 1 
ATOM 4750 C CA . ILE A-3 1 133 . 47.334 50.819 -11.872 1 5.34 ? CA ILE A-3 133 1 
ATOM 4751 C C . ILE A-3 1 133 . 46.198 51.75 -11.424 1 5.33 ? C ILE A-3 133 1 
ATOM 4752 O O . ILE A-3 1 133 . 45.187 51.291 -10.88 1 5.65 ? O ILE A-3 133 1 
ATOM 4753 C CB . ILE A-3 1 133 . 48.547 50.909 -10.915 1 5.79 ? CB ILE A-3 133 1 
ATOM 4754 C CG1 . ILE A-3 1 133 . 49.619 49.891 -11.291 1 6.07 ? CG1 ILE A-3 133 1 
ATOM 4755 C CG2 . ILE A-3 1 133 . 48.091 50.745 -9.489 1 7.06 ? CG2 ILE A-3 133 1 
ATOM 4756 C CD1 . ILE A-3 1 133 . 50.952 50.144 -10.577 1 7.92 ? CD1 ILE A-3 133 1 
ATOM 4757 N N . ALA A-3 1 134 . 46.363 53.035 -11.639 1 5.41 ? N ALA A-3 134 1 
ATOM 4758 C CA . ALA A-3 1 134 . 45.321 53.986 -11.238 1 5.92 ? CA ALA A-3 134 1 
ATOM 4759 C C . ALA A-3 1 134 . 44.002 53.656 -11.925 1 5.6 ? C ALA A-3 134 1 
ATOM 4760 O O . ALA A-3 1 134 . 42.949 53.753 -11.307 1 6.1 ? O ALA A-3 134 1 
ATOM 4761 C CB . ALA A-3 1 134 . 45.789 55.403 -11.553 1 7.1 ? CB ALA A-3 134 1 
ATOM 4762 N N . HIS A-3 1 135 . 44.049 53.335 -13.23 1 5.58 ? N HIS A-3 135 1 
ATOM 4763 C CA . HIS A-3 1 135 . 42.828 53.064 -13.964 1 5.72 ? CA HIS A-3 135 1 
ATOM 4764 C C . HIS A-3 1 135 . 42.088 51.835 -13.413 1 5.59 ? C HIS A-3 135 1 
ATOM 4765 O O . HIS A-3 1 135 . 40.866 51.812 -13.293 1 5.62 ? O HIS A-3 135 1 
ATOM 4766 C CB . HIS A-3 1 135 . 43.116 52.915 -15.438 1 6.16 ? CB HIS A-3 135 1 
ATOM 4767 C CG . HIS A-3 1 135 . 41.905 52.86 -16.287 1 5.81 ? CG HIS A-3 135 1 
ATOM 4768 N ND1 . HIS A-3 1 135 . 41.727 51.899 -17.238 1 6.31 ? ND1 HIS A-3 135 1 
ATOM 4769 C CD2 . HIS A-3 1 135 . 40.848 53.698 -16.321 1 7.03 ? CD2 HIS A-3 135 1 
ATOM 4770 C CE1 . HIS A-3 1 135 . 40.565 52.151 -17.809 1 6.99 ? CE1 HIS A-3 135 1 
ATOM 4771 N NE2 . HIS A-3 1 135 . 40.016 53.233 -17.274 1 7.1 ? NE2 HIS A-3 135 1 
ATOM 4772 N N . PHE A-3 1 136 . 42.866 50.791 -13.091 1 5.36 ? N PHE A-3 136 1 
ATOM 4773 C CA . PHE A-3 1 136 . 42.273 49.631 -12.433 1 5.33 ? CA PHE A-3 136 1 
ATOM 4774 C C . PHE A-3 1 136 . 41.483 50.033 -11.19 1 5.22 ? C PHE A-3 136 1 
ATOM 4775 O O . PHE A-3 1 136 . 40.323 49.647 -11.027 1 5.59 ? O PHE A-3 136 1 
ATOM 4776 C CB . PHE A-3 1 136 . 43.411 48.645 -12.092 1 5.6 ? CB PHE A-3 136 1 
ATOM 4777 C CG . PHE A-3 1 136 . 42.981 47.453 -11.264 1 5.68 ? CG PHE A-3 136 1 
ATOM 4778 C CD1 . PHE A-3 1 136 . 42.402 46.321 -11.849 1 6.1 ? CD1 PHE A-3 136 1 
ATOM 4779 C CD2 . PHE A-3 1 136 . 43.171 47.459 -9.903 1 6.18 ? CD2 PHE A-3 136 1 
ATOM 4780 C CE1 . PHE A-3 1 136 . 42.044 45.25 -11.027 1 6.38 ? CE1 PHE A-3 136 1 
ATOM 4781 C CE2 . PHE A-3 1 136 . 42.787 46.385 -9.105 1 7.41 ? CE2 PHE A-3 136 1 
ATOM 4782 C CZ . PHE A-3 1 136 . 42.229 45.277 -9.704 1 6.09 ? CZ PHE A-3 136 1 
ATOM 4783 N N . PHE A-3 1 137 . 42.117 50.812 -10.308 1 5.22 ? N PHE A-3 137 1 
ATOM 4784 C CA . PHE A-3 1 137 . 41.427 51.205 -9.077 1 5.53 ? CA PHE A-3 137 1 
ATOM 4785 C C . PHE A-3 1 137 . 40.303 52.193 -9.346 1 5.81 ? C PHE A-3 137 1 
ATOM 4786 O O . PHE A-3 1 137 . 39.353 52.243 -8.554 1 6.75 ? O PHE A-3 137 1 
ATOM 4787 C CB . PHE A-3 1 137 . 42.435 51.679 -8.037 1 6.28 ? CB PHE A-3 137 1 
ATOM 4788 C CG . PHE A-3 1 137 . 43.286 50.549 -7.467 1 5.99 ? CG PHE A-3 137 1 
ATOM 4789 C CD1 . PHE A-3 1 137 . 42.711 49.658 -6.591 1 6.04 ? CD1 PHE A-3 137 1 
ATOM 4790 C CD2 . PHE A-3 1 137 . 44.57 50.307 -7.893 1 6.63 ? CD2 PHE A-3 137 1 
ATOM 4791 C CE1 . PHE A-3 1 137 . 43.436 48.591 -6.078 1 6.64 ? CE1 PHE A-3 137 1 
ATOM 4792 C CE2 . PHE A-3 1 137 . 45.305 49.224 -7.413 1 6.81 ? CE2 PHE A-3 137 1 
ATOM 4793 C CZ . PHE A-3 1 137 . 44.729 48.364 -6.489 1 7.09 ? CZ PHE A-3 137 1 
ATOM 4794 N N . GLN A-3 1 138 . 40.36 52.946 -10.417 1 5.69 ? N GLN A-3 138 1 
ATOM 4795 C CA A GLN A-3 1 138 . 39.303 53.842 -10.805 0.58 5.18 ? CA GLN A-3 138 1 
ATOM 4796 C CA B GLN A-3 1 138 . 39.278 53.848 -10.763 0.42 8.58 ? CA GLN A-3 138 1 
ATOM 4797 C C . GLN A-3 1 138 . 38.035 53.088 -11.227 1 5.78 ? C GLN A-3 138 1 
ATOM 4798 O O . GLN A-3 1 138 . 36.939 53.605 -11.006 1 6.9 ? O GLN A-3 138 1 
ATOM 4799 C CB A GLN A-3 1 138 . 39.778 54.746 -11.969 0.58 5 ? CB GLN A-3 138 1 
ATOM 4800 C CB B GLN A-3 1 138 . 39.665 54.783 -11.895 0.42 12.08 ? CB GLN A-3 138 1 
ATOM 4801 C CG A GLN A-3 1 138 . 38.848 55.845 -12.334 0.58 7.28 ? CG GLN A-3 138 1 
ATOM 4802 C CG B GLN A-3 1 138 . 40.577 55.846 -11.49 0.42 12.47 ? CG GLN A-3 138 1 
ATOM 4803 C CD A GLN A-3 1 138 . 39.273 56.73 -13.43 0.58 11.27 ? CD GLN A-3 138 1 
ATOM 4804 C CD B GLN A-3 1 138 . 40.963 56.754 -12.629 0.42 15.04 ? CD GLN A-3 138 1 
ATOM 4805 O OE1 A GLN A-3 1 138 . 38.815 57.873 -13.474 0.58 18.8 ? OE1 GLN A-3 138 1 
ATOM 4806 O OE1 B GLN A-3 1 138 . 40.998 57.991 -12.457 0.42 18.94 ? OE1 GLN A-3 138 1 
ATOM 4807 N NE2 A GLN A-3 1 138 . 40.037 56.291 -14.275 0.58 12.35 ? NE2 GLN A-3 138 1 
ATOM 4808 N NE2 B GLN A-3 1 138 . 41.206 56.209 -13.787 0.42 14.43 ? NE2 GLN A-3 138 1 
ATOM 4809 N N . ARG A-3 1 139 . 38.179 51.953 -11.905 1 5.69 ? N ARG A-3 139 1 
ATOM 4810 C CA A ARG A-3 1 139 . 37.068 51.292 -12.628 0.57 5.65 ? CA ARG A-3 139 1 
ATOM 4811 C CA B ARG A-3 1 139 . 37.027 51.302 -12.508 0.43 7.1 ? CA ARG A-3 139 1 
ATOM 4812 C C . ARG A-3 1 139 . 36.663 49.946 -12.01 1 5.81 ? C ARG A-3 139 1 
ATOM 4813 O O . ARG A-3 1 139 . 35.551 49.456 -12.325 1 6.48 ? O ARG A-3 139 1 
ATOM 4814 C CB A ARG A-3 1 139 . 37.293 51.233 -14.152 0.57 5.73 ? CB ARG A-3 139 1 
ATOM 4815 C CB B ARG A-3 1 139 . 37.293 51.12 -14.001 0.43 7.85 ? CB ARG A-3 139 1 
ATOM 4816 C CG A ARG A-3 1 139 . 37.515 52.579 -14.802 0.57 6.63 ? CG ARG A-3 139 1 
ATOM 4817 C CG B ARG A-3 1 139 . 37.342 52.435 -14.814 0.43 9.66 ? CG ARG A-3 139 1 
ATOM 4818 C CD A ARG A-3 1 139 . 36.313 53.502 -14.613 0.57 8.67 ? CD ARG A-3 139 1 
ATOM 4819 C CD B ARG A-3 1 139 . 36.133 53.32 -14.586 0.43 8.53 ? CD ARG A-3 139 1 
ATOM 4820 N NE A ARG A-3 1 139 . 36.534 54.745 -15.329 0.57 9.6 ? NE ARG A-3 139 1 
ATOM 4821 N NE B ARG A-3 1 139 . 36.038 54.391 -15.565 0.43 7.91 ? NE ARG A-3 139 1 
ATOM 4822 C CZ A ARG A-3 1 139 . 36.022 55.892 -14.986 0.57 12.06 ? CZ ARG A-3 139 1 
ATOM 4823 C CZ B ARG A-3 1 139 . 35.098 55.305 -15.522 0.43 8.48 ? CZ ARG A-3 139 1 
ATOM 4824 N NH1 A ARG A-3 1 139 . 35.281 56.006 -13.894 0.57 14.03 ? NH1 ARG A-3 139 1 
ATOM 4825 N NH1 B ARG A-3 1 139 . 34.158 55.296 -14.561 0.43 11.47 ? NH1 ARG A-3 139 1 
ATOM 4826 N NH2 A ARG A-3 1 139 . 36.295 56.94 -15.76 0.57 14.24 ? NH2 ARG A-3 139 1 
ATOM 4827 N NH2 B ARG A-3 1 139 . 35.002 56.221 -16.49 0.43 10.75 ? NH2 ARG A-3 139 1 
ATOM 4828 N N . TYR A-3 1 140 . 37.511 49.285 -11.239 1 5.75 ? N TYR A-3 140 1 
ATOM 4829 C CA . TYR A-3 1 140 . 37.249 47.899 -10.9 1 6.16 ? CA TYR A-3 140 1 
ATOM 4830 C C . TYR A-3 1 140 . 36.013 47.648 -10.026 1 6.02 ? C TYR A-3 140 1 
ATOM 4831 O O . TYR A-3 1 140 . 35.543 46.507 -10.034 1 7.17 ? O TYR A-3 140 1 
ATOM 4832 C CB . TYR A-3 1 140 . 38.479 47.222 -10.248 1 6.11 ? CB TYR A-3 140 1 
ATOM 4833 C CG . TYR A-3 1 140 . 38.763 47.569 -8.81 1 5.87 ? CG TYR A-3 140 1 
ATOM 4834 C CD1 . TYR A-3 1 140 . 38.678 48.894 -8.334 1 5.89 ? CD1 TYR A-3 140 1 
ATOM 4835 C CD2 . TYR A-3 1 140 . 39.209 46.588 -7.934 1 7.11 ? CD2 TYR A-3 140 1 
ATOM 4836 C CE1 . TYR A-3 1 140 . 39.023 49.156 -7.001 1 6.5 ? CE1 TYR A-3 140 1 
ATOM 4837 C CE2 . TYR A-3 1 140 . 39.556 46.847 -6.641 1 7.2 ? CE2 TYR A-3 140 1 
ATOM 4838 C CZ . TYR A-3 1 140 . 39.48 48.16 -6.174 1 6.47 ? CZ TYR A-3 140 1 
ATOM 4839 O OH . TYR A-3 1 140 . 39.86 48.476 -4.897 1 7.76 ? OH TYR A-3 140 1 
ATOM 4840 N N A LYS A-3 1 141 . 35.48 48.704 -9.444 0.65 6.54 ? N LYS A-3 141 1 
ATOM 4841 N N B LYS A-3 1 141 . 35.54 48.595 -9.156 0.35 4.65 ? N LYS A-3 141 1 
ATOM 4842 C CA A LYS A-3 1 141 . 34.265 48.544 -8.617 0.65 6.74 ? CA LYS A-3 141 1 
ATOM 4843 C CA B LYS A-3 1 141 . 34.37 48.417 -8.275 0.35 4.38 ? CA LYS A-3 141 1 
ATOM 4844 C C A LYS A-3 1 141 . 33.065 49.152 -9.305 0.65 5.45 ? C LYS A-3 141 1 
ATOM 4845 C C B LYS A-3 1 141 . 33.086 49.032 -8.894 0.35 4.67 ? C LYS A-3 141 1 
ATOM 4846 O O A LYS A-3 1 141 . 31.989 49.227 -8.722 0.65 6.34 ? O LYS A-3 141 1 
ATOM 4847 O O B LYS A-3 1 141 . 32.03 49.067 -8.235 0.35 4.3 ? O LYS A-3 141 1 
ATOM 4848 C CB A LYS A-3 1 141 . 34.441 49.165 -7.208 0.65 7.81 ? CB LYS A-3 141 1 
ATOM 4849 C CB B LYS A-3 1 141 . 34.626 49.018 -6.893 0.35 5.84 ? CB LYS A-3 141 1 
ATOM 4850 C CG A LYS A-3 1 141 . 35.419 48.42 -6.324 0.65 8.83 ? CG LYS A-3 141 1 
ATOM 4851 C CG B LYS A-3 1 141 . 35.614 48.188 -6.182 0.35 6.48 ? CG LYS A-3 141 1 
ATOM 4852 C CD A LYS A-3 1 141 . 35.438 48.977 -4.846 0.65 11.13 ? CD LYS A-3 141 1 
ATOM 4853 C CD B LYS A-3 1 141 . 35.996 48.773 -4.837 0.35 5.7 ? CD LYS A-3 141 1 
ATOM 4854 C CE A LYS A-3 1 141 . 36.525 48.268 -4.021 0.65 12.78 ? CE LYS A-3 141 1 
ATOM 4855 C CE B LYS A-3 1 141 . 34.786 49.144 -3.992 0.35 8 ? CE LYS A-3 141 1 
ATOM 4856 N NZ A LYS A-3 1 141 . 36.266 48.458 -2.52 0.65 12.01 ? NZ LYS A-3 141 1 
ATOM 4857 N NZ B LYS A-3 1 141 . 35.283 49.636 -2.662 0.35 6.96 ? NZ LYS A-3 141 1 
ATOM 4858 N N A GLU A-3 1 142 . 33.181 49.552 -10.549 0.65 6.12 ? N GLU A-3 142 1 
ATOM 4859 N N B GLU A-3 1 142 . 33.159 49.461 -10.151 0.35 4.14 ? N GLU A-3 142 1 
ATOM 4860 C CA A GLU A-3 1 142 . 32.047 50.258 -11.168 0.65 6.63 ? CA GLU A-3 142 1 
ATOM 4861 C CA B GLU A-3 1 142 . 32.017 50.08 -10.799 0.35 5.65 ? CA GLU A-3 142 1 
ATOM 4862 C C A GLU A-3 1 142 . 30.792 49.352 -11.171 0.65 5.71 ? C GLU A-3 142 1 
ATOM 4863 C C B GLU A-3 1 142 . 30.758 49.239 -10.792 0.35 7.42 ? C GLU A-3 142 1 
ATOM 4864 O O A GLU A-3 1 142 . 29.695 49.805 -10.86 0.65 6.22 ? O GLU A-3 142 1 
ATOM 4865 O O B GLU A-3 1 142 . 29.629 49.741 -10.44 0.35 14.7 ? O GLU A-3 142 1 
ATOM 4866 C CB A GLU A-3 1 142 . 32.418 50.746 -12.518 0.65 6.24 ? CB GLU A-3 142 1 
ATOM 4867 C CB B GLU A-3 1 142 . 32.378 50.441 -12.25 0.35 8.82 ? CB GLU A-3 142 1 
ATOM 4868 C CG A GLU A-3 1 142 . 31.456 51.548 -13.091 0.65 8.74 ? CG GLU A-3 142 1 
ATOM 4869 C CG B GLU A-3 1 142 . 33.08 51.836 -12.357 0.35 14.22 ? CG GLU A-3 142 1 
ATOM 4870 C CD A GLU A-3 1 142 . 31.891 52.236 -14.407 0.65 9.36 ? CD GLU A-3 142 1 
ATOM 4871 C CD B GLU A-3 1 142 . 33.152 52.537 -13.749 0.35 13.68 ? CD GLU A-3 142 1 
ATOM 4872 O OE1 A GLU A-3 1 142 . 33.045 51.914 -14.965 0.65 7.7 ? OE1 GLU A-3 142 1 
ATOM 4873 O OE1 B GLU A-3 1 142 . 32.901 51.954 -14.811 0.35 16.25 ? OE1 GLU A-3 142 1 
ATOM 4874 O OE2 A GLU A-3 1 142 . 31.114 53.111 -14.822 0.65 15.28 ? OE2 GLU A-3 142 1 
ATOM 4875 O OE2 B GLU A-3 1 142 . 33.289 53.782 -13.677 0.35 15.47 ? OE2 GLU A-3 142 1 
ATOM 4876 N N . LEU A-3 1 143 . 30.892 48.031 -11.379 1 7.31 ? N LEU A-3 143 1 
ATOM 4877 C CA . LEU A-3 1 143 . 29.72 47.175 -11.442 1 7.31 ? CA LEU A-3 143 1 
ATOM 4878 C C . LEU A-3 1 143 . 29.183 46.81 -10.059 1 8.47 ? C LEU A-3 143 1 
ATOM 4879 O O . LEU A-3 1 143 . 28.047 46.332 -9.951 1 10.57 ? O LEU A-3 143 1 
ATOM 4880 C CB . LEU A-3 1 143 . 29.994 45.891 -12.225 1 7.31 ? CB LEU A-3 143 1 
ATOM 4881 C CG . LEU A-3 1 143 . 30.254 46.084 -13.736 1 8.14 ? CG LEU A-3 143 1 
ATOM 4882 C CD1 . LEU A-3 1 143 . 30.445 44.694 -14.346 1 7.91 ? CD1 LEU A-3 143 1 
ATOM 4883 C CD2 . LEU A-3 1 143 . 29.12 46.827 -14.399 1 11.51 ? CD2 LEU A-3 143 1 
ATOM 4884 N N . GLN A-3 1 144 . 29.968 47.023 -9.019 1 8.41 ? N GLN A-3 144 1 
ATOM 4885 C CA . GLN A-3 1 144 . 29.449 46.917 -7.665 1 10.9 ? CA GLN A-3 144 1 
ATOM 4886 C C . GLN A-3 1 144 . 28.697 48.132 -7.199 1 11.54 ? C GLN A-3 144 1 
ATOM 4887 O O . GLN A-3 1 144 . 28.085 48.138 -6.141 1 14.83 ? O GLN A-3 144 1 
ATOM 4888 C CB . GLN A-3 1 144 . 30.565 46.682 -6.681 1 10.83 ? CB GLN A-3 144 1 
ATOM 4889 C CG . GLN A-3 1 144 . 31.32 45.404 -6.898 1 11.64 ? CG GLN A-3 144 1 
ATOM 4890 C CD . GLN A-3 1 144 . 32.503 45.207 -5.914 1 12.36 ? CD GLN A-3 144 1 
ATOM 4891 O OE1 . GLN A-3 1 144 . 33.702 45.103 -6.267 1 13.75 ? OE1 GLN A-3 144 1 
ATOM 4892 N NE2 . GLN A-3 1 144 . 32.149 45.106 -4.661 1 15.89 ? NE2 GLN A-3 144 1 
ATOM 4893 N N . GLY A-3 1 145 . 28.737 49.194 -7.959 1 11.6 ? N GLY A-3 145 1 
ATOM 4894 C CA . GLY A-3 1 145 . 28.051 50.417 -7.547 1 13.97 ? CA GLY A-3 145 1 
ATOM 4895 C C . GLY A-3 1 145 . 28.768 51.102 -6.393 1 14.34 ? C GLY A-3 145 1 
ATOM 4896 O O . GLY A-3 1 145 . 28.109 51.816 -5.668 1 20.37 ? O GLY A-3 145 1 
ATOM 4897 N N . LYS A-3 1 146 . 30.066 50.944 -6.265 1 10.17 ? N LYS A-3 146 1 
ATOM 4898 C CA . LYS A-3 1 146 . 30.826 51.562 -5.206 1 10 ? CA LYS A-3 146 1 
ATOM 4899 C C . LYS A-3 1 146 . 31.751 52.602 -5.786 1 11.72 ? C LYS A-3 146 1 
ATOM 4900 O O . LYS A-3 1 146 . 32.363 52.364 -6.792 1 22.27 ? O LYS A-3 146 1 
ATOM 4901 C CB . LYS A-3 1 146 . 31.578 50.568 -4.403 1 12.21 ? CB LYS A-3 146 1 
ATOM 4902 C CG . LYS A-3 1 146 . 30.609 49.589 -3.684 1 22.54 ? CG LYS A-3 146 1 
ATOM 4903 C CD . LYS A-3 1 146 . 31.318 48.578 -2.824 1 52.94 ? CD LYS A-3 146 1 
ATOM 4904 C CE . LYS A-3 1 146 . 30.351 47.849 -1.958 1 80.4 ? CE LYS A-3 146 1 
ATOM 4905 N NZ . LYS A-3 1 146 . 31.041 46.911 -1.041 1 103.43 ? NZ LYS A-3 146 1 
ATOM 4906 N N . THR A-3 1 147 . 31.889 53.722 -5.159 1 7.27 ? N THR A-3 147 1 
ATOM 4907 C CA . THR A-3 1 147 . 32.687 54.836 -5.672 1 6.89 ? CA THR A-3 147 1 
ATOM 4908 C C . THR A-3 1 147 . 34.118 54.756 -5.212 1 6.26 ? C THR A-3 147 1 
ATOM 4909 O O . THR A-3 1 147 . 34.399 54.571 -4.054 1 8.18 ? O THR A-3 147 1 
ATOM 4910 C CB . THR A-3 1 147 . 32.059 56.149 -5.174 1 7.69 ? CB THR A-3 147 1 
ATOM 4911 O OG1 . THR A-3 1 147 . 30.76 56.222 -5.803 1 9.78 ? OG1 THR A-3 147 1 
ATOM 4912 C CG2 . THR A-3 1 147 . 32.894 57.35 -5.476 1 9.33 ? CG2 THR A-3 147 1 
ATOM 4913 N N . THR A-3 1 148 . 35.015 54.974 -6.174 1 6.5 ? N THR A-3 148 1 
ATOM 4914 C CA . THR A-3 1 148 . 36.424 55.166 -5.859 1 6.74 ? CA THR A-3 148 1 
ATOM 4915 C C . THR A-3 1 148 . 36.883 56.47 -6.508 1 6.73 ? C THR A-3 148 1 
ATOM 4916 O O . THR A-3 1 148 . 36.323 56.917 -7.529 1 8.17 ? O THR A-3 148 1 
ATOM 4917 C CB . THR A-3 1 148 . 37.307 54.012 -6.352 1 7.06 ? CB THR A-3 148 1 
ATOM 4918 O OG1 . THR A-3 1 148 . 37.347 54.074 -7.788 1 8.84 ? OG1 THR A-3 148 1 
ATOM 4919 C CG2 . THR A-3 1 148 . 36.802 52.666 -5.875 1 7.62 ? CG2 THR A-3 148 1 
ATOM 4920 N N . LYS A-3 1 149 . 37.9 57.067 -5.929 1 7.22 ? N LYS A-3 149 1 
ATOM 4921 C CA . LYS A-3 1 149 . 38.494 58.285 -6.478 1 8.59 ? CA LYS A-3 149 1 
ATOM 4922 C C . LYS A-3 1 149 . 40 58.146 -6.382 1 8.3 ? C LYS A-3 149 1 
ATOM 4923 O O . LYS A-3 1 149 . 40.524 57.862 -5.312 1 9.71 ? O LYS A-3 149 1 
ATOM 4924 C CB . LYS A-3 1 149 . 38.05 59.514 -5.726 1 11.47 ? CB LYS A-3 149 1 
ATOM 4925 C CG . LYS A-3 1 149 . 38.476 60.791 -6.312 1 18.91 ? CG LYS A-3 149 1 
ATOM 4926 C CD . LYS A-3 1 149 . 37.842 62.049 -5.635 1 24.49 ? CD LYS A-3 149 1 
ATOM 4927 C CE . LYS A-3 1 149 . 36.322 62.017 -5.606 1 27.79 ? CE LYS A-3 149 1 
ATOM 4928 N NZ . LYS A-3 1 149 . 35.862 63.475 -5.268 1 30.16 ? NZ LYS A-3 149 1 
ATOM 4929 N N . ILE A-3 1 150 . 40.701 58.392 -7.489 1 8.1 ? N ILE A-3 150 1 
ATOM 4930 C CA . ILE A-3 1 150 . 42.13 58.348 -7.503 1 8.49 ? CA ILE A-3 150 1 
ATOM 4931 C C . ILE A-3 1 150 . 42.645 59.773 -7.712 1 9.29 ? C ILE A-3 150 1 
ATOM 4932 O O . ILE A-3 1 150 . 42.361 60.384 -8.738 1 14.86 ? O ILE A-3 150 1 
ATOM 4933 C CB . ILE A-3 1 150 . 42.682 57.373 -8.6 1 12.17 ? CB ILE A-3 150 1 
ATOM 4934 C CG1 . ILE A-3 1 150 . 41.924 56.064 -8.63 1 16.32 ? CG1 ILE A-3 150 1 
ATOM 4935 C CG2 . ILE A-3 1 150 . 44.243 57.267 -8.45 1 15.08 ? CG2 ILE A-3 150 1 
ATOM 4936 C CD1 . ILE A-3 1 150 . 42.059 55.303 -7.421 1 20.28 ? CD1 ILE A-3 150 1 
ATOM 4937 N N . GLU A-3 1 151 . 43.331 60.278 -6.762 0.79 7.82 ? N GLU A-3 151 1 
ATOM 4938 C CA . GLU A-3 1 151 . 43.873 61.64 -6.806 0.79 10.79 ? CA GLU A-3 151 1 
ATOM 4939 C C . GLU A-3 1 151 . 45.128 61.803 -7.557 0.79 13.76 ? C GLU A-3 151 1 
ATOM 4940 O O . GLU A-3 1 151 . 45.288 62.835 -8.279 0.79 17.94 ? O GLU A-3 151 1 
ATOM 4941 C CB . GLU A-3 1 151 . 43.926 62.229 -5.384 0.79 14.75 ? CB GLU A-3 151 1 
ATOM 4942 C CG . GLU A-3 1 151 . 44.725 63.46 -5.246 0.79 27.48 ? CG GLU A-3 151 1 
ATOM 4943 C CD . GLU A-3 1 151 . 45.082 63.84 -3.751 0.79 29.46 ? CD GLU A-3 151 1 
ATOM 4944 O OE1 . GLU A-3 1 151 . 45.908 64.759 -3.633 0.79 29.14 ? OE1 GLU A-3 151 1 
ATOM 4945 O OE2 . GLU A-3 1 151 . 44.566 63.317 -2.671 0.79 29.71 ? OE2 GLU A-3 151 1 
ATOM 4946 N N . GLY A-3 1 152 . 45.911 60.81 -7.617 1 11.58 ? N GLY A-3 152 1 
ATOM 4947 C CA . GLY A-3 1 152 . 47.249 60.769 -8.239 1 11.7 ? CA GLY A-3 152 1 
ATOM 4948 C C . GLY A-3 1 152 . 48.208 59.989 -7.34 1 8.45 ? C GLY A-3 152 1 
ATOM 4949 O O . GLY A-3 1 152 . 47.792 59.129 -6.593 1 9.67 ? O GLY A-3 152 1 
ATOM 4950 N N . TRP A-3 1 153 . 49.483 60.309 -7.537 1 8.01 ? N TRP A-3 153 1 
ATOM 4951 C CA . TRP A-3 1 153 . 50.576 59.584 -6.921 1 8.04 ? CA TRP A-3 153 1 
ATOM 4952 C C . TRP A-3 1 153 . 51.406 60.533 -6.07 1 8.17 ? C TRP A-3 153 1 
ATOM 4953 O O . TRP A-3 1 153 . 51.673 61.67 -6.475 1 12.71 ? O TRP A-3 153 1 
ATOM 4954 C CB . TRP A-3 1 153 . 51.487 58.933 -7.991 1 8.95 ? CB TRP A-3 153 1 
ATOM 4955 C CG . TRP A-3 1 153 . 50.804 57.909 -8.801 1 8.38 ? CG TRP A-3 153 1 
ATOM 4956 C CD1 . TRP A-3 1 153 . 50.066 58.094 -9.915 1 8.87 ? CD1 TRP A-3 153 1 
ATOM 4957 C CD2 . TRP A-3 1 153 . 50.739 56.518 -8.494 1 7.11 ? CD2 TRP A-3 153 1 
ATOM 4958 N NE1 . TRP A-3 1 153 . 49.536 56.895 -10.346 1 9.09 ? NE1 TRP A-3 153 1 
ATOM 4959 C CE2 . TRP A-3 1 153 . 49.936 55.915 -9.482 1 7.9 ? CE2 TRP A-3 153 1 
ATOM 4960 C CE3 . TRP A-3 1 153 . 51.273 55.699 -7.489 1 7.32 ? CE3 TRP A-3 153 1 
ATOM 4961 C CZ2 . TRP A-3 1 153 . 49.686 54.554 -9.495 1 8.09 ? CZ2 TRP A-3 153 1 
ATOM 4962 C CZ3 . TRP A-3 1 153 . 51.035 54.351 -7.533 1 7.54 ? CZ3 TRP A-3 153 1 
ATOM 4963 C CH2 . TRP A-3 1 153 . 50.232 53.794 -8.54 1 7.81 ? CH2 TRP A-3 153 1 
ATOM 4964 N N . GLY A-3 1 154 . 51.864 60.05 -4.968 1 7.35 ? N GLY A-3 154 1 
ATOM 4965 C CA . GLY A-3 1 154 . 52.898 60.677 -4.172 1 7.77 ? CA GLY A-3 154 1 
ATOM 4966 C C . GLY A-3 1 154 . 54.231 59.97 -4.288 1 6.88 ? C GLY A-3 154 1 
ATOM 4967 O O . GLY A-3 1 154 . 54.298 58.802 -4.717 1 7.17 ? O GLY A-3 154 1 
ATOM 4968 N N . ASN A-3 1 155 . 55.289 60.663 -3.912 1 7.28 ? N ASN A-3 155 1 
ATOM 4969 C CA . ASN A-3 1 155 . 56.606 60.158 -4.011 1 7.43 ? CA ASN A-3 155 1 
ATOM 4970 C C . ASN A-3 1 155 . 56.984 59.266 -2.841 1 6.97 ? C ASN A-3 155 1 
ATOM 4971 O O . ASN A-3 1 155 . 56.182 58.972 -1.927 1 7.57 ? O ASN A-3 155 1 
ATOM 4972 C CB . ASN A-3 1 155 . 57.602 61.303 -4.222 1 8.61 ? CB ASN A-3 155 1 
ATOM 4973 C CG . ASN A-3 1 155 . 57.737 62.235 -3.054 1 10.04 ? CG ASN A-3 155 1 
ATOM 4974 O OD1 . ASN A-3 1 155 . 58.314 63.364 -3.29 1 14.72 ? OD1 ASN A-3 155 1 
ATOM 4975 N ND2 . ASN A-3 1 155 . 57.363 61.908 -1.926 1 8.45 ? ND2 ASN A-3 155 1 
ATOM 4976 N N . ALA A-3 1 156 . 58.196 58.776 -2.85 1 7.3 ? N ALA A-3 156 1 
ATOM 4977 C CA . ALA A-3 1 156 . 58.631 57.82 -1.844 1 7.65 ? CA ALA A-3 156 1 
ATOM 4978 C C . ALA A-3 1 156 . 58.608 58.428 -0.466 1 7.83 ? C ALA A-3 156 1 
ATOM 4979 O O . ALA A-3 1 156 . 58.305 57.735 0.531 1 8.21 ? O ALA A-3 156 1 
ATOM 4980 C CB . ALA A-3 1 156 . 60.042 57.306 -2.192 1 9.3 ? CB ALA A-3 156 1 
ATOM 4981 N N A GLU A-3 1 157 . 59.002 59.68 -0.274 0.56 8.06 ? N GLU A-3 157 1 
ATOM 4982 N N B GLU A-3 1 157 . 58.906 59.712 -0.401 0.44 7.89 ? N GLU A-3 157 1 
ATOM 4983 C CA A GLU A-3 1 157 . 58.902 60.313 1.041 0.56 9.17 ? CA GLU A-3 157 1 
ATOM 4984 C CA B GLU A-3 1 157 . 58.914 60.368 0.882 0.44 8.8 ? CA GLU A-3 157 1 
ATOM 4985 C C A GLU A-3 1 157 . 57.453 60.332 1.505 0.56 8.6 ? C GLU A-3 157 1 
ATOM 4986 C C B GLU A-3 1 157 . 57.525 60.478 1.495 0.44 8.83 ? C GLU A-3 157 1 
ATOM 4987 O O A GLU A-3 1 157 . 57.194 60.026 2.677 0.56 8.06 ? O GLU A-3 157 1 
ATOM 4988 O O B GLU A-3 1 157 . 57.335 60.32 2.707 0.44 9.77 ? O GLU A-3 157 1 
ATOM 4989 C CB A GLU A-3 1 157 . 59.508 61.734 0.984 0.56 10.69 ? CB GLU A-3 157 1 
ATOM 4990 C CB B GLU A-3 1 157 . 59.515 61.748 0.769 0.44 10.6 ? CB GLU A-3 157 1 
ATOM 4991 C CG A GLU A-3 1 157 . 61.024 61.741 0.677 0.56 14.71 ? CG GLU A-3 157 1 
ATOM 4992 C CG B GLU A-3 1 157 . 59.402 62.452 2.076 0.44 11.73 ? CG GLU A-3 157 1 
ATOM 4993 C CD A GLU A-3 1 157 . 61.966 61.058 1.74 0.56 18.56 ? CD GLU A-3 157 1 
ATOM 4994 C CD B GLU A-3 1 157 . 60.232 61.879 3.194 0.44 15.17 ? CD GLU A-3 157 1 
ATOM 4995 O OE1 A GLU A-3 1 157 . 62.968 60.28 1.428 0.56 19.99 ? OE1 GLU A-3 157 1 
ATOM 4996 O OE1 B GLU A-3 1 157 . 60.095 62.414 4.364 0.44 21.23 ? OE1 GLU A-3 157 1 
ATOM 4997 O OE2 A GLU A-3 1 157 . 61.851 61.338 2.929 0.56 22.25 ? OE2 GLU A-3 157 1 
ATOM 4998 O OE2 B GLU A-3 1 157 . 61.05 60.973 3.004 0.44 17.97 ? OE2 GLU A-3 157 1 
ATOM 4999 N N . GLU A-3 1 158 . 56.518 60.718 0.668 1 8.26 ? N GLU A-3 158 1 
ATOM 5000 C CA . GLU A-3 1 158 . 55.151 60.745 1.127 1 8.54 ? CA GLU A-3 158 1 
ATOM 5001 C C . GLU A-3 1 158 . 54.673 59.338 1.508 1 8.14 ? C GLU A-3 158 1 
ATOM 5002 O O . GLU A-3 1 158 . 53.912 59.156 2.463 1 8.62 ? O GLU A-3 158 1 
ATOM 5003 C CB . GLU A-3 1 158 . 54.236 61.335 0.032 1 9.5 ? CB GLU A-3 158 1 
ATOM 5004 C CG . GLU A-3 1 158 . 52.889 61.698 0.551 1 10.88 ? CG GLU A-3 158 1 
ATOM 5005 C CD . GLU A-3 1 158 . 52.043 62.601 -0.329 1 11.68 ? CD GLU A-3 158 1 
ATOM 5006 O OE1 . GLU A-3 1 158 . 52.423 62.888 -1.508 1 12.82 ? OE1 GLU A-3 158 1 
ATOM 5007 O OE2 . GLU A-3 1 158 . 50.995 63.06 0.185 1 14.3 ? OE2 GLU A-3 158 1 
ATOM 5008 N N . ALA A-3 1 159 . 55.126 58.332 0.748 1 6.98 ? N ALA A-3 159 1 
ATOM 5009 C CA . ALA A-3 1 159 . 54.784 56.951 1.082 1 7.04 ? CA ALA A-3 159 1 
ATOM 5010 C C . ALA A-3 1 159 . 55.307 56.554 2.447 1 7.02 ? C ALA A-3 159 1 
ATOM 5011 O O . ALA A-3 1 159 . 54.607 55.94 3.258 1 7.41 ? O ALA A-3 159 1 
ATOM 5012 C CB . ALA A-3 1 159 . 55.382 56.021 0.02 1 7.75 ? CB ALA A-3 159 1 
ATOM 5013 N N . LYS A-3 1 160 . 56.581 56.873 2.706 1 6.96 ? N LYS A-3 160 1 
ATOM 5014 C CA . LYS A-3 1 160 . 57.207 56.554 3.976 1 7.49 ? CA LYS A-3 160 1 
ATOM 5015 C C . LYS A-3 1 160 . 56.498 57.227 5.146 1 7.88 ? C LYS A-3 160 1 
ATOM 5016 O O . LYS A-3 1 160 . 56.299 56.611 6.193 1 8.26 ? O LYS A-3 160 1 
ATOM 5017 C CB . LYS A-3 1 160 . 58.685 56.861 3.942 1 8.24 ? CB LYS A-3 160 1 
ATOM 5018 C CG . LYS A-3 1 160 . 59.444 55.91 3.008 1 9 ? CG LYS A-3 160 1 
ATOM 5019 C CD . LYS A-3 1 160 . 60.92 56.168 2.959 1 11.31 ? CD LYS A-3 160 1 
ATOM 5020 C CE . LYS A-3 1 160 . 61.272 57.465 2.445 1 14.26 ? CE LYS A-3 160 1 
ATOM 5021 N NZ . LYS A-3 1 160 . 62.776 57.646 2.396 1 17.19 ? NZ LYS A-3 160 1 
ATOM 5022 N N . ARG A-3 1 161 . 56.113 58.498 4.969 1 7.94 ? N ARG A-3 161 1 
ATOM 5023 C CA . ARG A-3 1 161 . 55.355 59.157 6.035 1 9.02 ? CA ARG A-3 161 1 
ATOM 5024 C C . ARG A-3 1 161 . 54.046 58.448 6.301 1 7.95 ? C ARG A-3 161 1 
ATOM 5025 O O . ARG A-3 1 161 . 53.6 58.332 7.46 1 8.5 ? O ARG A-3 161 1 
ATOM 5026 C CB . ARG A-3 1 161 . 55.135 60.61 5.658 1 10.76 ? CB ARG A-3 161 1 
ATOM 5027 C CG . ARG A-3 1 161 . 56.396 61.441 5.689 1 15.91 ? CG ARG A-3 161 1 
ATOM 5028 C CD . ARG A-3 1 161 . 56.132 62.989 5.636 1 26.83 ? CD ARG A-3 161 1 
ATOM 5029 N NE . ARG A-3 1 161 . 55.496 63.445 4.376 1 35.18 ? NE ARG A-3 161 1 
ATOM 5030 C CZ . ARG A-3 1 161 . 56.154 63.827 3.259 1 46.06 ? CZ ARG A-3 161 1 
ATOM 5031 N NH1 . ARG A-3 1 161 . 57.483 63.899 3.274 1 61.49 ? NH1 ARG A-3 161 1 
ATOM 5032 N NH2 . ARG A-3 1 161 . 55.48 64.192 2.18 1 51.06 ? NH2 ARG A-3 161 1 
ATOM 5033 N N . GLU A-3 1 162 . 53.364 57.964 5.26 1 7.13 ? N GLU A-3 162 1 
ATOM 5034 C CA . GLU A-3 1 162 . 52.114 57.29 5.444 1 7.33 ? CA GLU A-3 162 1 
ATOM 5035 C C . GLU A-3 1 162 . 52.283 55.935 6.128 1 6.76 ? C GLU A-3 162 1 
ATOM 5036 O O . GLU A-3 1 162 . 51.443 55.534 6.943 1 7.13 ? O GLU A-3 162 1 
ATOM 5037 C CB . GLU A-3 1 162 . 51.327 57.173 4.155 1 7.46 ? CB GLU A-3 162 1 
ATOM 5038 C CG . GLU A-3 1 162 . 49.822 56.99 4.368 1 7.52 ? CG GLU A-3 162 1 
ATOM 5039 C CD . GLU A-3 1 162 . 49.109 58.202 4.929 1 8.3 ? CD GLU A-3 162 1 
ATOM 5040 O OE1 . GLU A-3 1 162 . 49.753 59.284 5.018 1 10.45 ? OE1 GLU A-3 162 1 
ATOM 5041 O OE2 . GLU A-3 1 162 . 47.904 58.072 5.201 1 8.26 ? OE2 GLU A-3 162 1 
ATOM 5042 N N . ILE A-3 1 163 . 53.364 55.229 5.812 1 6.57 ? N ILE A-3 163 1 
ATOM 5043 C CA . ILE A-3 1 163 . 53.679 53.99 6.512 1 6.37 ? CA ILE A-3 163 1 
ATOM 5044 C C . ILE A-3 1 163 . 53.809 54.275 8.012 1 6.92 ? C ILE A-3 163 1 
ATOM 5045 O O . ILE A-3 1 163 . 53.258 53.533 8.835 1 7.33 ? O ILE A-3 163 1 
ATOM 5046 C CB . ILE A-3 1 163 . 54.963 53.378 5.945 1 7.08 ? CB ILE A-3 163 1 
ATOM 5047 C CG1 . ILE A-3 1 163 . 54.746 52.852 4.521 1 6.6 ? CG1 ILE A-3 163 1 
ATOM 5048 C CG2 . ILE A-3 1 163 . 55.519 52.3 6.865 1 7.57 ? CG2 ILE A-3 163 1 
ATOM 5049 C CD1 . ILE A-3 1 163 . 55.995 52.562 3.741 1 7.43 ? CD1 ILE A-3 163 1 
ATOM 5050 N N . LEU A-3 1 164 . 54.527 55.325 8.382 1 7.17 ? N LEU A-3 164 1 
ATOM 5051 C CA . LEU A-3 1 164 . 54.67 55.624 9.818 1 7.92 ? CA LEU A-3 164 1 
ATOM 5052 C C . LEU A-3 1 164 . 53.337 55.917 10.424 1 7.73 ? C LEU A-3 164 1 
ATOM 5053 O O . LEU A-3 1 164 . 53.091 55.436 11.572 1 8.39 ? O LEU A-3 164 1 
ATOM 5054 C CB . LEU A-3 1 164 . 55.618 56.815 9.972 1 9.68 ? CB LEU A-3 164 1 
ATOM 5055 C CG . LEU A-3 1 164 . 57.051 56.542 9.57 1 10.69 ? CG LEU A-3 164 1 
ATOM 5056 C CD1 . LEU A-3 1 164 . 57.859 57.837 9.67 1 14.89 ? CD1 LEU A-3 164 1 
ATOM 5057 C CD2 . LEU A-3 1 164 . 57.701 55.451 10.36 1 13.66 ? CD2 LEU A-3 164 1 
ATOM 5058 N N . ARG A-3 1 165 . 52.444 56.62 9.767 1 7.53 ? N ARG A-3 165 1 
ATOM 5059 C CA . ARG A-3 1 165 . 51.095 56.867 10.299 1 7.54 ? CA ARG A-3 165 1 
ATOM 5060 C C . ARG A-3 1 165 . 50.363 55.56 10.515 1 7.52 ? C ARG A-3 165 1 
ATOM 5061 O O . ARG A-3 1 165 . 49.728 55.37 11.577 1 8.14 ? O ARG A-3 165 1 
ATOM 5062 C CB . ARG A-3 1 165 . 50.327 57.74 9.324 1 8.17 ? CB ARG A-3 165 1 
ATOM 5063 C CG . ARG A-3 1 165 . 48.86 57.883 9.687 1 9.58 ? CG ARG A-3 165 1 
ATOM 5064 C CD . ARG A-3 1 165 . 48.132 58.859 8.793 1 10.42 ? CD ARG A-3 165 1 
ATOM 5065 N NE . ARG A-3 1 165 . 46.71 58.945 9.203 0.93 10.16 ? NE ARG A-3 165 1 
ATOM 5066 C CZ . ARG A-3 1 165 . 45.658 58.352 8.61 0.88 8.73 ? CZ ARG A-3 165 1 
ATOM 5067 N NH1 . ARG A-3 1 165 . 44.465 58.424 9.161 1 10.57 ? NH1 ARG A-3 165 1 
ATOM 5068 N NH2 . ARG A-3 1 165 . 45.796 57.77 7.426 1 10.08 ? NH2 ARG A-3 165 1 
ATOM 5069 N N . ALA A-3 1 166 . 50.386 54.663 9.539 1 7.02 ? N ALA A-3 166 1 
ATOM 5070 C CA . ALA A-3 1 166 . 49.628 53.412 9.613 1 6.68 ? CA ALA A-3 166 1 
ATOM 5071 C C . ALA A-3 1 166 . 50.135 52.521 10.744 1 6.82 ? C ALA A-3 166 1 
ATOM 5072 O O . ALA A-3 1 166 . 49.361 51.799 11.382 1 7.05 ? O ALA A-3 166 1 
ATOM 5073 C CB . ALA A-3 1 166 . 49.674 52.721 8.275 1 7.28 ? CB ALA A-3 166 1 
ATOM 5074 N N . ILE A-3 1 167 . 51.456 52.534 10.975 1 7.08 ? N ILE A-3 167 1 
ATOM 5075 C CA . ILE A-3 1 167 . 52.044 51.8 12.079 1 7.36 ? CA ILE A-3 167 1 
ATOM 5076 C C . ILE A-3 1 167 . 51.494 52.333 13.431 1 7.73 ? C ILE A-3 167 1 
ATOM 5077 O O . ILE A-3 1 167 . 51.158 51.533 14.31 1 8.71 ? O ILE A-3 167 1 
ATOM 5078 C CB . ILE A-3 1 167 . 53.566 51.904 12.026 1 8 ? CB ILE A-3 167 1 
ATOM 5079 C CG1 . ILE A-3 1 167 . 54.064 51.049 10.843 1 8.5 ? CG1 ILE A-3 167 1 
ATOM 5080 C CG2 . ILE A-3 1 167 . 54.244 51.542 13.321 1 9.65 ? CG2 ILE A-3 167 1 
ATOM 5081 C CD1 . ILE A-3 1 167 . 55.526 51.173 10.573 1 10.01 ? CD1 ILE A-3 167 1 
ATOM 5082 N N . GLU A-3 1 168 . 51.381 53.652 13.553 1 8.34 ? N GLU A-3 168 1 
ATOM 5083 C CA . GLU A-3 1 168 . 50.826 54.217 14.788 1 8.74 ? CA GLU A-3 168 1 
ATOM 5084 C C . GLU A-3 1 168 . 49.325 53.919 14.915 1 8.52 ? C GLU A-3 168 1 
ATOM 5085 O O . GLU A-3 1 168 . 48.853 53.725 16.046 1 10.05 ? O GLU A-3 168 1 
ATOM 5086 C CB . GLU A-3 1 168 . 51.069 55.72 14.847 1 9.72 ? CB GLU A-3 168 1 
ATOM 5087 C CG . GLU A-3 1 168 . 52.549 56.056 14.893 1 11.73 ? CG GLU A-3 168 1 
ATOM 5088 C CD . GLU A-3 1 168 . 53.303 55.362 16.014 1 12.77 ? CD GLU A-3 168 1 
ATOM 5089 O OE1 . GLU A-3 1 168 . 54.426 54.783 15.764 1 16.08 ? OE1 GLU A-3 168 1 
ATOM 5090 O OE2 . GLU A-3 1 168 . 52.766 55.244 17.135 1 12.98 ? OE2 GLU A-3 168 1 
ATOM 5091 N N . MET A-3 1 169 . 48.609 53.853 13.813 1 8.29 ? N MET A-3 169 1 
ATOM 5092 C CA . MET A-3 1 169 . 47.175 53.509 13.884 1 8.29 ? CA MET A-3 169 1 
ATOM 5093 C C . MET A-3 1 169 . 46.96 52.111 14.43 1 8.32 ? C MET A-3 169 1 
ATOM 5094 O O . MET A-3 1 169 . 46.024 51.859 15.191 1 9.23 ? O MET A-3 169 1 
ATOM 5095 C CB . MET A-3 1 169 . 46.496 53.681 12.522 1 8.62 ? CB MET A-3 169 1 
ATOM 5096 C CG . MET A-3 1 169 . 46.434 55.11 12.025 1 10.2 ? CG MET A-3 169 1 
ATOM 5097 S SD . MET A-3 1 169 . 45.75 55.318 10.387 1 11.37 ? SD MET A-3 169 1 
ATOM 5098 C CE . MET A-3 1 169 . 44.11 54.935 10.709 1 14.74 ? CE MET A-3 169 1 
ATOM 5099 N N . TYR A-3 1 170 . 47.829 51.171 14.068 1 7.89 ? N TYR A-3 170 1 
ATOM 5100 C CA . TYR A-3 1 170 . 47.762 49.839 14.647 1 7.78 ? CA TYR A-3 170 1 
ATOM 5101 C C . TYR A-3 1 170 . 48.023 49.843 16.131 1 9.1 ? C TYR A-3 170 1 
ATOM 5102 O O . TYR A-3 1 170 . 47.333 49.195 16.904 1 10.18 ? O TYR A-3 170 1 
ATOM 5103 C CB . TYR A-3 1 170 . 48.784 48.922 13.924 1 8.41 ? CB TYR A-3 170 1 
ATOM 5104 C CG . TYR A-3 1 170 . 48.855 47.52 14.505 1 8.3 ? CG TYR A-3 170 1 
ATOM 5105 C CD1 . TYR A-3 1 170 . 49.659 47.246 15.594 1 9.52 ? CD1 TYR A-3 170 1 
ATOM 5106 C CD2 . TYR A-3 1 170 . 48.089 46.493 13.988 1 8.66 ? CD2 TYR A-3 170 1 
ATOM 5107 C CE1 . TYR A-3 1 170 . 49.713 45.962 16.122 1 10.76 ? CE1 TYR A-3 170 1 
ATOM 5108 C CE2 . TYR A-3 1 170 . 48.143 45.21 14.525 1 9.44 ? CE2 TYR A-3 170 1 
ATOM 5109 C CZ . TYR A-3 1 170 . 48.901 44.969 15.638 1 10.21 ? CZ TYR A-3 170 1 
ATOM 5110 O OH . TYR A-3 1 170 . 48.991 43.736 16.222 1 12.23 ? OH TYR A-3 170 1 
ATOM 5111 N N . LYS A-3 1 171 . 49.073 50.575 16.578 1 10 ? N LYS A-3 171 1 
ATOM 5112 C CA . LYS A-3 1 171 . 49.371 50.641 18.009 1 12.97 ? CA LYS A-3 171 1 
ATOM 5113 C C . LYS A-3 1 171 . 48.173 51.183 18.782 1 14.25 ? C LYS A-3 171 1 
ATOM 5114 O O . LYS A-3 1 171 . 47.915 50.683 19.871 1 16.52 ? O LYS A-3 171 1 
ATOM 5115 C CB . LYS A-3 1 171 . 50.626 51.464 18.226 1 13.85 ? CB LYS A-3 171 1 
ATOM 5116 C CG . LYS A-3 1 171 . 51.868 50.856 17.723 1 14.74 ? CG LYS A-3 171 1 
ATOM 5117 C CD . LYS A-3 1 171 . 53.052 51.813 17.865 1 24.07 ? CD LYS A-3 171 1 
ATOM 5118 C CE . LYS A-3 1 171 . 54.303 51.313 17.224 1 44.24 ? CE LYS A-3 171 1 
ATOM 5119 N NZ . LYS A-3 1 171 . 55.382 52.318 17.292 1 60.91 ? NZ LYS A-3 171 1 
ATOM 5120 N N . GLU A-3 1 172 . 47.52 52.185 18.226 1 13.58 ? N GLU A-3 172 1 
ATOM 5121 C CA . GLU A-3 1 172 . 46.425 52.79 18.915 1 14.99 ? CA GLU A-3 172 1 
ATOM 5122 C C . GLU A-3 1 172 . 45.27 51.848 18.969 1 17.08 ? C GLU A-3 172 1 
ATOM 5123 O O . GLU A-3 1 172 . 44.585 51.693 20.012 1 22.94 ? O GLU A-3 172 1 
ATOM 5124 C CB . GLU A-3 1 172 . 46.092 54.102 18.235 1 14.62 ? CB GLU A-3 172 1 
ATOM 5125 C CG . GLU A-3 1 172 . 44.959 54.829 18.857 1 14.81 ? CG GLU A-3 172 1 
ATOM 5126 C CD . GLU A-3 1 172 . 45.183 55.2 20.367 1 15.18 ? CD GLU A-3 172 1 
ATOM 5127 O OE1 . GLU A-3 1 172 . 44.118 55.404 21.005 1 18.01 ? OE1 GLU A-3 172 1 
ATOM 5128 O OE2 . GLU A-3 1 172 . 46.366 55.298 20.788 1 18.82 ? OE2 GLU A-3 172 1 
ATOM 5129 N N . LYS A-3 1 173 . 45.012 51.114 17.873 1 16.19 ? N LYS A-3 173 1 
ATOM 5130 C CA . LYS A-3 1 173 . 43.888 50.214 17.841 1 19.04 ? CA LYS A-3 173 1 
ATOM 5131 C C . LYS A-3 1 173 . 44.055 48.943 18.707 1 18.27 ? C LYS A-3 173 1 
ATOM 5132 O O . LYS A-3 1 173 . 43.167 48.53 19.439 1 24.3 ? O LYS A-3 173 1 
ATOM 5133 C CB . LYS A-3 1 173 . 43.528 49.786 16.424 1 30.69 ? CB LYS A-3 173 1 
ATOM 5134 C CG . LYS A-3 1 173 . 42.422 48.734 16.353 1 54.54 ? CG LYS A-3 173 1 
ATOM 5135 C CD . LYS A-3 1 173 . 41.437 48.941 15.282 1 76.44 ? CD LYS A-3 173 1 
ATOM 5136 C CE . LYS A-3 1 173 . 40.35 47.924 15.365 1 97.97 ? CE LYS A-3 173 1 
ATOM 5137 N NZ . LYS A-3 1 173 . 39.077 48.516 15.771 1 119.88 ? NZ LYS A-3 173 1 
ATOM 5138 N N . PHE A-3 1 174 . 45.195 48.341 18.582 1 15.43 ? N PHE A-3 174 1 
ATOM 5139 C CA . PHE A-3 1 174 . 45.454 47.038 19.193 1 18.59 ? CA PHE A-3 174 1 
ATOM 5140 C C . PHE A-3 1 174 . 46.372 47.255 20.437 1 27.35 ? C PHE A-3 174 1 
ATOM 5141 C CB . PHE A-3 1 174 . 46.068 46.105 18.216 1 16.46 ? CB PHE A-3 174 1 
ATOM 5142 C CG . PHE A-3 1 174 . 45.131 45.783 17.114 1 15.09 ? CG PHE A-3 174 1 
ATOM 5143 C CD1 . PHE A-3 1 174 . 44.101 44.837 17.257 1 16.67 ? CD1 PHE A-3 174 1 
ATOM 5144 C CD2 . PHE A-3 1 174 . 45.272 46.423 15.865 1 15.63 ? CD2 PHE A-3 174 1 
ATOM 5145 C CE1 . PHE A-3 1 174 . 43.247 44.576 16.274 1 18.55 ? CE1 PHE A-3 174 1 
ATOM 5146 C CE2 . PHE A-3 1 174 . 44.444 46.099 14.815 1 16.2 ? CE2 PHE A-3 174 1 
ATOM 5147 C CZ . PHE A-3 1 174 . 43.388 45.2 14.956 1 18.16 ? CZ PHE A-3 174 1 
ATOM 5148 N N . GLY A-3 1 175 . 46.532 48.46 20.969 1 29.76 ? N GLY A-3 175 1 
ATOM 5149 C CA . GLY A-3 1 175 . 47.055 48.587 22.356 1 29.86 ? CA GLY A-3 175 1 
ATOM 5150 C C . GLY A-3 1 175 . 45.857 48.324 23.265 1 30.3 ? C GLY A-3 175 1 
ATOM 5151 O O . GLY A-3 1 175 . 45.939 47.695 24.358 1 30.14 ? O GLY A-3 175 1 
ATOM 5152 N N . LYS A-3 1 176 . 44.674 48.805 22.859 0.82 37.57 ? N LYS A-3 176 1 
ATOM 5153 C CA . LYS A-3 1 176 . 43.426 48.531 23.582 0.85 33.27 ? CA LYS A-3 176 1 
ATOM 5154 C C . LYS A-3 1 176 . 42.782 47.273 22.992 0.84 33.34 ? C LYS A-3 176 1 
ATOM 5155 O O . LYS A-3 1 176 . 42.425 46.35 23.757 0.73 34.6 ? O LYS A-3 176 1 
ATOM 5156 C CB . LYS A-3 1 176 . 42.467 49.721 23.537 0.85 30.77 ? CB LYS A-3 176 1 
ATOM 5157 C CG . LYS A-3 1 176 . 43.072 51.093 23.274 0.87 28.43 ? CG LYS A-3 176 1 
ATOM 5158 C CD . LYS A-3 1 176 . 42.965 51.355 21.825 0.83 27.66 ? CD LYS A-3 176 1 
ATOM 5159 C CE . LYS A-3 1 176 . 42.045 52.512 21.553 0.81 27.26 ? CE LYS A-3 176 1 
ATOM 5160 N NZ . LYS A-3 1 176 . 42.26 53.479 22.714 0.85 28.19 ? NZ LYS A-3 176 1 
ATOM 5161 N N . GLU A-3 1 177 . 42.667 47.197 21.644 0.81 33.42 ? N GLU A-3 177 1 
ATOM 5162 C CA . GLU A-3 1 177 . 42.045 45.976 21.02 0.85 31.59 ? CA GLU A-3 177 1 
ATOM 5163 C C . GLU A-3 1 177 . 42.925 44.766 21.36 0.83 32.11 ? C GLU A-3 177 1 
ATOM 5164 O O . GLU A-3 1 177 . 43.013 44.358 22.535 0.69 34.38 ? O GLU A-3 177 1 
ATOM 5165 C CB . GLU A-3 1 177 . 41.916 46.067 19.512 0.85 28.63 ? CB GLU A-3 177 1 
ATOM 5166 C CG . GLU A-3 1 177 . 40.567 46.404 18.873 0.89 29.06 ? CG GLU A-3 177 1 
ATOM 5167 C CD . GLU A-3 1 177 . 39.815 45.12 18.496 0.85 30.59 ? CD GLU A-3 177 1 
ATOM 5168 O OE1 . GLU A-3 1 177 . 38.571 45.093 18.423 0.7 33.43 ? OE1 GLU A-3 177 1 
ATOM 5169 O OE2 . GLU A-3 1 177 . 40.469 44.052 18.283 0.73 32.65 ? OE2 GLU A-3 177 1 
ATOM 5170 N N . GLU A-3 1 178 . 43.585 44.214 20.349 0.74 30.04 ? N GLU A-3 178 1 
ATOM 5171 C CA . GLU A-3 1 178 . 44.5 43.099 20.552 0.87 29.37 ? CA GLU A-3 178 1 
ATOM 5172 C C . GLU A-3 1 178 . 45.86 43.597 21.033 0.81 29.87 ? C GLU A-3 178 1 
ATOM 5173 O O . GLU A-3 1 178 . 46.888 42.965 20.787 0.7 29.95 ? O GLU A-3 178 1 
ATOM 5174 C CB . GLU A-3 1 178 . 44.649 42.292 19.261 0.54 20.61 ? CB GLU A-3 178 1 
ATOM 5175 C CG . GLU A-3 1 178 . 46.06 41.81 18.981 0.63 20.13 ? CG GLU A-3 178 1 
ATOM 5176 C CD . GLU A-3 1 178 . 46.269 40.375 19.405 0.56 20.13 ? CD GLU A-3 178 1 
ATOM 5177 O OE1 . GLU A-3 1 178 . 46.972 40.149 20.412 0.2 20.18 ? OE1 GLU A-3 178 1 
ATOM 5178 O OE2 . GLU A-3 1 178 . 45.725 39.473 18.736 0.25 20.19 ? OE2 GLU A-3 178 1 
ATOM 5179 N N A MET A-4 1 1 . 52.539 25.763 -46.239 0.36 40.14 ? N MET A-4 1 1 
ATOM 5180 N N B MET A-4 1 1 . 52.945 25.47 -46.32 0.25 40.26 ? N MET A-4 1 1 
ATOM 5181 C CA A MET A-4 1 1 . 52.351 24.449 -46.822 0.36 35.49 ? CA MET A-4 1 1 
ATOM 5182 C CA B MET A-4 1 1 . 52.489 24.202 -46.867 0.25 35.98 ? CA MET A-4 1 1 
ATOM 5183 C CA C MET A-4 1 1 . 50.363 23.703 -48.268 0.28 34.51 ? CA MET A-4 1 1 
ATOM 5184 C CA D MET A-4 1 1 . 50.423 23.605 -48.32 0.11 34.38 ? CA MET A-4 1 1 
ATOM 5185 C C A MET A-4 1 1 . 51.614 23.575 -45.842 0.36 32.17 ? C MET A-4 1 1 
ATOM 5186 C C B MET A-4 1 1 . 51.441 23.618 -45.942 0.25 32.13 ? C MET A-4 1 1 
ATOM 5187 C C C MET A-4 1 1 . 49.986 22.918 -47.03 0.28 32.62 ? C MET A-4 1 1 
ATOM 5188 C C D MET A-4 1 1 . 50.008 22.911 -47.031 0.11 32.43 ? C MET A-4 1 1 
ATOM 5189 O O A MET A-4 1 1 . 51.887 23.637 -44.7 0.36 29.44 ? O MET A-4 1 1 
ATOM 5190 O O B MET A-4 1 1 . 51.673 23.617 -44.768 0.25 29.37 ? O MET A-4 1 1 
ATOM 5191 O O C MET A-4 1 1 . 50.857 22.534 -46.236 0.28 31.69 ? O MET A-4 1 1 
ATOM 5192 O O D MET A-4 1 1 . 50.853 22.563 -46.205 0.11 31.49 ? O MET A-4 1 1 
ATOM 5193 C CB A MET A-4 1 1 . 53.704 23.822 -47.1 0.36 34.98 ? CB MET A-4 1 1 
ATOM 5194 C CB B MET A-4 1 1 . 53.665 23.222 -46.951 0.25 35.51 ? CB MET A-4 1 1 
ATOM 5195 C CB C MET A-4 1 1 . 49.324 23.438 -49.347 0.28 34.42 ? CB MET A-4 1 1 
ATOM 5196 C CB D MET A-4 1 1 . 50.418 22.585 -49.459 0.11 34.16 ? CB MET A-4 1 1 
ATOM 5197 C CG A MET A-4 1 1 . 54.655 24.798 -47.776 0.36 34.12 ? CG MET A-4 1 1 
ATOM 5198 C CG B MET A-4 1 1 . 54.787 23.697 -47.857 0.25 35.7 ? CG MET A-4 1 1 
ATOM 5199 C CG C MET A-4 1 1 . 49.674 24.04 -50.681 0.28 33.1 ? CG MET A-4 1 1 
ATOM 5200 C CG D MET A-4 1 1 . 51.75 21.897 -49.671 0.11 32.87 ? CG MET A-4 1 1 
ATOM 5201 S SD A MET A-4 1 1 . 55.948 23.86 -48.589 0.36 36.19 ? SD MET A-4 1 1 
ATOM 5202 S SD B MET A-4 1 1 . 56.145 22.517 -47.955 0.25 35.99 ? SD MET A-4 1 1 
ATOM 5203 S SD C MET A-4 1 1 . 49.207 22.937 -52.014 0.28 33.31 ? SD MET A-4 1 1 
ATOM 5204 S SD D MET A-4 1 1 . 51.786 20.162 -49.165 0.11 31.06 ? SD MET A-4 1 1 
ATOM 5205 C CE A MET A-4 1 1 . 54.997 22.564 -49.352 0.36 35.71 ? CE MET A-4 1 1 
ATOM 5206 C CE B MET A-4 1 1 . 57.066 23.133 -49.354 0.25 37.61 ? CE MET A-4 1 1 
ATOM 5207 C CE C MET A-4 1 1 . 50.631 22.991 -53.061 0.28 34.8 ? CE MET A-4 1 1 
ATOM 5208 C CE D MET A-4 1 1 . 51.343 19.337 -50.684 0.11 34.52 ? CE MET A-4 1 1 
ATOM 5209 N N A ASN A-4 1 2 . 50.711 22.732 -46.367 0.36 33.6 ? N ASN A-4 2 1 
ATOM 5210 N N B ASN A-4 1 2 . 50.312 23.128 -46.501 0.25 32.8 ? N ASN A-4 2 1 
ATOM 5211 N N C ASN A-4 1 2 . 48.695 22.696 -46.856 0.28 32.44 ? N ASN A-4 2 1 
ATOM 5212 N N D ASN A-4 1 2 . 48.706 22.72 -46.864 0.11 31.64 ? N ASN A-4 2 1 
ATOM 5213 C CA A ASN A-4 1 2 . 49.842 21.861 -45.562 0.36 34.36 ? CA ASN A-4 2 1 
ATOM 5214 C CA B ASN A-4 1 2 . 49.292 22.35 -45.752 0.25 33.95 ? CA ASN A-4 2 1 
ATOM 5215 C CA C ASN A-4 1 2 . 48.21 21.815 -45.776 0.28 33.7 ? CA ASN A-4 2 1 
ATOM 5216 C CA D ASN A-4 1 2 . 48.161 21.909 -45.766 0.11 33.1 ? CA ASN A-4 2 1 
ATOM 5217 C C A ASN A-4 1 2 . 50.671 20.863 -44.794 0.36 26.62 ? C ASN A-4 2 1 
ATOM 5218 C C B ASN A-4 1 2 . 49.89 21.142 -45.092 0.25 25.14 ? C ASN A-4 2 1 
ATOM 5219 C C C ASN A-4 1 2 . 49.317 20.935 -45.167 0.28 24.9 ? C ASN A-4 2 1 
ATOM 5220 C C D ASN A-4 1 2 . 49.159 20.899 -45.171 0.11 25.36 ? C ASN A-4 2 1 
ATOM 5221 O O A ASN A-4 1 2 . 51.459 20.1 -45.365 0.36 28.36 ? O ASN A-4 2 1 
ATOM 5222 O O B ASN A-4 1 2 . 50.268 20.226 -45.797 0.25 23.83 ? O ASN A-4 2 1 
ATOM 5223 O O C ASN A-4 1 2 . 49.888 20.125 -45.877 0.28 24.62 ? O ASN A-4 2 1 
ATOM 5224 O O D ASN A-4 1 2 . 49.719 20.092 -45.902 0.11 23.05 ? O ASN A-4 2 1 
ATOM 5225 C CB A ASN A-4 1 2 . 48.83 21.165 -46.473 0.36 44.1 ? CB ASN A-4 2 1 
ATOM 5226 C CB B ASN A-4 1 2 . 48.177 21.865 -46.683 0.25 43.76 ? CB ASN A-4 2 1 
ATOM 5227 C CB C ASN A-4 1 2 . 47.062 20.928 -46.287 0.28 43.96 ? CB ASN A-4 2 1 
ATOM 5228 C CB D ASN A-4 1 2 . 46.908 21.17 -46.253 0.11 43.6 ? CB ASN A-4 2 1 
ATOM 5229 C CG A ASN A-4 1 2 . 47.69 20.483 -45.707 0.36 49.12 ? CG ASN A-4 2 1 
ATOM 5230 C CG B ASN A-4 1 2 . 47.308 20.753 -46.058 0.25 48.37 ? CG ASN A-4 2 1 
ATOM 5231 C CG C ASN A-4 1 2 . 46.287 20.264 -45.166 0.28 48.56 ? CG ASN A-4 2 1 
ATOM 5232 C CG D ASN A-4 1 2 . 46.234 20.359 -45.161 0.11 48.28 ? CG ASN A-4 2 1 
ATOM 5233 O OD1 A ASN A-4 1 2 . 47.897 19.548 -44.96 0.36 42.33 ? OD1 ASN A-4 2 1 
ATOM 5234 O OD1 B ASN A-4 1 2 . 47.807 19.725 -45.555 0.25 42.07 ? OD1 ASN A-4 2 1 
ATOM 5235 O OD1 C ASN A-4 1 2 . 46.845 19.875 -44.15 0.28 40.84 ? OD1 ASN A-4 2 1 
ATOM 5236 O OD1 D ASN A-4 1 2 . 46.863 19.936 -44.195 0.11 40.32 ? OD1 ASN A-4 2 1 
ATOM 5237 N ND2 A ASN A-4 1 2 . 46.482 20.953 -45.919 0.36 59.17 ? ND2 ASN A-4 2 1 
ATOM 5238 N ND2 B ASN A-4 1 2 . 46.011 20.953 -46.086 0.25 59.12 ? ND2 ASN A-4 2 1 
ATOM 5239 N ND2 C ASN A-4 1 2 . 44.983 20.119 -45.361 0.28 59.36 ? ND2 ASN A-4 2 1 
ATOM 5240 N ND2 D ASN A-4 1 2 . 44.938 20.123 -45.325 0.11 59.28 ? ND2 ASN A-4 2 1 
ATOM 5241 N N A PRO A-4 1 3 . 50.489 20.833 -43.471 0.36 21.88 ? N PRO A-4 3 1 
ATOM 5242 N N B PRO A-4 1 3 . 49.905 21.141 -43.765 0.25 19.02 ? N PRO A-4 3 1 
ATOM 5243 N N C PRO A-4 1 3 . 49.606 21.132 -43.882 0.28 19.35 ? N PRO A-4 3 1 
ATOM 5244 C CA A PRO A-4 1 3 . 51.412 19.994 -42.688 0.36 22.47 ? CA PRO A-4 3 1 
ATOM 5245 C CA B PRO A-4 1 3 . 50.821 20.266 -43.044 0.25 18.02 ? CA PRO A-4 3 1 
ATOM 5246 C CA C PRO A-4 1 3 . 50.69 20.388 -43.24 0.28 19.53 ? CA PRO A-4 3 1 
ATOM 5247 C C A PRO A-4 1 3 . 50.955 18.547 -42.63 0.36 20.39 ? C PRO A-4 3 1 
ATOM 5248 C C B PRO A-4 1 3 . 50.643 18.802 -43.331 0.25 11.06 ? C PRO A-4 3 1 
ATOM 5249 C C C PRO A-4 1 3 . 50.597 18.882 -43.4 0.28 14.57 ? C PRO A-4 3 1 
ATOM 5250 O O A PRO A-4 1 3 . 51.559 17.791 -41.943 0.36 22.55 ? O PRO A-4 3 1 
ATOM 5251 O O B PRO A-4 1 3 . 51.593 18.098 -43.483 0.25 10.59 ? O PRO A-4 3 1 
ATOM 5252 O O C PRO A-4 1 3 . 51.581 18.154 -43.509 0.28 14.5 ? O PRO A-4 3 1 
ATOM 5253 C CB A PRO A-4 1 3 . 51.289 20.577 -41.309 0.36 23.61 ? CB PRO A-4 3 1 
ATOM 5254 C CB B PRO A-4 1 3 . 50.508 20.612 -41.561 0.25 21.61 ? CB PRO A-4 3 1 
ATOM 5255 C CB C PRO A-4 1 3 . 50.527 20.792 -41.746 0.28 22.9 ? CB PRO A-4 3 1 
ATOM 5256 C CG A PRO A-4 1 3 . 49.918 21.248 -41.306 0.36 23.1 ? CG PRO A-4 3 1 
ATOM 5257 C CG B PRO A-4 1 3 . 49.777 21.855 -41.577 0.25 22.53 ? CG PRO A-4 3 1 
ATOM 5258 C CG C PRO A-4 1 3 . 49.758 22.046 -41.754 0.28 23.91 ? CG PRO A-4 3 1 
ATOM 5259 C CD A PRO A-4 1 3 . 49.726 21.805 -42.626 0.36 21.97 ? CD PRO A-4 3 1 
ATOM 5260 C CD B PRO A-4 1 3 . 49.098 21.998 -42.859 0.25 17.71 ? CD PRO A-4 3 1 
ATOM 5261 C CD C PRO A-4 1 3 . 48.88 22.017 -42.932 0.28 20.95 ? CD PRO A-4 3 1 
ATOM 5262 N N A PHE A-4 1 4 . 49.89 18.236 -43.365 0.36 17.27 ? N PHE A-4 4 1 
ATOM 5263 N N B PHE A-4 1 4 . 49.408 18.347 -43.302 0.25 9.76 ? N PHE A-4 4 1 
ATOM 5264 N N C PHE A-4 1 4 . 49.376 18.389 -43.337 0.28 10.24 ? N PHE A-4 4 1 
ATOM 5265 C CA A PHE A-4 1 4 . 49.418 16.855 -43.473 0.36 13.99 ? CA PHE A-4 4 1 
ATOM 5266 C CA B PHE A-4 1 4 . 49.128 16.937 -43.459 0.25 9.85 ? CA PHE A-4 4 1 
ATOM 5267 C CA C PHE A-4 1 4 . 49.138 16.942 -43.461 0.28 10.21 ? CA PHE A-4 4 1 
ATOM 5268 C C A PHE A-4 1 4 . 49.707 16.289 -44.884 0.36 12.25 ? C PHE A-4 4 1 
ATOM 5269 C C B PHE A-4 1 4 . 49.69 16.38 -44.802 0.25 9.54 ? C PHE A-4 4 1 
ATOM 5270 C C C PHE A-4 1 4 . 49.664 16.353 -44.814 0.28 10.14 ? C PHE A-4 4 1 
ATOM 5271 O O A PHE A-4 1 4 . 50.083 15.127 -45.053 0.36 18.17 ? O PHE A-4 4 1 
ATOM 5272 O O B PHE A-4 1 4 . 50.283 15.321 -44.838 0.25 6.57 ? O PHE A-4 4 1 
ATOM 5273 O O C PHE A-4 1 4 . 50.204 15.23 -44.862 0.28 8.76 ? O PHE A-4 4 1 
ATOM 5274 C CB A PHE A-4 1 4 . 47.934 16.864 -43.2 0.36 15.15 ? CB PHE A-4 4 1 
ATOM 5275 C CB B PHE A-4 1 4 . 47.642 16.806 -43.311 0.25 11.01 ? CB PHE A-4 4 1 
ATOM 5276 C CB C PHE A-4 1 4 . 47.664 16.751 -43.229 0.28 11.46 ? CB PHE A-4 4 1 
ATOM 5277 C CG A PHE A-4 1 4 . 47.215 15.611 -43.668 0.36 14.46 ? CG PHE A-4 4 1 
ATOM 5278 C CG B PHE A-4 1 4 . 47.089 15.464 -43.745 0.25 10.49 ? CG PHE A-4 4 1 
ATOM 5279 C CG C PHE A-4 1 4 . 47.105 15.42 -43.733 0.28 11.5 ? CG PHE A-4 4 1 
ATOM 5280 C CD1 A PHE A-4 1 4 . 47.647 14.34 -43.277 0.36 15 ? CD1 PHE A-4 4 1 
ATOM 5281 C CD1 B PHE A-4 1 4 . 45.993 15.411 -44.625 0.25 13.65 ? CD1 PHE A-4 4 1 
ATOM 5282 C CD1 C PHE A-4 1 4 . 47.711 14.208 -43.459 0.28 13.71 ? CD1 PHE A-4 4 1 
ATOM 5283 C CD2 A PHE A-4 1 4 . 46.125 15.725 -44.551 0.36 17.16 ? CD2 PHE A-4 4 1 
ATOM 5284 C CD2 B PHE A-4 1 4 . 47.683 14.28 -43.379 0.25 8.78 ? CD2 PHE A-4 4 1 
ATOM 5285 C CD2 C PHE A-4 1 4 . 45.971 15.416 -44.564 0.28 11.9 ? CD2 PHE A-4 4 1 
ATOM 5286 C CE1 A PHE A-4 1 4 . 46.974 13.186 -43.725 0.36 16.5 ? CE1 PHE A-4 4 1 
ATOM 5287 C CE1 B PHE A-4 1 4 . 45.458 14.207 -45.051 0.25 13.74 ? CE1 PHE A-4 4 1 
ATOM 5288 C CE1 C PHE A-4 1 4 . 47.158 13.011 -43.94 0.28 13.78 ? CE1 PHE A-4 4 1 
ATOM 5289 C CE2 A PHE A-4 1 4 . 45.455 14.598 -45.006 0.36 18.34 ? CE2 PHE A-4 4 1 
ATOM 5290 C CE2 B PHE A-4 1 4 . 47.171 13.046 -43.826 0.25 9.68 ? CE2 PHE A-4 4 1 
ATOM 5291 C CE2 C PHE A-4 1 4 . 45.409 14.256 -45.021 0.28 12.79 ? CE2 PHE A-4 4 1 
ATOM 5292 C CZ A PHE A-4 1 4 . 45.893 13.316 -44.591 0.36 16.8 ? CZ PHE A-4 4 1 
ATOM 5293 C CZ B PHE A-4 1 4 . 46.075 13.046 -44.675 0.25 11.74 ? CZ PHE A-4 4 1 
ATOM 5294 C CZ C PHE A-4 1 4 . 46.039 13.068 -44.732 0.28 12.79 ? CZ PHE A-4 4 1 
ATOM 5295 N N . HIS A-4 1 5 . 49.472 17.126 -45.892 0.88 10.61 ? N HIS A-4 5 1 
ATOM 5296 C CA . HIS A-4 1 5 . 49.879 16.706 -47.24 0.88 10.48 ? CA HIS A-4 5 1 
ATOM 5297 C C . HIS A-4 1 5 . 51.294 17.111 -47.584 0.88 11.8 ? C HIS A-4 5 1 
ATOM 5298 O O . HIS A-4 1 5 . 51.947 16.444 -48.378 0.88 14.12 ? O HIS A-4 5 1 
ATOM 5299 C CB . HIS A-4 1 5 . 48.899 17.281 -48.288 0.88 11.97 ? CB HIS A-4 5 1 
ATOM 5300 C CG . HIS A-4 1 5 . 47.524 16.723 -48.153 0.88 12.95 ? CG HIS A-4 5 1 
ATOM 5301 N ND1 . HIS A-4 1 5 . 47.272 15.382 -48.344 0.88 13.88 ? ND1 HIS A-4 5 1 
ATOM 5302 C CD2 . HIS A-4 1 5 . 46.318 17.347 -47.927 0.88 13.3 ? CD2 HIS A-4 5 1 
ATOM 5303 C CE1 . HIS A-4 1 5 . 45.963 15.211 -48.238 0.88 13.77 ? CE1 HIS A-4 5 1 
ATOM 5304 N NE2 . HIS A-4 1 5 . 45.347 16.372 -47.947 0.88 15.05 ? NE2 HIS A-4 5 1 
ATOM 5305 N N A GLU A-4 1 6 . 51.808 18.176 -47.04 0.62 11.43 ? N GLU A-4 6 1 
ATOM 5306 N N B GLU A-4 1 6 . 51.767 18.217 -47.021 0.38 12.39 ? N GLU A-4 6 1 
ATOM 5307 C CA A GLU A-4 1 6 . 53.033 18.655 -47.573 0.62 15.19 ? CA GLU A-4 6 1 
ATOM 5308 C CA B GLU A-4 1 6 . 53.067 18.785 -47.367 0.38 15.6 ? CA GLU A-4 6 1 
ATOM 5309 C C A GLU A-4 1 6 . 54.246 18.345 -46.749 0.62 13.6 ? C GLU A-4 6 1 
ATOM 5310 C C B GLU A-4 1 6 . 54.224 18.142 -46.637 0.38 15.58 ? C GLU A-4 6 1 
ATOM 5311 O O A GLU A-4 1 6 . 55.202 18.337 -47.422 0.62 18.14 ? O GLU A-4 6 1 
ATOM 5312 O O B GLU A-4 1 6 . 55.287 18.009 -47.218 0.38 18.6 ? O GLU A-4 6 1 
ATOM 5313 C CB A GLU A-4 1 6 . 52.839 20.175 -47.85 0.62 18.67 ? CB GLU A-4 6 1 
ATOM 5314 C CB B GLU A-4 1 6 . 53.02 20.324 -47.028 0.38 18.73 ? CB GLU A-4 6 1 
ATOM 5315 N N A LEU A-4 1 7 . 54.148 17.983 -45.47 0.62 13.54 ? N LEU A-4 7 1 
ATOM 5316 N N B LEU A-4 1 7 . 54.019 17.746 -45.41 0.38 16.64 ? N LEU A-4 7 1 
ATOM 5317 C CA A LEU A-4 1 7 . 55.237 17.353 -44.736 0.62 13.63 ? CA LEU A-4 7 1 
ATOM 5318 C CA B LEU A-4 1 7 . 55.121 17.172 -44.68 0.38 20.47 ? CA LEU A-4 7 1 
ATOM 5319 C C A LEU A-4 1 7 . 55.394 15.879 -45.084 0.62 12.89 ? C LEU A-4 7 1 
ATOM 5320 C C B LEU A-4 1 7 . 55.286 15.722 -45.149 0.38 15.58 ? C LEU A-4 7 1 
ATOM 5321 O O A LEU A-4 1 7 . 54.475 15.212 -45.065 0.62 11.25 ? O LEU A-4 7 1 
ATOM 5322 O O B LEU A-4 1 7 . 54.309 15.136 -45.511 0.38 13.67 ? O LEU A-4 7 1 
ATOM 5323 C CB A LEU A-4 1 7 . 55.017 17.481 -43.275 0.62 18.62 ? CB LEU A-4 7 1 
ATOM 5324 C CB B LEU A-4 1 7 . 54.778 17.212 -43.203 0.38 32.14 ? CB LEU A-4 7 1 
ATOM 5325 C CG A LEU A-4 1 7 . 55.186 18.792 -42.575 0.62 39.31 ? CG LEU A-4 7 1 
ATOM 5326 C CG B LEU A-4 1 7 . 55.669 17.905 -42.173 0.38 47.02 ? CG LEU A-4 7 1 
ATOM 5327 C CD1 A LEU A-4 1 7 . 54.665 18.696 -41.156 0.62 46.43 ? CD1 LEU A-4 7 1 
ATOM 5328 C CD1 B LEU A-4 1 7 . 56.672 18.863 -42.806 0.38 52.14 ? CD1 LEU A-4 7 1 
ATOM 5329 C CD2 A LEU A-4 1 7 . 56.681 19.161 -42.576 0.62 52.8 ? CD2 LEU A-4 7 1 
ATOM 5330 C CD2 B LEU A-4 1 7 . 54.822 18.604 -41.12 0.38 56.97 ? CD2 LEU A-4 7 1 
ATOM 5331 N N A GLU A-4 1 8 . 56.617 15.366 -45.232 0.62 13.39 ? N GLU A-4 8 1 
ATOM 5332 N N B GLU A-4 1 8 . 56.517 15.184 -45.018 0.38 17.54 ? N GLU A-4 8 1 
ATOM 5333 C CA A GLU A-4 1 8 . 56.837 13.904 -45.323 0.62 14.22 ? CA GLU A-4 8 1 
ATOM 5334 C CA B GLU A-4 1 8 . 56.837 13.809 -45.441 0.38 17.23 ? CA GLU A-4 8 1 
ATOM 5335 C C A GLU A-4 1 8 . 56.481 13.172 -44.007 0.62 8.36 ? C GLU A-4 8 1 
ATOM 5336 C C B GLU A-4 1 8 . 56.842 13.047 -44.119 0.38 14.86 ? C GLU A-4 8 1 
ATOM 5337 O O A GLU A-4 1 8 . 56.438 13.805 -42.959 0.62 7.86 ? O GLU A-4 8 1 
ATOM 5338 O O B GLU A-4 1 8 . 57.295 13.591 -43.212 0.38 20.08 ? O GLU A-4 8 1 
ATOM 5339 C CB A GLU A-4 1 8 . 58.293 13.598 -45.691 0.62 18.66 ? CB GLU A-4 8 1 
ATOM 5340 C CB B GLU A-4 1 8 . 58.226 13.752 -46.105 0.38 22.1 ? CB GLU A-4 8 1 
ATOM 5341 C CG A GLU A-4 1 8 . 58.701 14.042 -47.083 0.62 22.7 ? CG GLU A-4 8 1 
ATOM 5342 C CG B GLU A-4 1 8 . 59.382 14.153 -45.246 0.38 26.07 ? CG GLU A-4 8 1 
ATOM 5343 C CD A GLU A-4 1 8 . 57.799 13.48 -48.158 0.62 24.7 ? CD GLU A-4 8 1 
ATOM 5344 C CD B GLU A-4 1 8 . 60.675 13.468 -45.688 0.38 28.27 ? CD GLU A-4 8 1 
ATOM 5345 O OE1 A GLU A-4 1 8 . 57.266 14.278 -48.957 0.62 25.67 ? OE1 GLU A-4 8 1 
ATOM 5346 O OE1 B GLU A-4 1 8 . 60.632 12.635 -46.634 0.38 29.43 ? OE1 GLU A-4 8 1 
ATOM 5347 O OE2 A GLU A-4 1 8 . 57.622 12.246 -48.205 0.62 26.17 ? OE2 GLU A-4 8 1 
ATOM 5348 O OE2 B GLU A-4 1 8 . 61.766 13.762 -45.137 0.38 29.5 ? OE2 GLU A-4 8 1 
ATOM 5349 N N . PRO A-4 1 9 . 56.318 11.841 -44.042 1 10.23 ? N PRO A-4 9 1 
ATOM 5350 C CA . PRO A-4 1 9 . 56.055 11.17 -42.735 1 9.19 ? CA PRO A-4 9 1 
ATOM 5351 C C . PRO A-4 1 9 . 57.19 11.333 -41.771 1 8.97 ? C PRO A-4 9 1 
ATOM 5352 O O . PRO A-4 1 9 . 56.94 11.238 -40.546 1 9.65 ? O PRO A-4 9 1 
ATOM 5353 C CB . PRO A-4 1 9 . 55.74 9.747 -43.139 1 10.04 ? CB PRO A-4 9 1 
ATOM 5354 C CG . PRO A-4 1 9 . 55.267 9.796 -44.545 1 11.28 ? CG PRO A-4 9 1 
ATOM 5355 C CD . PRO A-4 1 9 . 56.119 10.911 -45.163 1 12.21 ? CD PRO A-4 9 1 
ATOM 5356 N N . GLY A-4 1 10 . 58.429 11.472 -42.201 1 8.68 ? N GLY A-4 10 1 
ATOM 5357 C CA . GLY A-4 1 10 . 59.502 11.536 -41.277 1 9.71 ? CA GLY A-4 10 1 
ATOM 5358 C C . GLY A-4 1 10 . 60.825 11.69 -42.03 1 9.57 ? C GLY A-4 10 1 
ATOM 5359 O O . GLY A-4 1 10 . 60.915 11.473 -43.24 1 11.97 ? O GLY A-4 10 1 
ATOM 5360 N N . PRO A-4 1 11 . 61.899 11.977 -41.29 1 10.16 ? N PRO A-4 11 1 
ATOM 5361 C CA . PRO A-4 1 11 . 63.229 12.076 -41.878 1 12.01 ? CA PRO A-4 11 1 
ATOM 5362 C C . PRO A-4 1 11 . 63.916 10.759 -42.005 1 11.05 ? C PRO A-4 11 1 
ATOM 5363 O O . PRO A-4 1 11 . 64.881 10.651 -42.808 1 14.23 ? O PRO A-4 11 1 
ATOM 5364 C CB . PRO A-4 1 11 . 63.937 13.03 -40.934 1 12.83 ? CB PRO A-4 11 1 
ATOM 5365 C CG . PRO A-4 1 11 . 63.344 12.675 -39.605 1 12.81 ? CG PRO A-4 11 1 
ATOM 5366 C CD . PRO A-4 1 11 . 61.851 12.494 -39.892 1 11 ? CD PRO A-4 11 1 
ATOM 5367 N N . GLU A-4 1 12 . 63.534 9.752 -41.221 1 10.84 ? N GLU A-4 12 1 
ATOM 5368 C CA . GLU A-4 1 12 . 64.199 8.414 -41.311 1 11.83 ? CA GLU A-4 12 1 
ATOM 5369 C C . GLU A-4 1 12 . 63.128 7.333 -40.996 1 9.88 ? C GLU A-4 12 1 
ATOM 5370 O O . GLU A-4 1 12 . 63.214 6.614 -40.014 1 10.77 ? O GLU A-4 12 1 
ATOM 5371 C CB . GLU A-4 1 12 . 65.332 8.268 -40.328 1 13.11 ? CB GLU A-4 12 1 
ATOM 5372 C CG . GLU A-4 1 12 . 66.389 9.188 -40.343 1 21.98 ? CG GLU A-4 12 1 
ATOM 5373 C CD . GLU A-4 1 12 . 67.45 8.916 -39.254 1 25.94 ? CD GLU A-4 12 1 
ATOM 5374 O OE1 . GLU A-4 1 12 . 67.794 7.687 -38.937 1 27.73 ? OE1 GLU A-4 12 1 
ATOM 5375 O OE2 . GLU A-4 1 12 . 67.847 9.919 -38.687 1 31.25 ? OE2 GLU A-4 12 1 
ATOM 5376 N N . VAL A-4 1 13 . 62.114 7.277 -41.846 1 9.87 ? N VAL A-4 13 1 
ATOM 5377 C CA . VAL A-4 1 13 . 60.988 6.418 -41.586 1 9.74 ? CA VAL A-4 13 1 
ATOM 5378 C C . VAL A-4 1 13 . 61.416 4.99 -41.585 1 9.69 ? C VAL A-4 13 1 
ATOM 5379 O O . VAL A-4 1 13 . 62.162 4.571 -42.497 1 10.53 ? O VAL A-4 13 1 
ATOM 5380 C CB . VAL A-4 1 13 . 59.933 6.679 -42.666 1 11.11 ? CB VAL A-4 13 1 
ATOM 5381 C CG1 . VAL A-4 1 13 . 58.822 5.626 -42.676 1 13.51 ? CG1 VAL A-4 13 1 
ATOM 5382 C CG2 . VAL A-4 1 13 . 59.302 8.102 -42.546 1 13.73 ? CG2 VAL A-4 13 1 
ATOM 5383 N N . PRO A-4 1 14 . 60.918 4.148 -40.666 1 9.3 ? N PRO A-4 14 1 
ATOM 5384 C CA . PRO A-4 1 14 . 59.985 4.41 -39.576 1 9.51 ? CA PRO A-4 14 1 
ATOM 5385 C C . PRO A-4 1 14 . 60.69 4.639 -38.235 1 9.02 ? C PRO A-4 14 1 
ATOM 5386 O O . PRO A-4 1 14 . 59.979 4.771 -37.225 1 10.43 ? O PRO A-4 14 1 
ATOM 5387 C CB . PRO A-4 1 14 . 59.131 3.163 -39.556 1 9.81 ? CB PRO A-4 14 1 
ATOM 5388 C CG . PRO A-4 1 14 . 60.143 2.063 -39.835 1 10.63 ? CG PRO A-4 14 1 
ATOM 5389 C CD . PRO A-4 1 14 . 61.086 2.692 -40.9 1 9.98 ? CD PRO A-4 14 1 
ATOM 5390 N N . GLU A-4 1 15 . 62.025 4.649 -38.21 1 9.93 ? N GLU A-4 15 1 
ATOM 5391 C CA . GLU A-4 1 15 . 62.725 4.85 -36.925 1 12.14 ? CA GLU A-4 15 1 
ATOM 5392 C C . GLU A-4 1 15 . 62.624 6.237 -36.371 1 10.18 ? C GLU A-4 15 1 
ATOM 5393 O O . GLU A-4 1 15 . 62.665 6.39 -35.123 1 10.58 ? O GLU A-4 15 1 
ATOM 5394 C CB . GLU A-4 1 15 . 64.217 4.494 -37.066 1 14.92 ? CB GLU A-4 15 1 
ATOM 5395 C CG . GLU A-4 1 15 . 64.466 2.98 -37.366 1 19.13 ? CG GLU A-4 15 1 
ATOM 5396 C CD . GLU A-4 1 15 . 64.366 2.751 -38.778 1 16.96 ? CD GLU A-4 15 1 
ATOM 5397 O OE1 . GLU A-4 1 15 . 64.086 1.625 -39.062 1 21.22 ? OE1 GLU A-4 15 1 
ATOM 5398 O OE2 . GLU A-4 1 15 . 64.544 3.691 -39.518 1 20.35 ? OE2 GLU A-4 15 1 
ATOM 5399 N N . VAL A-4 1 16 . 62.504 7.258 -37.214 1 9.52 ? N VAL A-4 16 1 
ATOM 5400 C CA . VAL A-4 1 16 . 62.288 8.644 -36.812 1 9.2 ? CA VAL A-4 16 1 
ATOM 5401 C C . VAL A-4 1 16 . 61.206 9.177 -37.699 1 8.11 ? C VAL A-4 16 1 
ATOM 5402 O O . VAL A-4 1 16 . 61.36 9.143 -38.944 1 10.13 ? O VAL A-4 16 1 
ATOM 5403 C CB . VAL A-4 1 16 . 63.528 9.519 -36.889 1 11.17 ? CB VAL A-4 16 1 
ATOM 5404 C CG1 . VAL A-4 1 16 . 63.186 10.892 -36.397 1 12.09 ? CG1 VAL A-4 16 1 
ATOM 5405 C CG2 . VAL A-4 1 16 . 64.704 8.899 -36.073 1 13.96 ? CG2 VAL A-4 16 1 
ATOM 5406 N N . VAL A-4 1 17 . 60.144 9.643 -37.125 1 6.81 ? N VAL A-4 17 1 
ATOM 5407 C CA . VAL A-4 1 17 . 59.031 10.219 -37.827 1 6.7 ? CA VAL A-4 17 1 
ATOM 5408 C C . VAL A-4 1 17 . 58.85 11.664 -37.41 1 6.82 ? C VAL A-4 17 1 
ATOM 5409 O O . VAL A-4 1 17 . 59.337 12.105 -36.357 1 7.92 ? O VAL A-4 17 1 
ATOM 5410 C CB . VAL A-4 1 17 . 57.734 9.422 -37.611 1 7.7 ? CB VAL A-4 17 1 
ATOM 5411 C CG1 . VAL A-4 1 17 . 57.901 8.003 -38.198 1 9.56 ? CG1 VAL A-4 17 1 
ATOM 5412 C CG2 . VAL A-4 1 17 . 57.245 9.425 -36.203 1 8.28 ? CG2 VAL A-4 17 1 
ATOM 5413 N N . TYR A-4 1 18 . 58.068 12.41 -38.186 1 7.2 ? N TYR A-4 18 1 
ATOM 5414 C CA . TYR A-4 1 18 . 57.52 13.694 -37.736 1 7.62 ? CA TYR A-4 18 1 
ATOM 5415 C C . TYR A-4 1 18 . 56.2 13.477 -37.048 1 7.56 ? C TYR A-4 18 1 
ATOM 5416 O O . TYR A-4 1 18 . 55.286 12.787 -37.575 1 9.26 ? O TYR A-4 18 1 
ATOM 5417 C CB . TYR A-4 1 18 . 57.333 14.665 -38.887 1 8.7 ? CB TYR A-4 18 1 
ATOM 5418 C CG . TYR A-4 1 18 . 58.562 15.094 -39.52 1 9.74 ? CG TYR A-4 18 1 
ATOM 5419 C CD1 . TYR A-4 1 18 . 58.723 14.982 -40.915 1 12.56 ? CD1 TYR A-4 18 1 
ATOM 5420 C CD2 . TYR A-4 1 18 . 59.643 15.575 -38.845 1 10.23 ? CD2 TYR A-4 18 1 
ATOM 5421 C CE1 . TYR A-4 1 18 . 59.948 15.314 -41.585 1 15.07 ? CE1 TYR A-4 18 1 
ATOM 5422 C CE2 . TYR A-4 1 18 . 60.789 16.049 -39.475 1 13.52 ? CE2 TYR A-4 18 1 
ATOM 5423 C CZ . TYR A-4 1 18 . 60.949 15.904 -40.822 1 14.9 ? CZ TYR A-4 18 1 
ATOM 5424 O OH . TYR A-4 1 18 . 62.107 16.243 -41.453 1 19.53 ? OH TYR A-4 18 1 
ATOM 5425 N N . ALA A-4 1 19 . 56.062 14.059 -35.898 1 6.71 ? N ALA A-4 19 1 
ATOM 5426 C CA . ALA A-4 1 19 . 54.775 14.205 -35.237 1 6.98 ? CA ALA A-4 19 1 
ATOM 5427 C C . ALA A-4 1 19 . 54.331 15.64 -35.407 1 6.79 ? C ALA A-4 19 1 
ATOM 5428 O O . ALA A-4 1 19 . 55.049 16.564 -34.992 1 9.69 ? O ALA A-4 19 1 
ATOM 5429 C CB . ALA A-4 1 19 . 54.872 13.858 -33.788 1 7.22 ? CB ALA A-4 19 1 
ATOM 5430 N N . LEU A-4 1 20 . 53.179 15.851 -35.965 1 5.56 ? N LEU A-4 20 1 
ATOM 5431 C CA . LEU A-4 1 20 . 52.533 17.181 -36.042 1 5.58 ? CA LEU A-4 20 1 
ATOM 5432 C C . LEU A-4 1 20 . 51.549 17.197 -34.89 1 5.22 ? C LEU A-4 20 1 
ATOM 5433 O O . LEU A-4 1 20 . 50.517 16.494 -34.925 1 5.58 ? O LEU A-4 20 1 
ATOM 5434 C CB . LEU A-4 1 20 . 51.897 17.37 -37.373 1 6.33 ? CB LEU A-4 20 1 
ATOM 5435 C CG . LEU A-4 1 20 . 51.245 18.752 -37.553 1 8.44 ? CG LEU A-4 20 1 
ATOM 5436 C CD1 . LEU A-4 1 20 . 52.286 19.857 -37.58 1 9.53 ? CD1 LEU A-4 20 1 
ATOM 5437 C CD2 . LEU A-4 1 20 . 50.427 18.737 -38.832 1 15.85 ? CD2 LEU A-4 20 1 
ATOM 5438 N N . ILE A-4 1 21 . 51.851 17.96 -33.846 1 5.48 ? N ILE A-4 21 1 
ATOM 5439 C CA . ILE A-4 1 21 . 51.011 17.967 -32.649 1 5.2 ? CA ILE A-4 21 1 
ATOM 5440 C C . ILE A-4 1 21 . 49.778 18.775 -32.865 1 5.21 ? C ILE A-4 21 1 
ATOM 5441 O O . ILE A-4 1 21 . 49.816 19.892 -33.395 1 7.29 ? O ILE A-4 21 1 
ATOM 5442 C CB . ILE A-4 1 21 . 51.832 18.441 -31.423 1 5.8 ? CB ILE A-4 21 1 
ATOM 5443 C CG1 . ILE A-4 1 21 . 53.022 17.511 -31.195 1 6.59 ? CG1 ILE A-4 21 1 
ATOM 5444 C CG2 . ILE A-4 1 21 . 50.952 18.59 -30.205 1 6.11 ? CG2 ILE A-4 21 1 
ATOM 5445 C CD1 . ILE A-4 1 21 . 52.697 16.024 -31.096 1 7.65 ? CD1 ILE A-4 21 1 
ATOM 5446 N N . GLU A-4 1 22 . 48.649 18.219 -32.461 1 5.02 ? N GLU A-4 22 1 
ATOM 5447 C CA . GLU A-4 1 22 . 47.343 18.899 -32.43 1 5.03 ? CA GLU A-4 22 1 
ATOM 5448 C C . GLU A-4 1 22 . 46.96 19.355 -31.026 1 5.04 ? C GLU A-4 22 1 
ATOM 5449 O O . GLU A-4 1 22 . 46.348 20.401 -30.873 1 5.87 ? O GLU A-4 22 1 
ATOM 5450 C CB . GLU A-4 1 22 . 46.266 17.965 -33.008 1 5.37 ? CB GLU A-4 22 1 
ATOM 5451 C CG . GLU A-4 1 22 . 46.45 17.641 -34.482 1 5.95 ? CG GLU A-4 22 1 
ATOM 5452 C CD . GLU A-4 1 22 . 45.672 16.442 -34.941 1 5.27 ? CD GLU A-4 22 1 
ATOM 5453 O OE1 . GLU A-4 1 22 . 45.681 15.41 -34.22 1 5.65 ? OE1 GLU A-4 22 1 
ATOM 5454 O OE2 . GLU A-4 1 22 . 45.081 16.504 -36.058 1 6.15 ? OE2 GLU A-4 22 1 
ATOM 5455 N N . ILE A-4 1 23 . 47.252 18.525 -30.031 1 4.85 ? N ILE A-4 23 1 
ATOM 5456 C CA . ILE A-4 1 23 . 46.772 18.707 -28.673 1 4.97 ? CA ILE A-4 23 1 
ATOM 5457 C C . ILE A-4 1 23 . 47.958 18.693 -27.716 1 4.87 ? C ILE A-4 23 1 
ATOM 5458 O O . ILE A-4 1 23 . 48.591 17.651 -27.515 1 5.92 ? O ILE A-4 23 1 
ATOM 5459 C CB . ILE A-4 1 23 . 45.78 17.647 -28.215 1 5.14 ? CB ILE A-4 23 1 
ATOM 5460 C CG1 . ILE A-4 1 23 . 44.698 17.402 -29.258 1 6.35 ? CG1 ILE A-4 23 1 
ATOM 5461 C CG2 . ILE A-4 1 23 . 45.192 18.035 -26.868 1 6.16 ? CG2 ILE A-4 23 1 
ATOM 5462 C CD1 . ILE A-4 1 23 . 43.723 16.288 -28.861 1 6.53 ? CD1 ILE A-4 23 1 
ATOM 5463 N N . PRO A-4 1 24 . 48.269 19.799 -27.06 1 5.11 ? N PRO A-4 24 1 
ATOM 5464 C CA . PRO A-4 1 24 . 49.318 19.777 -26.015 1 5.7 ? CA PRO A-4 24 1 
ATOM 5465 C C . PRO A-4 1 24 . 48.856 18.934 -24.826 1 5.52 ? C PRO A-4 24 1 
ATOM 5466 O O . PRO A-4 1 24 . 47.702 18.989 -24.42 1 5.71 ? O PRO A-4 24 1 
ATOM 5467 C CB . PRO A-4 1 24 . 49.471 21.25 -25.631 1 6.68 ? CB PRO A-4 24 1 
ATOM 5468 C CG . PRO A-4 1 24 . 48.899 22.027 -26.838 1 7.48 ? CG PRO A-4 24 1 
ATOM 5469 C CD . PRO A-4 1 24 . 47.733 21.172 -27.285 1 6.62 ? CD PRO A-4 24 1 
ATOM 5470 N N . LYS A-4 1 25 . 49.796 18.22 -24.205 1 5.89 ? N LYS A-4 25 1 
ATOM 5471 C CA A LYS A-4 1 25 . 49.457 17.523 -22.991 0.44 5.63 ? CA LYS A-4 25 1 
ATOM 5472 C CA B LYS A-4 1 25 . 49.533 17.557 -22.911 0.56 5.33 ? CA LYS A-4 25 1 
ATOM 5473 C C . LYS A-4 1 25 . 48.861 18.548 -21.988 1 5.44 ? C LYS A-4 25 1 
ATOM 5474 O O . LYS A-4 1 25 . 49.316 19.682 -21.869 1 5.97 ? O LYS A-4 25 1 
ATOM 5475 C CB A LYS A-4 1 25 . 50.742 16.906 -22.41 0.44 7.25 ? CB LYS A-4 25 1 
ATOM 5476 C CB B LYS A-4 1 25 . 50.843 17.051 -22.23 0.56 7.17 ? CB LYS A-4 25 1 
ATOM 5477 C CG A LYS A-4 1 25 . 50.581 16.189 -21.059 0.44 8.32 ? CG LYS A-4 25 1 
ATOM 5478 C CG B LYS A-4 1 25 . 50.722 16.631 -20.822 0.56 6.78 ? CG LYS A-4 25 1 
ATOM 5479 C CD A LYS A-4 1 25 . 50.915 17.073 -19.867 0.44 10.38 ? CD LYS A-4 25 1 
ATOM 5480 C CD B LYS A-4 1 25 . 52.023 16.167 -20.29 0.56 7.51 ? CD LYS A-4 25 1 
ATOM 5481 C CE A LYS A-4 1 25 . 51.052 16.331 -18.576 0.44 15.53 ? CE LYS A-4 25 1 
ATOM 5482 C CE B LYS A-4 1 25 . 53.071 17.264 -20.18 0.56 10.42 ? CE LYS A-4 25 1 
ATOM 5483 N NZ A LYS A-4 1 25 . 51.405 17.324 -17.503 0.44 27.79 ? NZ LYS A-4 25 1 
ATOM 5484 N NZ B LYS A-4 1 25 . 54.354 16.948 -19.404 0.56 9.27 ? NZ LYS A-4 25 1 
ATOM 5485 N N . GLY A-4 1 26 . 47.834 18.075 -21.278 1 5.55 ? N GLY A-4 26 1 
ATOM 5486 C CA . GLY A-4 1 26 . 47.149 18.881 -20.3 1 5.49 ? CA GLY A-4 26 1 
ATOM 5487 C C . GLY A-4 1 26 . 45.868 19.518 -20.801 1 5.73 ? C GLY A-4 26 1 
ATOM 5488 O O . GLY A-4 1 26 . 45.145 20.111 -20.023 1 7.67 ? O GLY A-4 26 1 
ATOM 5489 N N . SER A-4 1 27 . 45.567 19.384 -22.09 1 5.42 ? N SER A-4 27 1 
ATOM 5490 C CA A SER A-4 1 27 . 44.368 19.974 -22.692 0.74 5.55 ? CA SER A-4 27 1 
ATOM 5491 C CA B SER A-4 1 27 . 44.38 19.976 -22.626 0.26 4.82 ? CA SER A-4 27 1 
ATOM 5492 C C . SER A-4 1 27 . 43.159 19.035 -22.52 1 4.77 ? C SER A-4 27 1 
ATOM 5493 O O . SER A-4 1 27 . 43.287 17.838 -22.706 1 5.65 ? O SER A-4 27 1 
ATOM 5494 C CB A SER A-4 1 27 . 44.551 20.133 -24.194 0.74 6.56 ? CB SER A-4 27 1 
ATOM 5495 C CB B SER A-4 1 27 . 44.641 20.346 -24.108 0.26 5.87 ? CB SER A-4 27 1 
ATOM 5496 O OG A SER A-4 1 27 . 45.756 20.914 -24.444 0.74 6.87 ? OG SER A-4 27 1 
ATOM 5497 O OG B SER A-4 1 27 . 43.478 20.759 -24.752 0.26 7.98 ? OG SER A-4 27 1 
ATOM 5498 N N . ARG A-4 1 28 . 42.016 19.638 -22.278 1 5.09 ? N ARG A-4 28 1 
ATOM 5499 C CA . ARG A-4 1 28 . 40.718 19 -22.372 1 5.37 ? CA ARG A-4 28 1 
ATOM 5500 C C . ARG A-4 1 28 . 40.038 19.239 -23.71 1 5.59 ? C ARG A-4 28 1 
ATOM 5501 O O . ARG A-4 1 28 . 39.095 18.525 -24.097 1 6.91 ? O ARG A-4 28 1 
ATOM 5502 C CB . ARG A-4 1 28 . 39.843 19.462 -21.225 1 6.42 ? CB ARG A-4 28 1 
ATOM 5503 C CG . ARG A-4 1 28 . 38.446 18.865 -21.2 1 6.95 ? CG ARG A-4 28 1 
ATOM 5504 C CD . ARG A-4 1 28 . 37.655 19.362 -20.031 1 7.78 ? CD ARG A-4 28 1 
ATOM 5505 N NE . ARG A-4 1 28 . 36.279 18.899 -20.115 1 6.37 ? NE ARG A-4 28 1 
ATOM 5506 C CZ . ARG A-4 1 28 . 35.43 18.933 -19.111 1 5.64 ? CZ ARG A-4 28 1 
ATOM 5507 N NH1 . ARG A-4 1 28 . 35.714 19.637 -18.016 1 7.13 ? NH1 ARG A-4 28 1 
ATOM 5508 N NH2 . ARG A-4 1 28 . 34.294 18.26 -19.193 1 5.92 ? NH2 ARG A-4 28 1 
ATOM 5509 N N . ASN A-4 1 29 . 40.457 20.251 -24.45 1 5.68 ? N ASN A-4 29 1 
ATOM 5510 C CA . ASN A-4 1 29 . 39.945 20.513 -25.797 1 6.22 ? CA ASN A-4 29 1 
ATOM 5511 C C . ASN A-4 1 29 . 40.593 19.534 -26.787 1 5.91 ? C ASN A-4 29 1 
ATOM 5512 O O . ASN A-4 1 29 . 41.801 19.432 -26.869 1 7.08 ? O ASN A-4 29 1 
ATOM 5513 C CB . ASN A-4 1 29 . 40.223 21.931 -26.211 1 5.89 ? CB ASN A-4 29 1 
ATOM 5514 C CG . ASN A-4 1 29 . 39.423 22.968 -25.45 1 6.16 ? CG ASN A-4 29 1 
ATOM 5515 O OD1 . ASN A-4 1 29 . 38.387 22.654 -24.834 1 7.04 ? OD1 ASN A-4 29 1 
ATOM 5516 N ND2 . ASN A-4 1 29 . 39.843 24.199 -25.564 1 6.83 ? ND2 ASN A-4 29 1 
ATOM 5517 N N A LYS A-4 1 30 . 39.735 18.833 -27.531 0.73 5.89 ? N LYS A-4 30 1 
ATOM 5518 N N B LYS A-4 1 30 . 39.735 18.782 -27.472 0.27 5.78 ? N LYS A-4 30 1 
ATOM 5519 C CA A LYS A-4 1 30 . 40.189 17.894 -28.554 0.73 5.88 ? CA LYS A-4 30 1 
ATOM 5520 C CA B LYS A-4 1 30 . 40.171 17.894 -28.546 0.27 5.82 ? CA LYS A-4 30 1 
ATOM 5521 C C A LYS A-4 1 30 . 40.308 18.599 -29.9 0.73 5.33 ? C LYS A-4 30 1 
ATOM 5522 C C B LYS A-4 1 30 . 40.285 18.64 -29.874 0.27 5.44 ? C LYS A-4 30 1 
ATOM 5523 O O A LYS A-4 1 30 . 39.333 18.739 -30.635 0.73 8.13 ? O LYS A-4 30 1 
ATOM 5524 O O B LYS A-4 1 30 . 39.384 18.566 -30.711 0.27 8.04 ? O LYS A-4 30 1 
ATOM 5525 C CB A LYS A-4 1 30 . 39.242 16.69 -28.647 0.73 7.06 ? CB LYS A-4 30 1 
ATOM 5526 C CB B LYS A-4 1 30 . 39.2 16.719 -28.694 0.27 7.08 ? CB LYS A-4 30 1 
ATOM 5527 C CG A LYS A-4 1 30 . 39.169 16.007 -30.024 0.73 10.97 ? CG LYS A-4 30 1 
ATOM 5528 C CG B LYS A-4 1 30 . 39.877 15.376 -28.907 0.27 9.72 ? CG LYS A-4 30 1 
ATOM 5529 C CD A LYS A-4 1 30 . 40.477 15.326 -30.403 0.73 5.69 ? CD LYS A-4 30 1 
ATOM 5530 C CD B LYS A-4 1 30 . 40.512 15.277 -30.282 0.27 8.17 ? CD LYS A-4 30 1 
ATOM 5531 C CE A LYS A-4 1 30 . 40.26 14.121 -31.32 0.73 10.85 ? CE LYS A-4 30 1 
ATOM 5532 C CE B LYS A-4 1 30 . 41.03 13.871 -30.538 0.27 9.73 ? CE LYS A-4 30 1 
ATOM 5533 N NZ A LYS A-4 1 30 . 41.537 13.58 -31.869 0.73 7.38 ? NZ LYS A-4 30 1 
ATOM 5534 N NZ B LYS A-4 1 30 . 41.633 13.728 -31.892 0.27 7.75 ? NZ LYS A-4 30 1 
ATOM 5535 N N . TYR A-4 1 31 . 41.472 19.178 -30.14 1 5.95 ? N TYR A-4 31 1 
ATOM 5536 C CA . TYR A-4 1 31 . 41.779 19.826 -31.417 1 6.3 ? CA TYR A-4 31 1 
ATOM 5537 C C . TYR A-4 1 31 . 42.145 18.785 -32.451 1 6.04 ? C TYR A-4 31 1 
ATOM 5538 O O . TYR A-4 1 31 . 42.765 17.788 -32.116 1 6.73 ? O TYR A-4 31 1 
ATOM 5539 C CB . TYR A-4 1 31 . 42.962 20.748 -31.251 1 6.66 ? CB TYR A-4 31 1 
ATOM 5540 C CG . TYR A-4 1 31 . 42.824 21.777 -30.154 1 6.12 ? CG TYR A-4 31 1 
ATOM 5541 C CD1 . TYR A-4 1 31 . 43.63 21.754 -29.034 1 6.39 ? CD1 TYR A-4 31 1 
ATOM 5542 C CD2 . TYR A-4 1 31 . 41.898 22.813 -30.256 1 7.17 ? CD2 TYR A-4 31 1 
ATOM 5543 C CE1 . TYR A-4 1 31 . 43.523 22.666 -28.027 1 6.75 ? CE1 TYR A-4 31 1 
ATOM 5544 C CE2 . TYR A-4 1 31 . 41.783 23.745 -29.252 1 7.68 ? CE2 TYR A-4 31 1 
ATOM 5545 C CZ . TYR A-4 1 31 . 42.601 23.66 -28.138 1 7.11 ? CZ TYR A-4 31 1 
ATOM 5546 O OH . TYR A-4 1 31 . 42.424 24.609 -27.148 1 8.29 ? OH TYR A-4 31 1 
ATOM 5547 N N . GLU A-4 1 32 . 41.818 19.066 -33.704 1 6.11 ? N GLU A-4 32 1 
ATOM 5548 C CA . GLU A-4 1 32 . 42.254 18.27 -34.829 1 6.34 ? CA GLU A-4 32 1 
ATOM 5549 C C . GLU A-4 1 32 . 42.637 19.211 -35.956 1 7 ? C GLU A-4 32 1 
ATOM 5550 O O . GLU A-4 1 32 . 42.056 20.259 -36.131 1 8.98 ? O GLU A-4 32 1 
ATOM 5551 C CB . GLU A-4 1 32 . 41.178 17.325 -35.356 1 7.23 ? CB GLU A-4 32 1 
ATOM 5552 C CG . GLU A-4 1 32 . 40.828 16.211 -34.359 1 7.38 ? CG GLU A-4 32 1 
ATOM 5553 C CD . GLU A-4 1 32 . 39.822 15.204 -34.87 1 7.62 ? CD GLU A-4 32 1 
ATOM 5554 O OE1 . GLU A-4 1 32 . 39.874 14.043 -34.387 1 9.9 ? OE1 GLU A-4 32 1 
ATOM 5555 O OE2 . GLU A-4 1 32 . 38.973 15.534 -35.738 1 9.21 ? OE2 GLU A-4 32 1 
ATOM 5556 N N A LEU A-4 1 33 . 43.547 18.7 -36.797 0.13 8.75 ? N LEU A-4 33 1 
ATOM 5557 N N B LEU A-4 1 33 . 43.609 18.793 -36.774 0.87 7.07 ? N LEU A-4 33 1 
ATOM 5558 C CA A LEU A-4 1 33 . 43.902 19.334 -38.068 0.13 13.4 ? CA LEU A-4 33 1 
ATOM 5559 C CA B LEU A-4 1 33 . 43.866 19.512 -38.007 0.87 8.33 ? CA LEU A-4 33 1 
ATOM 5560 C C A LEU A-4 1 33 . 42.817 19.127 -39.127 0.13 13.71 ? C LEU A-4 33 1 
ATOM 5561 C C B LEU A-4 1 33 . 42.648 19.395 -38.893 0.87 11.32 ? C LEU A-4 33 1 
ATOM 5562 O O A LEU A-4 1 33 . 42.67 18.055 -39.713 0.13 11.04 ? O LEU A-4 33 1 
ATOM 5563 O O B LEU A-4 1 33 . 42.009 18.324 -39.067 0.87 12.93 ? O LEU A-4 33 1 
ATOM 5564 C CB A LEU A-4 1 33 . 45.235 18.746 -38.554 0.13 18 ? CB LEU A-4 33 1 
ATOM 5565 C CB B LEU A-4 1 33 . 45.146 18.868 -38.671 0.87 9.47 ? CB LEU A-4 33 1 
ATOM 5566 C CG A LEU A-4 1 33 . 45.716 18.969 -39.99 0.13 24.71 ? CG LEU A-4 33 1 
ATOM 5567 C CG B LEU A-4 1 33 . 45.574 19.599 -39.951 0.87 11.47 ? CG LEU A-4 33 1 
ATOM 5568 C CD1 A LEU A-4 1 33 . 47.158 18.493 -40.103 0.13 26.72 ? CD1 LEU A-4 33 1 
ATOM 5569 C CD1 B LEU A-4 1 33 . 46.259 20.929 -39.493 0.87 15.16 ? CD1 LEU A-4 33 1 
ATOM 5570 C CD2 A LEU A-4 1 33 . 44.847 18.237 -41.007 0.13 29.05 ? CD2 LEU A-4 33 1 
ATOM 5571 C CD2 B LEU A-4 1 33 . 46.705 18.917 -40.546 0.87 16.24 ? CD2 LEU A-4 33 1 
ATOM 5572 N N A ASP A-4 1 34 . 42.073 20.187 -39.412 0.13 18.46 ? N ASP A-4 34 1 
ATOM 5573 N N B ASP A-4 1 34 . 42.285 20.555 -39.474 0.87 13.67 ? N ASP A-4 34 1 
ATOM 5574 C CA A ASP A-4 1 34 . 41.065 20.102 -40.461 0.13 23.8 ? CA ASP A-4 34 1 
ATOM 5575 C CA B ASP A-4 1 34 . 41.217 20.556 -40.495 0.87 16.96 ? CA ASP A-4 34 1 
ATOM 5576 C C A ASP A-4 1 34 . 41.731 19.647 -41.76 0.13 25.77 ? C ASP A-4 34 1 
ATOM 5577 C C B ASP A-4 1 34 . 41.821 20.029 -41.795 0.87 21.25 ? C ASP A-4 34 1 
ATOM 5578 O O A ASP A-4 1 34 . 42.775 20.149 -42.133 0.13 24.05 ? O ASP A-4 34 1 
ATOM 5579 O O B ASP A-4 1 34 . 42.607 20.708 -42.295 0.87 25.41 ? O ASP A-4 34 1 
ATOM 5580 C CB A ASP A-4 1 34 . 40.399 21.464 -40.645 0.13 26.59 ? CB ASP A-4 34 1 
ATOM 5581 C CB B ASP A-4 1 34 . 40.631 22.028 -40.592 0.87 18.99 ? CB ASP A-4 34 1 
ATOM 5582 C CG A ASP A-4 1 34 . 39.186 21.403 -41.549 0.13 25.83 ? CG ASP A-4 34 1 
ATOM 5583 C CG B ASP A-4 1 34 . 39.549 22.16 -41.659 0.87 25.66 ? CG ASP A-4 34 1 
ATOM 5584 O OD1 A ASP A-4 1 34 . 39.361 21.187 -42.771 0.13 24.87 ? OD1 ASP A-4 34 1 
ATOM 5585 O OD1 B ASP A-4 1 34 . 39.693 23.088 -42.473 0.87 27.67 ? OD1 ASP A-4 34 1 
ATOM 5586 O OD2 A ASP A-4 1 34 . 38.057 21.581 -41.049 0.13 25.29 ? OD2 ASP A-4 34 1 
ATOM 5587 O OD2 B ASP A-4 1 34 . 38.644 21.32 -41.685 0.87 30.06 ? OD2 ASP A-4 34 1 
ATOM 5588 N N A LYS A-4 1 35 . 41.125 18.681 -42.443 0.13 31.19 ? N LYS A-4 35 1 
ATOM 5589 N N B LYS A-4 1 35 . 41.319 18.915 -42.329 0.87 23.84 ? N LYS A-4 35 1 
ATOM 5590 C CA A LYS A-4 1 35 . 41.67 18.197 -43.702 0.13 38.08 ? CA LYS A-4 35 1 
ATOM 5591 C CA B LYS A-4 1 35 . 41.853 18.29 -43.513 0.87 32.14 ? CA LYS A-4 35 1 
ATOM 5592 C C A LYS A-4 1 35 . 41.458 19.234 -44.81 0.13 35.69 ? C LYS A-4 35 1 
ATOM 5593 C C B LYS A-4 1 35 . 41.637 19.287 -44.726 0.87 32.28 ? C LYS A-4 35 1 
ATOM 5594 O O A LYS A-4 1 35 . 42.31 19.412 -45.674 0.13 33.54 ? O LYS A-4 35 1 
ATOM 5595 O O B LYS A-4 1 35 . 42.54 19.516 -45.465 0.87 32.37 ? O LYS A-4 35 1 
ATOM 5596 C CB A LYS A-4 1 35 . 41.018 16.869 -44.087 0.13 48.24 ? CB LYS A-4 35 1 
ATOM 5597 C CB B LYS A-4 1 35 . 41.14 16.981 -43.829 0.87 45.29 ? CB LYS A-4 35 1 
ATOM 5598 C CG A LYS A-4 1 35 . 41.826 15.64 -43.705 0.13 56.16 ? CG LYS A-4 35 1 
ATOM 5599 C CG B LYS A-4 1 35 . 41.831 15.734 -43.314 0.87 54.48 ? CG LYS A-4 35 1 
ATOM 5600 C CD A LYS A-4 1 35 . 40.981 14.602 -42.981 0.13 62.07 ? CD LYS A-4 35 1 
ATOM 5601 C CD B LYS A-4 1 35 . 40.814 14.635 -43.115 0.87 60.05 ? CD LYS A-4 35 1 
ATOM 5602 C CE A LYS A-4 1 35 . 39.623 14.421 -43.629 0.13 67.75 ? CE LYS A-4 35 1 
ATOM 5603 C CE B LYS A-4 1 35 . 39.888 15.04 -41.998 0.87 66.06 ? CE LYS A-4 35 1 
ATOM 5604 N NZ A LYS A-4 1 35 . 38.909 13.236 -43.081 0.13 72.93 ? NZ LYS A-4 35 1 
ATOM 5605 N NZ B LYS A-4 1 35 . 38.803 14.101 -41.852 0.87 71.33 ? NZ LYS A-4 35 1 
ATOM 5606 N N A ALA A-4 1 36 . 40.32 19.921 -44.761 0.13 38.02 ? N ALA A-4 36 1 
ATOM 5607 N N B ALA A-4 1 36 . 40.474 19.942 -44.796 0.87 35.81 ? N ALA A-4 36 1 
ATOM 5608 C CA A ALA A-4 1 36 . 39.961 20.916 -45.775 0.13 41.53 ? CA ALA A-4 36 1 
ATOM 5609 C CA B ALA A-4 1 36 . 40.171 20.823 -45.964 0.87 41.15 ? CA ALA A-4 36 1 
ATOM 5610 C C A ALA A-4 1 36 . 41.046 21.96 -45.961 0.13 38.04 ? C ALA A-4 36 1 
ATOM 5611 C C B ALA A-4 1 36 . 41.115 21.964 -46.01 0.87 37.73 ? C ALA A-4 36 1 
ATOM 5612 O O A ALA A-4 1 36 . 41.548 22.166 -47.063 0.13 36.07 ? O ALA A-4 36 1 
ATOM 5613 O O B ALA A-4 1 36 . 41.547 22.353 -47.109 0.87 36.23 ? O ALA A-4 36 1 
ATOM 5614 C CB A ALA A-4 1 36 . 38.642 21.6 -45.392 0.13 48.73 ? CB ALA A-4 36 1 
ATOM 5615 C CB B ALA A-4 1 36 . 38.706 21.335 -45.888 0.87 48.66 ? CB ALA A-4 36 1 
ATOM 5616 N N . THR A-4 1 37 . 41.383 22.618 -44.862 1 39.66 ? N THR A-4 37 1 
ATOM 5617 C CA . THR A-4 1 37 . 42.235 23.789 -44.863 1 34.01 ? CA THR A-4 37 1 
ATOM 5618 C C . THR A-4 1 37 . 43.581 23.796 -44.287 1 30.32 ? C THR A-4 37 1 
ATOM 5619 O O . THR A-4 1 37 . 44.26 24.811 -44.389 1 29.69 ? O THR A-4 37 1 
ATOM 5620 C CB . THR A-4 1 37 . 41.617 24.944 -44.082 1 33.29 ? CB THR A-4 37 1 
ATOM 5621 O OG1 . THR A-4 1 37 . 41.691 24.698 -42.659 1 28.71 ? OG1 THR A-4 37 1 
ATOM 5622 C CG2 . THR A-4 1 37 . 40.149 25.235 -44.563 1 37.3 ? CG2 THR A-4 37 1 
ATOM 5623 N N . GLY A-4 1 38 . 43.94 22.868 -43.397 1 27.54 ? N GLY A-4 38 1 
ATOM 5624 C CA . GLY A-4 1 38 . 45.24 23.064 -42.754 1 30.59 ? CA GLY A-4 38 1 
ATOM 5625 C C . GLY A-4 1 38 . 45.221 23.731 -41.37 1 24.91 ? C GLY A-4 38 1 
ATOM 5626 O O . GLY A-4 1 38 . 46.231 23.794 -40.637 1 28.51 ? O GLY A-4 38 1 
ATOM 5627 N N . LEU A-4 1 39 . 44.07 24.296 -40.993 1 18.54 ? N LEU A-4 39 1 
ATOM 5628 C CA . LEU A-4 1 39 . 43.986 25.067 -39.723 1 15.79 ? CA LEU A-4 39 1 
ATOM 5629 C C . LEU A-4 1 39 . 43.666 24.127 -38.568 1 12.44 ? C LEU A-4 39 1 
ATOM 5630 O O . LEU A-4 1 39 . 43.075 23.03 -38.797 1 15.33 ? O LEU A-4 39 1 
ATOM 5631 C CB . LEU A-4 1 39 . 42.916 26.071 -39.82 1 18.53 ? CB LEU A-4 39 1 
ATOM 5632 C CG . LEU A-4 1 39 . 43.194 27.233 -40.801 1 48.12 ? CG LEU A-4 39 1 
ATOM 5633 C CD1 . LEU A-4 1 39 . 41.89 28.003 -41.07 1 64.95 ? CD1 LEU A-4 39 1 
ATOM 5634 C CD2 . LEU A-4 1 39 . 44.252 28.12 -40.268 1 67.63 ? CD2 LEU A-4 39 1 
ATOM 5635 N N . LEU A-4 1 40 . 43.961 24.506 -37.359 1 10.69 ? N LEU A-4 40 1 
ATOM 5636 C CA . LEU A-4 1 40 . 43.486 23.788 -36.174 1 8.78 ? CA LEU A-4 40 1 
ATOM 5637 C C . LEU A-4 1 40 . 41.982 24.027 -36.003 1 7.17 ? C LEU A-4 40 1 
ATOM 5638 O O . LEU A-4 1 40 . 41.525 25.144 -36.107 1 6.72 ? O LEU A-4 40 1 
ATOM 5639 C CB . LEU A-4 1 40 . 44.253 24.242 -34.936 1 9.06 ? CB LEU A-4 40 1 
ATOM 5640 C CG . LEU A-4 1 40 . 44.234 23.282 -33.753 1 9.95 ? CG LEU A-4 40 1 
ATOM 5641 C CD1 . LEU A-4 1 40 . 45.108 22.034 -34.077 1 9.81 ? CD1 LEU A-4 40 1 
ATOM 5642 C CD2 . LEU A-4 1 40 . 44.656 23.959 -32.476 1 10.28 ? CD2 LEU A-4 40 1 
ATOM 5643 N N . LYS A-4 1 41 . 41.267 22.972 -35.637 1 7.49 ? N LYS A-4 41 1 
ATOM 5644 C CA . LYS A-4 1 41 . 39.832 23.038 -35.395 1 7.14 ? CA LYS A-4 41 1 
ATOM 5645 C C . LYS A-4 1 41 . 39.538 22.37 -34.052 1 6.45 ? C LYS A-4 41 1 
ATOM 5646 O O . LYS A-4 1 41 . 40.151 21.358 -33.675 1 8.05 ? O LYS A-4 41 1 
ATOM 5647 C CB . LYS A-4 1 41 . 39.082 22.391 -36.483 1 9.51 ? CB LYS A-4 41 1 
ATOM 5648 C CG . LYS A-4 1 41 . 37.59 22.468 -36.398 1 15.34 ? CG LYS A-4 41 1 
ATOM 5649 C CD . LYS A-4 1 41 . 36.974 21.987 -37.724 1 48.26 ? CD LYS A-4 41 1 
ATOM 5650 C CE . LYS A-4 1 41 . 35.436 21.893 -37.642 1 80.95 ? CE LYS A-4 41 1 
ATOM 5651 N NZ . LYS A-4 1 41 . 34.855 21.575 -38.971 1 108.74 ? NZ LYS A-4 41 1 
ATOM 5652 N N . LEU A-4 1 42 . 38.571 22.906 -33.306 1 6.14 ? N LEU A-4 42 1 
ATOM 5653 C CA . LEU A-4 1 42 . 38.038 22.225 -32.156 1 6.13 ? CA LEU A-4 42 1 
ATOM 5654 C C . LEU A-4 1 42 . 37.124 21.111 -32.634 1 6.32 ? C LEU A-4 42 1 
ATOM 5655 O O . LEU A-4 1 42 . 36.046 21.379 -33.171 1 8.31 ? O LEU A-4 42 1 
ATOM 5656 C CB . LEU A-4 1 42 . 37.264 23.212 -31.276 1 6.73 ? CB LEU A-4 42 1 
ATOM 5657 C CG . LEU A-4 1 42 . 36.716 22.628 -30.013 1 7.26 ? CG LEU A-4 42 1 
ATOM 5658 C CD1 . LEU A-4 1 42 . 37.841 22.316 -28.978 1 8.59 ? CD1 LEU A-4 42 1 
ATOM 5659 C CD2 . LEU A-4 1 42 . 35.678 23.565 -29.39 1 8.3 ? CD2 LEU A-4 42 1 
ATOM 5660 N N . ASP A-4 1 43 . 37.516 19.866 -32.456 0.91 5.74 ? N ASP A-4 43 1 
ATOM 5661 C CA . ASP A-4 1 43 . 36.622 18.727 -32.772 0.91 6.25 ? CA ASP A-4 43 1 
ATOM 5662 C C . ASP A-4 1 43 . 35.552 18.603 -31.714 0.91 7.16 ? C ASP A-4 43 1 
ATOM 5663 O O . ASP A-4 1 43 . 34.342 18.592 -32.019 0.91 9.66 ? O ASP A-4 43 1 
ATOM 5664 C CB . ASP A-4 1 43 . 37.44 17.434 -32.831 0.91 8.57 ? CB ASP A-4 43 1 
ATOM 5665 C CG . ASP A-4 1 43 . 36.596 16.154 -32.931 0.91 13.17 ? CG ASP A-4 43 1 
ATOM 5666 O OD1 . ASP A-4 1 43 . 35.704 16.22 -33.821 0.91 19.08 ? OD1 ASP A-4 43 1 
ATOM 5667 O OD2 . ASP A-4 1 43 . 36.896 15.111 -32.315 0.91 13.49 ? OD2 ASP A-4 43 1 
ATOM 5668 N N A ARG A-4 1 44 . 35.953 18.569 -30.42 0.88 7.5 ? N ARG A-4 44 1 
ATOM 5669 N N B ARG A-4 1 44 . 36.005 18.917 -30.518 0.12 10.17 ? N ARG A-4 44 1 
ATOM 5670 C CA A ARG A-4 1 44 . 34.927 18.711 -29.321 0.88 9.02 ? CA ARG A-4 44 1 
ATOM 5671 C CA B ARG A-4 1 44 . 35.35 18.517 -29.293 0.12 10.27 ? CA ARG A-4 44 1 
ATOM 5672 C C A ARG A-4 1 44 . 35.759 18.959 -28.072 0.88 6.96 ? C ARG A-4 44 1 
ATOM 5673 C C B ARG A-4 1 44 . 35.575 19.582 -28.162 0.12 8.97 ? C ARG A-4 44 1 
ATOM 5674 O O A ARG A-4 1 44 . 36.963 19.046 -28.067 0.88 7.94 ? O ARG A-4 44 1 
ATOM 5675 O O B ARG A-4 1 44 . 36.028 20.682 -28.418 0.12 11 ? O ARG A-4 44 1 
ATOM 5676 C CB A ARG A-4 1 44 . 34.061 17.452 -29.096 0.88 10.81 ? CB ARG A-4 44 1 
ATOM 5677 C CB B ARG A-4 1 44 . 36.099 17.282 -28.92 0.12 12.35 ? CB ARG A-4 44 1 
ATOM 5678 C CG A ARG A-4 1 44 . 35.135 16.372 -28.824 0.88 16.06 ? CG ARG A-4 44 1 
ATOM 5679 C CG B ARG A-4 1 44 . 35.357 15.951 -29.037 0.12 15.56 ? CG ARG A-4 44 1 
ATOM 5680 C CD A ARG A-4 1 44 . 34.574 15.1 -29.039 0.88 19.5 ? CD ARG A-4 44 1 
ATOM 5681 C CD B ARG A-4 1 44 . 35.045 15.534 -30.452 0.12 17.61 ? CD ARG A-4 44 1 
ATOM 5682 N NE A ARG A-4 1 44 . 35.232 13.994 -28.291 0.88 17.14 ? NE ARG A-4 44 1 
ATOM 5683 N NE B ARG A-4 1 44 . 33.621 15.263 -30.603 0.12 17.66 ? NE ARG A-4 44 1 
ATOM 5684 C CZ A ARG A-4 1 44 . 36.218 13.224 -28.73 0.88 12.3 ? CZ ARG A-4 44 1 
ATOM 5685 C CZ B ARG A-4 1 44 . 33.064 14.649 -31.643 0.12 14.5 ? CZ ARG A-4 44 1 
ATOM 5686 N NH1 A ARG A-4 1 44 . 36.934 13.534 -29.785 0.88 14.44 ? NH1 ARG A-4 44 1 
ATOM 5687 N NH1 B ARG A-4 1 44 . 33.799 14.228 -32.659 0.12 14.11 ? NH1 ARG A-4 44 1 
ATOM 5688 N NH2 A ARG A-4 1 44 . 36.571 12.249 -27.872 0.88 13.08 ? NH2 ARG A-4 44 1 
ATOM 5689 N NH2 B ARG A-4 1 44 . 31.759 14.455 -31.648 0.12 14.3 ? NH2 ARG A-4 44 1 
ATOM 5690 N N . VAL A-4 1 45 . 34.975 19.313 -27.018 1 7.95 ? N VAL A-4 45 1 
ATOM 5691 C CA . VAL A-4 1 45 . 35.474 19.399 -25.661 1 6.98 ? CA VAL A-4 45 1 
ATOM 5692 C C . VAL A-4 1 45 . 35.207 18.046 -24.987 1 5.99 ? C VAL A-4 45 1 
ATOM 5693 O O . VAL A-4 1 45 . 34.1 17.549 -25.061 1 6.51 ? O VAL A-4 45 1 
ATOM 5694 C CB . VAL A-4 1 45 . 34.793 20.54 -24.892 1 8.01 ? CB VAL A-4 45 1 
ATOM 5695 C CG1 . VAL A-4 1 45 . 35.26 20.625 -23.461 1 8.04 ? CG1 VAL A-4 45 1 
ATOM 5696 C CG2 . VAL A-4 1 45 . 35.052 21.895 -25.624 1 8.74 ? CG2 VAL A-4 45 1 
ATOM 5697 N N . LEU A-4 1 46 . 36.212 17.439 -24.337 1 5.69 ? N LEU A-4 46 1 
ATOM 5698 C CA . LEU A-4 1 46 . 35.944 16.17 -23.692 1 5.49 ? CA LEU A-4 46 1 
ATOM 5699 C C . LEU A-4 1 46 . 34.811 16.334 -22.696 1 5.41 ? C LEU A-4 46 1 
ATOM 5700 O O . LEU A-4 1 46 . 34.722 17.338 -21.968 1 5.8 ? O LEU A-4 46 1 
ATOM 5701 C CB . LEU A-4 1 46 . 37.155 15.58 -23.007 1 6.35 ? CB LEU A-4 46 1 
ATOM 5702 C CG . LEU A-4 1 46 . 38.36 15.296 -23.889 1 6.78 ? CG LEU A-4 46 1 
ATOM 5703 C CD1 . LEU A-4 1 46 . 39.465 14.642 -23.033 1 7.51 ? CD1 LEU A-4 46 1 
ATOM 5704 C CD2 . LEU A-4 1 46 . 38.018 14.395 -25.062 1 7.52 ? CD2 LEU A-4 46 1 
ATOM 5705 N N A TYR A-4 1 47 . 34.025 15.288 -22.542 0.58 5.39 ? N TYR A-4 47 1 
ATOM 5706 N N B TYR A-4 1 47 . 33.876 15.401 -22.649 0.42 6.2 ? N TYR A-4 47 1 
ATOM 5707 C CA A TYR A-4 1 47 . 32.802 15.38 -21.812 0.58 5.76 ? CA TYR A-4 47 1 
ATOM 5708 C CA B TYR A-4 1 47 . 32.685 15.484 -21.713 0.42 6.19 ? CA TYR A-4 47 1 
ATOM 5709 C C A TYR A-4 1 47 . 33.044 15.142 -20.35 0.58 5.11 ? C TYR A-4 47 1 
ATOM 5710 C C B TYR A-4 1 47 . 33.088 15.398 -20.216 0.42 5.23 ? C TYR A-4 47 1 
ATOM 5711 O O A TYR A-4 1 47 . 32.148 15.342 -19.532 0.58 5.35 ? O TYR A-4 47 1 
ATOM 5712 O O B TYR A-4 1 47 . 32.316 15.738 -19.34 0.42 5.77 ? O TYR A-4 47 1 
ATOM 5713 C CB A TYR A-4 1 47 . 31.731 14.38 -22.321 0.58 5.3 ? CB TYR A-4 47 1 
ATOM 5714 C CB B TYR A-4 1 47 . 31.677 14.316 -21.977 0.42 6.51 ? CB TYR A-4 47 1 
ATOM 5715 C CG A TYR A-4 1 47 . 31.022 14.715 -23.591 0.58 5.44 ? CG TYR A-4 47 1 
ATOM 5716 C CG B TYR A-4 1 47 . 30.748 14.529 -23.163 0.42 6.61 ? CG TYR A-4 47 1 
ATOM 5717 C CD1 A TYR A-4 1 47 . 29.723 14.274 -23.76 0.58 5.84 ? CD1 TYR A-4 47 1 
ATOM 5718 C CD1 B TYR A-4 1 47 . 29.447 14.219 -23.079 0.42 7.13 ? CD1 TYR A-4 47 1 
ATOM 5719 C CD2 A TYR A-4 1 47 . 31.625 15.464 -24.626 0.58 6.24 ? CD2 TYR A-4 47 1 
ATOM 5720 C CD2 B TYR A-4 1 47 . 31.167 15.209 -24.275 0.42 8.83 ? CD2 TYR A-4 47 1 
ATOM 5721 C CE1 A TYR A-4 1 47 . 29.021 14.569 -24.879 0.58 6.41 ? CE1 TYR A-4 47 1 
ATOM 5722 C CE1 B TYR A-4 1 47 . 28.539 14.487 -24.123 0.42 10.16 ? CE1 TYR A-4 47 1 
ATOM 5723 C CE2 A TYR A-4 1 47 . 30.921 15.718 -25.782 0.58 7.02 ? CE2 TYR A-4 47 1 
ATOM 5724 C CE2 B TYR A-4 1 47 . 30.256 15.481 -25.414 0.42 9.94 ? CE2 TYR A-4 47 1 
ATOM 5725 C CZ A TYR A-4 1 47 . 29.609 15.297 -25.882 0.58 7.68 ? CZ TYR A-4 47 1 
ATOM 5726 C CZ B TYR A-4 1 47 . 28.955 15.106 -25.279 0.42 9.86 ? CZ TYR A-4 47 1 
ATOM 5727 O OH A TYR A-4 1 47 . 28.848 15.561 -26.995 0.58 10.27 ? OH TYR A-4 47 1 
ATOM 5728 O OH B TYR A-4 1 47 . 28.02 15.357 -26.256 0.42 14.03 ? OH TYR A-4 47 1 
ATOM 5729 N N . SER A-4 1 48 . 34.248 14.786 -19.972 1 5.85 ? N SER A-4 48 1 
ATOM 5730 C CA . SER A-4 1 48 . 34.71 14.496 -18.615 1 5.71 ? CA SER A-4 48 1 
ATOM 5731 C C . SER A-4 1 48 . 35.912 15.377 -18.312 1 5.4 ? C SER A-4 48 1 
ATOM 5732 O O . SER A-4 1 48 . 36.616 15.797 -19.241 1 5.44 ? O SER A-4 48 1 
ATOM 5733 C CB . SER A-4 1 48 . 35.086 13.033 -18.524 1 6.22 ? CB SER A-4 48 1 
ATOM 5734 O OG . SER A-4 1 48 . 33.96 12.252 -18.825 1 6.9 ? OG SER A-4 48 1 
ATOM 5735 N N . PRO A-4 1 49 . 36.232 15.6 -17.024 1 5.28 ? N PRO A-4 49 1 
ATOM 5736 C CA . PRO A-4 1 49 . 37.367 16.462 -16.647 1 5.38 ? CA PRO A-4 49 1 
ATOM 5737 C C . PRO A-4 1 49 . 38.661 15.666 -16.665 1 4.94 ? C PRO A-4 49 1 
ATOM 5738 O O . PRO A-4 1 49 . 39.289 15.355 -15.656 1 5.7 ? O PRO A-4 49 1 
ATOM 5739 C CB . PRO A-4 1 49 . 36.989 16.928 -15.249 1 5.93 ? CB PRO A-4 49 1 
ATOM 5740 C CG . PRO A-4 1 49 . 36.205 15.774 -14.695 1 6.3 ? CG PRO A-4 49 1 
ATOM 5741 C CD . PRO A-4 1 49 . 35.444 15.21 -15.849 1 6.46 ? CD PRO A-4 49 1 
ATOM 5742 N N . PHE A-4 1 50 . 39.018 15.263 -17.886 1 5.13 ? N PHE A-4 50 1 
ATOM 5743 C CA . PHE A-4 1 50 . 40.187 14.511 -18.209 1 5.13 ? CA PHE A-4 50 1 
ATOM 5744 C C . PHE A-4 1 50 . 41.059 15.353 -19.135 1 5.39 ? C PHE A-4 50 1 
ATOM 5745 O O . PHE A-4 1 50 . 40.536 16.236 -19.84 0.89 5.68 ? O PHE A-4 50 1 
ATOM 5746 C CB . PHE A-4 1 50 . 39.828 13.184 -18.896 1 5.97 ? CB PHE A-4 50 1 
ATOM 5747 C CG . PHE A-4 1 50 . 38.846 12.269 -18.16 1 5.75 ? CG PHE A-4 50 1 
ATOM 5748 C CD1 . PHE A-4 1 50 . 38.329 11.217 -18.867 1 6.42 ? CD1 PHE A-4 50 1 
ATOM 5749 C CD2 . PHE A-4 1 50 . 38.502 12.404 -16.828 1 5.44 ? CD2 PHE A-4 50 1 
ATOM 5750 C CE1 . PHE A-4 1 50 . 37.473 10.31 -18.248 1 6.95 ? CE1 PHE A-4 50 1 
ATOM 5751 C CE2 . PHE A-4 1 50 . 37.622 11.511 -16.223 0.94 5.48 ? CE2 PHE A-4 50 1 
ATOM 5752 C CZ . PHE A-4 1 50 . 37.108 10.44 -16.954 1 6.74 ? CZ PHE A-4 50 1 
ATOM 5753 N N . PHE A-4 1 51 . 42.354 15.089 -19.144 1 5.53 ? N PHE A-4 51 1 
ATOM 5754 C CA . PHE A-4 1 51 . 43.246 15.801 -19.989 1 5.8 ? CA PHE A-4 51 1 
ATOM 5755 C C . PHE A-4 1 51 . 44.141 14.853 -20.761 1 4.96 ? C PHE A-4 51 1 
ATOM 5756 O O . PHE A-4 1 51 . 44.486 13.782 -20.305 1 5.55 ? O PHE A-4 51 1 
ATOM 5757 C CB . PHE A-4 1 51 . 44.115 16.844 -19.232 1 7.14 ? CB PHE A-4 51 1 
ATOM 5758 C CG . PHE A-4 1 51 . 45.062 16.23 -18.166 1 7.22 ? CG PHE A-4 51 1 
ATOM 5759 C CD1 . PHE A-4 1 51 . 46.305 15.77 -18.537 1 7.41 ? CD1 PHE A-4 51 1 
ATOM 5760 C CD2 . PHE A-4 1 51 . 44.683 16.075 -16.839 1 9.04 ? CD2 PHE A-4 51 1 
ATOM 5761 C CE1 . PHE A-4 1 51 . 47.199 15.253 -17.595 1 8.62 ? CE1 PHE A-4 51 1 
ATOM 5762 C CE2 . PHE A-4 1 51 . 45.561 15.547 -15.905 1 9.33 ? CE2 PHE A-4 51 1 
ATOM 5763 C CZ . PHE A-4 1 51 . 46.808 15.15 -16.298 1 9.81 ? CZ PHE A-4 51 1 
ATOM 5764 N N . TYR A-4 1 52 . 44.526 15.273 -21.97 1 5.42 ? N TYR A-4 52 1 
ATOM 5765 C CA . TYR A-4 1 52 . 45.417 14.436 -22.753 1 5.74 ? CA TYR A-4 52 1 
ATOM 5766 C C . TYR A-4 1 52 . 46.714 14.235 -22.003 1 5.22 ? C TYR A-4 52 1 
ATOM 5767 O O . TYR A-4 1 52 . 47.369 15.22 -21.623 1 5.96 ? O TYR A-4 52 1 
ATOM 5768 C CB . TYR A-4 1 52 . 45.65 15.01 -24.161 1 5.87 ? CB TYR A-4 52 1 
ATOM 5769 C CG . TYR A-4 1 52 . 44.545 14.615 -25.091 1 5.84 ? CG TYR A-4 52 1 
ATOM 5770 C CD1 . TYR A-4 1 52 . 43.325 15.252 -25.093 1 6.03 ? CD1 TYR A-4 52 1 
ATOM 5771 C CD2 . TYR A-4 1 52 . 44.704 13.519 -25.963 1 7.15 ? CD2 TYR A-4 52 1 
ATOM 5772 C CE1 . TYR A-4 1 52 . 42.258 14.759 -25.865 1 7.03 ? CE1 TYR A-4 52 1 
ATOM 5773 C CE2 . TYR A-4 1 52 . 43.683 13.04 -26.73 1 7.62 ? CE2 TYR A-4 52 1 
ATOM 5774 C CZ . TYR A-4 1 52 . 42.474 13.65 -26.664 1 7.93 ? CZ TYR A-4 52 1 
ATOM 5775 O OH . TYR A-4 1 52 . 41.373 13.192 -27.391 1 9.99 ? OH TYR A-4 52 1 
ATOM 5776 N N . PRO A-4 1 53 . 47.168 12.994 -21.836 1 5.53 ? N PRO A-4 53 1 
ATOM 5777 C CA . PRO A-4 1 53 . 48.345 12.735 -20.984 1 5.57 ? CA PRO A-4 53 1 
ATOM 5778 C C . PRO A-4 1 53 . 49.667 12.89 -21.725 1 5.35 ? C PRO A-4 53 1 
ATOM 5779 O O . PRO A-4 1 53 . 50.736 12.713 -21.092 1 6.68 ? O PRO A-4 53 1 
ATOM 5780 C CB . PRO A-4 1 53 . 48.125 11.308 -20.504 1 6.23 ? CB PRO A-4 53 1 
ATOM 5781 C CG . PRO A-4 1 53 . 47.328 10.665 -21.624 1 6.11 ? CG PRO A-4 53 1 
ATOM 5782 C CD . PRO A-4 1 53 . 46.379 11.748 -22.071 1 6.01 ? CD PRO A-4 53 1 
ATOM 5783 N N . VAL A-4 1 54 . 49.61 13.119 -23.008 1 5.39 ? N VAL A-4 54 1 
ATOM 5784 C CA . VAL A-4 1 54 . 50.696 13.17 -23.975 1 5.44 ? CA VAL A-4 54 1 
ATOM 5785 C C . VAL A-4 1 54 . 50.435 14.315 -24.91 1 5.39 ? C VAL A-4 54 1 
ATOM 5786 O O . VAL A-4 1 54 . 49.282 14.757 -25.042 1 6.44 ? O VAL A-4 54 1 
ATOM 5787 C CB . VAL A-4 1 54 . 50.735 11.834 -24.781 1 6.82 ? CB VAL A-4 54 1 
ATOM 5788 C CG1 . VAL A-4 1 54 . 51.183 10.688 -23.877 1 9.09 ? CG1 VAL A-4 54 1 
ATOM 5789 C CG2 . VAL A-4 1 54 . 49.408 11.563 -25.46 1 8.42 ? CG2 VAL A-4 54 1 
ATOM 5790 N N . ASP A-4 1 55 . 51.46 14.796 -25.601 1 5.29 ? N ASP A-4 55 1 
ATOM 5791 C CA A ASP A-4 1 55 . 51.27 15.666 -26.751 0.78 4.96 ? CA ASP A-4 55 1 
ATOM 5792 C CA B ASP A-4 1 55 . 51.231 15.668 -26.71 0.22 6.41 ? CA ASP A-4 55 1 
ATOM 5793 C C . ASP A-4 1 55 . 50.739 14.771 -27.868 1 5.12 ? C ASP A-4 55 1 
ATOM 5794 O O . ASP A-4 1 55 . 51.337 13.719 -28.176 1 8.66 ? O ASP A-4 55 1 
ATOM 5795 C CB A ASP A-4 1 55 . 52.548 16.37 -27.152 0.78 5.2 ? CB ASP A-4 55 1 
ATOM 5796 C CB B ASP A-4 1 55 . 52.509 16.44 -26.971 0.22 9.13 ? CB ASP A-4 55 1 
ATOM 5797 C CG A ASP A-4 1 55 . 52.908 17.567 -26.253 0.78 4.81 ? CG ASP A-4 55 1 
ATOM 5798 C CG B ASP A-4 1 55 . 52.827 17.389 -25.845 0.22 11.3 ? CG ASP A-4 55 1 
ATOM 5799 O OD1 A ASP A-4 1 55 . 52.466 17.584 -25.049 0.78 5.48 ? OD1 ASP A-4 55 1 
ATOM 5800 O OD1 B ASP A-4 1 55 . 52.36 18.521 -25.874 0.22 10.07 ? OD1 ASP A-4 55 1 
ATOM 5801 O OD2 A ASP A-4 1 55 . 53.674 18.395 -26.732 0.78 7 ? OD2 ASP A-4 55 1 
ATOM 5802 O OD2 B ASP A-4 1 55 . 53.492 16.992 -24.884 0.22 12.83 ? OD2 ASP A-4 55 1 
ATOM 5803 N N . TYR A-4 1 56 . 49.64 15.118 -28.454 1 4.78 ? N TYR A-4 56 1 
ATOM 5804 C CA . TYR A-4 1 56 . 48.848 14.212 -29.28 1 4.68 ? CA TYR A-4 56 1 
ATOM 5805 C C . TYR A-4 1 56 . 48.694 14.789 -30.67 1 4.31 ? C TYR A-4 56 1 
ATOM 5806 O O . TYR A-4 1 56 . 48.345 15.968 -30.821 1 4.97 ? O TYR A-4 56 1 
ATOM 5807 C CB . TYR A-4 1 56 . 47.482 14 -28.611 1 4.94 ? CB TYR A-4 56 1 
ATOM 5808 C CG . TYR A-4 1 56 . 46.618 12.995 -29.251 1 4.86 ? CG TYR A-4 56 1 
ATOM 5809 C CD1 . TYR A-4 1 56 . 46.609 11.672 -28.837 1 5.72 ? CD1 TYR A-4 56 1 
ATOM 5810 C CD2 . TYR A-4 1 56 . 45.786 13.312 -30.333 1 5.33 ? CD2 TYR A-4 56 1 
ATOM 5811 C CE1 . TYR A-4 1 56 . 45.819 10.71 -29.488 1 6.02 ? CE1 TYR A-4 56 1 
ATOM 5812 C CE2 . TYR A-4 1 56 . 44.996 12.382 -30.972 1 5.41 ? CE2 TYR A-4 56 1 
ATOM 5813 C CZ . TYR A-4 1 56 . 45.037 11.054 -30.55 1 5.07 ? CZ TYR A-4 56 1 
ATOM 5814 O OH . TYR A-4 1 56 . 44.311 10.083 -31.176 1 5.73 ? OH TYR A-4 56 1 
ATOM 5815 N N . GLY A-4 1 57 . 48.914 13.986 -31.708 1 4.69 ? N GLY A-4 57 1 
ATOM 5816 C CA . GLY A-4 1 57 . 48.726 14.51 -33.058 1 5.09 ? CA GLY A-4 57 1 
ATOM 5817 C C . GLY A-4 1 57 . 48.77 13.425 -34.099 1 4.53 ? C GLY A-4 57 1 
ATOM 5818 O O . GLY A-4 1 57 . 48.232 12.328 -33.888 1 4.87 ? O GLY A-4 57 1 
ATOM 5819 N N . ILE A-4 1 58 . 49.377 13.746 -35.227 1 4.98 ? N ILE A-4 58 1 
ATOM 5820 C CA . ILE A-4 1 58 . 49.384 12.895 -36.418 1 5.03 ? CA ILE A-4 58 1 
ATOM 5821 C C . ILE A-4 1 58 . 50.775 12.75 -36.96 1 5.26 ? C ILE A-4 58 1 
ATOM 5822 O O . ILE A-4 1 58 . 51.666 13.596 -36.765 1 5.72 ? O ILE A-4 58 1 
ATOM 5823 C CB . ILE A-4 1 58 . 48.465 13.45 -37.526 1 5.51 ? CB ILE A-4 58 1 
ATOM 5824 C CG1 . ILE A-4 1 58 . 48.923 14.775 -38.097 1 7.51 ? CG1 ILE A-4 58 1 
ATOM 5825 C CG2 . ILE A-4 1 58 . 47.044 13.498 -37.014 1 6.69 ? CG2 ILE A-4 58 1 
ATOM 5826 C CD1 . ILE A-4 1 58 . 48.173 15.202 -39.331 1 10.43 ? CD1 ILE A-4 58 1 
ATOM 5827 N N . ILE A-4 1 59 . 50.955 11.689 -37.749 1 5.62 ? N ILE A-4 59 1 
ATOM 5828 C CA . ILE A-4 1 59 . 52.104 11.566 -38.643 1 5.55 ? CA ILE A-4 59 1 
ATOM 5829 C C . ILE A-4 1 59 . 51.65 12.09 -39.991 1 5.5 ? C ILE A-4 59 1 
ATOM 5830 O O . ILE A-4 1 59 . 50.628 11.635 -40.535 1 6.11 ? O ILE A-4 59 1 
ATOM 5831 C CB . ILE A-4 1 59 . 52.634 10.149 -38.717 1 5.91 ? CB ILE A-4 59 1 
ATOM 5832 C CG1 . ILE A-4 1 59 . 53.049 9.653 -37.313 1 6.79 ? CG1 ILE A-4 59 1 
ATOM 5833 C CG2 . ILE A-4 1 59 . 53.802 10.096 -39.72 1 6.66 ? CG2 ILE A-4 59 1 
ATOM 5834 C CD1 . ILE A-4 1 59 . 53.48 8.221 -37.274 1 7.69 ? CD1 ILE A-4 59 1 
ATOM 5835 N N . PRO A-4 1 60 . 52.347 13.064 -40.589 1 6.35 ? N PRO A-4 60 1 
ATOM 5836 C CA . PRO A-4 1 60 . 51.905 13.561 -41.91 1 7.24 ? CA PRO A-4 60 1 
ATOM 5837 C C . PRO A-4 1 60 . 51.957 12.462 -42.965 1 6.6 ? C PRO A-4 60 1 
ATOM 5838 O O . PRO A-4 1 60 . 52.71 11.5 -42.867 1 6.97 ? O PRO A-4 60 1 
ATOM 5839 C CB . PRO A-4 1 60 . 52.935 14.676 -42.243 1 9.61 ? CB PRO A-4 60 1 
ATOM 5840 C CG . PRO A-4 1 60 . 53.524 15.05 -40.885 1 10.49 ? CG PRO A-4 60 1 
ATOM 5841 C CD . PRO A-4 1 60 . 53.537 13.779 -40.108 1 7.12 ? CD PRO A-4 60 1 
ATOM 5842 N N . GLN A-4 1 61 . 51.126 12.642 -44.009 1 6.87 ? N GLN A-4 61 1 
ATOM 5843 C CA A GLN A-4 1 61 . 51.114 11.692 -45.143 0.64 7.58 ? CA GLN A-4 61 1 
ATOM 5844 C CA B GLN A-4 1 61 . 51.199 11.722 -45.146 0.36 7.2 ? CA GLN A-4 61 1 
ATOM 5845 C C . GLN A-4 1 61 . 50.922 10.278 -44.674 1 7 ? C GLN A-4 61 1 
ATOM 5846 O O . GLN A-4 1 61 . 51.509 9.325 -45.175 1 7.54 ? O GLN A-4 61 1 
ATOM 5847 C CB A GLN A-4 1 61 . 52.298 11.878 -46.079 0.64 7.99 ? CB GLN A-4 61 1 
ATOM 5848 C CB B GLN A-4 1 61 . 52.51 11.868 -45.955 0.36 8.22 ? CB GLN A-4 61 1 
ATOM 5849 C CG A GLN A-4 1 61 . 52.25 13.245 -46.783 0.64 9.71 ? CG GLN A-4 61 1 
ATOM 5850 C CG B GLN A-4 1 61 . 52.473 13.12 -46.817 0.36 7.81 ? CG GLN A-4 61 1 
ATOM 5851 C CD A GLN A-4 1 61 . 53.281 13.321 -47.853 0.64 11.76 ? CD GLN A-4 61 1 
ATOM 5852 C CD B GLN A-4 1 61 . 53.599 13.176 -47.798 0.36 10.2 ? CD GLN A-4 61 1 
ATOM 5853 O OE1 A GLN A-4 1 61 . 53.309 12.462 -48.752 0.64 14.59 ? OE1 GLN A-4 61 1 
ATOM 5854 O OE1 B GLN A-4 1 61 . 54.26 12.178 -48.018 0.36 11 ? OE1 GLN A-4 61 1 
ATOM 5855 N NE2 A GLN A-4 1 61 . 54.241 14.23 -47.742 0.64 13.79 ? NE2 GLN A-4 61 1 
ATOM 5856 N NE2 B GLN A-4 1 61 . 53.846 14.318 -48.377 0.36 10.17 ? NE2 GLN A-4 61 1 
ATOM 5857 N N . THR A-4 1 62 . 49.991 10.121 -43.731 1 6.69 ? N THR A-4 62 1 
ATOM 5858 C CA . THR A-4 1 62 . 49.479 8.83 -43.305 1 6.47 ? CA THR A-4 62 1 
ATOM 5859 C C . THR A-4 1 62 . 47.959 8.878 -43.369 1 6.75 ? C THR A-4 62 1 
ATOM 5860 O O . THR A-4 1 62 . 47.326 9.922 -43.382 1 7.05 ? O THR A-4 62 1 
ATOM 5861 C CB . THR A-4 1 62 . 49.93 8.434 -41.892 1 6.69 ? CB THR A-4 62 1 
ATOM 5862 O OG1 . THR A-4 1 62 . 49.339 9.287 -40.925 1 6.43 ? OG1 THR A-4 62 1 
ATOM 5863 C CG2 . THR A-4 1 62 . 51.419 8.344 -41.784 1 7.11 ? CG2 THR A-4 62 1 
ATOM 5864 N N . TRP A-4 1 63 . 47.373 7.661 -43.35 1 7.15 ? N TRP A-4 63 1 
ATOM 5865 C CA . TRP A-4 1 63 . 45.929 7.49 -43.262 1 6.75 ? CA TRP A-4 63 1 
ATOM 5866 C C . TRP A-4 1 63 . 45.66 6.266 -42.441 1 6.5 ? C TRP A-4 63 1 
ATOM 5867 O O . TRP A-4 1 63 . 46.544 5.463 -42.199 1 7.85 ? O TRP A-4 63 1 
ATOM 5868 C CB . TRP A-4 1 63 . 45.306 7.428 -44.661 1 8.04 ? CB TRP A-4 63 1 
ATOM 5869 C CG . TRP A-4 1 63 . 43.85 7.684 -44.716 1 8.78 ? CG TRP A-4 63 1 
ATOM 5870 C CD1 . TRP A-4 1 63 . 42.83 6.804 -45.036 1 10.6 ? CD1 TRP A-4 63 1 
ATOM 5871 C CD2 . TRP A-4 1 63 . 43.21 8.947 -44.473 1 9.48 ? CD2 TRP A-4 63 1 
ATOM 5872 N NE1 . TRP A-4 1 63 . 41.617 7.457 -44.966 1 11.67 ? NE1 TRP A-4 63 1 
ATOM 5873 C CE2 . TRP A-4 1 63 . 41.825 8.77 -44.666 1 10.29 ? CE2 TRP A-4 63 1 
ATOM 5874 C CE3 . TRP A-4 1 63 . 43.689 10.204 -44.124 1 10.16 ? CE3 TRP A-4 63 1 
ATOM 5875 C CZ2 . TRP A-4 1 63 . 40.924 9.827 -44.556 1 12.8 ? CZ2 TRP A-4 63 1 
ATOM 5876 C CZ3 . TRP A-4 1 63 . 42.825 11.231 -44.037 1 11.15 ? CZ3 TRP A-4 63 1 
ATOM 5877 C CH2 . TRP A-4 1 63 . 41.416 11.05 -44.27 1 12.69 ? CH2 TRP A-4 63 1 
ATOM 5878 N N . TYR A-4 1 64 . 44.44 6.108 -41.993 1 6.79 ? N TYR A-4 64 1 
ATOM 5879 C CA . TYR A-4 1 64 . 44.147 5.029 -41.039 1 7.2 ? CA TYR A-4 64 1 
ATOM 5880 C C . TYR A-4 1 64 . 42.68 4.664 -41.085 1 6.84 ? C TYR A-4 64 1 
ATOM 5881 O O . TYR A-4 1 64 . 41.851 5.334 -41.726 1 7.99 ? O TYR A-4 64 1 
ATOM 5882 C CB . TYR A-4 1 64 . 44.6 5.414 -39.618 1 6.65 ? CB TYR A-4 64 1 
ATOM 5883 C CG . TYR A-4 1 64 . 45.037 4.211 -38.848 1 6.51 ? CG TYR A-4 64 1 
ATOM 5884 C CD1 . TYR A-4 1 64 . 46.166 3.502 -39.223 1 7.3 ? CD1 TYR A-4 64 1 
ATOM 5885 C CD2 . TYR A-4 1 64 . 44.333 3.715 -37.745 1 6.84 ? CD2 TYR A-4 64 1 
ATOM 5886 C CE1 . TYR A-4 1 64 . 46.596 2.381 -38.544 1 7.15 ? CE1 TYR A-4 64 1 
ATOM 5887 C CE2 . TYR A-4 1 64 . 44.715 2.59 -37.109 1 6.98 ? CE2 TYR A-4 64 1 
ATOM 5888 C CZ . TYR A-4 1 64 . 45.881 1.945 -37.461 1 7.13 ? CZ TYR A-4 64 1 
ATOM 5889 O OH . TYR A-4 1 64 . 46.284 0.85 -36.732 1 7.61 ? OH TYR A-4 64 1 
ATOM 5890 N N . ASP A-4 1 65 . 42.343 3.602 -40.375 1 7.16 ? N ASP A-4 65 1 
ATOM 5891 C CA . ASP A-4 1 65 . 41.032 2.959 -40.479 1 7.38 ? CA ASP A-4 65 1 
ATOM 5892 C C . ASP A-4 1 65 . 39.893 3.819 -40 1 7.67 ? C ASP A-4 65 1 
ATOM 5893 O O . ASP A-4 1 65 . 38.751 3.546 -40.361 1 9.41 ? O ASP A-4 65 1 
ATOM 5894 C CB . ASP A-4 1 65 . 41.005 1.665 -39.667 1 8.1 ? CB ASP A-4 65 1 
ATOM 5895 C CG . ASP A-4 1 65 . 42.057 0.672 -40.128 1 9.92 ? CG ASP A-4 65 1 
ATOM 5896 O OD1 . ASP A-4 1 65 . 43.243 0.963 -40.086 1 11.41 ? OD1 ASP A-4 65 1 
ATOM 5897 O OD2 . ASP A-4 1 65 . 41.685 -0.427 -40.509 1 18.8 ? OD2 ASP A-4 65 1 
ATOM 5898 N N . ASP A-4 1 66 . 40.161 4.813 -39.143 1 7.9 ? N ASP A-4 66 1 
ATOM 5899 C CA . ASP A-4 1 66 . 39.131 5.731 -38.685 1 7.53 ? CA ASP A-4 66 1 
ATOM 5900 C C . ASP A-4 1 66 . 38.947 6.906 -39.61 1 8.33 ? C ASP A-4 66 1 
ATOM 5901 O O . ASP A-4 1 66 . 38.22 7.856 -39.26 1 9.85 ? O ASP A-4 66 1 
ATOM 5902 C CB . ASP A-4 1 66 . 39.382 6.178 -37.252 1 7.95 ? CB ASP A-4 66 1 
ATOM 5903 C CG . ASP A-4 1 66 . 40.658 6.998 -37.073 1 6.05 ? CG ASP A-4 66 1 
ATOM 5904 O OD1 . ASP A-4 1 66 . 41.528 6.941 -37.953 1 7.24 ? OD1 ASP A-4 66 1 
ATOM 5905 O OD2 . ASP A-4 1 66 . 40.754 7.655 -35.991 1 5.76 ? OD2 ASP A-4 66 1 
ATOM 5906 N N . GLY A-4 1 67 . 39.491 6.851 -40.815 1 8.42 ? N GLY A-4 67 1 
ATOM 5907 C CA . GLY A-4 1 67 . 39.209 7.912 -41.762 1 9.79 ? CA GLY A-4 67 1 
ATOM 5908 C C . GLY A-4 1 67 . 39.898 9.213 -41.448 1 8.76 ? C GLY A-4 67 1 
ATOM 5909 O O . GLY A-4 1 67 . 39.312 10.297 -41.605 1 10.3 ? O GLY A-4 67 1 
ATOM 5910 N N . ASP A-4 1 68 . 41.135 9.128 -40.978 1 7.79 ? N ASP A-4 68 1 
ATOM 5911 C CA . ASP A-4 1 68 . 41.919 10.299 -40.624 1 7.88 ? CA ASP A-4 68 1 
ATOM 5912 C C . ASP A-4 1 68 . 43.38 9.841 -40.562 1 6.69 ? C ASP A-4 68 1 
ATOM 5913 O O . ASP A-4 1 68 . 43.674 8.65 -40.614 1 7.12 ? O ASP A-4 68 1 
ATOM 5914 C CB . ASP A-4 1 68 . 41.413 10.951 -39.32 1 8.23 ? CB ASP A-4 68 1 
ATOM 5915 C CG . ASP A-4 1 68 . 40.598 12.216 -39.579 1 9.4 ? CG ASP A-4 68 1 
ATOM 5916 O OD1 . ASP A-4 1 68 . 40.903 12.997 -40.496 1 10.77 ? OD1 ASP A-4 68 1 
ATOM 5917 O OD2 . ASP A-4 1 68 . 39.637 12.42 -38.775 1 11.24 ? OD2 ASP A-4 68 1 
ATOM 5918 N N . PRO A-4 1 69 . 44.311 10.805 -40.413 1 6.47 ? N PRO A-4 69 1 
ATOM 5919 C CA . PRO A-4 1 69 . 45.712 10.439 -40.323 1 6.24 ? CA PRO A-4 69 1 
ATOM 5920 C C . PRO A-4 1 69 . 45.993 9.553 -39.117 1 5.4 ? C PRO A-4 69 1 
ATOM 5921 O O . PRO A-4 1 69 . 45.291 9.597 -38.09 1 5.71 ? O PRO A-4 69 1 
ATOM 5922 C CB . PRO A-4 1 69 . 46.407 11.779 -40.233 1 7.11 ? CB PRO A-4 69 1 
ATOM 5923 C CG . PRO A-4 1 69 . 45.457 12.758 -40.888 1 8.02 ? CG PRO A-4 69 1 
ATOM 5924 C CD . PRO A-4 1 69 . 44.104 12.266 -40.465 1 7.55 ? CD PRO A-4 69 1 
ATOM 5925 N N . PHE A-4 1 70 . 47.07 8.811 -39.183 1 5.78 ? N PHE A-4 70 1 
ATOM 5926 C CA . PHE A-4 1 70 . 47.508 7.913 -38.105 1 5.49 ? CA PHE A-4 70 1 
ATOM 5927 C C . PHE A-4 1 70 . 47.96 8.744 -36.915 1 5.09 ? C PHE A-4 70 1 
ATOM 5928 O O . PHE A-4 1 70 . 48.693 9.726 -37.023 1 5.57 ? O PHE A-4 70 1 
ATOM 5929 C CB . PHE A-4 1 70 . 48.615 7.038 -38.683 1 6.16 ? CB PHE A-4 70 1 
ATOM 5930 C CG . PHE A-4 1 70 . 49.122 5.928 -37.797 1 5.66 ? CG PHE A-4 70 1 
ATOM 5931 C CD1 . PHE A-4 1 70 . 50.474 5.59 -37.82 1 6.83 ? CD1 PHE A-4 70 1 
ATOM 5932 C CD2 . PHE A-4 1 70 . 48.289 5.103 -37.057 1 6.46 ? CD2 PHE A-4 70 1 
ATOM 5933 C CE1 . PHE A-4 1 70 . 50.947 4.508 -37.109 1 7.3 ? CE1 PHE A-4 70 1 
ATOM 5934 C CE2 . PHE A-4 1 70 . 48.773 4.061 -36.313 1 6.67 ? CE2 PHE A-4 70 1 
ATOM 5935 C CZ . PHE A-4 1 70 . 50.102 3.747 -36.336 1 6.7 ? CZ PHE A-4 70 1 
ATOM 5936 N N . ASP A-4 1 71 . 47.518 8.298 -35.737 1 4.86 ? N ASP A-4 71 1 
ATOM 5937 C CA . ASP A-4 1 71 . 47.698 9.014 -34.498 0.93 4.19 ? CA ASP A-4 71 1 
ATOM 5938 C C . ASP A-4 1 71 . 49.043 8.698 -33.824 1 4.9 ? C ASP A-4 71 1 
ATOM 5939 O O . ASP A-4 1 71 . 49.483 7.551 -33.785 1 5.03 ? O ASP A-4 71 1 
ATOM 5940 C CB . ASP A-4 1 71 . 46.567 8.677 -33.518 1 5.03 ? CB ASP A-4 71 1 
ATOM 5941 C CG . ASP A-4 1 71 . 45.214 9.073 -34.033 1 4.56 ? CG ASP A-4 71 1 
ATOM 5942 O OD1 . ASP A-4 1 71 . 44.215 8.317 -33.79 1 4.86 ? OD1 ASP A-4 71 1 
ATOM 5943 O OD2 . ASP A-4 1 71 . 45.125 10.143 -34.666 1 4.97 ? OD2 ASP A-4 71 1 
ATOM 5944 N N . ILE A-4 1 72 . 49.64 9.746 -33.262 1 4.9 ? N ILE A-4 72 1 
ATOM 5945 C CA . ILE A-4 1 72 . 50.888 9.632 -32.522 1 4.73 ? CA ILE A-4 72 1 
ATOM 5946 C C . ILE A-4 1 72 . 50.805 10.421 -31.248 1 4.8 ? C ILE A-4 72 1 
ATOM 5947 O O . ILE A-4 1 72 . 50.231 11.518 -31.183 1 5.94 ? O ILE A-4 72 1 
ATOM 5948 C CB . ILE A-4 1 72 . 52.081 10.039 -33.418 1 5.17 ? CB ILE A-4 72 1 
ATOM 5949 C CG1 . ILE A-4 1 72 . 53.425 9.827 -32.691 1 5.54 ? CG1 ILE A-4 72 1 
ATOM 5950 C CG2 . ILE A-4 1 72 . 51.955 11.439 -33.954 1 5.7 ? CG2 ILE A-4 72 1 
ATOM 5951 C CD1 . ILE A-4 1 72 . 54.622 9.739 -33.648 1 6.31 ? CD1 ILE A-4 72 1 
ATOM 5952 N N . MET A-4 1 73 . 51.421 9.867 -30.233 1 4.76 ? N MET A-4 73 1 
ATOM 5953 C CA . MET A-4 1 73 . 51.503 10.384 -28.864 1 4.99 ? CA MET A-4 73 1 
ATOM 5954 C C . MET A-4 1 73 . 52.963 10.597 -28.539 1 5.58 ? C MET A-4 73 1 
ATOM 5955 O O . MET A-4 1 73 . 53.73 9.63 -28.57 1 7 ? O MET A-4 73 1 
ATOM 5956 C CB . MET A-4 1 73 . 50.898 9.349 -27.906 1 5.68 ? CB MET A-4 73 1 
ATOM 5957 C CG . MET A-4 1 73 . 49.476 8.931 -28.278 1 6.07 ? CG MET A-4 73 1 
ATOM 5958 S SD . MET A-4 1 73 . 48.67 7.847 -27.082 1 7.52 ? SD MET A-4 73 1 
ATOM 5959 C CE . MET A-4 1 73 . 49.708 6.37 -27.215 1 8.16 ? CE MET A-4 73 1 
ATOM 5960 N N . VAL A-4 1 74 . 53.365 11.835 -28.268 1 5.26 ? N VAL A-4 74 1 
ATOM 5961 C CA . VAL A-4 1 74 . 54.739 12.188 -27.974 1 5.11 ? CA VAL A-4 74 1 
ATOM 5962 C C . VAL A-4 1 74 . 54.831 12.596 -26.507 1 5.59 ? C VAL A-4 74 1 
ATOM 5963 O O . VAL A-4 1 74 . 54.077 13.436 -26.026 1 6.29 ? O VAL A-4 74 1 
ATOM 5964 C CB . VAL A-4 1 74 . 55.276 13.266 -28.874 1 5.78 ? CB VAL A-4 74 1 
ATOM 5965 C CG1 . VAL A-4 1 74 . 56.752 13.502 -28.556 1 6.92 ? CG1 VAL A-4 74 1 
ATOM 5966 C CG2 . VAL A-4 1 74 . 55.106 12.892 -30.337 1 6.87 ? CG2 VAL A-4 74 1 
ATOM 5967 N N . ILE A-4 1 75 . 55.787 11.995 -25.803 1 5.95 ? N ILE A-4 75 1 
ATOM 5968 C CA A ILE A-4 1 75 . 56.037 12.313 -24.444 0.24 6.15 ? CA ILE A-4 75 1 
ATOM 5969 C CA B ILE A-4 1 75 . 56.008 12.359 -24.393 0.76 6.32 ? CA ILE A-4 75 1 
ATOM 5970 C C . ILE A-4 1 75 . 56.943 13.583 -24.338 1 6.47 ? C ILE A-4 75 1 
ATOM 5971 O O . ILE A-4 1 75 . 58.121 13.488 -24.557 0.9 7.34 ? O ILE A-4 75 1 
ATOM 5972 C CB A ILE A-4 1 75 . 56.629 11.112 -23.734 0.24 9.65 ? CB ILE A-4 75 1 
ATOM 5973 C CB B ILE A-4 1 75 . 56.618 11.189 -23.617 0.76 6.06 ? CB ILE A-4 75 1 
ATOM 5974 C CG1 A ILE A-4 1 75 . 55.764 9.88 -24.068 0.24 8.58 ? CG1 ILE A-4 75 1 
ATOM 5975 C CG1 B ILE A-4 1 75 . 55.828 9.888 -23.798 0.76 8.44 ? CG1 ILE A-4 75 1 
ATOM 5976 C CG2 A ILE A-4 1 75 . 56.695 11.345 -22.205 0.24 14.17 ? CG2 ILE A-4 75 1 
ATOM 5977 C CG2 B ILE A-4 1 75 . 56.697 11.574 -22.146 0.76 7.07 ? CG2 ILE A-4 75 1 
ATOM 5978 C CD1 A ILE A-4 1 75 . 54.308 10.083 -23.76 0.24 8.05 ? CD1 ILE A-4 75 1 
ATOM 5979 C CD1 B ILE A-4 1 75 . 56.521 8.645 -23.198 0.76 9.61 ? CD1 ILE A-4 75 1 
ATOM 5980 N N . MET A-4 1 76 . 56.326 14.756 -24.097 1 7.14 ? N MET A-4 76 1 
ATOM 5981 C CA . MET A-4 1 76 . 57.025 16.04 -23.959 1 7.1 ? CA MET A-4 76 1 
ATOM 5982 C C . MET A-4 1 76 . 56.969 16.507 -22.483 1 7.57 ? C MET A-4 76 1 
ATOM 5983 O O . MET A-4 1 76 . 55.881 16.586 -21.929 1 9.76 ? O MET A-4 76 1 
ATOM 5984 C CB . MET A-4 1 76 . 56.479 17.14 -24.857 0.81 5.65 ? CB MET A-4 76 1 
ATOM 5985 C CG . MET A-4 1 76 . 56.769 16.944 -26.329 1 8.44 ? CG MET A-4 76 1 
ATOM 5986 S SD . MET A-4 1 76 . 58.568 17.101 -26.697 1 9.77 ? SD MET A-4 76 1 
ATOM 5987 C CE . MET A-4 1 76 . 58.829 18.829 -26.366 1 9.5 ? CE MET A-4 76 1 
ATOM 5988 N N . ARG A-4 1 77 . 58.093 16.89 -21.929 1 6.49 ? N ARG A-4 77 1 
ATOM 5989 C CA . ARG A-4 1 77 . 58.136 17.472 -20.605 1 6.33 ? CA ARG A-4 77 1 
ATOM 5990 C C . ARG A-4 1 77 . 57.438 18.826 -20.568 1 7.01 ? C ARG A-4 77 1 
ATOM 5991 O O . ARG A-4 1 77 . 56.536 19.038 -19.744 1 10.91 ? O ARG A-4 77 1 
ATOM 5992 C CB . ARG A-4 1 77 . 59.584 17.546 -20.08 1 7.12 ? CB ARG A-4 77 1 
ATOM 5993 C CG . ARG A-4 1 77 . 60.195 16.16 -19.912 1 7.08 ? CG ARG A-4 77 1 
ATOM 5994 C CD . ARG A-4 1 77 . 61.51 16.224 -19.174 1 7.8 ? CD ARG A-4 77 1 
ATOM 5995 N NE . ARG A-4 1 77 . 62.576 16.796 -19.993 1 7.04 ? NE ARG A-4 77 1 
ATOM 5996 C CZ . ARG A-4 1 77 . 63.704 17.313 -19.494 1 7.27 ? CZ ARG A-4 77 1 
ATOM 5997 N NH1 . ARG A-4 1 77 . 63.846 17.553 -18.189 1 7.82 ? NH1 ARG A-4 77 1 
ATOM 5998 N NH2 . ARG A-4 1 77 . 64.673 17.654 -20.333 1 7.52 ? NH2 ARG A-4 77 1 
ATOM 5999 N N . GLU A-4 1 78 . 57.814 19.745 -21.435 1 6.55 ? N GLU A-4 78 1 
ATOM 6000 C CA . GLU A-4 1 78 . 57.103 20.976 -21.648 1 6.08 ? CA GLU A-4 78 1 
ATOM 6001 C C . GLU A-4 1 78 . 56.224 20.762 -22.899 1 6.01 ? C GLU A-4 78 1 
ATOM 6002 O O . GLU A-4 1 78 . 56.798 20.501 -23.969 1 6.71 ? O GLU A-4 78 1 
ATOM 6003 C CB . GLU A-4 1 78 . 58.082 22.147 -21.898 1 6.87 ? CB GLU A-4 78 1 
ATOM 6004 C CG . GLU A-4 1 78 . 57.391 23.46 -22.167 1 7.07 ? CG GLU A-4 78 1 
ATOM 6005 C CD . GLU A-4 1 78 . 58.412 24.614 -22.323 1 7.94 ? CD GLU A-4 78 1 
ATOM 6006 O OE1 . GLU A-4 1 78 . 59.081 24.933 -21.355 1 8.79 ? OE1 GLU A-4 78 1 
ATOM 6007 O OE2 . GLU A-4 1 78 . 58.574 25.148 -23.436 1 8.75 ? OE2 GLU A-4 78 1 
ATOM 6008 N N . PRO A-4 1 79 . 54.926 20.835 -22.785 1 6.29 ? N PRO A-4 79 1 
ATOM 6009 C CA . PRO A-4 1 79 . 54.088 20.603 -23.986 1 7.4 ? CA PRO A-4 79 1 
ATOM 6010 C C . PRO A-4 1 79 . 54.394 21.632 -25.064 1 6.54 ? C PRO A-4 79 1 
ATOM 6011 O O . PRO A-4 1 79 . 54.744 22.764 -24.789 1 7.98 ? O PRO A-4 79 1 
ATOM 6012 C CB . PRO A-4 1 79 . 52.667 20.779 -23.444 1 9.58 ? CB PRO A-4 79 1 
ATOM 6013 C CG . PRO A-4 1 79 . 52.82 20.451 -21.961 1 11.99 ? CG PRO A-4 79 1 
ATOM 6014 C CD . PRO A-4 1 79 . 54.132 21.055 -21.582 1 9.34 ? CD PRO A-4 79 1 
ATOM 6015 N N . VAL A-4 1 80 . 54.224 21.186 -26.301 1 6.9 ? N VAL A-4 80 1 
ATOM 6016 C CA . VAL A-4 1 80 . 54.352 22.083 -27.421 1 6.39 ? CA VAL A-4 80 1 
ATOM 6017 C C . VAL A-4 1 80 . 53.055 22.751 -27.764 1 6.41 ? C VAL A-4 80 1 
ATOM 6018 O O . VAL A-4 1 80 . 52.005 22.314 -27.411 1 12.34 ? O VAL A-4 80 1 
ATOM 6019 C CB . VAL A-4 1 80 . 55.007 21.438 -28.667 1 7.07 ? CB VAL A-4 80 1 
ATOM 6020 C CG1 . VAL A-4 1 80 . 56.353 20.807 -28.32 1 7.7 ? CG1 VAL A-4 80 1 
ATOM 6021 C CG2 . VAL A-4 1 80 . 54.088 20.424 -29.374 1 7.07 ? CG2 VAL A-4 80 1 
ATOM 6022 N N . TYR A-4 1 81 . 53.105 23.752 -28.598 1 6.87 ? N TYR A-4 81 1 
ATOM 6023 C CA . TYR A-4 1 81 . 51.953 24.432 -29.123 1 6.61 ? CA TYR A-4 81 1 
ATOM 6024 C C . TYR A-4 1 81 . 51.32 23.614 -30.243 1 6.29 ? C TYR A-4 81 1 
ATOM 6025 O O . TYR A-4 1 81 . 52.05 22.909 -30.999 1 7.29 ? O TYR A-4 81 1 
ATOM 6026 C CB . TYR A-4 1 81 . 52.317 25.849 -29.62 1 6.91 ? CB TYR A-4 81 1 
ATOM 6027 C CG . TYR A-4 1 81 . 52.676 26.753 -28.507 1 6.95 ? CG TYR A-4 81 1 
ATOM 6028 C CD1 . TYR A-4 1 81 . 53.964 26.797 -27.966 1 7.61 ? CD1 TYR A-4 81 1 
ATOM 6029 C CD2 . TYR A-4 1 81 . 51.709 27.553 -27.903 1 6.69 ? CD2 TYR A-4 81 1 
ATOM 6030 C CE1 . TYR A-4 1 81 . 54.242 27.575 -26.877 1 8.61 ? CE1 TYR A-4 81 1 
ATOM 6031 C CE2 . TYR A-4 1 81 . 51.996 28.345 -26.805 1 7.91 ? CE2 TYR A-4 81 1 
ATOM 6032 C CZ . TYR A-4 1 81 . 53.292 28.328 -26.274 1 7.85 ? CZ TYR A-4 81 1 
ATOM 6033 O OH . TYR A-4 1 81 . 53.551 29.112 -25.189 1 9.9 ? OH TYR A-4 81 1 
ATOM 6034 N N . PRO A-4 1 82 . 50.023 23.72 -30.507 1 6.6 ? N PRO A-4 82 1 
ATOM 6035 C CA . PRO A-4 1 82 . 49.465 23.026 -31.663 1 6.49 ? CA PRO A-4 82 1 
ATOM 6036 C C . PRO A-4 1 82 . 50.142 23.459 -32.946 1 6.38 ? C PRO A-4 82 1 
ATOM 6037 O O . PRO A-4 1 82 . 50.54 24.619 -33.118 1 7.21 ? O PRO A-4 82 1 
ATOM 6038 C CB . PRO A-4 1 82 . 47.996 23.461 -31.657 1 8.01 ? CB PRO A-4 82 1 
ATOM 6039 C CG . PRO A-4 1 82 . 47.719 23.878 -30.23 1 8.51 ? CG PRO A-4 82 1 
ATOM 6040 C CD . PRO A-4 1 82 . 49.03 24.51 -29.763 1 7.51 ? CD PRO A-4 82 1 
ATOM 6041 N N . LEU A-4 1 83 . 50.231 22.493 -33.864 1 6.31 ? N LEU A-4 83 1 
ATOM 6042 C CA . LEU A-4 1 83 . 50.828 22.615 -35.174 1 6.74 ? CA LEU A-4 83 1 
ATOM 6043 C C . LEU A-4 1 83 . 52.334 22.706 -35.152 1 6.65 ? C LEU A-4 83 1 
ATOM 6044 O O . LEU A-4 1 83 . 52.95 23.075 -36.15 1 8.57 ? O LEU A-4 83 1 
ATOM 6045 C CB . LEU A-4 1 83 . 50.196 23.73 -36.032 1 9.23 ? CB LEU A-4 83 1 
ATOM 6046 C CG . LEU A-4 1 83 . 48.69 23.689 -36.112 1 13.43 ? CG LEU A-4 83 1 
ATOM 6047 C CD1 . LEU A-4 1 83 . 48.216 24.873 -37.035 1 19.69 ? CD1 LEU A-4 83 1 
ATOM 6048 C CD2 . LEU A-4 1 83 . 48.205 22.393 -36.603 1 16.76 ? CD2 LEU A-4 83 1 
ATOM 6049 N N . THR A-4 1 84 . 52.957 22.261 -34.046 1 6.22 ? N THR A-4 84 1 
ATOM 6050 C CA . THR A-4 1 84 . 54.41 22.158 -33.964 1 5.97 ? CA THR A-4 84 1 
ATOM 6051 C C . THR A-4 1 84 . 54.834 20.764 -34.479 1 5.51 ? C THR A-4 84 1 
ATOM 6052 O O . THR A-4 1 84 . 54.244 19.74 -34.096 1 6.08 ? O THR A-4 84 1 
ATOM 6053 C CB . THR A-4 1 84 . 54.878 22.342 -32.539 1 6.72 ? CB THR A-4 84 1 
ATOM 6054 O OG1 . THR A-4 1 84 . 54.431 23.59 -32.032 1 7.84 ? OG1 THR A-4 84 1 
ATOM 6055 C CG2 . THR A-4 1 84 . 56.395 22.32 -32.46 1 8.07 ? CG2 THR A-4 84 1 
ATOM 6056 N N . ILE A-4 1 85 . 55.909 20.744 -35.255 1 5.46 ? N ILE A-4 85 1 
ATOM 6057 C CA . ILE A-4 1 85 . 56.555 19.521 -35.704 1 5.41 ? CA ILE A-4 85 1 
ATOM 6058 C C . ILE A-4 1 85 . 57.575 19.063 -34.689 1 5.24 ? C ILE A-4 85 1 
ATOM 6059 O O . ILE A-4 1 85 . 58.433 19.843 -34.276 1 6.35 ? O ILE A-4 85 1 
ATOM 6060 C CB . ILE A-4 1 85 . 57.287 19.776 -37.028 1 7.14 ? CB ILE A-4 85 1 
ATOM 6061 C CG1 . ILE A-4 1 85 . 56.388 20.307 -38.123 1 8.97 ? CG1 ILE A-4 85 1 
ATOM 6062 C CG2 . ILE A-4 1 85 . 58.06 18.535 -37.449 1 8.84 ? CG2 ILE A-4 85 1 
ATOM 6063 C CD1 . ILE A-4 1 85 . 57.223 21.038 -39.222 1 12.02 ? CD1 ILE A-4 85 1 
ATOM 6064 N N . ILE A-4 1 86 . 57.52 17.799 -34.315 1 5.24 ? N ILE A-4 86 1 
ATOM 6065 C CA . ILE A-4 1 86 . 58.502 17.193 -33.428 1 5.71 ? CA ILE A-4 86 1 
ATOM 6066 C C . ILE A-4 1 86 . 59.131 15.998 -34.163 1 5.48 ? C ILE A-4 86 1 
ATOM 6067 O O . ILE A-4 1 86 . 58.388 15.115 -34.608 1 6.91 ? O ILE A-4 86 1 
ATOM 6068 C CB . ILE A-4 1 86 . 57.9 16.706 -32.098 1 5.78 ? CB ILE A-4 86 1 
ATOM 6069 C CG1 . ILE A-4 1 86 . 57.171 17.829 -31.364 1 6.45 ? CG1 ILE A-4 86 1 
ATOM 6070 C CG2 . ILE A-4 1 86 . 58.968 16.038 -31.217 1 6.8 ? CG2 ILE A-4 86 1 
ATOM 6071 C CD1 . ILE A-4 1 86 . 56.48 17.372 -30.108 1 6.96 ? CD1 ILE A-4 86 1 
ATOM 6072 N N . GLU A-4 1 87 . 60.442 15.901 -34.238 1 5.35 ? N GLU A-4 87 1 
ATOM 6073 C CA B GLU A-4 1 87 . 61.121 14.689 -34.665 0.52 5.91 ? CA GLU A-4 87 1 
ATOM 6074 C CA C GLU A-4 1 87 . 61.069 14.669 -34.68 0.16 4.53 ? CA GLU A-4 87 1 
ATOM 6075 C CA D GLU A-4 1 87 . 61.114 14.698 -34.683 0.32 6.15 ? CA GLU A-4 87 1 
ATOM 6076 C C . GLU A-4 1 87 . 61.035 13.667 -33.532 1 5.44 ? C GLU A-4 87 1 
ATOM 6077 O O . GLU A-4 1 87 . 61.527 13.935 -32.431 1 6.38 ? O GLU A-4 87 1 
ATOM 6078 C CB B GLU A-4 1 87 . 62.586 14.992 -34.956 0.52 6.91 ? CB GLU A-4 87 1 
ATOM 6079 C CB C GLU A-4 1 87 . 62.482 14.876 -35.221 0.16 6 ? CB GLU A-4 87 1 
ATOM 6080 C CB D GLU A-4 1 87 . 62.569 15.026 -35.058 0.32 6.84 ? CB GLU A-4 87 1 
ATOM 6081 C CG B GLU A-4 1 87 . 62.742 15.865 -36.095 0.52 8.71 ? CG GLU A-4 87 1 
ATOM 6082 C CG C GLU A-4 1 87 . 62.531 15.718 -36.477 0.16 8.87 ? CG GLU A-4 87 1 
ATOM 6083 C CG D GLU A-4 1 87 . 63.263 13.904 -35.744 0.32 6.84 ? CG GLU A-4 87 1 
ATOM 6084 C CD B GLU A-4 1 87 . 64.024 16.812 -36.004 0.52 13.19 ? CD GLU A-4 87 1 
ATOM 6085 C CD C GLU A-4 1 87 . 63.954 15.993 -36.938 0.16 11.76 ? CD GLU A-4 87 1 
ATOM 6086 C CD D GLU A-4 1 87 . 64.708 14.236 -36.189 0.32 10.09 ? CD GLU A-4 87 1 
ATOM 6087 O OE1 B GLU A-4 1 87 . 64.583 17.453 -34.91 0.52 13.17 ? OE1 GLU A-4 87 1 
ATOM 6088 O OE1 C GLU A-4 1 87 . 64.903 15.421 -36.361 0.16 14.6 ? OE1 GLU A-4 87 1 
ATOM 6089 O OE1 D GLU A-4 1 87 . 65.475 13.42 -36.67 0.32 9.99 ? OE1 GLU A-4 87 1 
ATOM 6090 O OE2 B GLU A-4 1 87 . 64.483 17.164 -37.132 0.52 17.98 ? OE2 GLU A-4 87 1 
ATOM 6091 O OE2 C GLU A-4 1 87 . 64.098 16.847 -37.86 0.16 12.42 ? OE2 GLU A-4 87 1 
ATOM 6092 O OE2 D GLU A-4 1 87 . 65.14 15.398 -36.084 0.32 16.66 ? OE2 GLU A-4 87 1 
ATOM 6093 N N . ALA A-4 1 88 . 60.415 12.538 -33.81 1 5.58 ? N ALA A-4 88 1 
ATOM 6094 C CA . ALA A-4 1 88 . 59.989 11.599 -32.753 1 6.66 ? CA ALA A-4 88 1 
ATOM 6095 C C . ALA A-4 1 88 . 60.461 10.186 -33.086 1 6.11 ? C ALA A-4 88 1 
ATOM 6096 O O . ALA A-4 1 88 . 60.405 9.731 -34.217 1 6.89 ? O ALA A-4 88 1 
ATOM 6097 C CB . ALA A-4 1 88 . 58.488 11.643 -32.631 1 8.29 ? CB ALA A-4 88 1 
ATOM 6098 N N . ARG A-4 1 89 . 60.904 9.5 -32.026 1 5.79 ? N ARG A-4 89 1 
ATOM 6099 C CA . ARG A-4 1 89 . 61.32 8.111 -32.076 1 5.79 ? CA ARG A-4 89 1 
ATOM 6100 C C . ARG A-4 1 89 . 60.2 7.229 -31.53 1 5.55 ? C ARG A-4 89 1 
ATOM 6101 O O . ARG A-4 1 89 . 59.89 7.281 -30.345 1 5.94 ? O ARG A-4 89 1 
ATOM 6102 C CB . ARG A-4 1 89 . 62.599 7.901 -31.199 1 6.92 ? CB ARG A-4 89 1 
ATOM 6103 C CG . ARG A-4 1 89 . 62.958 6.476 -30.988 1 8.75 ? CG ARG A-4 89 1 
ATOM 6104 C CD . ARG A-4 1 89 . 64.332 6.274 -30.339 1 10.31 ? CD ARG A-4 89 1 
ATOM 6105 N NE . ARG A-4 1 89 . 64.457 6.866 -28.949 1 9.21 ? NE ARG A-4 89 1 
ATOM 6106 C CZ . ARG A-4 1 89 . 65.079 8.028 -28.707 1 8.44 ? CZ ARG A-4 89 1 
ATOM 6107 N NH1 . ARG A-4 1 89 . 65.215 8.432 -27.479 1 9.12 ? NH1 ARG A-4 89 1 
ATOM 6108 N NH2 . ARG A-4 1 89 . 65.536 8.787 -29.712 1 10.1 ? NH2 ARG A-4 89 1 
ATOM 6109 N N . PRO A-4 1 90 . 59.59 6.403 -32.392 1 5.88 ? N PRO A-4 90 1 
ATOM 6110 C CA . PRO A-4 1 90 . 58.579 5.435 -31.917 1 6.06 ? CA PRO A-4 90 1 
ATOM 6111 C C . PRO A-4 1 90 . 59.221 4.448 -30.94 1 6.19 ? C PRO A-4 90 1 
ATOM 6112 O O . PRO A-4 1 90 . 60.271 3.887 -31.251 1 7.13 ? O PRO A-4 90 1 
ATOM 6113 C CB . PRO A-4 1 90 . 58.127 4.739 -33.208 1 6.57 ? CB PRO A-4 90 1 
ATOM 6114 C CG . PRO A-4 1 90 . 58.381 5.765 -34.287 1 7.36 ? CG PRO A-4 90 1 
ATOM 6115 C CD . PRO A-4 1 90 . 59.698 6.386 -33.862 1 7.96 ? CD PRO A-4 90 1 
ATOM 6116 N N . ILE A-4 1 91 . 58.523 4.219 -29.811 1 5.57 ? N ILE A-4 91 1 
ATOM 6117 C CA . ILE A-4 1 91 . 58.959 3.236 -28.824 1 6.35 ? CA ILE A-4 91 1 
ATOM 6118 C C . ILE A-4 1 91 . 57.917 2.189 -28.549 1 6.38 ? C ILE A-4 91 1 
ATOM 6119 O O . ILE A-4 1 91 . 58.219 1.219 -27.847 1 8.22 ? O ILE A-4 91 1 
ATOM 6120 C CB . ILE A-4 1 91 . 59.456 3.905 -27.515 1 6.85 ? CB ILE A-4 91 1 
ATOM 6121 C CG1 . ILE A-4 1 91 . 58.336 4.629 -26.774 1 7.48 ? CG1 ILE A-4 91 1 
ATOM 6122 C CG2 . ILE A-4 1 91 . 60.656 4.777 -27.83 1 7.64 ? CG2 ILE A-4 91 1 
ATOM 6123 C CD1 . ILE A-4 1 91 . 58.707 5.084 -25.4 1 8.92 ? CD1 ILE A-4 91 1 
ATOM 6124 N N . GLY A-4 1 92 . 56.683 2.318 -29.065 1 6.35 ? N GLY A-4 92 1 
ATOM 6125 C CA . GLY A-4 1 92 . 55.655 1.348 -28.788 1 6.45 ? CA GLY A-4 92 1 
ATOM 6126 C C . GLY A-4 1 92 . 54.369 1.827 -29.423 1 5.48 ? C GLY A-4 92 1 
ATOM 6127 O O . GLY A-4 1 92 . 54.34 2.848 -30.119 1 5.73 ? O GLY A-4 92 1 
ATOM 6128 N N . ILE A-4 1 93 . 53.297 1.084 -29.186 1 6.02 ? N ILE A-4 93 1 
ATOM 6129 C CA . ILE A-4 1 93 . 52.017 1.39 -29.831 1 5.79 ? CA ILE A-4 93 1 
ATOM 6130 C C . ILE A-4 1 93 . 50.879 0.94 -28.934 1 5.52 ? C ILE A-4 93 1 
ATOM 6131 O O . ILE A-4 1 93 . 50.868 -0.188 -28.406 1 6.71 ? O ILE A-4 93 1 
ATOM 6132 C CB . ILE A-4 1 93 . 51.956 0.79 -31.265 1 6.21 ? CB ILE A-4 93 1 
ATOM 6133 C CG1 . ILE A-4 1 93 . 50.667 1.201 -31.987 1 6.27 ? CG1 ILE A-4 93 1 
ATOM 6134 C CG2 . ILE A-4 1 93 . 52.177 -0.735 -31.295 1 7.06 ? CG2 ILE A-4 93 1 
ATOM 6135 C CD1 . ILE A-4 1 93 . 50.833 1.167 -33.488 1 7.5 ? CD1 ILE A-4 93 1 
ATOM 6136 N N . MET A-4 1 94 . 49.886 1.796 -28.744 1 5.89 ? N MET A-4 94 1 
ATOM 6137 C CA . MET A-4 1 94 . 48.688 1.482 -28.001 1 5.75 ? CA MET A-4 94 1 
ATOM 6138 C C . MET A-4 1 94 . 47.667 0.876 -28.97 1 5.75 ? C MET A-4 94 1 
ATOM 6139 O O . MET A-4 1 94 . 47.31 1.478 -29.976 1 6.5 ? O MET A-4 94 1 
ATOM 6140 C CB . MET A-4 1 94 . 48.1 2.752 -27.379 1 6.27 ? CB MET A-4 94 1 
ATOM 6141 C CG . MET A-4 1 94 . 46.923 2.485 -26.541 1 7.85 ? CG MET A-4 94 1 
ATOM 6142 S SD . MET A-4 1 94 . 46.18 3.969 -25.823 1 8.32 ? SD MET A-4 94 1 
ATOM 6143 C CE . MET A-4 1 94 . 45.639 4.769 -27.342 1 8.11 ? CE MET A-4 94 1 
ATOM 6144 N N . LYS A-4 1 95 . 47.185 -0.309 -28.615 1 5.93 ? N LYS A-4 95 1 
ATOM 6145 C CA . LYS A-4 1 95 . 46.239 -1.045 -29.484 1 6.61 ? CA LYS A-4 95 1 
ATOM 6146 C C . LYS A-4 1 95 . 44.849 -0.694 -29.012 1 6.55 ? C LYS A-4 95 1 
ATOM 6147 O O . LYS A-4 1 95 . 44.367 -1.16 -27.981 1 11.84 ? O LYS A-4 95 1 
ATOM 6148 C CB . LYS A-4 1 95 . 46.523 -2.541 -29.349 1 7.48 ? CB LYS A-4 95 1 
ATOM 6149 C CG . LYS A-4 1 95 . 47.916 -2.927 -29.785 1 8.92 ? CG LYS A-4 95 1 
ATOM 6150 C CD . LYS A-4 1 95 . 48.17 -4.398 -29.662 1 10.99 ? CD LYS A-4 95 1 
ATOM 6151 C CE . LYS A-4 1 95 . 49.588 -4.72 -30.219 1 13.89 ? CE LYS A-4 95 1 
ATOM 6152 N NZ . LYS A-4 1 95 . 49.926 -6.127 -30.154 1 16.81 ? NZ LYS A-4 95 1 
ATOM 6153 N N . MET A-4 1 96 . 44.202 0.193 -29.747 1 7.44 ? N MET A-4 96 1 
ATOM 6154 C CA . MET A-4 1 96 . 42.874 0.75 -29.449 1 7.88 ? CA MET A-4 96 1 
ATOM 6155 C C . MET A-4 1 96 . 41.934 0.517 -30.63 1 6.52 ? C MET A-4 96 1 
ATOM 6156 O O . MET A-4 1 96 . 42.301 0.794 -31.759 1 7.33 ? O MET A-4 96 1 
ATOM 6157 C CB . MET A-4 1 96 . 42.995 2.315 -29.22 1 6.95 ? CB MET A-4 96 1 
ATOM 6158 C CG . MET A-4 1 96 . 41.621 2.938 -28.974 1 7.55 ? CG MET A-4 96 1 
ATOM 6159 S SD . MET A-4 1 96 . 41.834 4.682 -28.638 1 8.41 ? SD MET A-4 96 1 
ATOM 6160 C CE . MET A-4 1 96 . 40.195 5.115 -28.102 1 8.51 ? CE MET A-4 96 1 
ATOM 6161 N N A GLU A-4 1 97 . 40.734 0.112 -30.281 0.51 6.35 ? N GLU A-4 97 1 
ATOM 6162 N N B GLU A-4 1 97 . 40.67 0.168 -30.363 0.49 6.46 ? N GLU A-4 97 1 
ATOM 6163 C CA A GLU A-4 1 97 . 39.616 0.22 -31.155 0.51 6.89 ? CA GLU A-4 97 1 
ATOM 6164 C CA B GLU A-4 1 97 . 39.548 0.198 -31.296 0.49 6.58 ? CA GLU A-4 97 1 
ATOM 6165 C C A GLU A-4 1 97 . 38.737 1.383 -30.667 0.51 6.23 ? C GLU A-4 97 1 
ATOM 6166 C C B GLU A-4 1 97 . 38.608 1.261 -30.765 0.49 6.42 ? C GLU A-4 97 1 
ATOM 6167 O O A GLU A-4 1 97 . 38.515 1.534 -29.476 0.51 6.9 ? O GLU A-4 97 1 
ATOM 6168 O O B GLU A-4 1 97 . 38.163 1.212 -29.626 0.49 7.9 ? O GLU A-4 97 1 
ATOM 6169 C CB A GLU A-4 1 97 . 38.86 -1.104 -31.169 0.51 10.65 ? CB GLU A-4 97 1 
ATOM 6170 C CB B GLU A-4 1 97 . 38.803 -1.153 -31.278 0.49 7.89 ? CB GLU A-4 97 1 
ATOM 6171 C CG A GLU A-4 1 97 . 37.902 -1.259 -32.401 0.51 10.77 ? CG GLU A-4 97 1 
ATOM 6172 C CG B GLU A-4 1 97 . 39.522 -2.241 -31.767 0.49 12.45 ? CG GLU A-4 97 1 
ATOM 6173 C CD A GLU A-4 1 97 . 37.194 -2.519 -32.53 0.51 15.18 ? CD GLU A-4 97 1 
ATOM 6174 C CD B GLU A-4 1 97 . 39.411 -2.412 -33.197 0.49 14.09 ? CD GLU A-4 97 1 
ATOM 6175 O OE1 A GLU A-4 1 97 . 37.787 -3.45 -33.144 0.51 18.96 ? OE1 GLU A-4 97 1 
ATOM 6176 O OE1 B GLU A-4 1 97 . 38.305 -2.234 -33.752 0.49 17.04 ? OE1 GLU A-4 97 1 
ATOM 6177 O OE2 A GLU A-4 1 97 . 35.969 -2.565 -32.211 0.51 18.85 ? OE2 GLU A-4 97 1 
ATOM 6178 O OE2 B GLU A-4 1 97 . 40.449 -2.774 -33.907 0.49 12.3 ? OE2 GLU A-4 97 1 
ATOM 6179 N N . ASP A-4 1 98 . 38.296 2.212 -31.613 1 5.71 ? N ASP A-4 98 1 
ATOM 6180 C CA . ASP A-4 1 98 . 37.548 3.417 -31.26 1 5.81 ? CA ASP A-4 98 1 
ATOM 6181 C C . ASP A-4 1 98 . 36.262 3.432 -32.073 1 5.82 ? C ASP A-4 98 1 
ATOM 6182 O O . ASP A-4 1 98 . 36.329 3.562 -33.294 1 6.32 ? O ASP A-4 98 1 
ATOM 6183 C CB . ASP A-4 1 98 . 38.391 4.654 -31.552 1 6.38 ? CB ASP A-4 98 1 
ATOM 6184 C CG . ASP A-4 1 98 . 37.78 5.947 -31.12 1 6.82 ? CG ASP A-4 98 1 
ATOM 6185 O OD1 . ASP A-4 1 98 . 36.665 5.9 -30.533 1 12.86 ? OD1 ASP A-4 98 1 
ATOM 6186 O OD2 . ASP A-4 1 98 . 38.331 7.027 -31.339 1 6.32 ? OD2 ASP A-4 98 1 
ATOM 6187 N N . SER A-4 1 99 . 35.131 3.238 -31.438 1 6.27 ? N SER A-4 99 1 
ATOM 6188 C CA . SER A-4 1 99 . 33.837 3.257 -32.139 1 7.62 ? CA SER A-4 99 1 
ATOM 6189 C C . SER A-4 1 99 . 33.817 2.241 -33.273 1 6.9 ? C SER A-4 99 1 
ATOM 6190 O O . SER A-4 1 99 . 33.161 2.446 -34.297 1 8.04 ? O SER A-4 99 1 
ATOM 6191 C CB . SER A-4 1 99 . 33.536 4.699 -32.618 1 10.18 ? CB SER A-4 99 1 
ATOM 6192 O OG . SER A-4 1 99 . 33.519 5.609 -31.543 1 12.09 ? OG SER A-4 99 1 
ATOM 6193 N N . GLY A-4 1 100 . 34.491 1.11 -33.082 1 6.27 ? N GLY A-4 100 1 
ATOM 6194 C CA . GLY A-4 1 100 . 34.517 0.065 -34.083 1 7.13 ? CA GLY A-4 100 1 
ATOM 6195 C C . GLY A-4 1 100 . 35.647 0.129 -35.09 1 6.42 ? C GLY A-4 100 1 
ATOM 6196 O O . GLY A-4 1 100 . 35.794 -0.821 -35.863 1 8.24 ? O GLY A-4 100 1 
ATOM 6197 N N . ASP A-4 1 101 . 36.429 1.191 -35.114 1 6.03 ? N ASP A-4 101 1 
ATOM 6198 C CA . ASP A-4 1 101 . 37.542 1.325 -36.034 1 6.22 ? CA ASP A-4 101 1 
ATOM 6199 C C . ASP A-4 1 101 . 38.851 1.004 -35.336 1 6.02 ? C ASP A-4 101 1 
ATOM 6200 O O . ASP A-4 1 101 . 39.135 1.485 -34.231 1 6.38 ? O ASP A-4 101 1 
ATOM 6201 C CB . ASP A-4 1 101 . 37.661 2.754 -36.555 1 7.2 ? CB ASP A-4 101 1 
ATOM 6202 C CG . ASP A-4 1 101 . 36.482 3.251 -37.297 1 8.76 ? CG ASP A-4 101 1 
ATOM 6203 O OD1 . ASP A-4 1 101 . 35.863 2.453 -38.031 1 9.13 ? OD1 ASP A-4 101 1 
ATOM 6204 O OD2 . ASP A-4 1 101 . 36.246 4.503 -37.17 1 10.67 ? OD2 ASP A-4 101 1 
ATOM 6205 N N . LYS A-4 1 102 . 39.735 0.305 -36.04 1 6.36 ? N LYS A-4 102 1 
ATOM 6206 C CA . LYS A-4 1 102 . 41.121 0.238 -35.586 1 6.02 ? CA LYS A-4 102 1 
ATOM 6207 C C . LYS A-4 1 102 . 41.619 1.69 -35.492 1 5.48 ? C LYS A-4 102 1 
ATOM 6208 O O . LYS A-4 1 102 . 41.415 2.5 -36.394 1 6.08 ? O LYS A-4 102 1 
ATOM 6209 C CB . LYS A-4 1 102 . 41.969 -0.554 -36.575 1 6.86 ? CB LYS A-4 102 1 
ATOM 6210 C CG . LYS A-4 1 102 . 43.259 -1.058 -36.002 1 6.63 ? CG LYS A-4 102 1 
ATOM 6211 C CD . LYS A-4 1 102 . 44.148 -1.755 -37.031 1 7.89 ? CD LYS A-4 102 1 
ATOM 6212 C CE . LYS A-4 1 102 . 45.331 -2.428 -36.378 1 8.66 ? CE LYS A-4 102 1 
ATOM 6213 N NZ . LYS A-4 1 102 . 46.273 -2.989 -37.392 1 9.62 ? NZ LYS A-4 102 1 
ATOM 6214 N N . ASP A-4 1 103 . 42.321 1.99 -34.388 1 5.38 ? N ASP A-4 103 1 
ATOM 6215 C CA . ASP A-4 1 103 . 42.682 3.357 -34.077 1 4.93 ? CA ASP A-4 103 1 
ATOM 6216 C C . ASP A-4 1 103 . 43.891 3.354 -33.172 1 5.1 ? C ASP A-4 103 1 
ATOM 6217 O O . ASP A-4 1 103 . 44.001 4.119 -32.194 1 5.63 ? O ASP A-4 103 1 
ATOM 6218 C CB . ASP A-4 1 103 . 41.519 4.117 -33.473 1 5.2 ? CB ASP A-4 103 1 
ATOM 6219 C CG . ASP A-4 1 103 . 41.602 5.627 -33.472 1 4.98 ? CG ASP A-4 103 1 
ATOM 6220 O OD1 . ASP A-4 1 103 . 42.401 6.195 -34.258 1 5.3 ? OD1 ASP A-4 103 1 
ATOM 6221 O OD2 . ASP A-4 1 103 . 40.847 6.216 -32.702 1 5.65 ? OD2 ASP A-4 103 1 
ATOM 6222 N N . TRP A-4 1 104 . 44.833 2.478 -33.473 1 5.28 ? N TRP A-4 104 1 
ATOM 6223 C CA . TRP A-4 1 104 . 46.08 2.346 -32.739 1 5.36 ? CA TRP A-4 104 1 
ATOM 6224 C C . TRP A-4 1 104 . 46.861 3.648 -32.8 1 5.4 ? C TRP A-4 104 1 
ATOM 6225 O O . TRP A-4 1 104 . 46.735 4.409 -33.727 1 5.88 ? O TRP A-4 104 1 
ATOM 6226 C CB . TRP A-4 1 104 . 46.934 1.185 -33.323 1 5.75 ? CB TRP A-4 104 1 
ATOM 6227 C CG . TRP A-4 1 104 . 46.349 -0.179 -33.175 1 6.12 ? CG TRP A-4 104 1 
ATOM 6228 C CD1 . TRP A-4 1 104 . 45.06 -0.55 -32.854 1 6.05 ? CD1 TRP A-4 104 1 
ATOM 6229 C CD2 . TRP A-4 1 104 . 47.083 -1.397 -33.31 1 7.21 ? CD2 TRP A-4 104 1 
ATOM 6230 N NE1 . TRP A-4 1 104 . 44.978 -1.913 -32.781 1 7.24 ? NE1 TRP A-4 104 1 
ATOM 6231 C CE2 . TRP A-4 1 104 . 46.197 -2.461 -33.06 1 7.44 ? CE2 TRP A-4 104 1 
ATOM 6232 C CE3 . TRP A-4 1 104 . 48.403 -1.677 -33.652 1 8.46 ? CE3 TRP A-4 104 1 
ATOM 6233 C CZ2 . TRP A-4 1 104 . 46.601 -3.781 -33.115 1 9.54 ? CZ2 TRP A-4 104 1 
ATOM 6234 C CZ3 . TRP A-4 1 104 . 48.801 -3.015 -33.716 1 10.02 ? CZ3 TRP A-4 104 1 
ATOM 6235 C CH2 . TRP A-4 1 104 . 47.908 -4.028 -33.439 1 10.56 ? CH2 TRP A-4 104 1 
ATOM 6236 N N . LYS A-4 1 105 . 47.722 3.832 -31.8 1 5.4 ? N LYS A-4 105 1 
ATOM 6237 C CA . LYS A-4 1 105 . 48.437 5.112 -31.669 1 5.79 ? CA LYS A-4 105 1 
ATOM 6238 C C . LYS A-4 1 105 . 49.861 4.874 -31.315 1 5.05 ? C LYS A-4 105 1 
ATOM 6239 O O . LYS A-4 1 105 . 50.187 4.19 -30.337 1 5.76 ? O LYS A-4 105 1 
ATOM 6240 C CB . LYS A-4 1 105 . 47.788 6.023 -30.653 1 5.85 ? CB LYS A-4 105 1 
ATOM 6241 C CG . LYS A-4 1 105 . 46.245 6.038 -30.793 1 6.04 ? CG LYS A-4 105 1 
ATOM 6242 C CD . LYS A-4 1 105 . 45.639 7.237 -30.103 1 5.87 ? CD LYS A-4 105 1 
ATOM 6243 C CE . LYS A-4 1 105 . 44.126 7.178 -30.027 1 5.53 ? CE LYS A-4 105 1 
ATOM 6244 N NZ . LYS A-4 1 105 . 43.517 6.922 -31.358 1 5.28 ? NZ LYS A-4 105 1 
ATOM 6245 N N . VAL A-4 1 106 . 50.799 5.407 -32.105 1 5.18 ? N VAL A-4 106 1 
ATOM 6246 C CA . VAL A-4 1 106 . 52.2 5.315 -31.785 1 5.46 ? CA VAL A-4 106 1 
ATOM 6247 C C . VAL A-4 1 106 . 52.489 6.05 -30.504 1 5.29 ? C VAL A-4 106 1 
ATOM 6248 O O . VAL A-4 1 106 . 51.98 7.158 -30.292 1 5.45 ? O VAL A-4 106 1 
ATOM 6249 C CB . VAL A-4 1 106 . 53.027 5.865 -32.93 1 6 ? CB VAL A-4 106 1 
ATOM 6250 C CG1 . VAL A-4 1 106 . 54.52 5.975 -32.581 1 6.49 ? CG1 VAL A-4 106 1 
ATOM 6251 C CG2 . VAL A-4 1 106 . 52.826 5.094 -34.229 1 7.83 ? CG2 VAL A-4 106 1 
ATOM 6252 N N . LEU A-4 1 107 . 53.341 5.474 -29.648 1 5.45 ? N LEU A-4 107 1 
ATOM 6253 C CA . LEU A-4 1 107 . 53.947 6.173 -28.507 1 5.03 ? CA LEU A-4 107 1 
ATOM 6254 C C . LEU A-4 1 107 . 55.383 6.471 -28.874 1 5.1 ? C LEU A-4 107 1 
ATOM 6255 O O . LEU A-4 1 107 . 56.111 5.558 -29.292 1 5.76 ? O LEU A-4 107 1 
ATOM 6256 C CB . LEU A-4 1 107 . 53.885 5.3 -27.247 1 6.15 ? CB LEU A-4 107 1 
ATOM 6257 C CG . LEU A-4 1 107 . 54.402 5.974 -25.986 1 6.87 ? CG LEU A-4 107 1 
ATOM 6258 C CD1 . LEU A-4 1 107 . 53.561 7.201 -25.573 1 9.06 ? CD1 LEU A-4 107 1 
ATOM 6259 C CD2 . LEU A-4 1 107 . 54.488 4.965 -24.863 1 9.34 ? CD2 LEU A-4 107 1 
ATOM 6260 N N . ALA A-4 1 108 . 55.794 7.727 -28.733 1 4.93 ? N ALA A-4 108 1 
ATOM 6261 C CA . ALA A-4 1 108 . 57.094 8.169 -29.162 1 5.09 ? CA ALA A-4 108 1 
ATOM 6262 C C . ALA A-4 1 108 . 57.682 9.145 -28.177 1 4.9 ? C ALA A-4 108 1 
ATOM 6263 O O . ALA A-4 1 108 . 56.966 9.764 -27.391 1 5.71 ? O ALA A-4 108 1 
ATOM 6264 C CB . ALA A-4 1 108 . 56.995 8.796 -30.535 1 6.16 ? CB ALA A-4 108 1 
ATOM 6265 N N . VAL A-4 1 109 . 59 9.328 -28.287 1 5.35 ? N VAL A-4 109 1 
ATOM 6266 C CA . VAL A-4 1 109 . 59.718 10.339 -27.517 1 5.67 ? CA VAL A-4 109 1 
ATOM 6267 C C . VAL A-4 1 109 . 60.409 11.287 -28.44 1 5.38 ? C VAL A-4 109 1 
ATOM 6268 O O . VAL A-4 1 109 . 60.798 10.925 -29.57 1 6.24 ? O VAL A-4 109 1 
ATOM 6269 C CB . VAL A-4 1 109 . 60.726 9.703 -26.519 1 6.31 ? CB VAL A-4 109 1 
ATOM 6270 C CG1 . VAL A-4 1 109 . 59.993 8.912 -25.42 1 7.55 ? CG1 VAL A-4 109 1 
ATOM 6271 C CG2 . VAL A-4 1 109 . 61.762 8.823 -27.224 1 6.79 ? CG2 VAL A-4 109 1 
ATOM 6272 N N . PRO A-4 1 110 . 60.638 12.528 -28.023 1 5.76 ? N PRO A-4 110 1 
ATOM 6273 C CA . PRO A-4 1 110 . 61.355 13.489 -28.871 1 5.83 ? CA PRO A-4 110 1 
ATOM 6274 C C . PRO A-4 1 110 . 62.804 13.089 -29.003 1 6.46 ? C PRO A-4 110 1 
ATOM 6275 O O . PRO A-4 1 110 . 63.491 12.874 -27.989 1 7.27 ? O PRO A-4 110 1 
ATOM 6276 C CB . PRO A-4 1 110 . 61.208 14.832 -28.11 1 6.89 ? CB PRO A-4 110 1 
ATOM 6277 C CG . PRO A-4 1 110 . 60.997 14.392 -26.666 1 7.94 ? CG PRO A-4 110 1 
ATOM 6278 C CD . PRO A-4 1 110 . 60.193 13.124 -26.746 1 6.7 ? CD PRO A-4 110 1 
ATOM 6279 N N . VAL A-4 1 111 . 63.319 13.088 -30.219 1 6.11 ? N VAL A-4 111 1 
ATOM 6280 C CA . VAL A-4 1 111 . 64.726 12.818 -30.458 1 7.1 ? CA VAL A-4 111 1 
ATOM 6281 C C . VAL A-4 1 111 . 65.591 13.873 -29.771 1 6.97 ? C VAL A-4 111 1 
ATOM 6282 O O . VAL A-4 1 111 . 66.712 13.528 -29.329 1 8.75 ? O VAL A-4 111 1 
ATOM 6283 C CB . VAL A-4 1 111 . 65.037 12.742 -31.966 1 10.46 ? CB VAL A-4 111 1 
ATOM 6284 C CG1 . VAL A-4 1 111 . 66.492 12.724 -32.303 1 14.55 ? CG1 VAL A-4 111 1 
ATOM 6285 C CG2 . VAL A-4 1 111 . 64.275 11.574 -32.586 1 11.66 ? CG2 VAL A-4 111 1 
ATOM 6286 N N A GLU A-4 1 112 . 65.149 15.092 -29.706 0.68 6.21 ? N GLU A-4 112 1 
ATOM 6287 N N B GLU A-4 1 112 . 65.1 15.153 -29.73 0.32 7.43 ? N GLU A-4 112 1 
ATOM 6288 C CA A GLU A-4 1 112 . 66.007 16.177 -29.278 0.68 6.76 ? CA GLU A-4 112 1 
ATOM 6289 C CA B GLU A-4 1 112 . 65.861 16.362 -29.222 0.32 7.98 ? CA GLU A-4 112 1 
ATOM 6290 C C A GLU A-4 1 112 . 65.664 16.659 -27.863 0.68 6.52 ? C GLU A-4 112 1 
ATOM 6291 C C B GLU A-4 1 112 . 65.896 16.551 -27.719 0.32 8.38 ? C GLU A-4 112 1 
ATOM 6292 O O A GLU A-4 1 112 . 65.918 17.802 -27.54 0.68 7.85 ? O GLU A-4 112 1 
ATOM 6293 O O B GLU A-4 1 112 . 66.565 17.449 -27.216 0.32 10.31 ? O GLU A-4 112 1 
ATOM 6294 C CB A GLU A-4 1 112 . 65.915 17.316 -30.285 0.68 7.42 ? CB GLU A-4 112 1 
ATOM 6295 C CB B GLU A-4 1 112 . 65.313 17.702 -29.761 0.32 9.3 ? CB GLU A-4 112 1 
ATOM 6296 C CG A GLU A-4 1 112 . 66.409 16.907 -31.656 0.68 9.27 ? CG GLU A-4 112 1 
ATOM 6297 C CG B GLU A-4 1 112 . 65.41 17.848 -31.254 0.32 10.72 ? CG GLU A-4 112 1 
ATOM 6298 C CD A GLU A-4 1 112 . 67.834 16.513 -31.765 0.68 12.08 ? CD GLU A-4 112 1 
ATOM 6299 C CD B GLU A-4 1 112 . 66.818 17.807 -31.814 0.32 11.17 ? CD GLU A-4 112 1 
ATOM 6300 O OE1 A GLU A-4 1 112 . 68.618 16.763 -30.846 0.68 14.63 ? OE1 GLU A-4 112 1 
ATOM 6301 O OE1 B GLU A-4 1 112 . 67.823 18.029 -31.049 0.32 13.11 ? OE1 GLU A-4 112 1 
ATOM 6302 O OE2 A GLU A-4 1 112 . 68.255 15.937 -32.802 0.68 17.51 ? OE2 GLU A-4 112 1 
ATOM 6303 O OE2 B GLU A-4 1 112 . 67.012 17.648 -33.017 0.32 12.44 ? OE2 GLU A-4 112 1 
ATOM 6304 N N . ASP A-4 1 113 . 65.186 15.758 -26.975 1 6.66 ? N ASP A-4 113 1 
ATOM 6305 C CA . ASP A-4 1 113 . 65.214 15.939 -25.529 1 6.75 ? CA ASP A-4 113 1 
ATOM 6306 C C . ASP A-4 1 113 . 66.096 14.852 -24.937 1 6.26 ? C ASP A-4 113 1 
ATOM 6307 O O . ASP A-4 1 113 . 65.696 13.684 -24.951 1 6.64 ? O ASP A-4 113 1 
ATOM 6308 C CB . ASP A-4 1 113 . 63.836 15.9 -24.92 1 6.88 ? CB ASP A-4 113 1 
ATOM 6309 C CG . ASP A-4 1 113 . 63.834 16.196 -23.439 1 6.94 ? CG ASP A-4 113 1 
ATOM 6310 O OD1 . ASP A-4 1 113 . 64.928 16.292 -22.846 1 7.21 ? OD1 ASP A-4 113 1 
ATOM 6311 O OD2 . ASP A-4 1 113 . 62.703 16.357 -22.865 1 7.37 ? OD2 ASP A-4 113 1 
ATOM 6312 N N . PRO A-4 1 114 . 67.261 15.2 -24.4 1 6.94 ? N PRO A-4 114 1 
ATOM 6313 C CA . PRO A-4 1 114 . 68.165 14.189 -23.898 1 7.18 ? CA PRO A-4 114 1 
ATOM 6314 C C . PRO A-4 1 114 . 67.626 13.439 -22.708 1 6.53 ? C PRO A-4 114 1 
ATOM 6315 O O . PRO A-4 1 114 . 68.103 12.32 -22.414 1 7.21 ? O PRO A-4 114 1 
ATOM 6316 C CB . PRO A-4 1 114 . 69.454 14.988 -23.572 1 8.19 ? CB PRO A-4 114 1 
ATOM 6317 C CG . PRO A-4 1 114 . 68.936 16.358 -23.191 1 9.14 ? CG PRO A-4 114 1 
ATOM 6318 C CD . PRO A-4 1 114 . 67.801 16.607 -24.196 1 8.43 ? CD PRO A-4 114 1 
ATOM 6319 N N . TYR A-4 1 115 . 66.611 13.95 -22.033 1 6.45 ? N TYR A-4 115 1 
ATOM 6320 C CA . TYR A-4 1 115 . 65.94 13.203 -20.946 1 6.22 ? CA TYR A-4 115 1 
ATOM 6321 C C . TYR A-4 1 115 . 65.56 11.816 -21.415 1 6.34 ? C TYR A-4 115 1 
ATOM 6322 O O . TYR A-4 1 115 . 65.584 10.873 -20.63 1 7.45 ? O TYR A-4 115 1 
ATOM 6323 C CB . TYR A-4 1 115 . 64.714 13.996 -20.507 1 6.58 ? CB TYR A-4 115 1 
ATOM 6324 C CG . TYR A-4 1 115 . 64.016 13.41 -19.307 1 6.3 ? CG TYR A-4 115 1 
ATOM 6325 C CD1 . TYR A-4 1 115 . 63.037 12.446 -19.468 1 7.18 ? CD1 TYR A-4 115 1 
ATOM 6326 C CD2 . TYR A-4 1 115 . 64.293 13.87 -18.031 1 6.78 ? CD2 TYR A-4 115 1 
ATOM 6327 C CE1 . TYR A-4 1 115 . 62.387 11.921 -18.353 1 8.14 ? CE1 TYR A-4 115 1 
ATOM 6328 C CE2 . TYR A-4 1 115 . 63.615 13.379 -16.942 1 8.1 ? CE2 TYR A-4 115 1 
ATOM 6329 C CZ . TYR A-4 1 115 . 62.692 12.364 -17.108 1 8.5 ? CZ TYR A-4 115 1 
ATOM 6330 O OH . TYR A-4 1 115 . 62.072 11.838 -15.988 1 11.03 ? OH TYR A-4 115 1 
ATOM 6331 N N . PHE A-4 1 116 . 65.128 11.697 -22.683 1 6.4 ? N PHE A-4 116 1 
ATOM 6332 C CA . PHE A-4 1 116 . 64.578 10.454 -23.221 1 6.99 ? CA PHE A-4 116 1 
ATOM 6333 C C . PHE A-4 1 116 . 65.602 9.625 -24 1 7.8 ? C PHE A-4 116 1 
ATOM 6334 O O . PHE A-4 1 116 . 65.213 8.658 -24.65 1 8.48 ? O PHE A-4 116 1 
ATOM 6335 C CB . PHE A-4 1 116 . 63.327 10.734 -24.07 1 7.8 ? CB PHE A-4 116 1 
ATOM 6336 C CG . PHE A-4 1 116 . 62.225 11.351 -23.287 1 6.87 ? CG PHE A-4 116 1 
ATOM 6337 C CD1 . PHE A-4 1 116 . 61.962 12.699 -23.376 1 7.33 ? CD1 PHE A-4 116 1 
ATOM 6338 C CD2 . PHE A-4 1 116 . 61.444 10.579 -22.436 1 7.83 ? CD2 PHE A-4 116 1 
ATOM 6339 C CE1 . PHE A-4 1 116 . 60.94 13.282 -22.629 1 8.12 ? CE1 PHE A-4 116 1 
ATOM 6340 C CE2 . PHE A-4 1 116 . 60.396 11.167 -21.671 1 7.83 ? CE2 PHE A-4 116 1 
ATOM 6341 C CZ . PHE A-4 1 116 . 60.18 12.508 -21.794 1 8.23 ? CZ PHE A-4 116 1 
ATOM 6342 N N . ASN A-4 1 117 . 66.889 9.955 -23.912 1 8.52 ? N ASN A-4 117 1 
ATOM 6343 C CA . ASN A-4 1 117 . 67.886 9.308 -24.763 1 9.83 ? CA ASN A-4 117 1 
ATOM 6344 C C . ASN A-4 1 117 . 67.857 7.794 -24.614 1 11.44 ? C ASN A-4 117 1 
ATOM 6345 O O . ASN A-4 1 117 . 68.127 7.101 -25.61 1 13.82 ? O ASN A-4 117 1 
ATOM 6346 C CB . ASN A-4 1 117 . 69.296 9.817 -24.467 1 11.42 ? CB ASN A-4 117 1 
ATOM 6347 C CG . ASN A-4 1 117 . 69.591 11.149 -25.116 1 12.81 ? CG ASN A-4 117 1 
ATOM 6348 O OD1 . ASN A-4 1 117 . 68.893 11.616 -26.02 1 14.65 ? OD1 ASN A-4 117 1 
ATOM 6349 N ND2 . ASN A-4 1 117 . 70.675 11.778 -24.625 1 16.66 ? ND2 ASN A-4 117 1 
ATOM 6350 N N . ASP A-4 1 118 . 67.616 7.285 -23.424 0.85 9.6 ? N ASP A-4 118 1 
ATOM 6351 C CA . ASP A-4 1 118 . 67.637 5.868 -23.168 0.85 11.44 ? CA ASP A-4 118 1 
ATOM 6352 C C . ASP A-4 1 118 . 66.243 5.202 -23.288 0.85 12.72 ? C ASP A-4 118 1 
ATOM 6353 O O . ASP A-4 1 118 . 66.107 4.036 -23.019 0.85 15.86 ? O ASP A-4 118 1 
ATOM 6354 C CB . ASP A-4 1 118 . 68.331 5.562 -21.86 0.85 13.44 ? CB ASP A-4 118 1 
ATOM 6355 C CG . ASP A-4 1 118 . 69.794 6.087 -21.851 0.85 18.97 ? CG ASP A-4 118 1 
ATOM 6356 O OD1 . ASP A-4 1 118 . 70.544 5.959 -22.845 0.85 24.02 ? OD1 ASP A-4 118 1 
ATOM 6357 O OD2 . ASP A-4 1 118 . 70.228 6.759 -20.926 0.85 23.93 ? OD2 ASP A-4 118 1 
ATOM 6358 N N . TRP A-4 1 119 . 65.233 5.928 -23.722 1 11.67 ? N TRP A-4 119 1 
ATOM 6359 C CA . TRP A-4 1 119 . 63.888 5.392 -23.985 1 11.02 ? CA TRP A-4 119 1 
ATOM 6360 C C . TRP A-4 1 119 . 63.842 4.944 -25.406 1 9.51 ? C TRP A-4 119 1 
ATOM 6361 O O . TRP A-4 1 119 . 63.791 5.781 -26.297 1 9.97 ? O TRP A-4 119 1 
ATOM 6362 C CB . TRP A-4 1 119 . 62.78 6.386 -23.696 1 10.49 ? CB TRP A-4 119 1 
ATOM 6363 C CG . TRP A-4 1 119 . 62.586 6.801 -22.273 1 13.41 ? CG TRP A-4 119 1 
ATOM 6364 C CD1 . TRP A-4 1 119 . 63.576 7.051 -21.378 1 18.44 ? CD1 TRP A-4 119 1 
ATOM 6365 C CD2 . TRP A-4 1 119 . 61.36 7.028 -21.615 1 13.33 ? CD2 TRP A-4 119 1 
ATOM 6366 N NE1 . TRP A-4 1 119 . 62.981 7.499 -20.181 1 20.76 ? NE1 TRP A-4 119 1 
ATOM 6367 C CE2 . TRP A-4 1 119 . 61.622 7.408 -20.266 1 17.13 ? CE2 TRP A-4 119 1 
ATOM 6368 C CE3 . TRP A-4 1 119 . 60.085 6.96 -22.019 1 12.72 ? CE3 TRP A-4 119 1 
ATOM 6369 C CZ2 . TRP A-4 1 119 . 60.619 7.854 -19.425 1 18.76 ? CZ2 TRP A-4 119 1 
ATOM 6370 C CZ3 . TRP A-4 1 119 . 59.095 7.312 -21.161 1 13.99 ? CZ3 TRP A-4 119 1 
ATOM 6371 C CH2 . TRP A-4 1 119 . 59.349 7.728 -19.873 1 15.54 ? CH2 TRP A-4 119 1 
ATOM 6372 N N . LYS A-4 1 120 . 63.843 3.618 -25.605 0.85 8.86 ? N LYS A-4 120 1 
ATOM 6373 C CA . LYS A-4 1 120 . 63.916 3.018 -26.938 1 9.93 ? CA LYS A-4 120 1 
ATOM 6374 C C . LYS A-4 1 120 . 62.844 1.968 -27.185 1 8.83 ? C LYS A-4 120 1 
ATOM 6375 O O . LYS A-4 1 120 . 62.616 1.592 -28.35 0.87 8.69 ? O LYS A-4 120 1 
ATOM 6376 C CB . LYS A-4 1 120 . 65.288 2.401 -27.129 1 12.63 ? CB LYS A-4 120 1 
ATOM 6377 C CG . LYS A-4 1 120 . 66.378 3.509 -27.092 1 15.58 ? CG LYS A-4 120 1 
ATOM 6378 C CD . LYS A-4 1 120 . 67.673 2.962 -27.184 1 21.8 ? CD LYS A-4 120 1 
ATOM 6379 C CE . LYS A-4 1 120 . 68.773 4.069 -27.052 0.8 37.82 ? CE LYS A-4 120 1 
ATOM 6380 N NZ . LYS A-4 1 120 . 70.164 3.518 -26.883 1 50.17 ? NZ LYS A-4 120 1 
ATOM 6381 N N . ASP A-4 1 121 . 62.173 1.502 -26.183 1 8.97 ? N ASP A-4 121 1 
ATOM 6382 C CA . ASP A-4 1 121 . 61.143 0.476 -26.357 1 8.83 ? CA ASP A-4 121 1 
ATOM 6383 C C . ASP A-4 1 121 . 60.144 0.581 -25.234 1 8.95 ? C ASP A-4 121 1 
ATOM 6384 O O . ASP A-4 1 121 . 60.347 1.345 -24.246 1 8.9 ? O ASP A-4 121 1 
ATOM 6385 C CB . ASP A-4 1 121 . 61.759 -0.933 -26.498 0.84 8.97 ? CB ASP A-4 121 1 
ATOM 6386 C CG . ASP A-4 1 121 . 60.953 -1.911 -27.375 0.89 10.23 ? CG ASP A-4 121 1 
ATOM 6387 O OD1 . ASP A-4 1 121 . 59.808 -1.692 -27.656 0.96 9.73 ? OD1 ASP A-4 121 1 
ATOM 6388 O OD2 . ASP A-4 1 121 . 61.56 -2.884 -27.842 0.74 12.37 ? OD2 ASP A-4 121 1 
ATOM 6389 N N . ILE A-4 1 122 . 59.075 -0.179 -25.359 1 8.9 ? N ILE A-4 122 1 
ATOM 6390 C CA . ILE A-4 1 122 . 57.938 -0.024 -24.496 1 9.96 ? CA ILE A-4 122 1 
ATOM 6391 C C . ILE A-4 1 122 . 58.268 -0.354 -23.045 1 9.77 ? C ILE A-4 122 1 
ATOM 6392 O O . ILE A-4 1 122 . 57.701 0.213 -22.135 1 11.34 ? O ILE A-4 122 1 
ATOM 6393 C CB . ILE A-4 1 122 . 56.762 -0.862 -25.093 1 11.1 ? CB ILE A-4 122 1 
ATOM 6394 C CG1 . ILE A-4 1 122 . 55.423 -0.524 -24.462 1 14.03 ? CG1 ILE A-4 122 1 
ATOM 6395 C CG2 . ILE A-4 1 122 . 56.974 -2.328 -25.068 1 12.56 ? CG2 ILE A-4 122 1 
ATOM 6396 C CD1 . ILE A-4 1 122 . 54.985 0.853 -24.687 1 15.59 ? CD1 ILE A-4 122 1 
ATOM 6397 N N . SER A-4 1 123 . 59.268 -1.226 -22.822 1 10.45 ? N SER A-4 123 1 
ATOM 6398 C CA . SER A-4 1 123 . 59.768 -1.566 -21.484 1 11.92 ? CA SER A-4 123 1 
ATOM 6399 C C . SER A-4 1 123 . 60.498 -0.443 -20.806 1 11.31 ? C SER A-4 123 1 
ATOM 6400 O O . SER A-4 1 123 . 60.713 -0.57 -19.572 1 13.56 ? O SER A-4 123 1 
ATOM 6401 C CB . SER A-4 1 123 . 60.686 -2.808 -21.566 1 15.55 ? CB SER A-4 123 1 
ATOM 6402 O OG . SER A-4 1 123 . 61.703 -2.581 -22.511 1 21.22 ? OG SER A-4 123 1 
ATOM 6403 N N . ASP A-4 1 124 . 60.859 0.615 -21.454 1 8.95 ? N ASP A-4 124 1 
ATOM 6404 C CA . ASP A-4 1 124 . 61.527 1.723 -20.843 1 9.27 ? CA ASP A-4 124 1 
ATOM 6405 C C . ASP A-4 1 124 . 60.556 2.718 -20.174 1 9.42 ? C ASP A-4 124 1 
ATOM 6406 O O . ASP A-4 1 124 . 61.001 3.635 -19.486 1 11.43 ? O ASP A-4 124 1 
ATOM 6407 C CB . ASP A-4 1 124 . 62.361 2.432 -21.884 1 9.94 ? CB ASP A-4 124 1 
ATOM 6408 C CG . ASP A-4 1 124 . 63.494 1.592 -22.418 1 10.3 ? CG ASP A-4 124 1 
ATOM 6409 O OD1 . ASP A-4 1 124 . 64.141 0.901 -21.58 1 12.9 ? OD1 ASP A-4 124 1 
ATOM 6410 O OD2 . ASP A-4 1 124 . 63.714 1.577 -23.621 1 9.65 ? OD2 ASP A-4 124 1 
ATOM 6411 N N . VAL A-4 1 125 . 59.275 2.562 -20.437 1 8.97 ? N VAL A-4 125 1 
ATOM 6412 C CA . VAL A-4 1 125 . 58.291 3.5 -19.918 1 8.19 ? CA VAL A-4 125 1 
ATOM 6413 C C . VAL A-4 1 125 . 57.786 3.02 -18.547 1 8.89 ? C VAL A-4 125 1 
ATOM 6414 O O . VAL A-4 1 125 . 57.501 1.833 -18.361 1 9.9 ? O VAL A-4 125 1 
ATOM 6415 C CB . VAL A-4 1 125 . 57.071 3.542 -20.879 1 8.33 ? CB VAL A-4 125 1 
ATOM 6416 C CG1 . VAL A-4 1 125 . 56.088 4.606 -20.371 1 8.14 ? CG1 VAL A-4 125 1 
ATOM 6417 C CG2 . VAL A-4 1 125 . 57.542 3.839 -22.307 1 9.03 ? CG2 VAL A-4 125 1 
ATOM 6418 N N . PRO A-4 1 126 . 57.625 3.924 -17.571 1 9.05 ? N PRO A-4 126 1 
ATOM 6419 C CA . PRO A-4 1 126 . 57.016 3.491 -16.296 1 9.13 ? CA PRO A-4 126 1 
ATOM 6420 C C . PRO A-4 1 126 . 55.675 2.809 -16.524 1 8.47 ? C PRO A-4 126 1 
ATOM 6421 O O . PRO A-4 1 126 . 54.822 3.302 -17.242 1 8.06 ? O PRO A-4 126 1 
ATOM 6422 C CB . PRO A-4 1 126 . 56.875 4.755 -15.52 1 10.28 ? CB PRO A-4 126 1 
ATOM 6423 C CG . PRO A-4 1 126 . 57.997 5.592 -16.014 1 12.04 ? CG PRO A-4 126 1 
ATOM 6424 C CD . PRO A-4 1 126 . 58.02 5.347 -17.527 1 10.15 ? CD PRO A-4 126 1 
ATOM 6425 N N . LYS A-4 1 127 . 55.476 1.647 -15.875 1 9.37 ? N LYS A-4 127 1 
ATOM 6426 C CA . LYS A-4 1 127 . 54.245 0.9 -16.09 1 10.12 ? CA LYS A-4 127 1 
ATOM 6427 C C . LYS A-4 1 127 . 53.011 1.732 -15.759 1 8.05 ? C LYS A-4 127 1 
ATOM 6428 O O . LYS A-4 1 127 . 51.988 1.659 -16.469 1 8.74 ? O LYS A-4 127 1 
ATOM 6429 C CB . LYS A-4 1 127 . 54.265 -0.387 -15.204 1 19.4 ? CB LYS A-4 127 1 
ATOM 6430 C CG . LYS A-4 1 127 . 53.097 -1.292 -15.486 1 55.16 ? CG LYS A-4 127 1 
ATOM 6431 C CD . LYS A-4 1 127 . 52.922 -1.542 -16.996 1 90.61 ? CD LYS A-4 127 1 
ATOM 6432 C CE . LYS A-4 1 127 . 51.823 -2.548 -17.309 1 122.15 ? CE LYS A-4 127 1 
ATOM 6433 N NZ . LYS A-4 1 127 . 51.788 -2.852 -18.761 1 151.23 ? NZ LYS A-4 127 1 
ATOM 6434 N N . ALA A-4 1 128 . 53.075 2.531 -14.672 1 6.97 ? N ALA A-4 128 1 
ATOM 6435 C CA . ALA A-4 1 128 . 51.928 3.297 -14.3 1 6.77 ? CA ALA A-4 128 1 
ATOM 6436 C C . ALA A-4 1 128 . 51.58 4.345 -15.368 1 6.08 ? C ALA A-4 128 1 
ATOM 6437 O O . ALA A-4 1 128 . 50.396 4.733 -15.473 1 6.5 ? O ALA A-4 128 1 
ATOM 6438 C CB . ALA A-4 1 128 . 52.135 3.978 -12.976 1 7.98 ? CB ALA A-4 128 1 
ATOM 6439 N N . PHE A-4 1 129 . 52.539 4.805 -16.12 1 5.95 ? N PHE A-4 129 1 
ATOM 6440 C CA . PHE A-4 1 129 . 52.298 5.772 -17.16 1 5.88 ? CA PHE A-4 129 1 
ATOM 6441 C C . PHE A-4 1 129 . 51.569 5.116 -18.345 1 5.89 ? C PHE A-4 129 1 
ATOM 6442 O O . PHE A-4 1 129 . 50.614 5.686 -18.879 1 5.78 ? O PHE A-4 129 1 
ATOM 6443 C CB . PHE A-4 1 129 . 53.601 6.449 -17.597 1 6.44 ? CB PHE A-4 129 1 
ATOM 6444 C CG . PHE A-4 1 129 . 53.418 7.625 -18.511 1 6.34 ? CG PHE A-4 129 1 
ATOM 6445 C CD1 . PHE A-4 1 129 . 52.699 8.739 -18.126 1 7.99 ? CD1 PHE A-4 129 1 
ATOM 6446 C CD2 . PHE A-4 1 129 . 53.95 7.624 -19.773 1 7.95 ? CD2 PHE A-4 129 1 
ATOM 6447 C CE1 . PHE A-4 1 129 . 52.538 9.806 -18.993 1 8.99 ? CE1 PHE A-4 129 1 
ATOM 6448 C CE2 . PHE A-4 1 129 . 53.812 8.719 -20.626 1 10.32 ? CE2 PHE A-4 129 1 
ATOM 6449 C CZ . PHE A-4 1 129 . 53.1 9.818 -20.2 1 9.68 ? CZ PHE A-4 129 1 
ATOM 6450 N N . LEU A-4 1 130 . 52.021 3.935 -18.757 1 5.84 ? N LEU A-4 130 1 
ATOM 6451 C CA . LEU A-4 1 130 . 51.258 3.21 -19.771 1 5.78 ? CA LEU A-4 130 1 
ATOM 6452 C C . LEU A-4 1 130 . 49.852 2.971 -19.321 1 5.7 ? C LEU A-4 130 1 
ATOM 6453 O O . LEU A-4 1 130 . 48.893 3.122 -20.08 1 6.45 ? O LEU A-4 130 1 
ATOM 6454 C CB . LEU A-4 1 130 . 51.963 1.895 -20.095 1 6.96 ? CB LEU A-4 130 1 
ATOM 6455 C CG . LEU A-4 1 130 . 53.336 2.004 -20.736 1 7.2 ? CG LEU A-4 130 1 
ATOM 6456 C CD1 . LEU A-4 1 130 . 53.884 0.63 -21.029 1 9.8 ? CD1 LEU A-4 130 1 
ATOM 6457 C CD2 . LEU A-4 1 130 . 53.32 2.835 -22.011 1 8.35 ? CD2 LEU A-4 130 1 
ATOM 6458 N N . ASP A-4 1 131 . 49.659 2.6 -18.053 1 6.12 ? N ASP A-4 131 1 
ATOM 6459 C CA . ASP A-4 1 131 . 48.321 2.365 -17.534 1 6.35 ? CA ASP A-4 131 1 
ATOM 6460 C C . ASP A-4 1 131 . 47.477 3.639 -17.563 1 5.75 ? C ASP A-4 131 1 
ATOM 6461 O O . ASP A-4 1 131 . 46.291 3.571 -17.869 1 6.12 ? O ASP A-4 131 1 
ATOM 6462 C CB . ASP A-4 1 131 . 48.384 1.825 -16.112 1 8.56 ? CB ASP A-4 131 1 
ATOM 6463 C CG . ASP A-4 1 131 . 48.888 0.459 -15.998 1 14.46 ? CG ASP A-4 131 1 
ATOM 6464 O OD1 . ASP A-4 1 131 . 49.095 -0.26 -16.975 1 15.16 ? OD1 ASP A-4 131 1 
ATOM 6465 O OD2 . ASP A-4 1 131 . 49.216 0.116 -14.82 1 20.29 ? OD2 ASP A-4 131 1 
ATOM 6466 N N . GLU A-4 1 132 . 48.075 4.783 -17.234 1 5.63 ? N GLU A-4 132 1 
ATOM 6467 C CA . GLU A-4 1 132 . 47.329 6.027 -17.2 1 5.6 ? CA GLU A-4 132 1 
ATOM 6468 C C . GLU A-4 1 132 . 46.85 6.391 -18.614 1 5.33 ? C GLU A-4 132 1 
ATOM 6469 O O . GLU A-4 1 132 . 45.722 6.905 -18.797 1 5.66 ? O GLU A-4 132 1 
ATOM 6470 C CB . GLU A-4 1 132 . 48.123 7.172 -16.551 1 6.15 ? CB GLU A-4 132 1 
ATOM 6471 C CG . GLU A-4 1 132 . 48.838 8.131 -17.477 1 6.84 ? CG GLU A-4 132 1 
ATOM 6472 C CD . GLU A-4 1 132 . 49.431 9.293 -16.695 1 6.48 ? CD GLU A-4 132 1 
ATOM 6473 O OE1 . GLU A-4 1 132 . 50.078 9.035 -15.643 1 6.69 ? OE1 GLU A-4 132 1 
ATOM 6474 O OE2 . GLU A-4 1 132 . 49.276 10.461 -17.146 1 6.97 ? OE2 GLU A-4 132 1 
ATOM 6475 N N . ILE A-4 1 133 . 47.694 6.168 -19.608 1 5.42 ? N ILE A-4 133 1 
ATOM 6476 C CA . ILE A-4 1 133 . 47.334 6.485 -20.98 1 5.34 ? CA ILE A-4 133 1 
ATOM 6477 C C . ILE A-4 1 133 . 46.198 5.554 -21.428 1 5.33 ? C ILE A-4 133 1 
ATOM 6478 O O . ILE A-4 1 133 . 45.187 6.013 -21.972 1 5.65 ? O ILE A-4 133 1 
ATOM 6479 C CB . ILE A-4 1 133 . 48.547 6.395 -21.937 1 5.79 ? CB ILE A-4 133 1 
ATOM 6480 C CG1 . ILE A-4 1 133 . 49.619 7.412 -21.561 1 6.07 ? CG1 ILE A-4 133 1 
ATOM 6481 C CG2 . ILE A-4 1 133 . 48.091 6.558 -23.363 1 7.06 ? CG2 ILE A-4 133 1 
ATOM 6482 C CD1 . ILE A-4 1 133 . 50.952 7.16 -22.275 1 7.92 ? CD1 ILE A-4 133 1 
ATOM 6483 N N . ALA A-4 1 134 . 46.363 4.269 -21.213 1 5.41 ? N ALA A-4 134 1 
ATOM 6484 C CA . ALA A-4 1 134 . 45.321 3.317 -21.614 1 5.92 ? CA ALA A-4 134 1 
ATOM 6485 C C . ALA A-4 1 134 . 44.002 3.647 -20.927 1 5.6 ? C ALA A-4 134 1 
ATOM 6486 O O . ALA A-4 1 134 . 42.949 3.551 -21.545 1 6.1 ? O ALA A-4 134 1 
ATOM 6487 C CB . ALA A-4 1 134 . 45.789 1.901 -21.299 1 7.1 ? CB ALA A-4 134 1 
ATOM 6488 N N . HIS A-4 1 135 . 44.049 3.969 -19.622 1 5.58 ? N HIS A-4 135 1 
ATOM 6489 C CA . HIS A-4 1 135 . 42.828 4.239 -18.888 1 5.72 ? CA HIS A-4 135 1 
ATOM 6490 C C . HIS A-4 1 135 . 42.088 5.469 -19.439 1 5.59 ? C HIS A-4 135 1 
ATOM 6491 O O . HIS A-4 1 135 . 40.866 5.492 -19.559 1 5.62 ? O HIS A-4 135 1 
ATOM 6492 C CB . HIS A-4 1 135 . 43.116 4.388 -17.414 1 6.16 ? CB HIS A-4 135 1 
ATOM 6493 C CG . HIS A-4 1 135 . 41.905 4.444 -16.565 1 5.81 ? CG HIS A-4 135 1 
ATOM 6494 N ND1 . HIS A-4 1 135 . 41.727 5.405 -15.614 1 6.31 ? ND1 HIS A-4 135 1 
ATOM 6495 C CD2 . HIS A-4 1 135 . 40.848 3.605 -16.531 1 7.03 ? CD2 HIS A-4 135 1 
ATOM 6496 C CE1 . HIS A-4 1 135 . 40.565 5.152 -15.043 1 6.99 ? CE1 HIS A-4 135 1 
ATOM 6497 N NE2 . HIS A-4 1 135 . 40.016 4.071 -15.578 1 7.1 ? NE2 HIS A-4 135 1 
ATOM 6498 N N . PHE A-4 1 136 . 42.866 6.513 -19.761 1 5.36 ? N PHE A-4 136 1 
ATOM 6499 C CA . PHE A-4 1 136 . 42.273 7.673 -20.419 1 5.33 ? CA PHE A-4 136 1 
ATOM 6500 C C . PHE A-4 1 136 . 41.483 7.271 -21.662 1 5.22 ? C PHE A-4 136 1 
ATOM 6501 O O . PHE A-4 1 136 . 40.323 7.657 -21.825 1 5.59 ? O PHE A-4 136 1 
ATOM 6502 C CB . PHE A-4 1 136 . 43.411 8.659 -20.76 1 5.6 ? CB PHE A-4 136 1 
ATOM 6503 C CG . PHE A-4 1 136 . 42.981 9.851 -21.588 1 5.68 ? CG PHE A-4 136 1 
ATOM 6504 C CD1 . PHE A-4 1 136 . 42.402 10.983 -21.003 1 6.1 ? CD1 PHE A-4 136 1 
ATOM 6505 C CD2 . PHE A-4 1 136 . 43.171 9.845 -22.949 1 6.18 ? CD2 PHE A-4 136 1 
ATOM 6506 C CE1 . PHE A-4 1 136 . 42.044 12.054 -21.825 1 6.38 ? CE1 PHE A-4 136 1 
ATOM 6507 C CE2 . PHE A-4 1 136 . 42.787 10.919 -23.747 1 7.41 ? CE2 PHE A-4 136 1 
ATOM 6508 C CZ . PHE A-4 1 136 . 42.229 12.026 -23.148 1 6.09 ? CZ PHE A-4 136 1 
ATOM 6509 N N . PHE A-4 1 137 . 42.117 6.492 -22.544 1 5.22 ? N PHE A-4 137 1 
ATOM 6510 C CA . PHE A-4 1 137 . 41.427 6.099 -23.775 1 5.53 ? CA PHE A-4 137 1 
ATOM 6511 C C . PHE A-4 1 137 . 40.303 5.111 -23.506 1 5.81 ? C PHE A-4 137 1 
ATOM 6512 O O . PHE A-4 1 137 . 39.353 5.061 -24.298 1 6.75 ? O PHE A-4 137 1 
ATOM 6513 C CB . PHE A-4 1 137 . 42.435 5.624 -24.815 1 6.28 ? CB PHE A-4 137 1 
ATOM 6514 C CG . PHE A-4 1 137 . 43.286 6.754 -25.385 1 5.99 ? CG PHE A-4 137 1 
ATOM 6515 C CD1 . PHE A-4 1 137 . 42.711 7.645 -26.261 1 6.04 ? CD1 PHE A-4 137 1 
ATOM 6516 C CD2 . PHE A-4 1 137 . 44.57 6.997 -24.959 1 6.63 ? CD2 PHE A-4 137 1 
ATOM 6517 C CE1 . PHE A-4 1 137 . 43.436 8.713 -26.774 1 6.64 ? CE1 PHE A-4 137 1 
ATOM 6518 C CE2 . PHE A-4 1 137 . 45.305 8.079 -25.439 1 6.81 ? CE2 PHE A-4 137 1 
ATOM 6519 C CZ . PHE A-4 1 137 . 44.729 8.94 -26.363 1 7.09 ? CZ PHE A-4 137 1 
ATOM 6520 N N . GLN A-4 1 138 . 40.36 4.357 -22.435 1 5.69 ? N GLN A-4 138 1 
ATOM 6521 C CA A GLN A-4 1 138 . 39.303 3.462 -22.047 0.58 5.18 ? CA GLN A-4 138 1 
ATOM 6522 C CA B GLN A-4 1 138 . 39.278 3.456 -22.089 0.42 8.58 ? CA GLN A-4 138 1 
ATOM 6523 C C . GLN A-4 1 138 . 38.035 4.216 -21.625 1 5.78 ? C GLN A-4 138 1 
ATOM 6524 O O . GLN A-4 1 138 . 36.939 3.699 -21.846 1 6.9 ? O GLN A-4 138 1 
ATOM 6525 C CB A GLN A-4 1 138 . 39.778 2.557 -20.883 0.58 5 ? CB GLN A-4 138 1 
ATOM 6526 C CB B GLN A-4 1 138 . 39.665 2.521 -20.957 0.42 12.08 ? CB GLN A-4 138 1 
ATOM 6527 C CG A GLN A-4 1 138 . 38.848 1.459 -20.518 0.58 7.28 ? CG GLN A-4 138 1 
ATOM 6528 C CG B GLN A-4 1 138 . 40.577 1.458 -21.362 0.42 12.47 ? CG GLN A-4 138 1 
ATOM 6529 C CD A GLN A-4 1 138 . 39.273 0.574 -19.422 0.58 11.27 ? CD GLN A-4 138 1 
ATOM 6530 C CD B GLN A-4 1 138 . 40.963 0.55 -20.223 0.42 15.04 ? CD GLN A-4 138 1 
ATOM 6531 O OE1 A GLN A-4 1 138 . 38.815 -0.569 -19.378 0.58 18.8 ? OE1 GLN A-4 138 1 
ATOM 6532 O OE1 B GLN A-4 1 138 . 40.998 -0.687 -20.395 0.42 18.94 ? OE1 GLN A-4 138 1 
ATOM 6533 N NE2 A GLN A-4 1 138 . 40.037 1.013 -18.577 0.58 12.35 ? NE2 GLN A-4 138 1 
ATOM 6534 N NE2 B GLN A-4 1 138 . 41.206 1.095 -19.065 0.42 14.43 ? NE2 GLN A-4 138 1 
ATOM 6535 N N . ARG A-4 1 139 . 38.179 5.351 -20.947 1 5.69 ? N ARG A-4 139 1 
ATOM 6536 C CA A ARG A-4 1 139 . 37.068 6.012 -20.224 0.57 5.65 ? CA ARG A-4 139 1 
ATOM 6537 C CA B ARG A-4 1 139 . 37.027 6.002 -20.344 0.43 7.1 ? CA ARG A-4 139 1 
ATOM 6538 C C . ARG A-4 1 139 . 36.663 7.358 -20.842 1 5.81 ? C ARG A-4 139 1 
ATOM 6539 O O . ARG A-4 1 139 . 35.551 7.847 -20.527 1 6.48 ? O ARG A-4 139 1 
ATOM 6540 C CB A ARG A-4 1 139 . 37.293 6.071 -18.7 0.57 5.73 ? CB ARG A-4 139 1 
ATOM 6541 C CB B ARG A-4 1 139 . 37.293 6.184 -18.851 0.43 7.85 ? CB ARG A-4 139 1 
ATOM 6542 C CG A ARG A-4 1 139 . 37.515 4.725 -18.05 0.57 6.63 ? CG ARG A-4 139 1 
ATOM 6543 C CG B ARG A-4 1 139 . 37.342 4.869 -18.038 0.43 9.66 ? CG ARG A-4 139 1 
ATOM 6544 C CD A ARG A-4 1 139 . 36.313 3.801 -18.239 0.57 8.67 ? CD ARG A-4 139 1 
ATOM 6545 C CD B ARG A-4 1 139 . 36.133 3.984 -18.266 0.43 8.53 ? CD ARG A-4 139 1 
ATOM 6546 N NE A ARG A-4 1 139 . 36.534 2.558 -17.523 0.57 9.6 ? NE ARG A-4 139 1 
ATOM 6547 N NE B ARG A-4 1 139 . 36.038 2.913 -17.287 0.43 7.91 ? NE ARG A-4 139 1 
ATOM 6548 C CZ A ARG A-4 1 139 . 36.022 1.412 -17.866 0.57 12.06 ? CZ ARG A-4 139 1 
ATOM 6549 C CZ B ARG A-4 1 139 . 35.098 1.999 -17.33 0.43 8.48 ? CZ ARG A-4 139 1 
ATOM 6550 N NH1 A ARG A-4 1 139 . 35.281 1.298 -18.958 0.57 14.03 ? NH1 ARG A-4 139 1 
ATOM 6551 N NH1 B ARG A-4 1 139 . 34.158 2.008 -18.291 0.43 11.47 ? NH1 ARG A-4 139 1 
ATOM 6552 N NH2 A ARG A-4 1 139 . 36.295 0.364 -17.092 0.57 14.24 ? NH2 ARG A-4 139 1 
ATOM 6553 N NH2 B ARG A-4 1 139 . 35.002 1.083 -16.362 0.43 10.75 ? NH2 ARG A-4 139 1 
ATOM 6554 N N . TYR A-4 1 140 . 37.511 8.018 -21.613 1 5.75 ? N TYR A-4 140 1 
ATOM 6555 C CA . TYR A-4 1 140 . 37.249 9.405 -21.952 1 6.16 ? CA TYR A-4 140 1 
ATOM 6556 C C . TYR A-4 1 140 . 36.013 9.656 -22.826 1 6.02 ? C TYR A-4 140 1 
ATOM 6557 O O . TYR A-4 1 140 . 35.543 10.797 -22.818 1 7.17 ? O TYR A-4 140 1 
ATOM 6558 C CB . TYR A-4 1 140 . 38.479 10.082 -22.604 1 6.11 ? CB TYR A-4 140 1 
ATOM 6559 C CG . TYR A-4 1 140 . 38.763 9.735 -24.042 1 5.87 ? CG TYR A-4 140 1 
ATOM 6560 C CD1 . TYR A-4 1 140 . 38.678 8.41 -24.518 1 5.89 ? CD1 TYR A-4 140 1 
ATOM 6561 C CD2 . TYR A-4 1 140 . 39.209 10.716 -24.918 1 7.11 ? CD2 TYR A-4 140 1 
ATOM 6562 C CE1 . TYR A-4 1 140 . 39.023 8.148 -25.851 1 6.5 ? CE1 TYR A-4 140 1 
ATOM 6563 C CE2 . TYR A-4 1 140 . 39.556 10.456 -26.211 1 7.2 ? CE2 TYR A-4 140 1 
ATOM 6564 C CZ . TYR A-4 1 140 . 39.48 9.144 -26.678 1 6.47 ? CZ TYR A-4 140 1 
ATOM 6565 O OH . TYR A-4 1 140 . 39.86 8.827 -27.955 1 7.76 ? OH TYR A-4 140 1 
ATOM 6566 N N A LYS A-4 1 141 . 35.48 8.599 -23.408 0.65 6.54 ? N LYS A-4 141 1 
ATOM 6567 N N B LYS A-4 1 141 . 35.54 8.709 -23.696 0.35 4.65 ? N LYS A-4 141 1 
ATOM 6568 C CA A LYS A-4 1 141 . 34.265 8.759 -24.235 0.65 6.74 ? CA LYS A-4 141 1 
ATOM 6569 C CA B LYS A-4 1 141 . 34.37 8.887 -24.577 0.35 4.38 ? CA LYS A-4 141 1 
ATOM 6570 C C A LYS A-4 1 141 . 33.065 8.152 -23.547 0.65 5.45 ? C LYS A-4 141 1 
ATOM 6571 C C B LYS A-4 1 141 . 33.086 8.272 -23.958 0.35 4.67 ? C LYS A-4 141 1 
ATOM 6572 O O A LYS A-4 1 141 . 31.989 8.077 -24.13 0.65 6.34 ? O LYS A-4 141 1 
ATOM 6573 O O B LYS A-4 1 141 . 32.03 8.237 -24.617 0.35 4.3 ? O LYS A-4 141 1 
ATOM 6574 C CB A LYS A-4 1 141 . 34.441 8.138 -25.644 0.65 7.81 ? CB LYS A-4 141 1 
ATOM 6575 C CB B LYS A-4 1 141 . 34.626 8.286 -25.959 0.35 5.84 ? CB LYS A-4 141 1 
ATOM 6576 C CG A LYS A-4 1 141 . 35.419 8.883 -26.528 0.65 8.83 ? CG LYS A-4 141 1 
ATOM 6577 C CG B LYS A-4 1 141 . 35.614 9.116 -26.67 0.35 6.48 ? CG LYS A-4 141 1 
ATOM 6578 C CD A LYS A-4 1 141 . 35.438 8.327 -28.006 0.65 11.13 ? CD LYS A-4 141 1 
ATOM 6579 C CD B LYS A-4 1 141 . 35.996 8.53 -28.015 0.35 5.7 ? CD LYS A-4 141 1 
ATOM 6580 C CE A LYS A-4 1 141 . 36.525 9.036 -28.831 0.65 12.78 ? CE LYS A-4 141 1 
ATOM 6581 C CE B LYS A-4 1 141 . 34.786 8.16 -28.86 0.35 8 ? CE LYS A-4 141 1 
ATOM 6582 N NZ A LYS A-4 1 141 . 36.266 8.845 -30.332 0.65 12.01 ? NZ LYS A-4 141 1 
ATOM 6583 N NZ B LYS A-4 1 141 . 35.283 7.668 -30.19 0.35 6.96 ? NZ LYS A-4 141 1 
ATOM 6584 N N A GLU A-4 1 142 . 33.181 7.751 -22.303 0.65 6.12 ? N GLU A-4 142 1 
ATOM 6585 N N B GLU A-4 1 142 . 33.159 7.843 -22.701 0.35 4.14 ? N GLU A-4 142 1 
ATOM 6586 C CA A GLU A-4 1 142 . 32.047 7.046 -21.684 0.65 6.63 ? CA GLU A-4 142 1 
ATOM 6587 C CA B GLU A-4 1 142 . 32.017 7.224 -22.053 0.35 5.65 ? CA GLU A-4 142 1 
ATOM 6588 C C A GLU A-4 1 142 . 30.792 7.952 -21.681 0.65 5.71 ? C GLU A-4 142 1 
ATOM 6589 C C B GLU A-4 1 142 . 30.758 8.065 -22.06 0.35 7.42 ? C GLU A-4 142 1 
ATOM 6590 O O A GLU A-4 1 142 . 29.695 7.499 -21.992 0.65 6.22 ? O GLU A-4 142 1 
ATOM 6591 O O B GLU A-4 1 142 . 29.629 7.562 -22.412 0.35 14.7 ? O GLU A-4 142 1 
ATOM 6592 C CB A GLU A-4 1 142 . 32.418 6.557 -20.334 0.65 6.24 ? CB GLU A-4 142 1 
ATOM 6593 C CB B GLU A-4 1 142 . 32.378 6.863 -20.602 0.35 8.82 ? CB GLU A-4 142 1 
ATOM 6594 C CG A GLU A-4 1 142 . 31.456 5.756 -19.761 0.65 8.74 ? CG GLU A-4 142 1 
ATOM 6595 C CG B GLU A-4 1 142 . 33.08 5.468 -20.495 0.35 14.22 ? CG GLU A-4 142 1 
ATOM 6596 C CD A GLU A-4 1 142 . 31.891 5.068 -18.445 0.65 9.36 ? CD GLU A-4 142 1 
ATOM 6597 C CD B GLU A-4 1 142 . 33.152 4.767 -19.103 0.35 13.68 ? CD GLU A-4 142 1 
ATOM 6598 O OE1 A GLU A-4 1 142 . 33.045 5.39 -17.887 0.65 7.7 ? OE1 GLU A-4 142 1 
ATOM 6599 O OE1 B GLU A-4 1 142 . 32.901 5.35 -18.041 0.35 16.25 ? OE1 GLU A-4 142 1 
ATOM 6600 O OE2 A GLU A-4 1 142 . 31.114 4.192 -18.03 0.65 15.28 ? OE2 GLU A-4 142 1 
ATOM 6601 O OE2 B GLU A-4 1 142 . 33.289 3.522 -19.175 0.35 15.47 ? OE2 GLU A-4 142 1 
ATOM 6602 N N . LEU A-4 1 143 . 30.892 9.273 -21.473 1 7.31 ? N LEU A-4 143 1 
ATOM 6603 C CA . LEU A-4 1 143 . 29.72 10.129 -21.41 1 7.31 ? CA LEU A-4 143 1 
ATOM 6604 C C . LEU A-4 1 143 . 29.183 10.494 -22.793 1 8.47 ? C LEU A-4 143 1 
ATOM 6605 O O . LEU A-4 1 143 . 28.047 10.972 -22.901 1 10.57 ? O LEU A-4 143 1 
ATOM 6606 C CB . LEU A-4 1 143 . 29.994 11.413 -20.627 1 7.31 ? CB LEU A-4 143 1 
ATOM 6607 C CG . LEU A-4 1 143 . 30.254 11.22 -19.116 1 8.14 ? CG LEU A-4 143 1 
ATOM 6608 C CD1 . LEU A-4 1 143 . 30.445 12.61 -18.506 1 7.91 ? CD1 LEU A-4 143 1 
ATOM 6609 C CD2 . LEU A-4 1 143 . 29.12 10.477 -18.453 1 11.51 ? CD2 LEU A-4 143 1 
ATOM 6610 N N . GLN A-4 1 144 . 29.968 10.281 -23.833 1 8.41 ? N GLN A-4 144 1 
ATOM 6611 C CA . GLN A-4 1 144 . 29.449 10.387 -25.187 1 10.9 ? CA GLN A-4 144 1 
ATOM 6612 C C . GLN A-4 1 144 . 28.697 9.172 -25.653 1 11.54 ? C GLN A-4 144 1 
ATOM 6613 O O . GLN A-4 1 144 . 28.085 9.166 -26.711 1 14.83 ? O GLN A-4 144 1 
ATOM 6614 C CB . GLN A-4 1 144 . 30.565 10.622 -26.171 1 10.83 ? CB GLN A-4 144 1 
ATOM 6615 C CG . GLN A-4 1 144 . 31.32 11.9 -25.954 1 11.64 ? CG GLN A-4 144 1 
ATOM 6616 C CD . GLN A-4 1 144 . 32.503 12.097 -26.938 1 12.36 ? CD GLN A-4 144 1 
ATOM 6617 O OE1 . GLN A-4 1 144 . 33.702 12.201 -26.585 1 13.75 ? OE1 GLN A-4 144 1 
ATOM 6618 N NE2 . GLN A-4 1 144 . 32.149 12.198 -28.191 1 15.89 ? NE2 GLN A-4 144 1 
ATOM 6619 N N . GLY A-4 1 145 . 28.737 8.11 -24.893 1 11.6 ? N GLY A-4 145 1 
ATOM 6620 C CA . GLY A-4 1 145 . 28.051 6.886 -25.305 1 13.97 ? CA GLY A-4 145 1 
ATOM 6621 C C . GLY A-4 1 145 . 28.768 6.202 -26.459 1 14.34 ? C GLY A-4 145 1 
ATOM 6622 O O . GLY A-4 1 145 . 28.109 5.488 -27.184 1 20.37 ? O GLY A-4 145 1 
ATOM 6623 N N . LYS A-4 1 146 . 30.066 6.36 -26.587 1 10.17 ? N LYS A-4 146 1 
ATOM 6624 C CA . LYS A-4 1 146 . 30.826 5.742 -27.646 1 10 ? CA LYS A-4 146 1 
ATOM 6625 C C . LYS A-4 1 146 . 31.751 4.702 -27.066 1 11.72 ? C LYS A-4 146 1 
ATOM 6626 O O . LYS A-4 1 146 . 32.363 4.94 -26.06 1 22.27 ? O LYS A-4 146 1 
ATOM 6627 C CB . LYS A-4 1 146 . 31.578 6.736 -28.449 1 12.21 ? CB LYS A-4 146 1 
ATOM 6628 C CG . LYS A-4 1 146 . 30.609 7.715 -29.168 1 22.54 ? CG LYS A-4 146 1 
ATOM 6629 C CD . LYS A-4 1 146 . 31.318 8.725 -30.028 1 52.94 ? CD LYS A-4 146 1 
ATOM 6630 C CE . LYS A-4 1 146 . 30.351 9.455 -30.894 1 80.4 ? CE LYS A-4 146 1 
ATOM 6631 N NZ . LYS A-4 1 146 . 31.041 10.393 -31.811 1 103.43 ? NZ LYS A-4 146 1 
ATOM 6632 N N . THR A-4 1 147 . 31.889 3.582 -27.693 1 7.27 ? N THR A-4 147 1 
ATOM 6633 C CA . THR A-4 1 147 . 32.687 2.468 -27.18 1 6.89 ? CA THR A-4 147 1 
ATOM 6634 C C . THR A-4 1 147 . 34.118 2.548 -27.64 1 6.26 ? C THR A-4 147 1 
ATOM 6635 O O . THR A-4 1 147 . 34.399 2.733 -28.798 1 8.18 ? O THR A-4 147 1 
ATOM 6636 C CB . THR A-4 1 147 . 32.059 1.155 -27.678 1 7.69 ? CB THR A-4 147 1 
ATOM 6637 O OG1 . THR A-4 1 147 . 30.76 1.081 -27.049 1 9.78 ? OG1 THR A-4 147 1 
ATOM 6638 C CG2 . THR A-4 1 147 . 32.894 -0.046 -27.376 1 9.33 ? CG2 THR A-4 147 1 
ATOM 6639 N N . THR A-4 1 148 . 35.015 2.329 -26.678 1 6.5 ? N THR A-4 148 1 
ATOM 6640 C CA . THR A-4 1 148 . 36.424 2.138 -26.993 1 6.74 ? CA THR A-4 148 1 
ATOM 6641 C C . THR A-4 1 148 . 36.883 0.834 -26.344 1 6.73 ? C THR A-4 148 1 
ATOM 6642 O O . THR A-4 1 148 . 36.323 0.387 -25.323 1 8.17 ? O THR A-4 148 1 
ATOM 6643 C CB . THR A-4 1 148 . 37.307 3.292 -26.5 1 7.06 ? CB THR A-4 148 1 
ATOM 6644 O OG1 . THR A-4 1 148 . 37.347 3.23 -25.064 1 8.84 ? OG1 THR A-4 148 1 
ATOM 6645 C CG2 . THR A-4 1 148 . 36.802 4.638 -26.977 1 7.62 ? CG2 THR A-4 148 1 
ATOM 6646 N N . LYS A-4 1 149 . 37.9 0.236 -26.923 1 7.22 ? N LYS A-4 149 1 
ATOM 6647 C CA . LYS A-4 1 149 . 38.494 -0.981 -26.374 1 8.59 ? CA LYS A-4 149 1 
ATOM 6648 C C . LYS A-4 1 149 . 40 -0.842 -26.47 1 8.3 ? C LYS A-4 149 1 
ATOM 6649 O O . LYS A-4 1 149 . 40.524 -0.558 -27.54 1 9.71 ? O LYS A-4 149 1 
ATOM 6650 C CB . LYS A-4 1 149 . 38.05 -2.211 -27.126 1 11.47 ? CB LYS A-4 149 1 
ATOM 6651 C CG . LYS A-4 1 149 . 38.476 -3.487 -26.54 1 18.91 ? CG LYS A-4 149 1 
ATOM 6652 C CD . LYS A-4 1 149 . 37.842 -4.745 -27.217 1 24.49 ? CD LYS A-4 149 1 
ATOM 6653 C CE . LYS A-4 1 149 . 36.322 -4.713 -27.246 1 27.79 ? CE LYS A-4 149 1 
ATOM 6654 N NZ . LYS A-4 1 149 . 35.862 -6.171 -27.584 1 30.16 ? NZ LYS A-4 149 1 
ATOM 6655 N N . ILE A-4 1 150 . 40.701 -1.088 -25.363 1 8.1 ? N ILE A-4 150 1 
ATOM 6656 C CA . ILE A-4 1 150 . 42.13 -1.044 -25.349 1 8.49 ? CA ILE A-4 150 1 
ATOM 6657 C C . ILE A-4 1 150 . 42.645 -2.469 -25.14 1 9.29 ? C ILE A-4 150 1 
ATOM 6658 O O . ILE A-4 1 150 . 42.361 -3.08 -24.114 1 14.86 ? O ILE A-4 150 1 
ATOM 6659 C CB . ILE A-4 1 150 . 42.682 -0.069 -24.252 1 12.17 ? CB ILE A-4 150 1 
ATOM 6660 C CG1 . ILE A-4 1 150 . 41.924 1.239 -24.222 1 16.32 ? CG1 ILE A-4 150 1 
ATOM 6661 C CG2 . ILE A-4 1 150 . 44.243 0.037 -24.402 1 15.08 ? CG2 ILE A-4 150 1 
ATOM 6662 C CD1 . ILE A-4 1 150 . 42.059 2.001 -25.431 1 20.28 ? CD1 ILE A-4 150 1 
ATOM 6663 N N . GLU A-4 1 151 . 43.331 -2.974 -26.09 0.79 7.82 ? N GLU A-4 151 1 
ATOM 6664 C CA . GLU A-4 1 151 . 43.873 -4.336 -26.046 0.79 10.79 ? CA GLU A-4 151 1 
ATOM 6665 C C . GLU A-4 1 151 . 45.128 -4.499 -25.295 0.79 13.76 ? C GLU A-4 151 1 
ATOM 6666 O O . GLU A-4 1 151 . 45.288 -5.532 -24.573 0.79 17.94 ? O GLU A-4 151 1 
ATOM 6667 C CB . GLU A-4 1 151 . 43.926 -4.925 -27.468 0.79 14.75 ? CB GLU A-4 151 1 
ATOM 6668 C CG . GLU A-4 1 151 . 44.725 -6.157 -27.606 0.79 27.48 ? CG GLU A-4 151 1 
ATOM 6669 C CD . GLU A-4 1 151 . 45.082 -6.536 -29.101 0.79 29.46 ? CD GLU A-4 151 1 
ATOM 6670 O OE1 . GLU A-4 1 151 . 45.908 -7.455 -29.219 0.79 29.14 ? OE1 GLU A-4 151 1 
ATOM 6671 O OE2 . GLU A-4 1 151 . 44.566 -6.013 -30.181 0.79 29.71 ? OE2 GLU A-4 151 1 
ATOM 6672 N N . GLY A-4 1 152 . 45.911 -3.507 -25.235 1 11.58 ? N GLY A-4 152 1 
ATOM 6673 C CA . GLY A-4 1 152 . 47.249 -3.465 -24.613 1 11.7 ? CA GLY A-4 152 1 
ATOM 6674 C C . GLY A-4 1 152 . 48.208 -2.685 -25.512 1 8.45 ? C GLY A-4 152 1 
ATOM 6675 O O . GLY A-4 1 152 . 47.792 -1.825 -26.259 1 9.67 ? O GLY A-4 152 1 
ATOM 6676 N N . TRP A-4 1 153 . 49.483 -3.006 -25.315 1 8.01 ? N TRP A-4 153 1 
ATOM 6677 C CA . TRP A-4 1 153 . 50.576 -2.28 -25.931 1 8.04 ? CA TRP A-4 153 1 
ATOM 6678 C C . TRP A-4 1 153 . 51.406 -3.229 -26.782 1 8.17 ? C TRP A-4 153 1 
ATOM 6679 O O . TRP A-4 1 153 . 51.673 -4.366 -26.377 1 12.71 ? O TRP A-4 153 1 
ATOM 6680 C CB . TRP A-4 1 153 . 51.487 -1.63 -24.861 1 8.95 ? CB TRP A-4 153 1 
ATOM 6681 C CG . TRP A-4 1 153 . 50.804 -0.606 -24.051 1 8.38 ? CG TRP A-4 153 1 
ATOM 6682 C CD1 . TRP A-4 1 153 . 50.066 -0.791 -22.937 1 8.87 ? CD1 TRP A-4 153 1 
ATOM 6683 C CD2 . TRP A-4 1 153 . 50.739 0.786 -24.358 1 7.11 ? CD2 TRP A-4 153 1 
ATOM 6684 N NE1 . TRP A-4 1 153 . 49.536 0.409 -22.506 1 9.09 ? NE1 TRP A-4 153 1 
ATOM 6685 C CE2 . TRP A-4 1 153 . 49.936 1.388 -23.37 1 7.9 ? CE2 TRP A-4 153 1 
ATOM 6686 C CE3 . TRP A-4 1 153 . 51.273 1.605 -25.363 1 7.32 ? CE3 TRP A-4 153 1 
ATOM 6687 C CZ2 . TRP A-4 1 153 . 49.686 2.75 -23.357 1 8.09 ? CZ2 TRP A-4 153 1 
ATOM 6688 C CZ3 . TRP A-4 1 153 . 51.035 2.953 -25.319 1 7.54 ? CZ3 TRP A-4 153 1 
ATOM 6689 C CH2 . TRP A-4 1 153 . 50.232 3.51 -24.312 1 7.81 ? CH2 TRP A-4 153 1 
ATOM 6690 N N . GLY A-4 1 154 . 51.864 -2.746 -27.884 1 7.35 ? N GLY A-4 154 1 
ATOM 6691 C CA . GLY A-4 1 154 . 52.898 -3.374 -28.68 1 7.77 ? CA GLY A-4 154 1 
ATOM 6692 C C . GLY A-4 1 154 . 54.231 -2.666 -28.564 1 6.88 ? C GLY A-4 154 1 
ATOM 6693 O O . GLY A-4 1 154 . 54.298 -1.498 -28.135 1 7.17 ? O GLY A-4 154 1 
ATOM 6694 N N . ASN A-4 1 155 . 55.289 -3.359 -28.94 1 7.28 ? N ASN A-4 155 1 
ATOM 6695 C CA . ASN A-4 1 155 . 56.606 -2.854 -28.841 1 7.43 ? CA ASN A-4 155 1 
ATOM 6696 C C . ASN A-4 1 155 . 56.984 -1.962 -30.011 1 6.97 ? C ASN A-4 155 1 
ATOM 6697 O O . ASN A-4 1 155 . 56.182 -1.668 -30.925 1 7.57 ? O ASN A-4 155 1 
ATOM 6698 C CB . ASN A-4 1 155 . 57.602 -3.999 -28.63 1 8.61 ? CB ASN A-4 155 1 
ATOM 6699 C CG . ASN A-4 1 155 . 57.737 -4.932 -29.798 1 10.04 ? CG ASN A-4 155 1 
ATOM 6700 O OD1 . ASN A-4 1 155 . 58.314 -6.061 -29.562 1 14.72 ? OD1 ASN A-4 155 1 
ATOM 6701 N ND2 . ASN A-4 1 155 . 57.363 -4.604 -30.926 1 8.45 ? ND2 ASN A-4 155 1 
ATOM 6702 N N . ALA A-4 1 156 . 58.196 -1.472 -30.002 1 7.3 ? N ALA A-4 156 1 
ATOM 6703 C CA . ALA A-4 1 156 . 58.631 -0.516 -31.008 1 7.65 ? CA ALA A-4 156 1 
ATOM 6704 C C . ALA A-4 1 156 . 58.608 -1.124 -32.386 1 7.83 ? C ALA A-4 156 1 
ATOM 6705 O O . ALA A-4 1 156 . 58.305 -0.431 -33.383 1 8.21 ? O ALA A-4 156 1 
ATOM 6706 C CB . ALA A-4 1 156 . 60.042 -0.002 -30.66 1 9.3 ? CB ALA A-4 156 1 
ATOM 6707 N N A GLU A-4 1 157 . 59.002 -2.376 -32.578 0.56 8.06 ? N GLU A-4 157 1 
ATOM 6708 N N B GLU A-4 1 157 . 58.906 -2.408 -32.451 0.44 7.89 ? N GLU A-4 157 1 
ATOM 6709 C CA A GLU A-4 1 157 . 58.902 -3.01 -33.893 0.56 9.17 ? CA GLU A-4 157 1 
ATOM 6710 C CA B GLU A-4 1 157 . 58.914 -3.064 -33.734 0.44 8.8 ? CA GLU A-4 157 1 
ATOM 6711 C C A GLU A-4 1 157 . 57.453 -3.029 -34.357 0.56 8.6 ? C GLU A-4 157 1 
ATOM 6712 C C B GLU A-4 1 157 . 57.525 -3.174 -34.347 0.44 8.83 ? C GLU A-4 157 1 
ATOM 6713 O O A GLU A-4 1 157 . 57.194 -2.722 -35.529 0.56 8.06 ? O GLU A-4 157 1 
ATOM 6714 O O B GLU A-4 1 157 . 57.335 -3.016 -35.559 0.44 9.77 ? O GLU A-4 157 1 
ATOM 6715 C CB A GLU A-4 1 157 . 59.508 -4.43 -33.836 0.56 10.69 ? CB GLU A-4 157 1 
ATOM 6716 C CB B GLU A-4 1 157 . 59.515 -4.445 -33.621 0.44 10.6 ? CB GLU A-4 157 1 
ATOM 6717 C CG A GLU A-4 1 157 . 61.024 -4.437 -33.529 0.56 14.71 ? CG GLU A-4 157 1 
ATOM 6718 C CG B GLU A-4 1 157 . 59.402 -5.148 -34.928 0.44 11.73 ? CG GLU A-4 157 1 
ATOM 6719 C CD A GLU A-4 1 157 . 61.966 -3.755 -34.592 0.56 18.56 ? CD GLU A-4 157 1 
ATOM 6720 C CD B GLU A-4 1 157 . 60.232 -4.575 -36.046 0.44 15.17 ? CD GLU A-4 157 1 
ATOM 6721 O OE1 A GLU A-4 1 157 . 62.968 -2.976 -34.28 0.56 19.99 ? OE1 GLU A-4 157 1 
ATOM 6722 O OE1 B GLU A-4 1 157 . 60.095 -5.11 -37.216 0.44 21.23 ? OE1 GLU A-4 157 1 
ATOM 6723 O OE2 A GLU A-4 1 157 . 61.851 -4.035 -35.781 0.56 22.25 ? OE2 GLU A-4 157 1 
ATOM 6724 O OE2 B GLU A-4 1 157 . 61.05 -3.669 -35.856 0.44 17.97 ? OE2 GLU A-4 157 1 
ATOM 6725 N N . GLU A-4 1 158 . 56.518 -3.414 -33.52 1 8.26 ? N GLU A-4 158 1 
ATOM 6726 C CA . GLU A-4 1 158 . 55.151 -3.441 -33.979 1 8.54 ? CA GLU A-4 158 1 
ATOM 6727 C C . GLU A-4 1 158 . 54.673 -2.035 -34.36 1 8.14 ? C GLU A-4 158 1 
ATOM 6728 O O . GLU A-4 1 158 . 53.912 -1.853 -35.315 1 8.62 ? O GLU A-4 158 1 
ATOM 6729 C CB . GLU A-4 1 158 . 54.236 -4.032 -32.884 1 9.5 ? CB GLU A-4 158 1 
ATOM 6730 C CG . GLU A-4 1 158 . 52.889 -4.394 -33.403 1 10.88 ? CG GLU A-4 158 1 
ATOM 6731 C CD . GLU A-4 1 158 . 52.043 -5.298 -32.523 1 11.68 ? CD GLU A-4 158 1 
ATOM 6732 O OE1 . GLU A-4 1 158 . 52.423 -5.584 -31.344 1 12.82 ? OE1 GLU A-4 158 1 
ATOM 6733 O OE2 . GLU A-4 1 158 . 50.995 -5.756 -33.037 1 14.3 ? OE2 GLU A-4 158 1 
ATOM 6734 N N . ALA A-4 1 159 . 55.126 -1.029 -33.6 1 6.98 ? N ALA A-4 159 1 
ATOM 6735 C CA . ALA A-4 1 159 . 54.784 0.353 -33.934 1 7.04 ? CA ALA A-4 159 1 
ATOM 6736 C C . ALA A-4 1 159 . 55.307 0.749 -35.299 1 7.02 ? C ALA A-4 159 1 
ATOM 6737 O O . ALA A-4 1 159 . 54.607 1.364 -36.11 1 7.41 ? O ALA A-4 159 1 
ATOM 6738 C CB . ALA A-4 1 159 . 55.382 1.283 -32.872 1 7.75 ? CB ALA A-4 159 1 
ATOM 6739 N N . LYS A-4 1 160 . 56.581 0.431 -35.558 1 6.96 ? N LYS A-4 160 1 
ATOM 6740 C CA . LYS A-4 1 160 . 57.207 0.75 -36.828 1 7.49 ? CA LYS A-4 160 1 
ATOM 6741 C C . LYS A-4 1 160 . 56.498 0.077 -37.998 1 7.88 ? C LYS A-4 160 1 
ATOM 6742 O O . LYS A-4 1 160 . 56.299 0.693 -39.045 1 8.26 ? O LYS A-4 160 1 
ATOM 6743 C CB . LYS A-4 1 160 . 58.685 0.443 -36.794 1 8.24 ? CB LYS A-4 160 1 
ATOM 6744 C CG . LYS A-4 1 160 . 59.444 1.394 -35.86 1 9 ? CG LYS A-4 160 1 
ATOM 6745 C CD . LYS A-4 1 160 . 60.92 1.136 -35.811 1 11.31 ? CD LYS A-4 160 1 
ATOM 6746 C CE . LYS A-4 1 160 . 61.272 -0.161 -35.297 1 14.26 ? CE LYS A-4 160 1 
ATOM 6747 N NZ . LYS A-4 1 160 . 62.776 -0.342 -35.248 1 17.19 ? NZ LYS A-4 160 1 
ATOM 6748 N N . ARG A-4 1 161 . 56.113 -1.194 -37.821 1 7.94 ? N ARG A-4 161 1 
ATOM 6749 C CA . ARG A-4 1 161 . 55.355 -1.853 -38.887 1 9.02 ? CA ARG A-4 161 1 
ATOM 6750 C C . ARG A-4 1 161 . 54.046 -1.144 -39.153 1 7.95 ? C ARG A-4 161 1 
ATOM 6751 O O . ARG A-4 1 161 . 53.6 -1.028 -40.312 1 8.5 ? O ARG A-4 161 1 
ATOM 6752 C CB . ARG A-4 1 161 . 55.135 -3.306 -38.51 1 10.76 ? CB ARG A-4 161 1 
ATOM 6753 C CG . ARG A-4 1 161 . 56.396 -4.138 -38.541 1 15.91 ? CG ARG A-4 161 1 
ATOM 6754 C CD . ARG A-4 1 161 . 56.132 -5.685 -38.488 1 26.83 ? CD ARG A-4 161 1 
ATOM 6755 N NE . ARG A-4 1 161 . 55.496 -6.141 -37.228 1 35.18 ? NE ARG A-4 161 1 
ATOM 6756 C CZ . ARG A-4 1 161 . 56.154 -6.524 -36.111 1 46.06 ? CZ ARG A-4 161 1 
ATOM 6757 N NH1 . ARG A-4 1 161 . 57.483 -6.596 -36.126 1 61.49 ? NH1 ARG A-4 161 1 
ATOM 6758 N NH2 . ARG A-4 1 161 . 55.48 -6.888 -35.032 1 51.06 ? NH2 ARG A-4 161 1 
ATOM 6759 N N . GLU A-4 1 162 . 53.364 -0.66 -38.112 1 7.13 ? N GLU A-4 162 1 
ATOM 6760 C CA . GLU A-4 1 162 . 52.114 0.014 -38.296 1 7.33 ? CA GLU A-4 162 1 
ATOM 6761 C C . GLU A-4 1 162 . 52.283 1.368 -38.98 1 6.76 ? C GLU A-4 162 1 
ATOM 6762 O O . GLU A-4 1 162 . 51.443 1.77 -39.795 1 7.13 ? O GLU A-4 162 1 
ATOM 6763 C CB . GLU A-4 1 162 . 51.327 0.131 -37.007 1 7.46 ? CB GLU A-4 162 1 
ATOM 6764 C CG . GLU A-4 1 162 . 49.822 0.314 -37.22 1 7.52 ? CG GLU A-4 162 1 
ATOM 6765 C CD . GLU A-4 1 162 . 49.109 -0.898 -37.781 1 8.3 ? CD GLU A-4 162 1 
ATOM 6766 O OE1 . GLU A-4 1 162 . 49.753 -1.98 -37.87 1 10.45 ? OE1 GLU A-4 162 1 
ATOM 6767 O OE2 . GLU A-4 1 162 . 47.904 -0.768 -38.053 1 8.26 ? OE2 GLU A-4 162 1 
ATOM 6768 N N . ILE A-4 1 163 . 53.364 2.074 -38.664 1 6.57 ? N ILE A-4 163 1 
ATOM 6769 C CA . ILE A-4 1 163 . 53.679 3.314 -39.364 1 6.37 ? CA ILE A-4 163 1 
ATOM 6770 C C . ILE A-4 1 163 . 53.809 3.029 -40.864 1 6.92 ? C ILE A-4 163 1 
ATOM 6771 O O . ILE A-4 1 163 . 53.258 3.771 -41.687 1 7.33 ? O ILE A-4 163 1 
ATOM 6772 C CB . ILE A-4 1 163 . 54.963 3.926 -38.797 1 7.08 ? CB ILE A-4 163 1 
ATOM 6773 C CG1 . ILE A-4 1 163 . 54.746 4.452 -37.373 1 6.6 ? CG1 ILE A-4 163 1 
ATOM 6774 C CG2 . ILE A-4 1 163 . 55.519 5.003 -39.717 1 7.57 ? CG2 ILE A-4 163 1 
ATOM 6775 C CD1 . ILE A-4 1 163 . 55.995 4.741 -36.593 1 7.43 ? CD1 ILE A-4 163 1 
ATOM 6776 N N . LEU A-4 1 164 . 54.527 1.979 -41.234 1 7.17 ? N LEU A-4 164 1 
ATOM 6777 C CA . LEU A-4 1 164 . 54.67 1.679 -42.67 1 7.92 ? CA LEU A-4 164 1 
ATOM 6778 C C . LEU A-4 1 164 . 53.337 1.387 -43.276 1 7.73 ? C LEU A-4 164 1 
ATOM 6779 O O . LEU A-4 1 164 . 53.091 1.868 -44.424 1 8.39 ? O LEU A-4 164 1 
ATOM 6780 C CB . LEU A-4 1 164 . 55.618 0.489 -42.824 1 9.68 ? CB LEU A-4 164 1 
ATOM 6781 C CG . LEU A-4 1 164 . 57.051 0.762 -42.422 1 10.69 ? CG LEU A-4 164 1 
ATOM 6782 C CD1 . LEU A-4 1 164 . 57.859 -0.533 -42.522 1 14.89 ? CD1 LEU A-4 164 1 
ATOM 6783 C CD2 . LEU A-4 1 164 . 57.701 1.852 -43.212 1 13.66 ? CD2 LEU A-4 164 1 
ATOM 6784 N N . ARG A-4 1 165 . 52.444 0.683 -42.619 1 7.53 ? N ARG A-4 165 1 
ATOM 6785 C CA . ARG A-4 1 165 . 51.095 0.437 -43.151 1 7.54 ? CA ARG A-4 165 1 
ATOM 6786 C C . ARG A-4 1 165 . 50.363 1.744 -43.367 1 7.52 ? C ARG A-4 165 1 
ATOM 6787 O O . ARG A-4 1 165 . 49.728 1.934 -44.429 1 8.14 ? O ARG A-4 165 1 
ATOM 6788 C CB . ARG A-4 1 165 . 50.327 -0.437 -42.176 1 8.17 ? CB ARG A-4 165 1 
ATOM 6789 C CG . ARG A-4 1 165 . 48.86 -0.579 -42.539 1 9.58 ? CG ARG A-4 165 1 
ATOM 6790 C CD . ARG A-4 1 165 . 48.132 -1.555 -41.645 1 10.42 ? CD ARG A-4 165 1 
ATOM 6791 N NE . ARG A-4 1 165 . 46.71 -1.642 -42.055 0.93 10.16 ? NE ARG A-4 165 1 
ATOM 6792 C CZ . ARG A-4 1 165 . 45.658 -1.048 -41.462 0.88 8.73 ? CZ ARG A-4 165 1 
ATOM 6793 N NH1 . ARG A-4 1 165 . 44.465 -1.12 -42.013 1 10.57 ? NH1 ARG A-4 165 1 
ATOM 6794 N NH2 . ARG A-4 1 165 . 45.796 -0.466 -40.278 1 10.08 ? NH2 ARG A-4 165 1 
ATOM 6795 N N . ALA A-4 1 166 . 50.386 2.641 -42.391 1 7.02 ? N ALA A-4 166 1 
ATOM 6796 C CA . ALA A-4 1 166 . 49.628 3.892 -42.465 1 6.68 ? CA ALA A-4 166 1 
ATOM 6797 C C . ALA A-4 1 166 . 50.135 4.783 -43.596 1 6.82 ? C ALA A-4 166 1 
ATOM 6798 O O . ALA A-4 1 166 . 49.361 5.504 -44.234 1 7.05 ? O ALA A-4 166 1 
ATOM 6799 C CB . ALA A-4 1 166 . 49.674 4.582 -41.127 1 7.28 ? CB ALA A-4 166 1 
ATOM 6800 N N . ILE A-4 1 167 . 51.456 4.769 -43.827 1 7.08 ? N ILE A-4 167 1 
ATOM 6801 C CA . ILE A-4 1 167 . 52.044 5.504 -44.931 1 7.36 ? CA ILE A-4 167 1 
ATOM 6802 C C . ILE A-4 1 167 . 51.494 4.971 -46.283 1 7.73 ? C ILE A-4 167 1 
ATOM 6803 O O . ILE A-4 1 167 . 51.158 5.77 -47.162 1 8.71 ? O ILE A-4 167 1 
ATOM 6804 C CB . ILE A-4 1 167 . 53.566 5.4 -44.878 1 8 ? CB ILE A-4 167 1 
ATOM 6805 C CG1 . ILE A-4 1 167 . 54.064 6.254 -43.695 1 8.5 ? CG1 ILE A-4 167 1 
ATOM 6806 C CG2 . ILE A-4 1 167 . 54.244 5.762 -46.173 1 9.65 ? CG2 ILE A-4 167 1 
ATOM 6807 C CD1 . ILE A-4 1 167 . 55.526 6.131 -43.425 1 10.01 ? CD1 ILE A-4 167 1 
ATOM 6808 N N . GLU A-4 1 168 . 51.381 3.652 -46.405 1 8.34 ? N GLU A-4 168 1 
ATOM 6809 C CA . GLU A-4 1 168 . 50.826 3.087 -47.64 1 8.74 ? CA GLU A-4 168 1 
ATOM 6810 C C . GLU A-4 1 168 . 49.325 3.384 -47.767 1 8.52 ? C GLU A-4 168 1 
ATOM 6811 O O . GLU A-4 1 168 . 48.853 3.578 -48.898 1 10.05 ? O GLU A-4 168 1 
ATOM 6812 C CB . GLU A-4 1 168 . 51.069 1.584 -47.699 1 9.72 ? CB GLU A-4 168 1 
ATOM 6813 C CG . GLU A-4 1 168 . 52.549 1.248 -47.745 1 11.73 ? CG GLU A-4 168 1 
ATOM 6814 C CD . GLU A-4 1 168 . 53.303 1.942 -48.866 1 12.77 ? CD GLU A-4 168 1 
ATOM 6815 O OE1 . GLU A-4 1 168 . 54.426 2.52 -48.616 1 16.08 ? OE1 GLU A-4 168 1 
ATOM 6816 O OE2 . GLU A-4 1 168 . 52.766 2.06 -49.987 1 12.98 ? OE2 GLU A-4 168 1 
ATOM 6817 N N . MET A-4 1 169 . 48.609 3.451 -46.665 1 8.29 ? N MET A-4 169 1 
ATOM 6818 C CA . MET A-4 1 169 . 47.175 3.794 -46.736 1 8.29 ? CA MET A-4 169 1 
ATOM 6819 C C . MET A-4 1 169 . 46.96 5.193 -47.282 1 8.32 ? C MET A-4 169 1 
ATOM 6820 O O . MET A-4 1 169 . 46.024 5.445 -48.043 1 9.23 ? O MET A-4 169 1 
ATOM 6821 C CB . MET A-4 1 169 . 46.496 3.623 -45.374 1 8.62 ? CB MET A-4 169 1 
ATOM 6822 C CG . MET A-4 1 169 . 46.434 2.193 -44.877 1 10.2 ? CG MET A-4 169 1 
ATOM 6823 S SD . MET A-4 1 169 . 45.75 1.986 -43.239 1 11.37 ? SD MET A-4 169 1 
ATOM 6824 C CE . MET A-4 1 169 . 44.11 2.369 -43.561 1 14.74 ? CE MET A-4 169 1 
ATOM 6825 N N . TYR A-4 1 170 . 47.829 6.133 -46.92 1 7.89 ? N TYR A-4 170 1 
ATOM 6826 C CA . TYR A-4 1 170 . 47.762 7.464 -47.499 1 7.78 ? CA TYR A-4 170 1 
ATOM 6827 C C . TYR A-4 1 170 . 48.023 7.461 -48.983 1 9.1 ? C TYR A-4 170 1 
ATOM 6828 O O . TYR A-4 1 170 . 47.333 8.108 -49.756 1 10.18 ? O TYR A-4 170 1 
ATOM 6829 C CB . TYR A-4 1 170 . 48.784 8.381 -46.776 1 8.41 ? CB TYR A-4 170 1 
ATOM 6830 C CG . TYR A-4 1 170 . 48.855 9.784 -47.357 1 8.3 ? CG TYR A-4 170 1 
ATOM 6831 C CD1 . TYR A-4 1 170 . 49.659 10.058 -48.446 1 9.52 ? CD1 TYR A-4 170 1 
ATOM 6832 C CD2 . TYR A-4 1 170 . 48.089 10.811 -46.84 1 8.66 ? CD2 TYR A-4 170 1 
ATOM 6833 C CE1 . TYR A-4 1 170 . 49.713 11.342 -48.974 1 10.76 ? CE1 TYR A-4 170 1 
ATOM 6834 C CE2 . TYR A-4 1 170 . 48.143 12.093 -47.377 1 9.44 ? CE2 TYR A-4 170 1 
ATOM 6835 C CZ . TYR A-4 1 170 . 48.901 12.335 -48.49 1 10.21 ? CZ TYR A-4 170 1 
ATOM 6836 O OH . TYR A-4 1 170 . 48.991 13.568 -49.074 1 12.23 ? OH TYR A-4 170 1 
ATOM 6837 N N . LYS A-4 1 171 . 49.073 6.729 -49.43 1 10 ? N LYS A-4 171 1 
ATOM 6838 C CA . LYS A-4 1 171 . 49.371 6.663 -50.861 1 12.97 ? CA LYS A-4 171 1 
ATOM 6839 C C . LYS A-4 1 171 . 48.173 6.121 -51.634 1 14.25 ? C LYS A-4 171 1 
ATOM 6840 O O . LYS A-4 1 171 . 47.915 6.621 -52.723 1 16.52 ? O LYS A-4 171 1 
ATOM 6841 C CB . LYS A-4 1 171 . 50.626 5.84 -51.078 1 13.85 ? CB LYS A-4 171 1 
ATOM 6842 C CG . LYS A-4 1 171 . 51.868 6.447 -50.575 1 14.74 ? CG LYS A-4 171 1 
ATOM 6843 C CD . LYS A-4 1 171 . 53.052 5.491 -50.717 1 24.07 ? CD LYS A-4 171 1 
ATOM 6844 C CE . LYS A-4 1 171 . 54.303 5.99 -50.076 1 44.24 ? CE LYS A-4 171 1 
ATOM 6845 N NZ . LYS A-4 1 171 . 55.382 4.985 -50.144 1 60.91 ? NZ LYS A-4 171 1 
ATOM 6846 N N . GLU A-4 1 172 . 47.52 5.119 -51.078 1 13.58 ? N GLU A-4 172 1 
ATOM 6847 C CA . GLU A-4 1 172 . 46.425 4.514 -51.767 1 14.99 ? CA GLU A-4 172 1 
ATOM 6848 C C . GLU A-4 1 172 . 45.27 5.455 -51.821 1 17.08 ? C GLU A-4 172 1 
ATOM 6849 O O . GLU A-4 1 172 . 44.585 5.611 -52.864 1 22.94 ? O GLU A-4 172 1 
ATOM 6850 C CB . GLU A-4 1 172 . 46.092 3.202 -51.087 1 14.62 ? CB GLU A-4 172 1 
ATOM 6851 C CG . GLU A-4 1 172 . 44.959 2.475 -51.709 1 14.81 ? CG GLU A-4 172 1 
ATOM 6852 C CD . GLU A-4 1 172 . 45.183 2.104 -53.219 1 15.18 ? CD GLU A-4 172 1 
ATOM 6853 O OE1 . GLU A-4 1 172 . 44.118 1.9 -53.857 1 18.01 ? OE1 GLU A-4 172 1 
ATOM 6854 O OE2 . GLU A-4 1 172 . 46.366 2.006 -53.64 1 18.82 ? OE2 GLU A-4 172 1 
ATOM 6855 N N . LYS A-4 1 173 . 45.012 6.19 -50.725 1 16.19 ? N LYS A-4 173 1 
ATOM 6856 C CA . LYS A-4 1 173 . 43.888 7.089 -50.693 1 19.04 ? CA LYS A-4 173 1 
ATOM 6857 C C . LYS A-4 1 173 . 44.055 8.361 -51.559 1 18.27 ? C LYS A-4 173 1 
ATOM 6858 O O . LYS A-4 1 173 . 43.167 8.774 -52.291 1 24.3 ? O LYS A-4 173 1 
ATOM 6859 C CB . LYS A-4 1 173 . 43.528 7.518 -49.276 1 30.69 ? CB LYS A-4 173 1 
ATOM 6860 C CG . LYS A-4 1 173 . 42.422 8.569 -49.205 1 54.54 ? CG LYS A-4 173 1 
ATOM 6861 C CD . LYS A-4 1 173 . 41.437 8.362 -48.134 1 76.44 ? CD LYS A-4 173 1 
ATOM 6862 C CE . LYS A-4 1 173 . 40.35 9.38 -48.217 1 97.97 ? CE LYS A-4 173 1 
ATOM 6863 N NZ . LYS A-4 1 173 . 39.077 8.788 -48.623 1 119.88 ? NZ LYS A-4 173 1 
ATOM 6864 N N . PHE A-4 1 174 . 45.195 8.963 -51.434 1 15.43 ? N PHE A-4 174 1 
ATOM 6865 C CA . PHE A-4 1 174 . 45.454 10.266 -52.045 1 18.59 ? CA PHE A-4 174 1 
ATOM 6866 C C . PHE A-4 1 174 . 46.372 10.049 -53.289 1 27.35 ? C PHE A-4 174 1 
ATOM 6867 C CB . PHE A-4 1 174 . 46.068 11.199 -51.068 1 16.46 ? CB PHE A-4 174 1 
ATOM 6868 C CG . PHE A-4 1 174 . 45.131 11.52 -49.966 1 15.09 ? CG PHE A-4 174 1 
ATOM 6869 C CD1 . PHE A-4 1 174 . 44.101 12.466 -50.109 1 16.67 ? CD1 PHE A-4 174 1 
ATOM 6870 C CD2 . PHE A-4 1 174 . 45.272 10.881 -48.717 1 15.63 ? CD2 PHE A-4 174 1 
ATOM 6871 C CE1 . PHE A-4 1 174 . 43.247 12.727 -49.126 1 18.55 ? CE1 PHE A-4 174 1 
ATOM 6872 C CE2 . PHE A-4 1 174 . 44.444 11.205 -47.667 1 16.2 ? CE2 PHE A-4 174 1 
ATOM 6873 C CZ . PHE A-4 1 174 . 43.388 12.104 -47.808 1 18.16 ? CZ PHE A-4 174 1 
ATOM 6874 N N . GLY A-4 1 175 . 46.532 8.843 -53.821 1 29.76 ? N GLY A-4 175 1 
ATOM 6875 C CA . GLY A-4 1 175 . 47.055 8.717 -55.208 1 29.86 ? CA GLY A-4 175 1 
ATOM 6876 C C . GLY A-4 1 175 . 45.857 8.98 -56.117 1 30.3 ? C GLY A-4 175 1 
ATOM 6877 O O . GLY A-4 1 175 . 45.939 9.608 -57.21 1 30.14 ? O GLY A-4 175 1 
ATOM 6878 N N . LYS A-4 1 176 . 44.674 8.499 -55.711 0.82 37.57 ? N LYS A-4 176 1 
ATOM 6879 C CA . LYS A-4 1 176 . 43.426 8.773 -56.434 0.85 33.27 ? CA LYS A-4 176 1 
ATOM 6880 C C . LYS A-4 1 176 . 42.782 10.031 -55.844 0.84 33.34 ? C LYS A-4 176 1 
ATOM 6881 O O . LYS A-4 1 176 . 42.425 10.953 -56.609 0.73 34.6 ? O LYS A-4 176 1 
ATOM 6882 C CB . LYS A-4 1 176 . 42.467 7.583 -56.389 0.85 30.77 ? CB LYS A-4 176 1 
ATOM 6883 C CG . LYS A-4 1 176 . 43.072 6.211 -56.126 0.87 28.43 ? CG LYS A-4 176 1 
ATOM 6884 C CD . LYS A-4 1 176 . 42.965 5.949 -54.677 0.83 27.66 ? CD LYS A-4 176 1 
ATOM 6885 C CE . LYS A-4 1 176 . 42.045 4.792 -54.405 0.81 27.26 ? CE LYS A-4 176 1 
ATOM 6886 N NZ . LYS A-4 1 176 . 42.26 3.825 -55.566 0.85 28.19 ? NZ LYS A-4 176 1 
ATOM 6887 N N . GLU A-4 1 177 . 42.667 10.107 -54.496 0.81 33.42 ? N GLU A-4 177 1 
ATOM 6888 C CA . GLU A-4 1 177 . 42.045 11.328 -53.872 0.85 31.59 ? CA GLU A-4 177 1 
ATOM 6889 C C . GLU A-4 1 177 . 42.925 12.538 -54.212 0.83 32.11 ? C GLU A-4 177 1 
ATOM 6890 O O . GLU A-4 1 177 . 43.013 12.945 -55.387 0.69 34.38 ? O GLU A-4 177 1 
ATOM 6891 C CB . GLU A-4 1 177 . 41.916 11.237 -52.364 0.85 28.63 ? CB GLU A-4 177 1 
ATOM 6892 C CG . GLU A-4 1 177 . 40.567 10.899 -51.725 0.89 29.06 ? CG GLU A-4 177 1 
ATOM 6893 C CD . GLU A-4 1 177 . 39.815 12.183 -51.348 0.85 30.59 ? CD GLU A-4 177 1 
ATOM 6894 O OE1 . GLU A-4 1 177 . 38.571 12.211 -51.275 0.7 33.43 ? OE1 GLU A-4 177 1 
ATOM 6895 O OE2 . GLU A-4 1 177 . 40.469 13.252 -51.135 0.73 32.65 ? OE2 GLU A-4 177 1 
ATOM 6896 N N . GLU A-4 1 178 . 43.585 13.09 -53.201 0.74 30.04 ? N GLU A-4 178 1 
ATOM 6897 C CA . GLU A-4 1 178 . 44.5 14.204 -53.404 0.87 29.37 ? CA GLU A-4 178 1 
ATOM 6898 C C . GLU A-4 1 178 . 45.86 13.707 -53.885 0.81 29.87 ? C GLU A-4 178 1 
ATOM 6899 O O . GLU A-4 1 178 . 46.888 14.339 -53.639 0.7 29.95 ? O GLU A-4 178 1 
ATOM 6900 C CB . GLU A-4 1 178 . 44.649 15.012 -52.113 0.54 20.61 ? CB GLU A-4 178 1 
ATOM 6901 C CG . GLU A-4 1 178 . 46.06 15.494 -51.833 0.63 20.13 ? CG GLU A-4 178 1 
ATOM 6902 C CD . GLU A-4 1 178 . 46.269 16.929 -52.257 0.56 20.13 ? CD GLU A-4 178 1 
ATOM 6903 O OE1 . GLU A-4 1 178 . 46.972 17.155 -53.264 0.2 20.18 ? OE1 GLU A-4 178 1 
ATOM 6904 O OE2 . GLU A-4 1 178 . 45.725 17.831 -51.588 0.25 20.19 ? OE2 GLU A-4 178 1 
ATOM 6905 N N A MET A-5 1 1 . 45.668 27.574 -46.239 0.36 40.14 ? N MET A-5 1 1 
ATOM 6906 N N B MET A-5 1 1 . 45.212 27.369 -46.32 0.25 40.26 ? N MET A-5 1 1 
ATOM 6907 C CA A MET A-5 1 1 . 44.624 28.394 -46.822 0.36 35.49 ? CA MET A-5 1 1 
ATOM 6908 C CA B MET A-5 1 1 . 44.342 28.398 -46.867 0.25 35.98 ? CA MET A-5 1 1 
ATOM 6909 C CA C MET A-5 1 1 . 44.972 30.489 -48.268 0.28 34.51 ? CA MET A-5 1 1 
ATOM 6910 C CA D MET A-5 1 1 . 44.858 30.486 -48.32 0.11 34.38 ? CA MET A-5 1 1 
ATOM 6911 C C A MET A-5 1 1 . 44.236 29.469 -45.842 0.36 32.17 ? C MET A-5 1 1 
ATOM 6912 C C B MET A-5 1 1 . 44.36 29.598 -45.942 0.25 32.13 ? C MET A-5 1 1 
ATOM 6913 C C C MET A-5 1 1 . 44.481 31.208 -47.03 0.28 32.62 ? C MET A-5 1 1 
ATOM 6914 C C D MET A-5 1 1 . 44.464 31.192 -47.031 0.11 32.43 ? C MET A-5 1 1 
ATOM 6915 O O A MET A-5 1 1 . 44.153 29.202 -44.7 0.36 29.44 ? O MET A-5 1 1 
ATOM 6916 O O B MET A-5 1 1 . 44.243 29.397 -44.768 0.25 29.37 ? O MET A-5 1 1 
ATOM 6917 O O C MET A-5 1 1 . 43.713 30.646 -46.236 0.28 31.69 ? O MET A-5 1 1 
ATOM 6918 O O D MET A-5 1 1 . 43.74 30.634 -46.205 0.11 31.49 ? O MET A-5 1 1 
ATOM 6919 C CB A MET A-5 1 1 . 43.405 27.536 -47.1 0.36 34.98 ? CB MET A-5 1 1 
ATOM 6920 C CB B MET A-5 1 1 . 42.905 27.869 -46.951 0.25 35.51 ? CB MET A-5 1 1 
ATOM 6921 C CB C MET A-5 1 1 . 45.262 31.521 -49.347 0.28 34.42 ? CB MET A-5 1 1 
ATOM 6922 C CB D MET A-5 1 1 . 43.977 31 -49.459 0.11 34.16 ? CB MET A-5 1 1 
ATOM 6923 C CG A MET A-5 1 1 . 43.775 26.224 -47.776 0.36 34.12 ? CG MET A-5 1 1 
ATOM 6924 C CG B MET A-5 1 1 . 42.755 26.66 -47.857 0.25 35.7 ? CG MET A-5 1 1 
ATOM 6925 C CG C MET A-5 1 1 . 45.609 30.917 -50.681 0.28 33.1 ? CG MET A-5 1 1 
ATOM 6926 C CG D MET A-5 1 1 . 42.715 30.19 -49.671 0.11 32.87 ? CG MET A-5 1 1 
ATOM 6927 S SD A MET A-5 1 1 . 42.316 25.573 -48.589 0.36 36.19 ? SD MET A-5 1 1 
ATOM 6928 S SD B MET A-5 1 1 . 41.054 26.074 -47.955 0.25 35.99 ? SD MET A-5 1 1 
ATOM 6929 S SD C MET A-5 1 1 . 44.887 31.873 -52.014 0.28 33.31 ? SD MET A-5 1 1 
ATOM 6930 S SD D MET A-5 1 1 . 41.194 31.027 -49.165 0.11 31.06 ? SD MET A-5 1 1 
ATOM 6931 C CE A MET A-5 1 1 . 41.669 27.045 -49.352 0.36 35.71 ? CE MET A-5 1 1 
ATOM 6932 C CE B MET A-5 1 1 . 41.127 24.969 -49.354 0.25 37.61 ? CE MET A-5 1 1 
ATOM 6933 C CE C MET A-5 1 1 . 44.222 30.613 -53.061 0.28 34.8 ? CE MET A-5 1 1 
ATOM 6934 C CE D MET A-5 1 1 . 40.701 31.823 -50.684 0.11 34.52 ? CE MET A-5 1 1 
ATOM 6935 N N A ASN A-5 1 2 . 43.957 30.673 -46.367 0.36 33.6 ? N ASN A-5 2 1 
ATOM 6936 N N B ASN A-5 1 2 . 44.5 30.82 -46.501 0.25 32.8 ? N ASN A-5 2 1 
ATOM 6937 N N C ASN A-5 1 2 . 44.934 32.437 -46.856 0.28 32.44 ? N ASN A-5 2 1 
ATOM 6938 N N D ASN A-5 1 2 . 44.95 32.415 -46.864 0.11 31.64 ? N ASN A-5 2 1 
ATOM 6939 C CA A ASN A-5 1 2 . 43.638 31.861 -45.562 0.36 34.36 ? CA ASN A-5 2 1 
ATOM 6940 C CA B ASN A-5 1 2 . 44.336 32.093 -45.752 0.25 33.95 ? CA ASN A-5 2 1 
ATOM 6941 C CA C ASN A-5 1 2 . 44.414 33.297 -45.776 0.28 33.7 ? CA ASN A-5 2 1 
ATOM 6942 C CA D ASN A-5 1 2 . 44.52 33.293 -45.766 0.11 33.1 ? CA ASN A-5 2 1 
ATOM 6943 C C A ASN A-5 1 2 . 42.359 31.642 -44.794 0.36 26.62 ? C ASN A-5 2 1 
ATOM 6944 C C B ASN A-5 1 2 . 42.991 32.179 -45.092 0.25 25.14 ? C ASN A-5 2 1 
ATOM 6945 C C C ASN A-5 1 2 . 43.098 32.779 -45.167 0.28 24.9 ? C ASN A-5 2 1 
ATOM 6946 C C D ASN A-5 1 2 . 43.146 32.934 -45.171 0.11 25.36 ? C ASN A-5 2 1 
ATOM 6947 O O A ASN A-5 1 2 . 41.304 31.341 -45.365 0.36 28.36 ? O ASN A-5 2 1 
ATOM 6948 O O B ASN A-5 1 2 . 42.009 32.309 -45.797 0.25 23.83 ? O ASN A-5 2 1 
ATOM 6949 O O C ASN A-5 1 2 . 42.111 32.689 -45.877 0.28 24.62 ? O ASN A-5 2 1 
ATOM 6950 O O D ASN A-5 1 2 . 42.167 32.852 -45.902 0.11 23.05 ? O ASN A-5 2 1 
ATOM 6951 C CB A ASN A-5 1 2 . 43.541 33.085 -46.473 0.36 44.1 ? CB ASN A-5 2 1 
ATOM 6952 C CB B ASN A-5 1 2 . 44.474 33.301 -46.683 0.25 43.76 ? CB ASN A-5 2 1 
ATOM 6953 C CB C ASN A-5 1 2 . 44.22 34.735 -46.287 0.28 43.96 ? CB ASN A-5 2 1 
ATOM 6954 C CB D ASN A-5 1 2 . 44.506 34.747 -46.253 0.11 43.6 ? CB ASN A-5 2 1 
ATOM 6955 C CG A ASN A-5 1 2 . 43.52 34.414 -45.707 0.36 49.12 ? CG ASN A-5 2 1 
ATOM 6956 C CG B ASN A-5 1 2 . 43.945 34.61 -46.058 0.25 48.37 ? CG ASN A-5 2 1 
ATOM 6957 C CG C ASN A-5 1 2 . 44.032 35.738 -45.166 0.28 48.56 ? CG ASN A-5 2 1 
ATOM 6958 C CG D ASN A-5 1 2 . 44.141 35.736 -45.161 0.11 48.28 ? CG ASN A-5 2 1 
ATOM 6959 O OD1 A ASN A-5 1 2 . 42.607 34.702 -44.96 0.36 42.33 ? OD1 ASN A-5 2 1 
ATOM 6960 O OD1 B ASN A-5 1 2 . 42.805 34.691 -45.555 0.25 42.07 ? OD1 ASN A-5 2 1 
ATOM 6961 O OD1 C ASN A-5 1 2 . 43.416 35.449 -44.15 0.28 40.84 ? OD1 ASN A-5 2 1 
ATOM 6962 O OD1 D ASN A-5 1 2 . 43.46 35.403 -44.195 0.11 40.32 ? OD1 ASN A-5 2 1 
ATOM 6963 N ND2 A ASN A-5 1 2 . 44.531 35.225 -45.919 0.36 59.17 ? ND2 ASN A-5 2 1 
ATOM 6964 N ND2 B ASN A-5 1 2 . 44.767 35.633 -46.086 0.25 59.12 ? ND2 ASN A-5 2 1 
ATOM 6965 N ND2 C ASN A-5 1 2 . 44.559 36.94 -45.361 0.28 59.36 ? ND2 ASN A-5 2 1 
ATOM 6966 N ND2 D ASN A-5 1 2 . 44.584 36.977 -45.325 0.11 59.28 ? ND2 ASN A-5 2 1 
ATOM 6967 N N A PRO A-5 1 3 . 42.424 31.815 -43.471 0.36 21.88 ? N PRO A-5 3 1 
ATOM 6968 N N B PRO A-5 1 3 . 42.983 32.166 -43.765 0.25 19.02 ? N PRO A-5 3 1 
ATOM 6969 N N C PRO A-5 1 3 . 43.125 32.43 -43.882 0.28 19.35 ? N PRO A-5 3 1 
ATOM 6970 C CA A PRO A-5 1 3 . 41.236 31.435 -42.688 0.36 22.47 ? CA PRO A-5 3 1 
ATOM 6971 C CA B PRO A-5 1 3 . 41.767 31.811 -43.044 0.25 18.02 ? CA PRO A-5 3 1 
ATOM 6972 C CA C PRO A-5 1 3 . 41.938 31.863 -43.24 0.28 19.53 ? CA PRO A-5 3 1 
ATOM 6973 C C A PRO A-5 1 3 . 40.211 32.554 -42.63 0.36 20.39 ? C PRO A-5 3 1 
ATOM 6974 C C B PRO A-5 1 3 . 40.588 32.697 -43.331 0.25 11.06 ? C PRO A-5 3 1 
ATOM 6975 C C C PRO A-5 1 3 . 40.68 32.697 -43.4 0.28 14.57 ? C PRO A-5 3 1 
ATOM 6976 O O A PRO A-5 1 3 . 39.255 32.409 -41.943 0.36 22.55 ? O PRO A-5 3 1 
ATOM 6977 O O B PRO A-5 1 3 . 39.503 32.226 -43.483 0.25 10.59 ? O PRO A-5 3 1 
ATOM 6978 O O C PRO A-5 1 3 . 39.558 32.208 -43.509 0.28 14.5 ? O PRO A-5 3 1 
ATOM 6979 C CB A PRO A-5 1 3 . 41.802 31.25 -41.309 0.36 23.61 ? CB PRO A-5 3 1 
ATOM 6980 C CB B PRO A-5 1 3 . 42.223 31.909 -41.561 0.25 21.61 ? CB PRO A-5 3 1 
ATOM 6981 C CB C PRO A-5 1 3 . 42.369 31.802 -41.746 0.28 22.9 ? CB PRO A-5 3 1 
ATOM 6982 C CG A PRO A-5 1 3 . 43.069 32.102 -41.306 0.36 23.1 ? CG PRO A-5 3 1 
ATOM 6983 C CG B PRO A-5 1 3 . 43.665 31.92 -41.577 0.25 22.53 ? CG PRO A-5 3 1 
ATOM 6984 C CG C PRO A-5 1 3 . 43.84 31.841 -41.754 0.28 23.91 ? CG PRO A-5 3 1 
ATOM 6985 C CD A PRO A-5 1 3 . 43.647 31.99 -42.626 0.36 21.97 ? CD PRO A-5 3 1 
ATOM 6986 C CD B PRO A-5 1 3 . 44.128 32.437 -42.859 0.25 17.71 ? CD PRO A-5 3 1 
ATOM 6987 C CD C PRO A-5 1 3 . 44.254 32.616 -42.932 0.28 20.95 ? CD PRO A-5 3 1 
ATOM 6988 N N A PHE A-5 1 4 . 40.474 33.632 -43.365 0.36 17.27 ? N PHE A-5 4 1 
ATOM 6989 N N B PHE A-5 1 4 . 40.812 33.994 -43.302 0.25 9.76 ? N PHE A-5 4 1 
ATOM 6990 N N C PHE A-5 1 4 . 40.864 34 -43.337 0.28 10.24 ? N PHE A-5 4 1 
ATOM 6991 C CA A PHE A-5 1 4 . 39.514 34.731 -43.473 0.36 13.99 ? CA PHE A-5 4 1 
ATOM 6992 C CA B PHE A-5 1 4 . 39.73 34.941 -43.459 0.25 9.85 ? CA PHE A-5 4 1 
ATOM 6993 C CA C PHE A-5 1 4 . 39.73 34.93 -43.461 0.28 10.21 ? CA PHE A-5 4 1 
ATOM 6994 C C A PHE A-5 1 4 . 38.88 34.764 -44.884 0.36 12.25 ? C PHE A-5 4 1 
ATOM 6995 C C B PHE A-5 1 4 . 38.967 34.733 -44.802 0.25 9.54 ? C PHE A-5 4 1 
ATOM 6996 C C C PHE A-5 1 4 . 38.956 34.769 -44.814 0.28 10.14 ? C PHE A-5 4 1 
ATOM 6997 O O A PHE A-5 1 4 . 37.685 35.019 -45.053 0.36 18.17 ? O PHE A-5 4 1 
ATOM 6998 O O B PHE A-5 1 4 . 37.753 34.749 -44.838 0.25 6.57 ? O PHE A-5 4 1 
ATOM 6999 O O C PHE A-5 1 4 . 37.714 34.863 -44.862 0.28 8.76 ? O PHE A-5 4 1 
ATOM 7000 C CB A PHE A-5 1 4 . 40.264 36.012 -43.2 0.36 15.15 ? CB PHE A-5 4 1 
ATOM 7001 C CB B PHE A-5 1 4 . 40.36 36.294 -43.311 0.25 11.01 ? CB PHE A-5 4 1 
ATOM 7002 C CB C PHE A-5 1 4 . 40.301 36.302 -43.229 0.28 11.46 ? CB PHE A-5 4 1 
ATOM 7003 C CG A PHE A-5 1 4 . 39.538 37.261 -43.668 0.36 14.46 ? CG PHE A-5 4 1 
ATOM 7004 C CG B PHE A-5 1 4 . 39.474 37.444 -43.745 0.25 10.49 ? CG PHE A-5 4 1 
ATOM 7005 C CG C PHE A-5 1 4 . 39.428 37.452 -43.733 0.28 11.5 ? CG PHE A-5 4 1 
ATOM 7006 C CD1 A PHE A-5 1 4 . 38.222 37.522 -43.277 0.36 15 ? CD1 PHE A-5 4 1 
ATOM 7007 C CD1 B PHE A-5 1 4 . 39.976 38.419 -44.625 0.25 13.65 ? CD1 PHE A-5 4 1 
ATOM 7008 C CD1 C PHE A-5 1 4 . 38.075 37.533 -43.459 0.28 13.71 ? CD1 PHE A-5 4 1 
ATOM 7009 C CD2 A PHE A-5 1 4 . 40.182 38.148 -44.551 0.36 17.16 ? CD2 PHE A-5 4 1 
ATOM 7010 C CD2 B PHE A-5 1 4 . 38.152 37.521 -43.379 0.25 8.78 ? CD2 PHE A-5 4 1 
ATOM 7011 C CD2 C PHE A-5 1 4 . 39.992 38.436 -44.564 0.28 11.9 ? CD2 PHE A-5 4 1 
ATOM 7012 C CE1 A PHE A-5 1 4 . 37.559 38.682 -43.725 0.36 16.5 ? CE1 PHE A-5 4 1 
ATOM 7013 C CE1 B PHE A-5 1 4 . 39.201 39.485 -45.051 0.25 13.74 ? CE1 PHE A-5 4 1 
ATOM 7014 C CE1 C PHE A-5 1 4 . 37.315 38.61 -43.94 0.28 13.78 ? CE1 PHE A-5 4 1 
ATOM 7015 C CE2 A PHE A-5 1 4 . 39.541 39.292 -45.006 0.36 18.34 ? CE2 PHE A-5 4 1 
ATOM 7016 C CE2 B PHE A-5 1 4 . 37.339 38.582 -43.826 0.25 9.68 ? CE2 PHE A-5 4 1 
ATOM 7017 C CE2 C PHE A-5 1 4 . 39.268 39.502 -45.021 0.28 12.79 ? CE2 PHE A-5 4 1 
ATOM 7018 C CZ A PHE A-5 1 4 . 38.212 39.553 -44.591 0.36 16.8 ? CZ PHE A-5 4 1 
ATOM 7019 C CZ B PHE A-5 1 4 . 37.887 39.531 -44.675 0.25 11.74 ? CZ PHE A-5 4 1 
ATOM 7020 C CZ C PHE A-5 1 4 . 37.924 39.551 -44.732 0.28 12.79 ? CZ PHE A-5 4 1 
ATOM 7021 N N . HIS A-5 1 5 . 39.722 34.549 -45.892 0.88 10.61 ? N HIS A-5 5 1 
ATOM 7022 C CA . HIS A-5 1 5 . 39.155 34.406 -47.24 0.88 10.48 ? CA HIS A-5 5 1 
ATOM 7023 C C . HIS A-5 1 5 . 38.798 32.978 -47.584 0.88 11.8 ? C HIS A-5 5 1 
ATOM 7024 O O . HIS A-5 1 5 . 37.894 32.746 -48.378 0.88 14.12 ? O HIS A-5 5 1 
ATOM 7025 C CB . HIS A-5 1 5 . 40.143 34.968 -48.288 0.88 11.97 ? CB HIS A-5 5 1 
ATOM 7026 C CG . HIS A-5 1 5 . 40.347 36.437 -48.153 0.88 12.95 ? CG HIS A-5 5 1 
ATOM 7027 N ND1 . HIS A-5 1 5 . 39.312 37.326 -48.344 0.88 13.88 ? ND1 HIS A-5 5 1 
ATOM 7028 C CD2 . HIS A-5 1 5 . 41.491 37.17 -47.927 0.88 13.3 ? CD2 HIS A-5 5 1 
ATOM 7029 C CE1 . HIS A-5 1 5 . 39.818 38.545 -48.238 0.88 13.77 ? CE1 HIS A-5 5 1 
ATOM 7030 N NE2 . HIS A-5 1 5 . 41.132 38.498 -47.947 0.88 15.05 ? NE2 HIS A-5 5 1 
ATOM 7031 N N A GLU A-5 1 6 . 39.464 32.001 -47.04 0.62 11.43 ? N GLU A-5 6 1 
ATOM 7032 N N B GLU A-5 1 6 . 39.519 32.016 -47.021 0.38 12.39 ? N GLU A-5 6 1 
ATOM 7033 C CA A GLU A-5 1 6 . 39.266 30.7 -47.573 0.62 15.19 ? CA GLU A-5 6 1 
ATOM 7034 C CA B GLU A-5 1 6 . 39.361 30.606 -47.367 0.38 15.6 ? CA GLU A-5 6 1 
ATOM 7035 C C A GLU A-5 1 6 . 38.391 29.805 -46.749 0.62 13.6 ? C GLU A-5 6 1 
ATOM 7036 C C B GLU A-5 1 6 . 38.226 29.925 -46.637 0.38 15.58 ? C GLU A-5 6 1 
ATOM 7037 O O A GLU A-5 1 6 . 37.906 28.981 -47.422 0.62 18.14 ? O GLU A-5 6 1 
ATOM 7038 O O B GLU A-5 1 6 . 37.579 29.071 -47.218 0.38 18.6 ? O GLU A-5 6 1 
ATOM 7039 C CB A GLU A-5 1 6 . 40.679 30.108 -47.85 0.62 18.67 ? CB GLU A-5 6 1 
ATOM 7040 C CB B GLU A-5 1 6 . 40.717 29.877 -47.028 0.38 18.73 ? CB GLU A-5 6 1 
ATOM 7041 N N A LEU A-5 1 7 . 38.126 30.071 -45.47 0.62 13.54 ? N LEU A-5 7 1 
ATOM 7042 N N B LEU A-5 1 7 . 37.985 30.301 -45.41 0.38 16.64 ? N LEU A-5 7 1 
ATOM 7043 C CA A LEU A-5 1 7 . 37.036 29.443 -44.736 0.62 13.63 ? CA LEU A-5 7 1 
ATOM 7044 C CA B LEU A-5 1 7 . 36.937 29.634 -44.68 0.38 20.47 ? CA LEU A-5 7 1 
ATOM 7045 C C A LEU A-5 1 7 . 35.681 30.044 -45.084 0.62 12.89 ? C LEU A-5 7 1 
ATOM 7046 C C B LEU A-5 1 7 . 35.599 30.216 -45.149 0.38 15.58 ? C LEU A-5 7 1 
ATOM 7047 O O A LEU A-5 1 7 . 35.563 31.173 -45.065 0.62 11.25 ? O LEU A-5 7 1 
ATOM 7048 O O B LEU A-5 1 7 . 35.58 31.355 -45.511 0.38 13.67 ? O LEU A-5 7 1 
ATOM 7049 C CB A LEU A-5 1 7 . 37.257 29.569 -43.275 0.62 18.62 ? CB LEU A-5 7 1 
ATOM 7050 C CB B LEU A-5 1 7 . 37.144 29.911 -43.203 0.38 32.14 ? CB LEU A-5 7 1 
ATOM 7051 C CG A LEU A-5 1 7 . 38.308 28.767 -42.575 0.62 39.31 ? CG LEU A-5 7 1 
ATOM 7052 C CG B LEU A-5 1 7 . 37.298 28.793 -42.173 0.38 47.02 ? CG LEU A-5 7 1 
ATOM 7053 C CD1 A LEU A-5 1 7 . 38.485 29.267 -41.156 0.62 46.43 ? CD1 LEU A-5 7 1 
ATOM 7054 C CD1 B LEU A-5 1 7 . 37.626 27.445 -42.806 0.38 52.14 ? CD1 LEU A-5 7 1 
ATOM 7055 C CD2 A LEU A-5 1 7 . 37.88 27.288 -42.576 0.62 52.8 ? CD2 LEU A-5 7 1 
ATOM 7056 C CD2 B LEU A-5 1 7 . 38.327 29.177 -41.12 0.38 56.97 ? CD2 LEU A-5 7 1 
ATOM 7057 N N A GLU A-5 1 8 . 34.625 29.241 -45.232 0.62 13.39 ? N GLU A-5 8 1 
ATOM 7058 N N B GLU A-5 1 8 . 34.518 29.419 -45.018 0.38 17.54 ? N GLU A-5 8 1 
ATOM 7059 C CA A GLU A-5 1 8 . 33.249 29.782 -45.323 0.62 14.22 ? CA GLU A-5 8 1 
ATOM 7060 C CA B GLU A-5 1 8 . 33.167 29.829 -45.441 0.38 17.23 ? CA GLU A-5 8 1 
ATOM 7061 C C A GLU A-5 1 8 . 32.793 30.456 -44.007 0.62 8.36 ? C GLU A-5 8 1 
ATOM 7062 C C B GLU A-5 1 8 . 32.505 30.206 -44.119 0.38 14.86 ? C GLU A-5 8 1 
ATOM 7063 O O A GLU A-5 1 8 . 33.363 30.177 -42.959 0.62 7.86 ? O GLU A-5 8 1 
ATOM 7064 O O B GLU A-5 1 8 . 32.749 29.541 -43.212 0.38 20.08 ? O GLU A-5 8 1 
ATOM 7065 C CB A GLU A-5 1 8 . 32.256 28.674 -45.691 0.62 18.66 ? CB GLU A-5 8 1 
ATOM 7066 C CB B GLU A-5 1 8 . 32.423 28.655 -46.105 0.38 22.1 ? CB GLU A-5 8 1 
ATOM 7067 C CG A GLU A-5 1 8 . 32.437 28.098 -47.083 0.62 22.7 ? CG GLU A-5 8 1 
ATOM 7068 C CG B GLU A-5 1 8 . 32.192 27.453 -45.246 0.38 26.07 ? CG GLU A-5 8 1 
ATOM 7069 C CD A GLU A-5 1 8 . 32.401 29.161 -48.158 0.62 24.7 ? CD GLU A-5 8 1 
ATOM 7070 C CD B GLU A-5 1 8 . 30.953 26.676 -45.688 0.38 28.27 ? CD GLU A-5 8 1 
ATOM 7071 O OE1 A GLU A-5 1 8 . 33.359 29.223 -48.957 0.62 25.67 ? OE1 GLU A-5 8 1 
ATOM 7072 O OE1 B GLU A-5 1 8 . 30.253 27.129 -46.634 0.38 29.43 ? OE1 GLU A-5 8 1 
ATOM 7073 O OE2 A GLU A-5 1 8 . 31.421 29.931 -48.205 0.62 26.17 ? OE2 GLU A-5 8 1 
ATOM 7074 O OE2 B GLU A-5 1 8 . 30.662 25.584 -45.137 0.38 29.5 ? OE2 GLU A-5 8 1 
ATOM 7075 N N . PRO A-5 1 9 . 31.722 31.263 -44.042 1 10.23 ? N PRO A-5 9 1 
ATOM 7076 C CA . PRO A-5 1 9 . 31.273 31.826 -42.735 1 9.19 ? CA PRO A-5 9 1 
ATOM 7077 C C . PRO A-5 1 9 . 30.846 30.761 -41.771 1 8.97 ? C PRO A-5 9 1 
ATOM 7078 O O . PRO A-5 1 9 . 30.889 31.025 -40.546 1 9.65 ? O PRO A-5 9 1 
ATOM 7079 C CB . PRO A-5 1 9 . 30.198 32.81 -43.139 1 10.04 ? CB PRO A-5 9 1 
ATOM 7080 C CG . PRO A-5 1 9 . 30.477 33.195 -44.545 1 11.28 ? CG PRO A-5 9 1 
ATOM 7081 C CD . PRO A-5 1 9 . 31.016 31.9 -45.163 1 12.21 ? CD PRO A-5 9 1 
ATOM 7082 N N . GLY A-5 1 10 . 30.347 29.619 -42.201 1 8.68 ? N GLY A-5 10 1 
ATOM 7083 C CA . GLY A-5 1 10 . 29.866 28.658 -41.277 1 9.71 ? CA GLY A-5 10 1 
ATOM 7084 C C . GLY A-5 1 10 . 29.338 27.435 -42.03 1 9.57 ? C GLY A-5 10 1 
ATOM 7085 O O . GLY A-5 1 10 . 29.105 27.465 -43.24 1 11.97 ? O GLY A-5 10 1 
ATOM 7086 N N . PRO A-5 1 11 . 29.049 26.361 -41.29 1 10.16 ? N PRO A-5 11 1 
ATOM 7087 C CA . PRO A-5 1 11 . 28.47 25.16 -41.878 1 12.01 ? CA PRO A-5 11 1 
ATOM 7088 C C . PRO A-5 1 11 . 26.986 25.223 -42.005 1 11.05 ? C PRO A-5 11 1 
ATOM 7089 O O . PRO A-5 1 11 . 26.41 24.442 -42.808 1 14.23 ? O PRO A-5 11 1 
ATOM 7090 C CB . PRO A-5 1 11 . 28.942 24.07 -40.934 1 12.83 ? CB PRO A-5 11 1 
ATOM 7091 C CG . PRO A-5 1 11 . 28.931 24.761 -39.605 1 12.81 ? CG PRO A-5 11 1 
ATOM 7092 C CD . PRO A-5 1 11 . 29.521 26.144 -39.892 1 11 ? CD PRO A-5 11 1 
ATOM 7093 N N . GLU A-5 1 12 . 26.305 26.058 -41.221 1 10.84 ? N GLU A-5 12 1 
ATOM 7094 C CA . GLU A-5 1 12 . 24.814 26.151 -41.311 1 11.83 ? CA GLU A-5 12 1 
ATOM 7095 C C . GLU A-5 1 12 . 24.413 27.619 -40.996 1 9.88 ? C GLU A-5 12 1 
ATOM 7096 O O . GLU A-5 1 12 . 23.748 27.904 -40.014 1 10.77 ? O GLU A-5 12 1 
ATOM 7097 C CB . GLU A-5 1 12 . 24.121 25.243 -40.328 1 13.11 ? CB GLU A-5 12 1 
ATOM 7098 C CG . GLU A-5 1 12 . 24.389 23.867 -40.343 1 21.98 ? CG GLU A-5 12 1 
ATOM 7099 C CD . GLU A-5 1 12 . 23.623 23.084 -39.254 1 25.94 ? CD GLU A-5 12 1 
ATOM 7100 O OE1 . GLU A-5 1 12 . 22.387 23.401 -38.937 1 27.73 ? OE1 GLU A-5 12 1 
ATOM 7101 O OE2 . GLU A-5 1 12 . 24.293 22.239 -38.687 1 31.25 ? OE2 GLU A-5 12 1 
ATOM 7102 N N . VAL A-5 1 13 . 24.872 28.525 -41.846 1 9.87 ? N VAL A-5 13 1 
ATOM 7103 C CA . VAL A-5 1 13 . 24.691 29.93 -41.586 1 9.74 ? CA VAL A-5 13 1 
ATOM 7104 C C . VAL A-5 1 13 . 23.24 30.273 -41.585 1 9.69 ? C VAL A-5 13 1 
ATOM 7105 O O . VAL A-5 1 13 . 22.504 29.837 -42.497 1 10.53 ? O VAL A-5 13 1 
ATOM 7106 C CB . VAL A-5 1 13 . 25.444 30.713 -42.666 1 11.11 ? CB VAL A-5 13 1 
ATOM 7107 C CG1 . VAL A-5 1 13 . 25.088 32.201 -42.676 1 13.51 ? CG1 VAL A-5 13 1 
ATOM 7108 C CG2 . VAL A-5 1 13 . 26.992 30.548 -42.546 1 13.73 ? CG2 VAL A-5 13 1 
ATOM 7109 N N . PRO A-5 1 14 . 22.76 31.125 -40.666 1 9.3 ? N PRO A-5 14 1 
ATOM 7110 C CA . PRO A-5 1 14 . 23.453 31.802 -39.576 1 9.51 ? CA PRO A-5 14 1 
ATOM 7111 C C . PRO A-5 1 14 . 23.299 31.077 -38.235 1 9.02 ? C PRO A-5 14 1 
ATOM 7112 O O . PRO A-5 1 14 . 23.769 31.627 -37.225 1 10.43 ? O PRO A-5 14 1 
ATOM 7113 C CB . PRO A-5 1 14 . 22.8 33.166 -39.556 1 9.81 ? CB PRO A-5 14 1 
ATOM 7114 C CG . PRO A-5 1 14 . 21.342 32.839 -39.835 1 10.63 ? CG PRO A-5 14 1 
ATOM 7115 C CD . PRO A-5 1 14 . 21.415 31.708 -40.9 1 9.98 ? CD PRO A-5 14 1 
ATOM 7116 N N . GLU A-5 1 15 . 22.64 29.916 -38.21 1 9.93 ? N GLU A-5 15 1 
ATOM 7117 C CA . GLU A-5 1 15 . 22.464 29.209 -36.925 1 12.14 ? CA GLU A-5 15 1 
ATOM 7118 C C . GLU A-5 1 15 . 23.716 28.603 -36.371 1 10.18 ? C GLU A-5 15 1 
ATOM 7119 O O . GLU A-5 1 15 . 23.828 28.491 -35.123 1 10.58 ? O GLU A-5 15 1 
ATOM 7120 C CB . GLU A-5 1 15 . 21.41 28.095 -37.066 1 14.92 ? CB GLU A-5 15 1 
ATOM 7121 C CG . GLU A-5 1 15 . 19.974 28.637 -37.366 1 19.13 ? CG GLU A-5 15 1 
ATOM 7122 C CD . GLU A-5 1 15 . 19.826 28.838 -38.778 1 16.96 ? CD GLU A-5 15 1 
ATOM 7123 O OE1 . GLU A-5 1 15 . 18.991 29.643 -39.062 1 21.22 ? OE1 GLU A-5 15 1 
ATOM 7124 O OE2 . GLU A-5 1 15 . 20.551 28.214 -39.518 1 20.35 ? OE2 GLU A-5 15 1 
ATOM 7125 N N . VAL A-5 1 16 . 24.66 28.197 -37.214 1 9.52 ? N VAL A-5 16 1 
ATOM 7126 C CA . VAL A-5 1 16 . 25.968 27.691 -36.812 1 9.2 ? CA VAL A-5 16 1 
ATOM 7127 C C . VAL A-5 1 16 . 26.971 28.361 -37.699 1 8.11 ? C VAL A-5 16 1 
ATOM 7128 O O . VAL A-5 1 16 . 26.865 28.245 -38.944 1 10.13 ? O VAL A-5 16 1 
ATOM 7129 C CB . VAL A-5 1 16 . 26.106 26.18 -36.889 1 11.17 ? CB VAL A-5 16 1 
ATOM 7130 C CG1 . VAL A-5 1 16 . 27.466 25.789 -36.397 1 12.09 ? CG1 VAL A-5 16 1 
ATOM 7131 C CG2 . VAL A-5 1 16 . 24.981 25.471 -36.073 1 13.96 ? CG2 VAL A-5 16 1 
ATOM 7132 N N . VAL A-5 1 17 . 27.906 29.048 -37.125 1 6.81 ? N VAL A-5 17 1 
ATOM 7133 C CA . VAL A-5 1 17 . 28.961 29.724 -37.827 1 6.7 ? CA VAL A-5 17 1 
ATOM 7134 C C . VAL A-5 1 17 . 30.303 29.158 -37.41 1 6.82 ? C VAL A-5 17 1 
ATOM 7135 O O . VAL A-5 1 17 . 30.441 28.516 -36.357 1 7.92 ? O VAL A-5 17 1 
ATOM 7136 C CB . VAL A-5 1 17 . 28.919 31.246 -37.611 1 7.7 ? CB VAL A-5 17 1 
ATOM 7137 C CG1 . VAL A-5 1 17 . 27.607 31.811 -38.198 1 9.56 ? CG1 VAL A-5 17 1 
ATOM 7138 C CG2 . VAL A-5 1 17 . 29.166 31.668 -36.203 1 8.28 ? CG2 VAL A-5 17 1 
ATOM 7139 N N . TYR A-5 1 18 . 31.34 29.462 -38.186 1 7.2 ? N TYR A-5 18 1 
ATOM 7140 C CA . TYR A-5 1 18 . 32.726 29.295 -37.736 1 7.62 ? CA TYR A-5 18 1 
ATOM 7141 C C . TYR A-5 1 18 . 33.198 30.547 -37.048 1 7.56 ? C TYR A-5 18 1 
ATOM 7142 O O . TYR A-5 1 18 . 33.057 31.683 -37.575 1 9.26 ? O TYR A-5 18 1 
ATOM 7143 C CB . TYR A-5 1 18 . 33.66 28.972 -38.887 1 8.7 ? CB TYR A-5 18 1 
ATOM 7144 C CG . TYR A-5 1 18 . 33.417 27.693 -39.52 1 9.74 ? CG TYR A-5 18 1 
ATOM 7145 C CD1 . TYR A-5 1 18 . 33.24 27.609 -40.915 1 12.56 ? CD1 TYR A-5 18 1 
ATOM 7146 C CD2 . TYR A-5 1 18 . 33.293 26.516 -38.845 1 10.23 ? CD2 TYR A-5 18 1 
ATOM 7147 C CE1 . TYR A-5 1 18 . 32.915 26.382 -41.585 1 15.07 ? CE1 TYR A-5 18 1 
ATOM 7148 C CE2 . TYR A-5 1 18 . 33.131 25.287 -39.475 1 13.52 ? CE2 TYR A-5 18 1 
ATOM 7149 C CZ . TYR A-5 1 18 . 32.925 25.221 -40.822 1 14.9 ? CZ TYR A-5 18 1 
ATOM 7150 O OH . TYR A-5 1 18 . 32.64 24.048 -41.453 1 19.53 ? OH TYR A-5 18 1 
ATOM 7151 N N . ALA A-5 1 19 . 33.771 30.375 -35.898 1 6.71 ? N ALA A-5 19 1 
ATOM 7152 C CA . ALA A-5 1 19 . 34.541 31.417 -35.237 1 6.98 ? CA ALA A-5 19 1 
ATOM 7153 C C . ALA A-5 1 19 . 36.006 31.084 -35.407 1 6.79 ? C ALA A-5 19 1 
ATOM 7154 O O . ALA A-5 1 19 . 36.447 30 -34.992 1 9.69 ? O ALA A-5 19 1 
ATOM 7155 C CB . ALA A-5 1 19 . 34.192 31.506 -33.788 1 7.22 ? CB ALA A-5 19 1 
ATOM 7156 N N . LEU A-5 1 20 . 36.764 31.976 -35.965 1 5.56 ? N LEU A-5 20 1 
ATOM 7157 C CA . LEU A-5 1 20 . 38.239 31.87 -36.042 1 5.58 ? CA LEU A-5 20 1 
ATOM 7158 C C . LEU A-5 1 20 . 38.745 32.715 -34.89 1 5.22 ? C LEU A-5 20 1 
ATOM 7159 O O . LEU A-5 1 20 . 38.652 33.96 -34.925 1 5.58 ? O LEU A-5 20 1 
ATOM 7160 C CB . LEU A-5 1 20 . 38.721 32.327 -37.373 1 6.33 ? CB LEU A-5 20 1 
ATOM 7161 C CG . LEU A-5 1 20 . 40.244 32.2 -37.553 1 8.44 ? CG LEU A-5 20 1 
ATOM 7162 C CD1 . LEU A-5 1 20 . 40.68 30.746 -37.58 1 9.53 ? CD1 LEU A-5 20 1 
ATOM 7163 C CD2 . LEU A-5 1 20 . 40.64 32.916 -38.832 1 15.85 ? CD2 LEU A-5 20 1 
ATOM 7164 N N . ILE A-5 1 21 . 39.255 32.072 -33.846 1 5.48 ? N ILE A-5 21 1 
ATOM 7165 C CA . ILE A-5 1 21 . 39.681 32.795 -32.649 1 5.2 ? CA ILE A-5 21 1 
ATOM 7166 C C . ILE A-5 1 21 . 40.997 33.46 -32.865 1 5.21 ? C ILE A-5 21 1 
ATOM 7167 O O . ILE A-5 1 21 . 41.946 32.868 -33.395 1 7.29 ? O ILE A-5 21 1 
ATOM 7168 C CB . ILE A-5 1 21 . 39.681 31.847 -31.423 1 5.8 ? CB ILE A-5 21 1 
ATOM 7169 C CG1 . ILE A-5 1 21 . 38.28 31.282 -31.195 1 6.59 ? CG1 ILE A-5 21 1 
ATOM 7170 C CG2 . ILE A-5 1 21 . 40.25 32.535 -30.205 1 6.11 ? CG2 ILE A-5 21 1 
ATOM 7171 C CD1 . ILE A-5 1 21 . 37.155 32.307 -31.096 1 7.65 ? CD1 ILE A-5 21 1 
ATOM 7172 N N . GLU A-5 1 22 . 41.08 34.715 -32.461 1 5.02 ? N GLU A-5 22 1 
ATOM 7173 C CA . GLU A-5 1 22 . 42.322 35.506 -32.43 1 5.03 ? CA GLU A-5 22 1 
ATOM 7174 C C . GLU A-5 1 22 . 42.909 35.61 -31.026 1 5.04 ? C GLU A-5 22 1 
ATOM 7175 O O . GLU A-5 1 22 . 44.12 35.617 -30.873 1 5.87 ? O GLU A-5 22 1 
ATOM 7176 C CB . GLU A-5 1 22 . 42.052 36.906 -33.008 1 5.37 ? CB GLU A-5 22 1 
ATOM 7177 C CG . GLU A-5 1 22 . 41.679 36.909 -34.482 1 5.95 ? CG GLU A-5 22 1 
ATOM 7178 C CD . GLU A-5 1 22 . 41.03 38.182 -34.941 1 5.27 ? CD GLU A-5 22 1 
ATOM 7179 O OE1 . GLU A-5 1 22 . 40.132 38.69 -34.22 1 5.65 ? OE1 GLU A-5 22 1 
ATOM 7180 O OE2 . GLU A-5 1 22 . 41.379 38.663 -36.058 1 6.15 ? OE2 GLU A-5 22 1 
ATOM 7181 N N . ILE A-5 1 23 . 42.044 35.772 -30.031 1 4.85 ? N ILE A-5 23 1 
ATOM 7182 C CA . ILE A-5 1 23 . 42.441 36.097 -28.673 1 4.97 ? CA ILE A-5 23 1 
ATOM 7183 C C . ILE A-5 1 23 . 41.836 35.077 -27.716 1 4.87 ? C ILE A-5 23 1 
ATOM 7184 O O . ILE A-5 1 23 . 40.617 35.049 -27.515 1 5.92 ? O ILE A-5 23 1 
ATOM 7185 C CB . ILE A-5 1 23 . 42.019 37.486 -28.215 1 5.14 ? CB ILE A-5 23 1 
ATOM 7186 C CG1 . ILE A-5 1 23 . 42.348 38.545 -29.258 1 6.35 ? CG1 ILE A-5 23 1 
ATOM 7187 C CG2 . ILE A-5 1 23 . 42.649 37.801 -26.868 1 6.16 ? CG2 ILE A-5 23 1 
ATOM 7188 C CD1 . ILE A-5 1 23 . 41.871 39.947 -28.861 1 6.53 ? CD1 ILE A-5 23 1 
ATOM 7189 N N . PRO A-5 1 24 . 42.638 34.254 -27.06 1 5.11 ? N PRO A-5 24 1 
ATOM 7190 C CA . PRO A-5 1 24 . 42.095 33.357 -26.015 1 5.7 ? CA PRO A-5 24 1 
ATOM 7191 C C . PRO A-5 1 24 . 41.596 34.178 -24.826 1 5.52 ? C PRO A-5 24 1 
ATOM 7192 O O . PRO A-5 1 24 . 42.22 35.15 -24.42 1 5.71 ? O PRO A-5 24 1 
ATOM 7193 C CB . PRO A-5 1 24 . 43.294 32.488 -25.631 1 6.68 ? CB PRO A-5 24 1 
ATOM 7194 C CG . PRO A-5 1 24 . 44.253 32.594 -26.838 1 7.48 ? CG PRO A-5 24 1 
ATOM 7195 C CD . PRO A-5 1 24 . 44.096 34.032 -27.285 1 6.62 ? CD PRO A-5 24 1 
ATOM 7196 N N . LYS A-5 1 25 . 40.507 33.721 -24.205 1 5.89 ? N LYS A-5 25 1 
ATOM 7197 C CA A LYS A-5 1 25 . 40.073 34.363 -22.991 0.44 5.63 ? CA LYS A-5 25 1 
ATOM 7198 C CA B LYS A-5 1 25 . 40.065 34.281 -22.911 0.56 5.33 ? CA LYS A-5 25 1 
ATOM 7199 C C . LYS A-5 1 25 . 41.259 34.367 -21.988 1 5.44 ? C LYS A-5 25 1 
ATOM 7200 O O . LYS A-5 1 25 . 42.014 33.406 -21.869 1 5.97 ? O LYS A-5 25 1 
ATOM 7201 C CB A LYS A-5 1 25 . 38.896 33.559 -22.41 0.44 7.25 ? CB LYS A-5 25 1 
ATOM 7202 C CB B LYS A-5 1 25 . 38.972 33.399 -22.23 0.56 7.17 ? CB LYS A-5 25 1 
ATOM 7203 C CG A LYS A-5 1 25 . 38.356 34.057 -21.059 0.44 8.32 ? CG LYS A-5 25 1 
ATOM 7204 C CG B LYS A-5 1 25 . 38.668 33.714 -20.822 0.56 6.78 ? CG LYS A-5 25 1 
ATOM 7205 C CD A LYS A-5 1 25 . 38.955 33.326 -19.867 0.44 10.38 ? CD LYS A-5 25 1 
ATOM 7206 C CD B LYS A-5 1 25 . 37.616 32.819 -20.29 0.56 7.51 ? CD LYS A-5 25 1 
ATOM 7207 C CE A LYS A-5 1 25 . 38.244 33.578 -18.576 0.44 15.53 ? CE LYS A-5 25 1 
ATOM 7208 C CE B LYS A-5 1 25 . 38.042 31.363 -20.18 0.56 10.42 ? CE LYS A-5 25 1 
ATOM 7209 N NZ A LYS A-5 1 25 . 38.927 32.776 -17.503 0.44 27.79 ? NZ LYS A-5 25 1 
ATOM 7210 N NZ B LYS A-5 1 25 . 37.127 30.41 -19.404 0.56 9.27 ? NZ LYS A-5 25 1 
ATOM 7211 N N . GLY A-5 1 26 . 41.363 35.493 -21.278 1 5.55 ? N GLY A-5 26 1 
ATOM 7212 C CA . GLY A-5 1 26 . 42.403 35.683 -20.3 1 5.49 ? CA GLY A-5 26 1 
ATOM 7213 C C . GLY A-5 1 26 . 43.595 36.474 -20.801 1 5.73 ? C GLY A-5 26 1 
ATOM 7214 O O . GLY A-5 1 26 . 44.471 36.804 -20.023 1 7.67 ? O GLY A-5 26 1 
ATOM 7215 N N . SER A-5 1 27 . 43.63 36.802 -22.09 1 5.42 ? N SER A-5 27 1 
ATOM 7216 C CA A SER A-5 1 27 . 44.741 37.545 -22.692 0.74 5.55 ? CA SER A-5 27 1 
ATOM 7217 C CA B SER A-5 1 27 . 44.736 37.534 -22.626 0.26 4.82 ? CA SER A-5 27 1 
ATOM 7218 C C . SER A-5 1 27 . 44.532 39.062 -22.52 1 4.77 ? C SER A-5 27 1 
ATOM 7219 O O . SER A-5 1 27 . 43.431 39.549 -22.706 1 5.65 ? O SER A-5 27 1 
ATOM 7220 C CB A SER A-5 1 27 . 44.787 37.307 -24.194 0.74 6.56 ? CB SER A-5 27 1 
ATOM 7221 C CB B SER A-5 1 27 . 44.926 37.123 -24.108 0.26 5.87 ? CB SER A-5 27 1 
ATOM 7222 O OG A SER A-5 1 27 . 44.861 35.873 -24.444 0.74 6.87 ? OG SER A-5 27 1 
ATOM 7223 O OG B SER A-5 1 27 . 45.865 37.923 -24.752 0.26 7.98 ? OG SER A-5 27 1 
ATOM 7224 N N . ARG A-5 1 28 . 45.625 39.75 -22.278 1 5.09 ? N ARG A-5 28 1 
ATOM 7225 C CA . ARG A-5 1 28 . 45.722 41.193 -22.372 1 5.37 ? CA ARG A-5 28 1 
ATOM 7226 C C . ARG A-5 1 28 . 46.269 41.663 -23.71 1 5.59 ? C ARG A-5 28 1 
ATOM 7227 O O . ARG A-5 1 28 . 46.122 42.836 -24.097 1 6.91 ? O ARG A-5 28 1 
ATOM 7228 C CB . ARG A-5 1 28 . 46.56 41.72 -21.225 1 6.42 ? CB ARG A-5 28 1 
ATOM 7229 C CG . ARG A-5 1 28 . 46.741 43.228 -21.2 1 6.95 ? CG ARG A-5 28 1 
ATOM 7230 C CD . ARG A-5 1 28 . 47.567 43.665 -20.031 1 7.78 ? CD ARG A-5 28 1 
ATOM 7231 N NE . ARG A-5 1 28 . 47.854 45.088 -20.115 1 6.37 ? NE ARG A-5 28 1 
ATOM 7232 C CZ . ARG A-5 1 28 . 48.308 45.806 -19.111 1 5.64 ? CZ ARG A-5 28 1 
ATOM 7233 N NH1 . ARG A-5 1 28 . 48.776 45.208 -18.016 1 7.13 ? NH1 ARG A-5 28 1 
ATOM 7234 N NH2 . ARG A-5 1 28 . 48.293 47.126 -19.193 1 5.92 ? NH2 ARG A-5 28 1 
ATOM 7235 N N . ASN A-5 1 29 . 46.936 40.794 -24.45 1 5.68 ? N ASN A-5 29 1 
ATOM 7236 C CA . ASN A-5 1 29 . 47.419 41.106 -25.797 1 6.22 ? CA ASN A-5 29 1 
ATOM 7237 C C . ASN A-5 1 29 . 46.247 41.034 -26.787 1 5.91 ? C ASN A-5 29 1 
ATOM 7238 O O . ASN A-5 1 29 . 45.554 40.039 -26.869 1 7.08 ? O ASN A-5 29 1 
ATOM 7239 C CB . ASN A-5 1 29 . 48.508 40.156 -26.211 1 5.89 ? CB ASN A-5 29 1 
ATOM 7240 C CG . ASN A-5 1 29 . 49.806 40.331 -25.45 1 6.16 ? CG ASN A-5 29 1 
ATOM 7241 O OD1 . ASN A-5 1 29 . 50.052 41.385 -24.834 1 7.04 ? OD1 ASN A-5 29 1 
ATOM 7242 N ND2 . ASN A-5 1 29 . 50.662 39.351 -25.564 1 6.83 ? ND2 ASN A-5 29 1 
ATOM 7243 N N A LYS A-5 1 30 . 46.069 42.128 -27.531 0.73 5.89 ? N LYS A-5 30 1 
ATOM 7244 N N B LYS A-5 1 30 . 46.025 42.153 -27.472 0.27 5.78 ? N LYS A-5 30 1 
ATOM 7245 C CA A LYS A-5 1 30 . 45.029 42.204 -28.554 0.73 5.88 ? CA LYS A-5 30 1 
ATOM 7246 C CA B LYS A-5 1 30 . 45.038 42.22 -28.546 0.27 5.82 ? CA LYS A-5 30 1 
ATOM 7247 C C A LYS A-5 1 30 . 45.58 41.749 -29.9 0.73 5.33 ? C LYS A-5 30 1 
ATOM 7248 C C B LYS A-5 1 30 . 45.627 41.748 -29.874 0.27 5.44 ? C LYS A-5 30 1 
ATOM 7249 O O A LYS A-5 1 30 . 46.188 42.523 -30.635 0.73 8.13 ? O LYS A-5 30 1 
ATOM 7250 O O B LYS A-5 1 30 . 46.013 42.565 -30.711 0.27 8.04 ? O LYS A-5 30 1 
ATOM 7251 C CB A LYS A-5 1 30 . 44.459 43.626 -28.647 0.73 7.06 ? CB LYS A-5 30 1 
ATOM 7252 C CB B LYS A-5 1 30 . 44.505 43.648 -28.694 0.27 7.08 ? CB LYS A-5 30 1 
ATOM 7253 C CG A LYS A-5 1 30 . 43.905 44.031 -30.024 0.73 10.97 ? CG LYS A-5 30 1 
ATOM 7254 C CG B LYS A-5 1 30 . 43.004 43.733 -28.907 0.27 9.72 ? CG LYS A-5 30 1 
ATOM 7255 C CD A LYS A-5 1 30 . 42.661 43.239 -30.403 0.73 5.69 ? CD LYS A-5 30 1 
ATOM 7256 C CD B LYS A-5 1 30 . 42.601 43.233 -30.282 0.27 8.17 ? CD LYS A-5 30 1 
ATOM 7257 C CE A LYS A-5 1 30 . 41.725 44.029 -31.32 0.73 10.85 ? CE LYS A-5 30 1 
ATOM 7258 C CE B LYS A-5 1 30 . 41.124 43.488 -30.538 0.27 9.73 ? CE LYS A-5 30 1 
ATOM 7259 N NZ A LYS A-5 1 30 . 40.619 43.194 -31.869 0.73 7.38 ? NZ LYS A-5 30 1 
ATOM 7260 N NZ B LYS A-5 1 30 . 40.699 43.037 -31.892 0.27 7.75 ? NZ LYS A-5 30 1 
ATOM 7261 N N . TYR A-5 1 31 . 45.499 40.451 -30.14 1 5.95 ? N TYR A-5 31 1 
ATOM 7262 C CA . TYR A-5 1 31 . 45.907 39.861 -31.417 1 6.3 ? CA TYR A-5 31 1 
ATOM 7263 C C . TYR A-5 1 31 . 44.822 40.065 -32.451 1 6.04 ? C TYR A-5 31 1 
ATOM 7264 O O . TYR A-5 1 31 . 43.649 40.026 -32.116 1 6.73 ? O TYR A-5 31 1 
ATOM 7265 C CB . TYR A-5 1 31 . 46.114 38.376 -31.251 1 6.66 ? CB TYR A-5 31 1 
ATOM 7266 C CG . TYR A-5 1 31 . 47.074 37.981 -30.154 1 6.12 ? CG TYR A-5 31 1 
ATOM 7267 C CD1 . TYR A-5 1 31 . 46.651 37.294 -29.034 1 6.39 ? CD1 TYR A-5 31 1 
ATOM 7268 C CD2 . TYR A-5 1 31 . 48.434 38.265 -30.256 1 7.17 ? CD2 TYR A-5 31 1 
ATOM 7269 C CE1 . TYR A-5 1 31 . 47.494 36.931 -28.027 1 6.75 ? CE1 TYR A-5 31 1 
ATOM 7270 C CE2 . TYR A-5 1 31 . 49.299 37.898 -29.252 1 7.68 ? CE2 TYR A-5 31 1 
ATOM 7271 C CZ . TYR A-5 1 31 . 48.816 37.232 -28.138 1 7.11 ? CZ TYR A-5 31 1 
ATOM 7272 O OH . TYR A-5 1 31 . 49.726 36.911 -27.148 1 8.29 ? OH TYR A-5 31 1 
ATOM 7273 N N . GLU A-5 1 32 . 45.229 40.207 -33.704 1 6.11 ? N GLU A-5 32 1 
ATOM 7274 C CA . GLU A-5 1 32 . 44.322 40.228 -34.829 1 6.34 ? CA GLU A-5 32 1 
ATOM 7275 C C . GLU A-5 1 32 . 44.945 39.426 -35.956 1 7 ? C GLU A-5 32 1 
ATOM 7276 O O . GLU A-5 1 32 . 46.143 39.405 -36.131 1 8.98 ? O GLU A-5 32 1 
ATOM 7277 C CB . GLU A-5 1 32 . 44.041 41.632 -35.356 1 7.23 ? CB GLU A-5 32 1 
ATOM 7278 C CG . GLU A-5 1 32 . 43.252 42.492 -34.359 1 7.38 ? CG GLU A-5 32 1 
ATOM 7279 C CD . GLU A-5 1 32 . 42.882 43.867 -34.87 1 7.62 ? CD GLU A-5 32 1 
ATOM 7280 O OE1 . GLU A-5 1 32 . 41.851 44.402 -34.387 1 9.9 ? OE1 GLU A-5 32 1 
ATOM 7281 O OE2 . GLU A-5 1 32 . 43.593 44.437 -35.738 1 9.21 ? OE2 GLU A-5 32 1 
ATOM 7282 N N A LEU A-5 1 33 . 44.048 38.893 -36.797 0.13 8.75 ? N LEU A-5 33 1 
ATOM 7283 N N B LEU A-5 1 33 . 44.097 38.793 -36.774 0.87 7.07 ? N LEU A-5 33 1 
ATOM 7284 C CA A LEU A-5 1 33 . 44.419 38.269 -38.068 0.13 13.4 ? CA LEU A-5 33 1 
ATOM 7285 C CA B LEU A-5 1 33 . 44.591 38.211 -38.007 0.87 8.33 ? CA LEU A-5 33 1 
ATOM 7286 C C A LEU A-5 1 33 . 44.783 39.312 -39.127 0.13 13.71 ? C LEU A-5 33 1 
ATOM 7287 C C B LEU A-5 1 33 . 45.099 39.324 -38.893 0.87 11.32 ? C LEU A-5 33 1 
ATOM 7288 O O A LEU A-5 1 33 . 43.927 39.975 -39.713 0.13 11.04 ? O LEU A-5 33 1 
ATOM 7289 O O B LEU A-5 1 33 . 44.491 40.413 -39.067 0.87 12.93 ? O LEU A-5 33 1 
ATOM 7290 C CB A LEU A-5 1 33 . 43.243 37.408 -38.554 0.13 18 ? CB LEU A-5 33 1 
ATOM 7291 C CB B LEU A-5 1 33 . 43.394 37.424 -38.671 0.87 9.47 ? CB LEU A-5 33 1 
ATOM 7292 C CG A LEU A-5 1 33 . 43.196 36.88 -39.99 0.13 24.71 ? CG LEU A-5 33 1 
ATOM 7293 C CG B LEU A-5 1 33 . 43.813 36.688 -39.951 0.87 11.47 ? CG LEU A-5 33 1 
ATOM 7294 C CD1 A LEU A-5 1 33 . 42.063 35.869 -40.103 0.13 26.72 ? CD1 LEU A-5 33 1 
ATOM 7295 C CD1 B LEU A-5 1 33 . 44.622 35.43 -39.493 0.87 15.16 ? CD1 LEU A-5 33 1 
ATOM 7296 C CD2 A LEU A-5 1 33 . 42.997 37.999 -41.007 0.13 29.05 ? CD2 LEU A-5 33 1 
ATOM 7297 C CD2 B LEU A-5 1 33 . 42.657 36.05 -40.546 0.87 16.24 ? CD2 LEU A-5 33 1 
ATOM 7298 N N A ASP A-5 1 34 . 46.072 39.426 -39.412 0.13 18.46 ? N ASP A-5 34 1 
ATOM 7299 N N B ASP A-5 1 34 . 46.285 39.059 -39.474 0.87 13.67 ? N ASP A-5 34 1 
ATOM 7300 C CA A ASP A-5 1 34 . 46.503 40.342 -40.461 0.13 23.8 ? CA ASP A-5 34 1 
ATOM 7301 C CA B ASP A-5 1 34 . 46.82 39.983 -40.495 0.87 16.96 ? CA ASP A-5 34 1 
ATOM 7302 C C A ASP A-5 1 34 . 45.776 39.992 -41.76 0.13 25.77 ? C ASP A-5 34 1 
ATOM 7303 C C B ASP A-5 1 34 . 46.062 39.723 -41.795 0.87 21.25 ? C ASP A-5 34 1 
ATOM 7304 O O A ASP A-5 1 34 . 45.689 38.837 -42.133 0.13 24.05 ? O ASP A-5 34 1 
ATOM 7305 O O B ASP A-5 1 34 . 46.257 38.703 -42.295 0.87 25.41 ? O ASP A-5 34 1 
ATOM 7306 C CB A ASP A-5 1 34 . 48.015 40.237 -40.645 0.13 26.59 ? CB ASP A-5 34 1 
ATOM 7307 C CB B ASP A-5 1 34 . 48.388 39.754 -40.592 0.87 18.99 ? CB ASP A-5 34 1 
ATOM 7308 C CG A ASP A-5 1 34 . 48.569 41.318 -41.549 0.13 25.83 ? CG ASP A-5 34 1 
ATOM 7309 C CG B ASP A-5 1 34 . 49.043 40.625 -41.659 0.87 25.66 ? CG ASP A-5 34 1 
ATOM 7310 O OD1 A ASP A-5 1 34 . 48.295 41.275 -42.771 0.13 24.87 ? OD1 ASP A-5 34 1 
ATOM 7311 O OD1 B ASP A-5 1 34 . 49.775 40.037 -42.473 0.87 27.67 ? OD1 ASP A-5 34 1 
ATOM 7312 O OD2 A ASP A-5 1 34 . 49.288 42.207 -41.049 0.13 25.29 ? OD2 ASP A-5 34 1 
ATOM 7313 O OD2 B ASP A-5 1 34 . 48.768 41.829 -41.685 0.87 30.06 ? OD2 ASP A-5 34 1 
ATOM 7314 N N A LYS A-5 1 35 . 45.242 41 -42.443 0.13 31.19 ? N LYS A-5 35 1 
ATOM 7315 N N B LYS A-5 1 35 . 45.348 40.715 -42.329 0.87 23.84 ? N LYS A-5 35 1 
ATOM 7316 C CA A LYS A-5 1 35 . 44.551 40.77 -43.702 0.13 38.08 ? CA LYS A-5 35 1 
ATOM 7317 C CA B LYS A-5 1 35 . 44.54 40.565 -43.513 0.87 32.14 ? CA LYS A-5 35 1 
ATOM 7318 C C A LYS A-5 1 35 . 45.555 40.435 -44.81 0.13 35.69 ? C LYS A-5 35 1 
ATOM 7319 C C B LYS A-5 1 35 . 45.511 40.254 -44.726 0.87 32.28 ? C LYS A-5 35 1 
ATOM 7320 O O A LYS A-5 1 35 . 45.283 39.608 -45.674 0.13 33.54 ? O LYS A-5 35 1 
ATOM 7321 O O B LYS A-5 1 35 . 45.258 39.357 -45.465 0.87 32.37 ? O LYS A-5 35 1 
ATOM 7322 C CB A LYS A-5 1 35 . 43.727 41.999 -44.087 0.13 48.24 ? CB LYS A-5 35 1 
ATOM 7323 C CB B LYS A-5 1 35 . 43.763 41.837 -43.829 0.87 45.29 ? CB LYS A-5 35 1 
ATOM 7324 C CG A LYS A-5 1 35 . 42.258 41.913 -43.705 0.13 56.16 ? CG LYS A-5 35 1 
ATOM 7325 C CG B LYS A-5 1 35 . 42.337 41.862 -43.314 0.87 54.48 ? CG LYS A-5 35 1 
ATOM 7326 C CD A LYS A-5 1 35 . 41.782 43.164 -42.981 0.13 62.07 ? CD LYS A-5 35 1 
ATOM 7327 C CD B LYS A-5 1 35 . 41.894 43.292 -43.115 0.87 60.05 ? CD LYS A-5 35 1 
ATOM 7328 C CE A LYS A-5 1 35 . 42.304 44.431 -43.629 0.13 67.75 ? CE LYS A-5 35 1 
ATOM 7329 C CE B LYS A-5 1 35 . 42.708 43.892 -41.998 0.87 66.06 ? CE LYS A-5 35 1 
ATOM 7330 N NZ A LYS A-5 1 35 . 41.635 45.642 -43.081 0.13 72.93 ? NZ LYS A-5 35 1 
ATOM 7331 N NZ B LYS A-5 1 35 . 42.437 45.301 -41.852 0.87 71.33 ? NZ LYS A-5 35 1 
ATOM 7332 N N A ALA A-5 1 36 . 46.719 41.077 -44.761 0.13 38.02 ? N ALA A-5 36 1 
ATOM 7333 N N B ALA A-5 1 36 . 46.66 40.933 -44.796 0.87 35.81 ? N ALA A-5 36 1 
ATOM 7334 C CA A ALA A-5 1 36 . 47.76 40.891 -45.775 0.13 41.53 ? CA ALA A-5 36 1 
ATOM 7335 C CA B ALA A-5 1 36 . 47.574 40.755 -45.964 0.87 41.15 ? CA ALA A-5 36 1 
ATOM 7336 C C A ALA A-5 1 36 . 48.121 39.429 -45.961 0.13 38.04 ? C ALA A-5 36 1 
ATOM 7337 C C B ALA A-5 1 36 . 48.09 39.367 -46.01 0.87 37.73 ? C ALA A-5 36 1 
ATOM 7338 O O A ALA A-5 1 36 . 48.049 38.891 -47.063 0.13 36.07 ? O ALA A-5 36 1 
ATOM 7339 O O B ALA A-5 1 36 . 48.211 38.799 -47.109 0.87 36.23 ? O ALA A-5 36 1 
ATOM 7340 C CB A ALA A-5 1 36 . 49.012 41.691 -45.392 0.13 48.73 ? CB ALA A-5 36 1 
ATOM 7341 C CB B ALA A-5 1 36 . 48.75 41.768 -45.888 0.87 48.66 ? CB ALA A-5 36 1 
ATOM 7342 N N . THR A-5 1 37 . 48.523 38.808 -44.862 1 39.66 ? N THR A-5 37 1 
ATOM 7343 C CA . THR A-5 1 37 . 49.111 37.485 -44.863 1 34.01 ? CA THR A-5 37 1 
ATOM 7344 C C . THR A-5 1 37 . 48.444 36.316 -44.287 1 30.32 ? C THR A-5 37 1 
ATOM 7345 O O . THR A-5 1 37 . 48.983 35.22 -44.389 1 29.69 ? O THR A-5 37 1 
ATOM 7346 C CB . THR A-5 1 37 . 50.42 37.443 -44.082 1 33.29 ? CB THR A-5 37 1 
ATOM 7347 O OG1 . THR A-5 1 37 . 50.17 37.501 -42.659 1 28.71 ? OG1 THR A-5 37 1 
ATOM 7348 C CG2 . THR A-5 1 37 . 51.406 38.568 -44.563 1 37.3 ? CG2 THR A-5 37 1 
ATOM 7349 N N . GLY A-5 1 38 . 47.461 36.469 -43.397 1 27.54 ? N GLY A-5 38 1 
ATOM 7350 C CA . GLY A-5 1 38 . 46.981 35.245 -42.754 1 30.59 ? CA GLY A-5 38 1 
ATOM 7351 C C . GLY A-5 1 38 . 47.568 34.928 -41.37 1 24.91 ? C GLY A-5 38 1 
ATOM 7352 O O . GLY A-5 1 38 . 47.117 34.022 -40.637 1 28.51 ? O GLY A-5 38 1 
ATOM 7353 N N . LEU A-5 1 39 . 48.632 35.642 -40.993 1 18.54 ? N LEU A-5 39 1 
ATOM 7354 C CA . LEU A-5 1 39 . 49.342 35.33 -39.723 1 15.79 ? CA LEU A-5 39 1 
ATOM 7355 C C . LEU A-5 1 39 . 48.688 36.077 -38.568 1 12.44 ? C LEU A-5 39 1 
ATOM 7356 O O . LEU A-5 1 39 . 48.034 37.137 -38.797 1 15.33 ? O LEU A-5 39 1 
ATOM 7357 C CB . LEU A-5 1 39 . 50.747 35.754 -39.82 1 18.53 ? CB LEU A-5 39 1 
ATOM 7358 C CG . LEU A-5 1 39 . 51.614 34.932 -40.801 1 48.12 ? CG LEU A-5 39 1 
ATOM 7359 C CD1 . LEU A-5 1 39 . 52.933 35.677 -41.07 1 64.95 ? CD1 LEU A-5 39 1 
ATOM 7360 C CD2 . LEU A-5 1 39 . 51.853 33.573 -40.268 1 67.63 ? CD2 LEU A-5 39 1 
ATOM 7361 N N . LEU A-5 1 40 . 48.869 35.631 -37.359 1 10.69 ? N LEU A-5 40 1 
ATOM 7362 C CA . LEU A-5 1 40 . 48.485 36.402 -36.174 1 8.78 ? CA LEU A-5 40 1 
ATOM 7363 C C . LEU A-5 1 40 . 49.443 37.585 -36.003 1 7.17 ? C LEU A-5 40 1 
ATOM 7364 O O . LEU A-5 1 40 . 50.639 37.422 -36.107 1 6.72 ? O LEU A-5 40 1 
ATOM 7365 C CB . LEU A-5 1 40 . 48.494 35.511 -34.936 1 9.06 ? CB LEU A-5 40 1 
ATOM 7366 C CG . LEU A-5 1 40 . 47.672 36.007 -33.753 1 9.95 ? CG LEU A-5 40 1 
ATOM 7367 C CD1 . LEU A-5 1 40 . 46.154 35.874 -34.077 1 9.81 ? CD1 LEU A-5 40 1 
ATOM 7368 C CD2 . LEU A-5 1 40 . 48.048 35.303 -32.476 1 10.28 ? CD2 LEU A-5 40 1 
ATOM 7369 N N . LYS A-5 1 41 . 48.887 38.732 -35.637 1 7.49 ? N LYS A-5 41 1 
ATOM 7370 C CA . LYS A-5 1 41 . 49.662 39.941 -35.395 1 7.14 ? CA LYS A-5 41 1 
ATOM 7371 C C . LYS A-5 1 41 . 49.23 40.53 -34.052 1 6.45 ? C LYS A-5 41 1 
ATOM 7372 O O . LYS A-5 1 41 . 48.048 40.505 -33.675 1 8.05 ? O LYS A-5 41 1 
ATOM 7373 C CB . LYS A-5 1 41 . 49.477 40.914 -36.483 1 9.51 ? CB LYS A-5 41 1 
ATOM 7374 C CG . LYS A-5 1 41 . 50.289 42.168 -36.398 1 15.34 ? CG LYS A-5 41 1 
ATOM 7375 C CD . LYS A-5 1 41 . 50.181 42.942 -37.724 1 48.26 ? CD LYS A-5 41 1 
ATOM 7376 C CE . LYS A-5 1 41 . 50.868 44.321 -37.642 1 80.95 ? CE LYS A-5 41 1 
ATOM 7377 N NZ . LYS A-5 1 41 . 50.883 44.983 -38.971 1 108.74 ? NZ LYS A-5 41 1 
ATOM 7378 N N . LEU A-5 1 42 . 50.178 41.099 -33.306 1 6.14 ? N LEU A-5 42 1 
ATOM 7379 C CA . LEU A-5 1 42 . 49.855 41.901 -32.156 1 6.13 ? CA LEU A-5 42 1 
ATOM 7380 C C . LEU A-5 1 42 . 49.347 43.25 -32.634 1 6.32 ? C LEU A-5 42 1 
ATOM 7381 O O . LEU A-5 1 42 . 50.118 44.05 -33.171 1 8.31 ? O LEU A-5 42 1 
ATOM 7382 C CB . LEU A-5 1 42 . 51.097 42.078 -31.276 1 6.73 ? CB LEU A-5 42 1 
ATOM 7383 C CG . LEU A-5 1 42 . 50.865 42.845 -30.013 1 7.26 ? CG LEU A-5 42 1 
ATOM 7384 C CD1 . LEU A-5 1 42 . 50.032 42.027 -28.978 1 8.59 ? CD1 LEU A-5 42 1 
ATOM 7385 C CD2 . LEU A-5 1 42 . 52.195 43.275 -29.39 1 8.3 ? CD2 LEU A-5 42 1 
ATOM 7386 N N . ASP A-5 1 43 . 48.073 43.533 -32.456 0.91 5.74 ? N ASP A-5 43 1 
ATOM 7387 C CA . ASP A-5 1 43 . 47.534 44.877 -32.772 0.91 6.25 ? CA ASP A-5 43 1 
ATOM 7388 C C . ASP A-5 1 43 . 47.961 45.865 -31.714 0.91 7.16 ? C ASP A-5 43 1 
ATOM 7389 O O . ASP A-5 1 43 . 48.557 46.919 -32.019 0.91 9.66 ? O ASP A-5 43 1 
ATOM 7390 C CB . ASP A-5 1 43 . 46.005 44.815 -32.831 0.91 8.57 ? CB ASP A-5 43 1 
ATOM 7391 C CG . ASP A-5 1 43 . 45.318 46.186 -32.931 0.91 13.17 ? CG ASP A-5 43 1 
ATOM 7392 O OD1 . ASP A-5 1 43 . 45.821 46.925 -33.821 0.91 19.08 ? OD1 ASP A-5 43 1 
ATOM 7393 O OD2 . ASP A-5 1 43 . 44.265 46.447 -32.315 0.91 13.49 ? OD2 ASP A-5 43 1 
ATOM 7394 N N A ARG A-5 1 44 . 47.731 45.535 -30.42 0.88 7.5 ? N ARG A-5 44 1 
ATOM 7395 N N B ARG A-5 1 44 . 48.007 45.316 -30.518 0.12 10.17 ? N ARG A-5 44 1 
ATOM 7396 C CA A ARG A-5 1 44 . 48.367 46.353 -29.321 0.88 9.02 ? CA ARG A-5 44 1 
ATOM 7397 C CA B ARG A-5 1 44 . 47.988 46.083 -29.293 0.12 10.27 ? CA ARG A-5 44 1 
ATOM 7398 C C A ARG A-5 1 44 . 48.166 45.508 -28.072 0.88 6.96 ? C ARG A-5 44 1 
ATOM 7399 C C B ARG A-5 1 44 . 48.798 45.356 -28.162 0.12 8.97 ? C ARG A-5 44 1 
ATOM 7400 O O A ARG A-5 1 44 . 47.639 44.422 -28.067 0.88 7.94 ? O ARG A-5 44 1 
ATOM 7401 O O B ARG A-5 1 44 . 49.524 44.414 -28.418 0.12 11 ? O ARG A-5 44 1 
ATOM 7402 C CB A ARG A-5 1 44 . 47.71 47.732 -29.096 0.88 10.81 ? CB ARG A-5 44 1 
ATOM 7403 C CB B ARG A-5 1 44 . 46.544 46.052 -28.92 0.12 12.35 ? CB ARG A-5 44 1 
ATOM 7404 C CG A ARG A-5 1 44 . 46.237 47.342 -28.824 0.88 16.06 ? CG ARG A-5 44 1 
ATOM 7405 C CG B ARG A-5 1 44 . 45.762 47.36 -29.037 0.12 15.56 ? CG ARG A-5 44 1 
ATOM 7406 C CD A ARG A-5 1 44 . 45.416 48.464 -29.039 0.88 19.5 ? CD ARG A-5 44 1 
ATOM 7407 C CD B ARG A-5 1 44 . 45.557 47.839 -30.452 0.12 17.61 ? CD ARG A-5 44 1 
ATOM 7408 N NE A ARG A-5 1 44 . 44.13 48.447 -28.291 0.88 17.14 ? NE ARG A-5 44 1 
ATOM 7409 N NE B ARG A-5 1 44 . 46.034 49.208 -30.603 0.12 17.66 ? NE ARG A-5 44 1 
ATOM 7410 C CZ A ARG A-5 1 44 . 42.97 47.978 -28.73 0.88 12.3 ? CZ ARG A-5 44 1 
ATOM 7411 C CZ B ARG A-5 1 44 . 45.781 49.997 -31.643 0.12 14.5 ? CZ ARG A-5 44 1 
ATOM 7412 N NH1 A ARG A-5 1 44 . 42.88 47.203 -29.785 0.88 14.44 ? NH1 ARG A-5 44 1 
ATOM 7413 N NH1 B ARG A-5 1 44 . 45.049 49.571 -32.659 0.12 14.11 ? NH1 ARG A-5 44 1 
ATOM 7414 N NH2 A ARG A-5 1 44 . 41.949 48.16 -27.872 0.88 13.08 ? NH2 ARG A-5 44 1 
ATOM 7415 N NH2 B ARG A-5 1 44 . 46.265 51.224 -31.648 0.12 14.3 ? NH2 ARG A-5 44 1 
ATOM 7416 N N . VAL A-5 1 45 . 48.865 46.01 -27.018 1 7.95 ? N VAL A-5 45 1 
ATOM 7417 C CA . VAL A-5 1 45 . 48.689 45.535 -25.661 1 6.98 ? CA VAL A-5 45 1 
ATOM 7418 C C . VAL A-5 1 45 . 47.651 46.443 -24.987 1 5.99 ? C VAL A-5 45 1 
ATOM 7419 O O . VAL A-5 1 45 . 47.775 47.65 -25.061 1 6.51 ? O VAL A-5 45 1 
ATOM 7420 C CB . VAL A-5 1 45 . 50.018 45.554 -24.892 1 8.01 ? CB VAL A-5 45 1 
ATOM 7421 C CG1 . VAL A-5 1 45 . 49.858 45.107 -23.461 1 8.04 ? CG1 VAL A-5 45 1 
ATOM 7422 C CG2 . VAL A-5 1 45 . 51.062 44.653 -25.624 1 8.74 ? CG2 VAL A-5 45 1 
ATOM 7423 N N . LEU A-5 1 46 . 46.623 45.876 -24.337 1 5.69 ? N LEU A-5 46 1 
ATOM 7424 C CA . LEU A-5 1 46 . 45.658 46.743 -23.692 1 5.49 ? CA LEU A-5 46 1 
ATOM 7425 C C . LEU A-5 1 46 . 46.367 47.642 -22.696 1 5.41 ? C LEU A-5 46 1 
ATOM 7426 O O . LEU A-5 1 46 . 47.281 47.217 -21.968 1 5.8 ? O LEU A-5 46 1 
ATOM 7427 C CB . LEU A-5 1 46 . 44.542 45.989 -23.007 1 6.35 ? CB LEU A-5 46 1 
ATOM 7428 C CG . LEU A-5 1 46 . 43.693 45.087 -23.889 1 6.78 ? CG LEU A-5 46 1 
ATOM 7429 C CD1 . LEU A-5 1 46 . 42.574 44.457 -23.033 1 7.51 ? CD1 LEU A-5 46 1 
ATOM 7430 C CD2 . LEU A-5 1 46 . 43.084 45.834 -25.062 1 7.52 ? CD2 LEU A-5 46 1 
ATOM 7431 N N A TYR A-5 1 47 . 45.854 48.845 -22.542 0.58 5.39 ? N TYR A-5 47 1 
ATOM 7432 N N B TYR A-5 1 47 . 46.026 48.918 -22.649 0.42 6.2 ? N TYR A-5 47 1 
ATOM 7433 C CA A TYR A-5 1 47 . 46.545 49.859 -21.812 0.58 5.76 ? CA TYR A-5 47 1 
ATOM 7434 C CA B TYR A-5 1 47 . 46.694 49.908 -21.713 0.42 6.19 ? CA TYR A-5 47 1 
ATOM 7435 C C A TYR A-5 1 47 . 46.218 49.768 -20.35 0.58 5.11 ? C TYR A-5 47 1 
ATOM 7436 C C B TYR A-5 1 47 . 46.418 49.602 -20.216 0.42 5.23 ? C TYR A-5 47 1 
ATOM 7437 O O A TYR A-5 1 47 . 46.839 50.444 -19.532 0.58 5.35 ? O TYR A-5 47 1 
ATOM 7438 O O B TYR A-5 1 47 . 47.098 50.1 -19.34 0.42 5.77 ? O TYR A-5 47 1 
ATOM 7439 C CB A TYR A-5 1 47 . 46.214 51.286 -22.321 0.58 5.3 ? CB TYR A-5 47 1 
ATOM 7440 C CB B TYR A-5 1 47 . 46.186 51.365 -21.977 0.42 6.51 ? CB TYR A-5 47 1 
ATOM 7441 C CG A TYR A-5 1 47 . 46.859 51.733 -23.591 0.58 5.44 ? CG TYR A-5 47 1 
ATOM 7442 C CG B TYR A-5 1 47 . 46.835 52.063 -23.163 0.42 6.61 ? CG TYR A-5 47 1 
ATOM 7443 C CD1 A TYR A-5 1 47 . 47.127 53.078 -23.76 0.58 5.84 ? CD1 TYR A-5 47 1 
ATOM 7444 C CD1 B TYR A-5 1 47 . 47.217 53.344 -23.079 0.42 7.13 ? CD1 TYR A-5 47 1 
ATOM 7445 C CD2 A TYR A-5 1 47 . 47.206 50.836 -24.626 0.58 6.24 ? CD2 TYR A-5 47 1 
ATOM 7446 C CD2 B TYR A-5 1 47 . 47.214 51.36 -24.275 0.42 8.83 ? CD2 TYR A-5 47 1 
ATOM 7447 C CE1 A TYR A-5 1 47 . 47.733 53.538 -24.879 0.58 6.41 ? CE1 TYR A-5 47 1 
ATOM 7448 C CE1 B TYR A-5 1 47 . 47.903 53.997 -24.123 0.42 10.16 ? CE1 TYR A-5 47 1 
ATOM 7449 C CE2 A TYR A-5 1 47 . 47.778 51.319 -25.782 0.58 7.02 ? CE2 TYR A-5 47 1 
ATOM 7450 C CE2 B TYR A-5 1 47 . 47.906 52.013 -25.414 0.42 9.94 ? CE2 TYR A-5 47 1 
ATOM 7451 C CZ A TYR A-5 1 47 . 48.07 52.665 -25.882 0.58 7.68 ? CZ TYR A-5 47 1 
ATOM 7452 C CZ B TYR A-5 1 47 . 48.231 53.327 -25.279 0.42 9.86 ? CZ TYR A-5 47 1 
ATOM 7453 O OH A TYR A-5 1 47 . 48.679 53.192 -26.995 0.58 10.27 ? OH TYR A-5 47 1 
ATOM 7454 O OH B TYR A-5 1 47 . 48.916 54.011 -26.256 0.42 14.03 ? OH TYR A-5 47 1 
ATOM 7455 N N . SER A-5 1 48 . 45.307 48.903 -19.972 1 5.85 ? N SER A-5 48 1 
ATOM 7456 C CA . SER A-5 1 48 . 44.825 48.648 -18.615 1 5.71 ? CA SER A-5 48 1 
ATOM 7457 C C . SER A-5 1 48 . 44.987 47.167 -18.312 1 5.4 ? C SER A-5 48 1 
ATOM 7458 O O . SER A-5 1 48 . 44.999 46.347 -19.241 1 5.44 ? O SER A-5 48 1 
ATOM 7459 C CB . SER A-5 1 48 . 43.37 49.054 -18.524 1 6.22 ? CB SER A-5 48 1 
ATOM 7460 O OG . SER A-5 1 48 . 43.257 50.42 -18.825 1 6.9 ? OG SER A-5 48 1 
ATOM 7461 N N . PRO A-5 1 49 . 45.021 46.778 -17.024 1 5.28 ? N PRO A-5 49 1 
ATOM 7462 C CA . PRO A-5 1 49 . 45.2 45.364 -16.647 1 5.38 ? CA PRO A-5 49 1 
ATOM 7463 C C . PRO A-5 1 49 . 43.863 44.641 -16.665 1 4.94 ? C PRO A-5 49 1 
ATOM 7464 O O . PRO A-5 1 49 . 43.28 44.253 -15.656 1 5.7 ? O PRO A-5 49 1 
ATOM 7465 C CB . PRO A-5 1 49 . 45.792 45.459 -15.249 1 5.93 ? CB PRO A-5 49 1 
ATOM 7466 C CG . PRO A-5 1 49 . 45.185 46.714 -14.695 1 6.3 ? CG PRO A-5 49 1 
ATOM 7467 C CD . PRO A-5 1 49 . 45.077 47.655 -15.849 1 6.46 ? CD PRO A-5 49 1 
ATOM 7468 N N . PHE A-5 1 50 . 43.336 44.534 -17.886 1 5.13 ? N PHE A-5 50 1 
ATOM 7469 C CA . PHE A-5 1 50 . 42.1 43.897 -18.209 1 5.13 ? CA PHE A-5 50 1 
ATOM 7470 C C . PHE A-5 1 50 . 42.393 42.721 -19.135 1 5.39 ? C PHE A-5 50 1 
ATOM 7471 O O . PHE A-5 1 50 . 43.419 42.733 -19.84 0.89 5.68 ? O PHE A-5 50 1 
ATOM 7472 C CB . PHE A-5 1 50 . 41.13 44.872 -18.896 1 5.97 ? CB PHE A-5 50 1 
ATOM 7473 C CG . PHE A-5 1 50 . 40.829 46.18 -18.16 1 5.75 ? CG PHE A-5 50 1 
ATOM 7474 C CD1 . PHE A-5 1 50 . 40.176 47.154 -18.867 1 6.42 ? CD1 PHE A-5 50 1 
ATOM 7475 C CD2 . PHE A-5 1 50 . 41.118 46.41 -16.828 1 5.44 ? CD2 PHE A-5 50 1 
ATOM 7476 C CE1 . PHE A-5 1 50 . 39.819 48.348 -18.248 1 6.95 ? CE1 PHE A-5 50 1 
ATOM 7477 C CE2 . PHE A-5 1 50 . 40.784 47.619 -16.223 0.94 5.48 ? CE2 PHE A-5 50 1 
ATOM 7478 C CZ . PHE A-5 1 50 . 40.114 48.599 -16.954 1 6.74 ? CZ PHE A-5 50 1 
ATOM 7479 N N . PHE A-5 1 51 . 41.517 41.732 -19.144 1 5.53 ? N PHE A-5 51 1 
ATOM 7480 C CA . PHE A-5 1 51 . 41.688 40.603 -19.989 1 5.8 ? CA PHE A-5 51 1 
ATOM 7481 C C . PHE A-5 1 51 . 40.419 40.302 -20.761 1 4.96 ? C PHE A-5 51 1 
ATOM 7482 O O . PHE A-5 1 51 . 39.319 40.539 -20.305 1 5.55 ? O PHE A-5 51 1 
ATOM 7483 C CB . PHE A-5 1 51 . 42.156 39.329 -19.232 1 7.14 ? CB PHE A-5 51 1 
ATOM 7484 C CG . PHE A-5 1 51 . 41.151 38.816 -18.166 1 7.22 ? CG PHE A-5 51 1 
ATOM 7485 C CD1 . PHE A-5 1 51 . 40.131 37.97 -18.537 1 7.41 ? CD1 PHE A-5 51 1 
ATOM 7486 C CD2 . PHE A-5 1 51 . 41.206 39.222 -16.839 1 9.04 ? CD2 PHE A-5 51 1 
ATOM 7487 C CE1 . PHE A-5 1 51 . 39.237 37.454 -17.595 1 8.62 ? CE1 PHE A-5 51 1 
ATOM 7488 C CE2 . PHE A-5 1 51 . 40.31 38.726 -15.905 1 9.33 ? CE2 PHE A-5 51 1 
ATOM 7489 C CZ . PHE A-5 1 51 . 39.343 37.844 -16.298 1 9.81 ? CZ PHE A-5 51 1 
ATOM 7490 N N . TYR A-5 1 52 . 40.59 39.759 -21.97 1 5.42 ? N TYR A-5 52 1 
ATOM 7491 C CA . TYR A-5 1 52 . 39.42 39.406 -22.753 1 5.74 ? CA TYR A-5 52 1 
ATOM 7492 C C . TYR A-5 1 52 . 38.597 38.383 -22.003 1 5.22 ? C TYR A-5 52 1 
ATOM 7493 O O . TYR A-5 1 52 . 39.123 37.323 -21.623 1 5.96 ? O TYR A-5 52 1 
ATOM 7494 C CB . TYR A-5 1 52 . 39.801 38.917 -24.161 1 5.87 ? CB TYR A-5 52 1 
ATOM 7495 C CG . TYR A-5 1 52 . 40.011 40.071 -25.091 1 5.84 ? CG TYR A-5 52 1 
ATOM 7496 C CD1 . TYR A-5 1 52 . 41.173 40.809 -25.093 1 6.03 ? CD1 TYR A-5 52 1 
ATOM 7497 C CD2 . TYR A-5 1 52 . 38.982 40.482 -25.963 1 7.15 ? CD2 TYR A-5 52 1 
ATOM 7498 C CE1 . TYR A-5 1 52 . 41.279 41.98 -25.865 1 7.03 ? CE1 TYR A-5 52 1 
ATOM 7499 C CE2 . TYR A-5 1 52 . 39.078 41.605 -26.73 1 7.62 ? CE2 TYR A-5 52 1 
ATOM 7500 C CZ . TYR A-5 1 52 . 40.211 42.347 -26.664 1 7.93 ? CZ TYR A-5 52 1 
ATOM 7501 O OH . TYR A-5 1 52 . 40.365 43.53 -27.391 1 9.99 ? OH TYR A-5 52 1 
ATOM 7502 N N . PRO A-5 1 53 . 37.295 38.61 -21.836 1 5.53 ? N PRO A-5 53 1 
ATOM 7503 C CA . PRO A-5 1 53 . 36.483 37.72 -20.984 1 5.57 ? CA PRO A-5 53 1 
ATOM 7504 C C . PRO A-5 1 53 . 35.956 36.498 -21.725 1 5.35 ? C PRO A-5 53 1 
ATOM 7505 O O . PRO A-5 1 53 . 35.268 35.661 -21.092 1 6.68 ? O PRO A-5 53 1 
ATOM 7506 C CB . PRO A-5 1 53 . 35.357 38.624 -20.504 1 6.23 ? CB PRO A-5 53 1 
ATOM 7507 C CG . PRO A-5 1 53 . 35.199 39.636 -21.624 1 6.11 ? CG PRO A-5 53 1 
ATOM 7508 C CD . PRO A-5 1 53 . 36.611 39.917 -22.071 1 6.01 ? CD PRO A-5 53 1 
ATOM 7509 N N . VAL A-5 1 54 . 36.183 36.433 -23.008 1 5.39 ? N VAL A-5 54 1 
ATOM 7510 C CA . VAL A-5 1 54 . 35.684 35.467 -23.975 1 5.44 ? CA VAL A-5 54 1 
ATOM 7511 C C . VAL A-5 1 54 . 36.806 35.121 -24.91 1 5.39 ? C VAL A-5 54 1 
ATOM 7512 O O . VAL A-5 1 54 . 37.765 35.898 -25.042 1 6.44 ? O VAL A-5 54 1 
ATOM 7513 C CB . VAL A-5 1 54 . 34.507 36.101 -24.781 1 6.82 ? CB VAL A-5 54 1 
ATOM 7514 C CG1 . VAL A-5 1 54 . 33.291 36.286 -23.877 1 9.09 ? CG1 VAL A-5 54 1 
ATOM 7515 C CG2 . VAL A-5 1 54 . 34.936 37.386 -25.46 1 8.42 ? CG2 VAL A-5 54 1 
ATOM 7516 N N . ASP A-5 1 55 . 36.71 33.992 -25.601 1 5.29 ? N ASP A-5 55 1 
ATOM 7517 C CA A ASP A-5 1 55 . 37.559 33.722 -26.751 0.78 4.96 ? CA ASP A-5 55 1 
ATOM 7518 C CA B ASP A-5 1 55 . 37.58 33.755 -26.71 0.22 6.41 ? CA ASP A-5 55 1 
ATOM 7519 C C . ASP A-5 1 55 . 37.049 34.629 -27.868 1 5.12 ? C ASP A-5 55 1 
ATOM 7520 O O . ASP A-5 1 55 . 35.839 34.637 -28.176 1 8.66 ? O ASP A-5 55 1 
ATOM 7521 C CB A ASP A-5 1 55 . 37.529 32.263 -27.152 0.78 5.2 ? CB ASP A-5 55 1 
ATOM 7522 C CB B ASP A-5 1 55 . 37.61 32.262 -26.971 0.22 9.13 ? CB ASP A-5 55 1 
ATOM 7523 C CG A ASP A-5 1 55 . 38.386 31.353 -26.253 0.78 4.81 ? CG ASP A-5 55 1 
ATOM 7524 C CG B ASP A-5 1 55 . 38.272 31.512 -25.845 0.22 11.3 ? CG ASP A-5 55 1 
ATOM 7525 O OD1 A ASP A-5 1 55 . 38.622 31.727 -25.049 0.78 5.48 ? OD1 ASP A-5 55 1 
ATOM 7526 O OD1 B ASP A-5 1 55 . 39.486 31.35 -25.874 0.22 10.07 ? OD1 ASP A-5 55 1 
ATOM 7527 O OD2 A ASP A-5 1 55 . 38.72 30.275 -26.732 0.78 7 ? OD2 ASP A-5 55 1 
ATOM 7528 O OD2 B ASP A-5 1 55 . 37.596 31.134 -24.884 0.22 12.83 ? OD2 ASP A-5 55 1 
ATOM 7529 N N . TYR A-5 1 56 . 37.899 35.407 -28.454 1 4.78 ? N TYR A-5 56 1 
ATOM 7530 C CA . TYR A-5 1 56 . 37.51 36.546 -29.28 1 4.68 ? CA TYR A-5 56 1 
ATOM 7531 C C . TYR A-5 1 56 . 38.087 36.391 -30.67 1 4.31 ? C TYR A-5 56 1 
ATOM 7532 O O . TYR A-5 1 56 . 39.283 36.104 -30.821 1 4.97 ? O TYR A-5 56 1 
ATOM 7533 C CB . TYR A-5 1 56 . 38.01 37.835 -28.611 1 4.94 ? CB TYR A-5 56 1 
ATOM 7534 C CG . TYR A-5 1 56 . 37.571 39.086 -29.251 1 4.86 ? CG TYR A-5 56 1 
ATOM 7535 C CD1 . TYR A-5 1 56 . 36.43 39.755 -28.837 1 5.72 ? CD1 TYR A-5 56 1 
ATOM 7536 C CD2 . TYR A-5 1 56 . 38.262 39.648 -30.333 1 5.33 ? CD2 TYR A-5 56 1 
ATOM 7537 C CE1 . TYR A-5 1 56 . 35.992 40.92 -29.488 1 6.02 ? CE1 TYR A-5 56 1 
ATOM 7538 C CE2 . TYR A-5 1 56 . 37.852 40.797 -30.972 1 5.41 ? CE2 TYR A-5 56 1 
ATOM 7539 C CZ . TYR A-5 1 56 . 36.681 41.426 -30.55 1 5.07 ? CZ TYR A-5 56 1 
ATOM 7540 O OH . TYR A-5 1 56 . 36.203 42.54 -31.176 1 5.73 ? OH TYR A-5 56 1 
ATOM 7541 N N . GLY A-5 1 57 . 37.282 36.602 -31.708 1 4.69 ? N GLY A-5 57 1 
ATOM 7542 C CA . GLY A-5 1 57 . 37.83 36.503 -33.058 1 5.09 ? CA GLY A-5 57 1 
ATOM 7543 C C . GLY A-5 1 57 . 36.868 37.007 -34.099 1 4.53 ? C GLY A-5 57 1 
ATOM 7544 O O . GLY A-5 1 57 . 36.187 38.022 -33.888 1 4.87 ? O GLY A-5 57 1 
ATOM 7545 N N . ILE A-5 1 58 . 36.842 36.321 -35.227 1 4.98 ? N ILE A-5 58 1 
ATOM 7546 C CA . ILE A-5 1 58 . 36.102 36.74 -36.418 1 5.03 ? CA ILE A-5 58 1 
ATOM 7547 C C . ILE A-5 1 58 . 35.281 35.608 -36.96 1 5.26 ? C ILE A-5 58 1 
ATOM 7548 O O . ILE A-5 1 58 . 35.568 34.414 -36.765 1 5.72 ? O ILE A-5 58 1 
ATOM 7549 C CB . ILE A-5 1 58 . 37.042 37.259 -37.526 1 5.51 ? CB ILE A-5 58 1 
ATOM 7550 C CG1 . ILE A-5 1 58 . 37.961 36.2 -38.097 1 7.51 ? CG1 ILE A-5 58 1 
ATOM 7551 C CG2 . ILE A-5 1 58 . 37.794 38.466 -37.014 1 6.69 ? CG2 ILE A-5 58 1 
ATOM 7552 C CD1 . ILE A-5 1 58 . 38.705 36.636 -39.331 1 10.43 ? CD1 ILE A-5 58 1 
ATOM 7553 N N . ILE A-5 1 59 . 34.272 35.983 -37.749 1 5.62 ? N ILE A-5 59 1 
ATOM 7554 C CA . ILE A-5 1 59 . 33.591 35.049 -38.643 1 5.55 ? CA ILE A-5 59 1 
ATOM 7555 C C . ILE A-5 1 59 . 34.272 35.181 -39.991 1 5.5 ? C ILE A-5 59 1 
ATOM 7556 O O . ILE A-5 1 59 . 34.389 36.293 -40.535 1 6.11 ? O ILE A-5 59 1 
ATOM 7557 C CB . ILE A-5 1 59 . 32.099 35.299 -38.717 1 5.91 ? CB ILE A-5 59 1 
ATOM 7558 C CG1 . ILE A-5 1 59 . 31.462 35.188 -37.313 1 6.79 ? CG1 ILE A-5 59 1 
ATOM 7559 C CG2 . ILE A-5 1 59 . 31.469 34.314 -39.72 1 6.66 ? CG2 ILE A-5 59 1 
ATOM 7560 C CD1 . ILE A-5 1 59 . 30.006 35.53 -37.274 1 7.69 ? CD1 ILE A-5 59 1 
ATOM 7561 N N . PRO A-5 1 60 . 34.767 34.09 -40.589 1 6.35 ? N PRO A-5 60 1 
ATOM 7562 C CA . PRO A-5 1 60 . 35.418 34.225 -41.91 1 7.24 ? CA PRO A-5 60 1 
ATOM 7563 C C . PRO A-5 1 60 . 34.44 34.729 -42.965 1 6.6 ? C PRO A-5 60 1 
ATOM 7564 O O . PRO A-5 1 60 . 33.231 34.558 -42.867 1 6.97 ? O PRO A-5 60 1 
ATOM 7565 C CB . PRO A-5 1 60 . 35.869 32.775 -42.243 1 9.61 ? CB PRO A-5 60 1 
ATOM 7566 C CG . PRO A-5 1 60 . 35.898 32.078 -40.885 1 10.49 ? CG PRO A-5 60 1 
ATOM 7567 C CD . PRO A-5 1 60 . 34.791 32.702 -40.108 1 7.12 ? CD PRO A-5 60 1 
ATOM 7568 N N . GLN A-5 1 61 . 35.012 35.358 -44.009 1 6.87 ? N GLN A-5 61 1 
ATOM 7569 C CA A GLN A-5 1 61 . 34.195 35.844 -45.143 0.64 7.58 ? CA GLN A-5 61 1 
ATOM 7570 C CA B GLN A-5 1 61 . 34.178 35.755 -45.146 0.36 7.2 ? CA GLN A-5 61 1 
ATOM 7571 C C . GLN A-5 1 61 . 33.066 36.717 -44.674 1 7 ? C GLN A-5 61 1 
ATOM 7572 O O . GLN A-5 1 61 . 31.948 36.685 -45.175 1 7.54 ? O GLN A-5 61 1 
ATOM 7573 C CB A GLN A-5 1 61 . 33.764 34.726 -46.079 0.64 7.99 ? CB GLN A-5 61 1 
ATOM 7574 C CB B GLN A-5 1 61 . 33.649 34.547 -45.955 0.36 8.22 ? CB GLN A-5 61 1 
ATOM 7575 C CG A GLN A-5 1 61 . 34.972 34.083 -46.783 0.64 9.71 ? CG GLN A-5 61 1 
ATOM 7576 C CG B GLN A-5 1 61 . 34.752 33.953 -46.817 0.36 7.81 ? CG GLN A-5 61 1 
ATOM 7577 C CD A GLN A-5 1 61 . 34.522 33.153 -47.853 0.64 11.76 ? CD GLN A-5 61 1 
ATOM 7578 C CD B GLN A-5 1 61 . 34.238 32.95 -47.798 0.36 10.2 ? CD GLN A-5 61 1 
ATOM 7579 O OE1 A GLN A-5 1 61 . 33.764 33.558 -48.752 0.64 14.59 ? OE1 GLN A-5 61 1 
ATOM 7580 O OE1 B GLN A-5 1 61 . 33.043 32.876 -48.018 0.36 11 ? OE1 GLN A-5 61 1 
ATOM 7581 N NE2 A GLN A-5 1 61 . 34.83 31.867 -47.742 0.64 13.79 ? NE2 GLN A-5 61 1 
ATOM 7582 N NE2 B GLN A-5 1 61 . 35.103 32.165 -48.377 0.36 10.17 ? NE2 GLN A-5 61 1 
ATOM 7583 N N . THR A-5 1 62 . 33.396 37.602 -43.731 1 6.69 ? N THR A-5 62 1 
ATOM 7584 C CA . THR A-5 1 62 . 32.534 38.691 -43.305 1 6.47 ? CA THR A-5 62 1 
ATOM 7585 C C . THR A-5 1 62 . 33.336 39.983 -43.369 1 6.75 ? C THR A-5 62 1 
ATOM 7586 O O . THR A-5 1 62 . 34.556 40.01 -43.382 1 7.05 ? O THR A-5 62 1 
ATOM 7587 C CB . THR A-5 1 62 . 31.965 38.498 -41.892 1 6.69 ? CB THR A-5 62 1 
ATOM 7588 O OG1 . THR A-5 1 62 . 33 38.583 -40.925 1 6.43 ? OG1 THR A-5 62 1 
ATOM 7589 C CG2 . THR A-5 1 62 . 31.143 37.254 -41.784 1 7.11 ? CG2 THR A-5 62 1 
ATOM 7590 N N . TRP A-5 1 63 . 32.574 41.099 -43.35 1 7.15 ? N TRP A-5 63 1 
ATOM 7591 C CA . TRP A-5 1 63 . 33.148 42.435 -43.262 1 6.75 ? CA TRP A-5 63 1 
ATOM 7592 C C . TRP A-5 1 63 . 32.223 43.28 -42.441 1 6.5 ? C TRP A-5 63 1 
ATOM 7593 O O . TRP A-5 1 63 . 31.085 42.916 -42.199 1 7.85 ? O TRP A-5 63 1 
ATOM 7594 C CB . TRP A-5 1 63 . 33.406 43.006 -44.661 1 8.04 ? CB TRP A-5 63 1 
ATOM 7595 C CG . TRP A-5 1 63 . 34.356 44.139 -44.716 1 8.78 ? CG TRP A-5 63 1 
ATOM 7596 C CD1 . TRP A-5 1 63 . 34.104 45.462 -45.036 1 10.6 ? CD1 TRP A-5 63 1 
ATOM 7597 C CD2 . TRP A-5 1 63 . 35.77 44.061 -44.473 1 9.48 ? CD2 TRP A-5 63 1 
ATOM 7598 N NE1 . TRP A-5 1 63 . 35.276 46.186 -44.966 1 11.67 ? NE1 TRP A-5 63 1 
ATOM 7599 C CE2 . TRP A-5 1 63 . 36.309 45.349 -44.666 1 10.29 ? CE2 TRP A-5 63 1 
ATOM 7600 C CE3 . TRP A-5 1 63 . 36.619 43.018 -44.124 1 10.16 ? CE3 TRP A-5 63 1 
ATOM 7601 C CZ2 . TRP A-5 1 63 . 37.675 45.601 -44.556 1 12.8 ? CZ2 TRP A-5 63 1 
ATOM 7602 C CZ3 . TRP A-5 1 63 . 37.94 43.253 -44.037 1 11.15 ? CZ3 TRP A-5 63 1 
ATOM 7603 C CH2 . TRP A-5 1 63 . 38.488 44.564 -44.27 1 12.69 ? CH2 TRP A-5 63 1 
ATOM 7604 N N . TYR A-5 1 64 . 32.696 44.416 -41.993 1 6.79 ? N TYR A-5 64 1 
ATOM 7605 C CA . TYR A-5 1 64 . 31.908 45.209 -41.039 1 7.2 ? CA TYR A-5 64 1 
ATOM 7606 C C . TYR A-5 1 64 . 32.326 46.662 -41.085 1 6.84 ? C TYR A-5 64 1 
ATOM 7607 O O . TYR A-5 1 64 . 33.321 47.045 -41.726 1 7.99 ? O TYR A-5 64 1 
ATOM 7608 C CB . TYR A-5 1 64 . 32.015 44.624 -39.618 1 6.65 ? CB TYR A-5 64 1 
ATOM 7609 C CG . TYR A-5 1 64 . 30.755 44.847 -38.848 1 6.51 ? CG TYR A-5 64 1 
ATOM 7610 C CD1 . TYR A-5 1 64 . 29.576 44.224 -39.223 1 7.3 ? CD1 TYR A-5 64 1 
ATOM 7611 C CD2 . TYR A-5 1 64 . 30.677 45.705 -37.745 1 6.84 ? CD2 TYR A-5 64 1 
ATOM 7612 C CE1 . TYR A-5 1 64 . 28.391 44.412 -38.544 1 7.15 ? CE1 TYR A-5 64 1 
ATOM 7613 C CE2 . TYR A-5 1 64 . 29.512 45.937 -37.109 1 6.98 ? CE2 TYR A-5 64 1 
ATOM 7614 C CZ . TYR A-5 1 64 . 28.37 45.249 -37.461 1 7.13 ? CZ TYR A-5 64 1 
ATOM 7615 O OH . TYR A-5 1 64 . 27.221 45.448 -36.732 1 7.61 ? OH TYR A-5 64 1 
ATOM 7616 N N . ASP A-5 1 65 . 31.574 47.485 -40.375 1 7.16 ? N ASP A-5 65 1 
ATOM 7617 C CA . ASP A-5 1 65 . 31.673 48.942 -40.479 1 7.38 ? CA ASP A-5 65 1 
ATOM 7618 C C . ASP A-5 1 65 . 32.987 49.498 -40 1 7.67 ? C ASP A-5 65 1 
ATOM 7619 O O . ASP A-5 1 65 . 33.322 50.624 -40.361 1 9.41 ? O ASP A-5 65 1 
ATOM 7620 C CB . ASP A-5 1 65 . 30.566 49.612 -39.667 1 8.1 ? CB ASP A-5 65 1 
ATOM 7621 C CG . ASP A-5 1 65 . 29.18 49.197 -40.128 1 9.92 ? CG ASP A-5 65 1 
ATOM 7622 O OD1 . ASP A-5 1 65 . 28.839 48.025 -40.086 1 11.41 ? OD1 ASP A-5 65 1 
ATOM 7623 O OD2 . ASP A-5 1 65 . 28.414 50.069 -40.509 1 18.8 ? OD2 ASP A-5 65 1 
ATOM 7624 N N . ASP A-5 1 66 . 33.714 48.769 -39.143 1 7.9 ? N ASP A-5 66 1 
ATOM 7625 C CA . ASP A-5 1 66 . 35.024 49.202 -38.685 1 7.53 ? CA ASP A-5 66 1 
ATOM 7626 C C . ASP A-5 1 66 . 36.134 48.774 -39.61 1 8.33 ? C ASP A-5 66 1 
ATOM 7627 O O . ASP A-5 1 66 . 37.32 48.928 -39.26 1 9.85 ? O ASP A-5 66 1 
ATOM 7628 C CB . ASP A-5 1 66 . 35.286 48.761 -37.252 1 7.95 ? CB ASP A-5 66 1 
ATOM 7629 C CG . ASP A-5 1 66 . 35.358 47.246 -37.073 1 6.05 ? CG ASP A-5 66 1 
ATOM 7630 O OD1 . ASP A-5 1 66 . 34.874 46.521 -37.953 1 7.24 ? OD1 ASP A-5 66 1 
ATOM 7631 O OD2 . ASP A-5 1 66 . 35.879 46.834 -35.991 1 5.76 ? OD2 ASP A-5 66 1 
ATOM 7632 N N . GLY A-5 1 67 . 35.814 48.33 -40.815 1 8.42 ? N GLY A-5 67 1 
ATOM 7633 C CA . GLY A-5 1 67 . 36.874 48.044 -41.762 1 9.79 ? CA GLY A-5 67 1 
ATOM 7634 C C . GLY A-5 1 67 . 37.656 46.797 -41.448 1 8.76 ? C GLY A-5 67 1 
ATOM 7635 O O . GLY A-5 1 67 . 38.888 46.762 -41.605 1 10.3 ? O GLY A-5 67 1 
ATOM 7636 N N . ASP A-5 1 68 . 36.964 45.768 -40.978 1 7.79 ? N ASP A-5 68 1 
ATOM 7637 C CA . ASP A-5 1 68 . 37.586 44.504 -40.624 1 7.88 ? CA ASP A-5 68 1 
ATOM 7638 C C . ASP A-5 1 68 . 36.459 43.467 -40.562 1 6.69 ? C ASP A-5 68 1 
ATOM 7639 O O . ASP A-5 1 68 . 35.28 43.808 -40.614 1 7.12 ? O ASP A-5 68 1 
ATOM 7640 C CB . ASP A-5 1 68 . 38.404 44.616 -39.32 1 8.23 ? CB ASP A-5 68 1 
ATOM 7641 C CG . ASP A-5 1 68 . 39.907 44.689 -39.579 1 9.4 ? CG ASP A-5 68 1 
ATOM 7642 O OD1 . ASP A-5 1 68 . 40.431 44.034 -40.496 1 10.77 ? OD1 ASP A-5 68 1 
ATOM 7643 O OD2 . ASP A-5 1 68 . 40.564 45.419 -38.775 1 11.24 ? OD2 ASP A-5 68 1 
ATOM 7644 N N . PRO A-5 1 69 . 36.828 42.179 -40.413 1 6.47 ? N PRO A-5 69 1 
ATOM 7645 C CA . PRO A-5 1 69 . 35.811 41.149 -40.323 1 6.24 ? CA PRO A-5 69 1 
ATOM 7646 C C . PRO A-5 1 69 . 34.903 41.348 -39.117 1 5.4 ? C PRO A-5 69 1 
ATOM 7647 O O . PRO A-5 1 69 . 35.292 41.934 -38.09 1 5.71 ? O PRO A-5 69 1 
ATOM 7648 C CB . PRO A-5 1 69 . 36.624 39.877 -40.233 1 7.11 ? CB PRO A-5 69 1 
ATOM 7649 C CG . PRO A-5 1 69 . 37.947 40.21 -40.888 1 8.02 ? CG PRO A-5 69 1 
ATOM 7650 C CD . PRO A-5 1 69 . 38.197 41.628 -40.465 1 7.55 ? CD PRO A-5 69 1 
ATOM 7651 N N . PHE A-5 1 70 . 33.722 40.787 -39.183 1 5.78 ? N PHE A-5 70 1 
ATOM 7652 C CA . PHE A-5 1 70 . 32.725 40.856 -38.105 1 5.49 ? CA PHE A-5 70 1 
ATOM 7653 C C . PHE A-5 1 70 . 33.219 40.049 -36.915 1 5.09 ? C PHE A-5 70 1 
ATOM 7654 O O . PHE A-5 1 70 . 33.703 38.924 -37.023 1 5.57 ? O PHE A-5 70 1 
ATOM 7655 C CB . PHE A-5 1 70 . 31.414 40.335 -38.683 1 6.16 ? CB PHE A-5 70 1 
ATOM 7656 C CG . PHE A-5 1 70 . 30.199 40.451 -37.797 1 5.66 ? CG PHE A-5 70 1 
ATOM 7657 C CD1 . PHE A-5 1 70 . 29.23 39.449 -37.82 1 6.83 ? CD1 PHE A-5 70 1 
ATOM 7658 C CD2 . PHE A-5 1 70 . 29.901 41.585 -37.057 1 6.46 ? CD2 PHE A-5 70 1 
ATOM 7659 C CE1 . PHE A-5 1 70 . 28.057 39.58 -37.109 1 7.3 ? CE1 PHE A-5 70 1 
ATOM 7660 C CE2 . PHE A-5 1 70 . 28.757 41.687 -36.313 1 6.67 ? CE2 PHE A-5 70 1 
ATOM 7661 C CZ . PHE A-5 1 70 . 27.821 40.693 -36.336 1 6.7 ? CZ PHE A-5 70 1 
ATOM 7662 N N . ASP A-5 1 71 . 33.054 40.655 -35.737 1 4.86 ? N ASP A-5 71 1 
ATOM 7663 C CA . ASP A-5 1 71 . 33.584 40.141 -34.498 0.93 4.19 ? CA ASP A-5 71 1 
ATOM 7664 C C . ASP A-5 1 71 . 32.638 39.134 -33.824 1 4.9 ? C ASP A-5 71 1 
ATOM 7665 O O . ASP A-5 1 71 . 31.424 39.327 -33.785 1 5.03 ? O ASP A-5 71 1 
ATOM 7666 C CB . ASP A-5 1 71 . 33.857 41.289 -33.518 1 5.03 ? CB ASP A-5 71 1 
ATOM 7667 C CG . ASP A-5 1 71 . 34.877 42.263 -34.033 1 4.56 ? CG ASP A-5 71 1 
ATOM 7668 O OD1 . ASP A-5 1 71 . 34.722 43.506 -33.79 1 4.86 ? OD1 ASP A-5 71 1 
ATOM 7669 O OD2 . ASP A-5 1 71 . 35.848 41.805 -34.666 1 4.97 ? OD2 ASP A-5 71 1 
ATOM 7670 N N . ILE A-5 1 72 . 33.247 38.093 -33.262 1 4.9 ? N ILE A-5 72 1 
ATOM 7671 C CA . ILE A-5 1 72 . 32.524 37.07 -32.522 1 4.73 ? CA ILE A-5 72 1 
ATOM 7672 C C . ILE A-5 1 72 . 33.249 36.747 -31.248 1 4.8 ? C ILE A-5 72 1 
ATOM 7673 O O . ILE A-5 1 72 . 34.486 36.695 -31.183 1 5.94 ? O ILE A-5 72 1 
ATOM 7674 C CB . ILE A-5 1 72 . 32.28 35.833 -33.418 1 5.17 ? CB ILE A-5 72 1 
ATOM 7675 C CG1 . ILE A-5 1 72 . 31.424 34.775 -32.691 1 5.54 ? CG1 ILE A-5 72 1 
ATOM 7676 C CG2 . ILE A-5 1 72 . 33.555 35.242 -33.954 1 5.7 ? CG2 ILE A-5 72 1 
ATOM 7677 C CD1 . ILE A-5 1 72 . 30.75 33.782 -33.648 1 6.31 ? CD1 ILE A-5 72 1 
ATOM 7678 N N . MET A-5 1 73 . 32.461 36.491 -30.233 1 4.76 ? N MET A-5 73 1 
ATOM 7679 C CA . MET A-5 1 73 . 32.868 36.161 -28.864 1 4.99 ? CA MET A-5 73 1 
ATOM 7680 C C . MET A-5 1 73 . 32.322 34.79 -28.539 1 5.58 ? C MET A-5 73 1 
ATOM 7681 O O . MET A-5 1 73 . 31.101 34.609 -28.57 1 7 ? O MET A-5 73 1 
ATOM 7682 C CB . MET A-5 1 73 . 32.274 37.202 -27.906 1 5.68 ? CB MET A-5 73 1 
ATOM 7683 C CG . MET A-5 1 73 . 32.623 38.643 -28.278 1 6.07 ? CG MET A-5 73 1 
ATOM 7684 S SD . MET A-5 1 73 . 32.087 39.883 -27.082 1 7.52 ? SD MET A-5 73 1 
ATOM 7685 C CE . MET A-5 1 73 . 30.289 39.723 -27.215 1 8.16 ? CE MET A-5 73 1 
ATOM 7686 N N . VAL A-5 1 74 . 33.193 33.823 -28.268 1 5.26 ? N VAL A-5 74 1 
ATOM 7687 C CA . VAL A-5 1 74 . 32.812 32.456 -27.974 1 5.11 ? CA VAL A-5 74 1 
ATOM 7688 C C . VAL A-5 1 74 . 33.119 32.173 -26.507 1 5.59 ? C VAL A-5 74 1 
ATOM 7689 O O . VAL A-5 1 74 . 34.224 32.406 -26.026 1 6.29 ? O VAL A-5 74 1 
ATOM 7690 C CB . VAL A-5 1 74 . 33.477 31.453 -28.874 1 5.78 ? CB VAL A-5 74 1 
ATOM 7691 C CG1 . VAL A-5 1 74 . 32.943 30.056 -28.556 1 6.92 ? CG1 VAL A-5 74 1 
ATOM 7692 C CG2 . VAL A-5 1 74 . 33.238 31.787 -30.337 1 6.87 ? CG2 VAL A-5 74 1 
ATOM 7693 N N . ILE A-5 1 75 . 32.121 31.645 -25.803 1 5.95 ? N ILE A-5 75 1 
ATOM 7694 C CA A ILE A-5 1 75 . 32.272 31.27 -24.444 0.24 6.15 ? CA ILE A-5 75 1 
ATOM 7695 C CA B ILE A-5 1 75 . 32.326 31.272 -24.393 0.76 6.32 ? CA ILE A-5 75 1 
ATOM 7696 C C . ILE A-5 1 75 . 32.918 29.85 -24.338 1 6.47 ? C ILE A-5 75 1 
ATOM 7697 O O . ILE A-5 1 75 . 32.247 28.878 -24.557 0.9 7.34 ? O ILE A-5 75 1 
ATOM 7698 C CB A ILE A-5 1 75 . 30.935 31.358 -23.734 0.24 9.65 ? CB ILE A-5 75 1 
ATOM 7699 C CB B ILE A-5 1 75 . 31.008 31.329 -23.617 0.76 6.06 ? CB ILE A-5 75 1 
ATOM 7700 C CG1 A ILE A-5 1 75 . 30.301 32.723 -24.068 0.24 8.58 ? CG1 ILE A-5 75 1 
ATOM 7701 C CG1 B ILE A-5 1 75 . 30.276 32.663 -23.798 0.76 8.44 ? CG1 ILE A-5 75 1 
ATOM 7702 C CG2 A ILE A-5 1 75 . 31.104 31.184 -22.205 0.24 14.17 ? CG2 ILE A-5 75 1 
ATOM 7703 C CG2 B ILE A-5 1 75 . 31.301 31.068 -22.146 0.76 7.07 ? CG2 ILE A-5 75 1 
ATOM 7704 C CD1 A ILE A-5 1 75 . 31.205 33.882 -23.76 0.24 8.05 ? CD1 ILE A-5 75 1 
ATOM 7705 C CD1 B ILE A-5 1 75 . 28.853 32.685 -23.198 0.76 9.61 ? CD1 ILE A-5 75 1 
ATOM 7706 N N . MET A-5 1 76 . 34.242 29.798 -24.097 1 7.14 ? N MET A-5 76 1 
ATOM 7707 C CA . MET A-5 1 76 . 35.005 28.551 -23.959 1 7.1 ? CA MET A-5 76 1 
ATOM 7708 C C . MET A-5 1 76 . 35.438 28.366 -22.483 1 7.57 ? C MET A-5 76 1 
ATOM 7709 O O . MET A-5 1 76 . 36.05 29.269 -21.929 1 9.76 ? O MET A-5 76 1 
ATOM 7710 C CB . MET A-5 1 76 . 36.231 28.474 -24.857 0.81 5.65 ? CB MET A-5 76 1 
ATOM 7711 C CG . MET A-5 1 76 . 35.916 28.32 -26.329 1 8.44 ? CG MET A-5 76 1 
ATOM 7712 S SD . MET A-5 1 76 . 35.152 26.684 -26.697 1 9.77 ? SD MET A-5 76 1 
ATOM 7713 C CE . MET A-5 1 76 . 36.518 25.594 -26.366 1 9.5 ? CE MET A-5 76 1 
ATOM 7714 N N . ARG A-5 1 77 . 35.207 27.201 -21.929 1 6.49 ? N ARG A-5 77 1 
ATOM 7715 C CA . ARG A-5 1 77 . 35.69 26.873 -20.605 1 6.33 ? CA ARG A-5 77 1 
ATOM 7716 C C . ARG A-5 1 77 . 37.211 26.8 -20.568 1 7.01 ? C ARG A-5 77 1 
ATOM 7717 O O . ARG A-5 1 77 . 37.846 27.475 -19.744 1 10.91 ? O ARG A-5 77 1 
ATOM 7718 C CB . ARG A-5 1 77 . 35.03 25.582 -20.08 1 7.12 ? CB ARG A-5 77 1 
ATOM 7719 C CG . ARG A-5 1 77 . 33.524 25.746 -19.912 1 7.08 ? CG ARG A-5 77 1 
ATOM 7720 C CD . ARG A-5 1 77 . 32.922 24.575 -19.174 1 7.8 ? CD ARG A-5 77 1 
ATOM 7721 N NE . ARG A-5 1 77 . 32.884 23.366 -19.993 1 7.04 ? NE ARG A-5 77 1 
ATOM 7722 C CZ . ARG A-5 1 77 . 32.768 22.13 -19.494 1 7.27 ? CZ ARG A-5 77 1 
ATOM 7723 N NH1 . ARG A-5 1 77 . 32.905 21.887 -18.189 1 7.82 ? NH1 ARG A-5 77 1 
ATOM 7724 N NH2 . ARG A-5 1 77 . 32.579 21.12 -20.333 1 7.52 ? NH2 ARG A-5 77 1 
ATOM 7725 N N . GLU A-5 1 78 . 37.819 26.015 -21.435 1 6.55 ? N GLU A-5 78 1 
ATOM 7726 C CA . GLU A-5 1 78 . 39.241 26.015 -21.648 1 6.08 ? CA GLU A-5 78 1 
ATOM 7727 C C . GLU A-5 1 78 . 39.495 26.883 -22.899 1 6.01 ? C GLU A-5 78 1 
ATOM 7728 O O . GLU A-5 1 78 . 38.982 26.517 -23.969 1 6.71 ? O GLU A-5 78 1 
ATOM 7729 C CB . GLU A-5 1 78 . 39.766 24.582 -21.898 1 6.87 ? CB GLU A-5 78 1 
ATOM 7730 C CG . GLU A-5 1 78 . 41.248 24.524 -22.167 1 7.07 ? CG GLU A-5 78 1 
ATOM 7731 C CD . GLU A-5 1 78 . 41.737 23.063 -22.323 1 7.94 ? CD GLU A-5 78 1 
ATOM 7732 O OE1 . GLU A-5 1 78 . 41.679 22.324 -21.355 1 8.79 ? OE1 GLU A-5 78 1 
ATOM 7733 O OE2 . GLU A-5 1 78 . 42.118 22.655 -23.436 1 8.75 ? OE2 GLU A-5 78 1 
ATOM 7734 N N . PRO A-5 1 79 . 40.207 27.971 -22.785 1 6.29 ? N PRO A-5 79 1 
ATOM 7735 C CA . PRO A-5 1 79 . 40.425 28.813 -23.986 1 7.4 ? CA PRO A-5 79 1 
ATOM 7736 C C . PRO A-5 1 79 . 41.163 28.033 -25.064 1 6.54 ? C PRO A-5 79 1 
ATOM 7737 O O . PRO A-5 1 79 . 41.969 27.164 -24.789 1 7.98 ? O PRO A-5 79 1 
ATOM 7738 C CB . PRO A-5 1 79 . 41.288 29.956 -23.444 1 9.58 ? CB PRO A-5 79 1 
ATOM 7739 C CG . PRO A-5 1 79 . 40.928 29.987 -21.961 1 11.99 ? CG PRO A-5 79 1 
ATOM 7740 C CD . PRO A-5 1 79 . 40.795 28.549 -21.582 1 9.34 ? CD PRO A-5 79 1 
ATOM 7741 N N . VAL A-5 1 80 . 40.862 28.403 -26.301 1 6.9 ? N VAL A-5 80 1 
ATOM 7742 C CA . VAL A-5 1 80 . 41.575 27.844 -27.421 1 6.39 ? CA VAL A-5 80 1 
ATOM 7743 C C . VAL A-5 1 80 . 42.802 28.633 -27.764 1 6.41 ? C VAL A-5 80 1 
ATOM 7744 O O . VAL A-5 1 80 . 42.948 29.761 -27.411 1 12.34 ? O VAL A-5 80 1 
ATOM 7745 C CB . VAL A-5 1 80 . 40.689 27.599 -28.667 1 7.07 ? CB VAL A-5 80 1 
ATOM 7746 C CG1 . VAL A-5 1 80 . 39.469 26.749 -28.32 1 7.7 ? CG1 VAL A-5 80 1 
ATOM 7747 C CG2 . VAL A-5 1 80 . 40.27 28.902 -29.374 1 7.07 ? CG2 VAL A-5 80 1 
ATOM 7748 N N . TYR A-5 1 81 . 43.644 28.09 -28.598 1 6.87 ? N TYR A-5 81 1 
ATOM 7749 C CA . TYR A-5 1 81 . 44.809 28.747 -29.123 1 6.61 ? CA TYR A-5 81 1 
ATOM 7750 C C . TYR A-5 1 81 . 44.417 29.704 -30.243 1 6.29 ? C TYR A-5 81 1 
ATOM 7751 O O . TYR A-5 1 81 . 43.441 29.425 -30.999 1 7.29 ? O TYR A-5 81 1 
ATOM 7752 C CB . TYR A-5 1 81 . 45.854 27.723 -29.62 1 6.91 ? CB TYR A-5 81 1 
ATOM 7753 C CG . TYR A-5 1 81 . 46.457 26.961 -28.507 1 6.95 ? CG TYR A-5 81 1 
ATOM 7754 C CD1 . TYR A-5 1 81 . 45.851 25.823 -27.966 1 7.61 ? CD1 TYR A-5 81 1 
ATOM 7755 C CD2 . TYR A-5 1 81 . 47.633 27.398 -27.903 1 6.69 ? CD2 TYR A-5 81 1 
ATOM 7756 C CE1 . TYR A-5 1 81 . 46.386 25.193 -26.877 1 8.61 ? CE1 TYR A-5 81 1 
ATOM 7757 C CE2 . TYR A-5 1 81 . 48.176 26.754 -26.805 1 7.91 ? CE2 TYR A-5 81 1 
ATOM 7758 C CZ . TYR A-5 1 81 . 47.513 25.64 -26.274 1 7.85 ? CZ TYR A-5 81 1 
ATOM 7759 O OH . TYR A-5 1 81 . 48.063 25.023 -25.189 1 9.9 ? OH TYR A-5 81 1 
ATOM 7760 N N . PRO A-5 1 82 . 45.157 30.775 -30.507 1 6.6 ? N PRO A-5 82 1 
ATOM 7761 C CA . PRO A-5 1 82 . 44.835 31.605 -31.663 1 6.49 ? CA PRO A-5 82 1 
ATOM 7762 C C . PRO A-5 1 82 . 44.872 30.802 -32.946 1 6.38 ? C PRO A-5 82 1 
ATOM 7763 O O . PRO A-5 1 82 . 45.677 29.878 -33.118 1 7.21 ? O PRO A-5 82 1 
ATOM 7764 C CB . PRO A-5 1 82 . 45.946 32.66 -31.657 1 8.01 ? CB PRO A-5 82 1 
ATOM 7765 C CG . PRO A-5 1 82 . 46.446 32.691 -30.23 1 8.51 ? CG PRO A-5 82 1 
ATOM 7766 C CD . PRO A-5 1 82 . 46.338 31.24 -29.763 1 7.51 ? CD PRO A-5 82 1 
ATOM 7767 N N . LEU A-5 1 83 . 43.991 31.208 -33.864 1 6.31 ? N LEU A-5 83 1 
ATOM 7768 C CA . LEU A-5 1 83 . 43.798 30.63 -35.174 1 6.74 ? CA LEU A-5 83 1 
ATOM 7769 C C . LEU A-5 1 83 . 43.123 29.28 -35.152 1 6.65 ? C LEU A-5 83 1 
ATOM 7770 O O . LEU A-5 1 83 . 43.135 28.562 -36.15 1 8.57 ? O LEU A-5 83 1 
ATOM 7771 C CB . LEU A-5 1 83 . 45.079 30.62 -36.032 1 9.23 ? CB LEU A-5 83 1 
ATOM 7772 C CG . LEU A-5 1 83 . 45.797 31.944 -36.112 1 13.43 ? CG LEU A-5 83 1 
ATOM 7773 C CD1 . LEU A-5 1 83 . 47.059 31.763 -37.035 1 19.69 ? CD1 LEU A-5 83 1 
ATOM 7774 C CD2 . LEU A-5 1 83 . 44.917 33.013 -36.603 1 16.76 ? CD2 LEU A-5 83 1 
ATOM 7775 N N . THR A-5 1 84 . 42.427 28.963 -34.046 1 6.22 ? N THR A-5 84 1 
ATOM 7776 C CA . THR A-5 1 84 . 41.611 27.756 -33.964 1 5.97 ? CA THR A-5 84 1 
ATOM 7777 C C . THR A-5 1 84 . 40.192 28.086 -34.479 1 5.51 ? C THR A-5 84 1 
ATOM 7778 O O . THR A-5 1 84 . 39.6 29.109 -34.096 1 6.08 ? O THR A-5 84 1 
ATOM 7779 C CB . THR A-5 1 84 . 41.536 27.259 -32.539 1 6.72 ? CB THR A-5 84 1 
ATOM 7780 O OG1 . THR A-5 1 84 . 42.84 27.022 -32.032 1 7.84 ? OG1 THR A-5 84 1 
ATOM 7781 C CG2 . THR A-5 1 84 . 40.759 25.956 -32.46 1 8.07 ? CG2 THR A-5 84 1 
ATOM 7782 N N . ILE A-5 1 85 . 39.637 27.165 -35.255 1 5.46 ? N ILE A-5 85 1 
ATOM 7783 C CA . ILE A-5 1 85 . 38.255 27.217 -35.704 1 5.41 ? CA ILE A-5 85 1 
ATOM 7784 C C . ILE A-5 1 85 . 37.348 26.563 -34.689 1 5.24 ? C ILE A-5 85 1 
ATOM 7785 O O . ILE A-5 1 85 . 37.595 25.43 -34.276 1 6.35 ? O ILE A-5 85 1 
ATOM 7786 C CB . ILE A-5 1 85 . 38.11 26.456 -37.028 1 7.14 ? CB ILE A-5 85 1 
ATOM 7787 C CG1 . ILE A-5 1 85 . 39.019 26.969 -38.123 1 8.97 ? CG1 ILE A-5 85 1 
ATOM 7788 C CG2 . ILE A-5 1 85 . 36.648 26.407 -37.449 1 8.84 ? CG2 ILE A-5 85 1 
ATOM 7789 C CD1 . ILE A-5 1 85 . 39.234 25.88 -39.222 1 12.02 ? CD1 ILE A-5 85 1 
ATOM 7790 N N . ILE A-5 1 86 . 36.281 27.243 -34.315 1 5.24 ? N ILE A-5 86 1 
ATOM 7791 C CA . ILE A-5 1 86 . 35.265 26.695 -33.428 1 5.71 ? CA ILE A-5 86 1 
ATOM 7792 C C . ILE A-5 1 86 . 33.916 26.748 -34.163 1 5.48 ? C ILE A-5 86 1 
ATOM 7793 O O . ILE A-5 1 86 . 33.523 27.833 -34.608 1 6.91 ? O ILE A-5 86 1 
ATOM 7794 C CB . ILE A-5 1 86 . 35.144 27.46 -32.098 1 5.78 ? CB ILE A-5 86 1 
ATOM 7795 C CG1 . ILE A-5 1 86 . 36.482 27.53 -31.364 1 6.45 ? CG1 ILE A-5 86 1 
ATOM 7796 C CG2 . ILE A-5 1 86 . 34.032 26.869 -31.217 1 6.8 ? CG2 ILE A-5 86 1 
ATOM 7797 C CD1 . ILE A-5 1 86 . 36.431 28.357 -30.108 1 6.96 ? CD1 ILE A-5 86 1 
ATOM 7798 N N . GLU A-5 1 87 . 33.176 25.661 -34.238 1 5.35 ? N GLU A-5 87 1 
ATOM 7799 C CA B GLU A-5 1 87 . 31.787 25.679 -34.665 0.52 5.91 ? CA GLU A-5 87 1 
ATOM 7800 C CA C GLU A-5 1 87 . 31.796 25.734 -34.68 0.16 4.53 ? CA GLU A-5 87 1 
ATOM 7801 C CA D GLU A-5 1 87 . 31.798 25.681 -34.683 0.32 6.15 ? CA GLU A-5 87 1 
ATOM 7802 C C . GLU A-5 1 87 . 30.945 26.264 -33.532 1 5.44 ? C GLU A-5 87 1 
ATOM 7803 O O . GLU A-5 1 87 . 30.931 25.705 -32.431 1 6.38 ? O GLU A-5 87 1 
ATOM 7804 C CB B GLU A-5 1 87 . 31.317 24.259 -34.956 0.52 6.91 ? CB GLU A-5 87 1 
ATOM 7805 C CB C GLU A-5 1 87 . 31.268 24.407 -35.221 0.16 6 ? CB GLU A-5 87 1 
ATOM 7806 C CB D GLU A-5 1 87 . 31.355 24.257 -35.058 0.32 6.84 ? CB GLU A-5 87 1 
ATOM 7807 C CG B GLU A-5 1 87 . 31.995 23.687 -36.095 0.52 8.71 ? CG GLU A-5 87 1 
ATOM 7808 C CG C GLU A-5 1 87 . 31.973 23.944 -36.477 0.16 8.87 ? CG GLU A-5 87 1 
ATOM 7809 C CG D GLU A-5 1 87 . 30.036 24.217 -35.744 0.32 6.84 ? CG GLU A-5 87 1 
ATOM 7810 C CD B GLU A-5 1 87 . 32.174 22.104 -36.004 0.52 13.19 ? CD GLU A-5 87 1 
ATOM 7811 C CD C GLU A-5 1 87 . 31.5 22.574 -36.938 0.16 11.76 ? CD GLU A-5 87 1 
ATOM 7812 C CD D GLU A-5 1 87 . 29.601 22.799 -36.189 0.32 10.09 ? CD GLU A-5 87 1 
ATOM 7813 O OE1 B GLU A-5 1 87 . 32.45 21.299 -34.91 0.52 13.17 ? OE1 GLU A-5 87 1 
ATOM 7814 O OE1 C GLU A-5 1 87 . 30.53 22.038 -36.361 0.16 14.6 ? OE1 GLU A-5 87 1 
ATOM 7815 O OE1 D GLU A-5 1 87 . 28.511 22.543 -36.67 0.32 9.99 ? OE1 GLU A-5 87 1 
ATOM 7816 O OE2 B GLU A-5 1 87 . 32.249 21.53 -37.132 0.52 17.98 ? OE2 GLU A-5 87 1 
ATOM 7817 O OE2 C GLU A-5 1 87 . 32.167 22.022 -37.86 0.16 12.42 ? OE2 GLU A-5 87 1 
ATOM 7818 O OE2 D GLU A-5 1 87 . 30.392 21.844 -36.084 0.32 16.66 ? OE2 GLU A-5 87 1 
ATOM 7819 N N . ALA A-5 1 88 . 30.277 27.366 -33.81 1 5.58 ? N ALA A-5 88 1 
ATOM 7820 C CA . ALA A-5 1 88 . 29.677 28.204 -32.753 1 6.66 ? CA ALA A-5 88 1 
ATOM 7821 C C . ALA A-5 1 88 . 28.217 28.502 -33.086 1 6.11 ? C ALA A-5 88 1 
ATOM 7822 O O . ALA A-5 1 88 . 27.851 28.778 -34.217 1 6.89 ? O ALA A-5 88 1 
ATOM 7823 C CB . ALA A-5 1 88 . 30.466 29.482 -32.631 1 8.29 ? CB ALA A-5 88 1 
ATOM 7824 N N . ARG A-5 1 89 . 27.402 28.461 -32.026 1 5.79 ? N ARG A-5 89 1 
ATOM 7825 C CA . ARG A-5 1 89 . 25.991 28.796 -32.076 1 5.79 ? CA ARG A-5 89 1 
ATOM 7826 C C . ARG A-5 1 89 . 25.787 30.207 -31.53 1 5.55 ? C ARG A-5 89 1 
ATOM 7827 O O . ARG A-5 1 89 . 25.987 30.449 -30.345 1 5.94 ? O ARG A-5 89 1 
ATOM 7828 C CB . ARG A-5 1 89 . 25.169 27.793 -31.199 1 6.92 ? CB ARG A-5 89 1 
ATOM 7829 C CG . ARG A-5 1 89 . 23.756 28.194 -30.988 1 8.75 ? CG ARG A-5 89 1 
ATOM 7830 C CD . ARG A-5 1 89 . 22.894 27.106 -30.339 1 10.31 ? CD ARG A-5 89 1 
ATOM 7831 N NE . ARG A-5 1 89 . 23.344 26.702 -28.949 1 9.21 ? NE ARG A-5 89 1 
ATOM 7832 C CZ . ARG A-5 1 89 . 24.04 25.582 -28.707 1 8.44 ? CZ ARG A-5 89 1 
ATOM 7833 N NH1 . ARG A-5 1 89 . 24.321 25.262 -27.479 1 9.12 ? NH1 ARG A-5 89 1 
ATOM 7834 N NH2 . ARG A-5 1 89 . 24.468 24.807 -29.712 1 10.1 ? NH2 ARG A-5 89 1 
ATOM 7835 N N . PRO A-5 1 90 . 25.377 31.148 -32.392 1 5.88 ? N PRO A-5 90 1 
ATOM 7836 C CA . PRO A-5 1 90 . 25.044 32.507 -31.917 1 6.06 ? CA PRO A-5 90 1 
ATOM 7837 C C . PRO A-5 1 90 . 23.868 32.445 -30.94 1 6.19 ? C PRO A-5 90 1 
ATOM 7838 O O . PRO A-5 1 90 . 22.857 31.816 -31.251 1 7.13 ? O PRO A-5 90 1 
ATOM 7839 C CB . PRO A-5 1 90 . 24.667 33.247 -33.208 1 6.57 ? CB PRO A-5 90 1 
ATOM 7840 C CG . PRO A-5 1 90 . 25.429 32.514 -34.287 1 7.36 ? CG PRO A-5 90 1 
ATOM 7841 C CD . PRO A-5 1 90 . 25.308 31.063 -33.862 1 7.96 ? CD PRO A-5 90 1 
ATOM 7842 N N . ILE A-5 1 91 . 24.019 33.164 -29.811 1 5.57 ? N ILE A-5 91 1 
ATOM 7843 C CA . ILE A-5 1 91 . 22.949 33.278 -28.824 1 6.35 ? CA ILE A-5 91 1 
ATOM 7844 C C . ILE A-5 1 91 . 22.564 34.704 -28.549 1 6.38 ? C ILE A-5 91 1 
ATOM 7845 O O . ILE A-5 1 91 . 21.573 34.927 -27.847 1 8.22 ? O ILE A-5 91 1 
ATOM 7846 C CB . ILE A-5 1 91 . 23.28 32.513 -27.515 1 6.85 ? CB ILE A-5 91 1 
ATOM 7847 C CG1 . ILE A-5 1 91 . 24.467 33.121 -26.774 1 7.48 ? CG1 ILE A-5 91 1 
ATOM 7848 C CG2 . ILE A-5 1 91 . 23.436 31.038 -27.83 1 7.64 ? CG2 ILE A-5 91 1 
ATOM 7849 C CD1 . ILE A-5 1 91 . 24.676 32.572 -25.4 1 8.92 ? CD1 ILE A-5 91 1 
ATOM 7850 N N . GLY A-5 1 92 . 23.292 35.708 -29.065 1 6.35 ? N GLY A-5 92 1 
ATOM 7851 C CA . GLY A-5 1 92 . 22.966 37.083 -28.788 1 6.45 ? CA GLY A-5 92 1 
ATOM 7852 C C . GLY A-5 1 92 . 24.024 37.957 -29.423 1 5.48 ? C GLY A-5 92 1 
ATOM 7853 O O . GLY A-5 1 92 . 24.923 37.472 -30.119 1 5.73 ? O GLY A-5 92 1 
ATOM 7854 N N . ILE A-5 1 93 . 23.917 39.257 -29.186 1 6.02 ? N ILE A-5 93 1 
ATOM 7855 C CA . ILE A-5 1 93 . 24.822 40.213 -29.831 1 5.79 ? CA ILE A-5 93 1 
ATOM 7856 C C . ILE A-5 1 93 . 25.001 41.423 -28.934 1 5.52 ? C ILE A-5 93 1 
ATOM 7857 O O . ILE A-5 1 93 . 24.03 41.997 -28.406 1 6.71 ? O ILE A-5 93 1 
ATOM 7858 C CB . ILE A-5 1 93 . 24.333 40.566 -31.265 1 6.21 ? CB ILE A-5 93 1 
ATOM 7859 C CG1 . ILE A-5 1 93 . 25.333 41.476 -31.987 1 6.27 ? CG1 ILE A-5 93 1 
ATOM 7860 C CG2 . ILE A-5 1 93 . 22.902 41.137 -31.295 1 7.06 ? CG2 ILE A-5 93 1 
ATOM 7861 C CD1 . ILE A-5 1 93 . 25.221 41.35 -33.488 1 7.5 ? CD1 ILE A-5 93 1 
ATOM 7862 N N . MET A-5 1 94 . 26.239 41.855 -28.744 1 5.89 ? N MET A-5 94 1 
ATOM 7863 C CA . MET A-5 1 94 . 26.566 43.05 -28.001 1 5.75 ? CA MET A-5 94 1 
ATOM 7864 C C . MET A-5 1 94 . 26.552 44.237 -28.97 1 5.75 ? C MET A-5 94 1 
ATOM 7865 O O . MET A-5 1 94 . 27.251 44.245 -29.976 1 6.5 ? O MET A-5 94 1 
ATOM 7866 C CB . MET A-5 1 94 . 27.96 42.924 -27.379 1 6.27 ? CB MET A-5 94 1 
ATOM 7867 C CG . MET A-5 1 94 . 28.317 44.077 -26.541 1 7.85 ? CG MET A-5 94 1 
ATOM 7868 S SD . MET A-5 1 94 . 29.974 43.978 -25.823 1 8.32 ? SD MET A-5 94 1 
ATOM 7869 C CE . MET A-5 1 94 . 30.937 44.047 -27.342 1 8.11 ? CE MET A-5 94 1 
ATOM 7870 N N . LYS A-5 1 95 . 25.766 45.247 -28.615 1 5.93 ? N LYS A-5 95 1 
ATOM 7871 C CA . LYS A-5 1 95 . 25.602 46.434 -29.484 1 6.61 ? CA LYS A-5 95 1 
ATOM 7872 C C . LYS A-5 1 95 . 26.601 47.463 -29.012 1 6.55 ? C LYS A-5 95 1 
ATOM 7873 O O . LYS A-5 1 95 . 26.439 48.113 -27.981 1 11.84 ? O LYS A-5 95 1 
ATOM 7874 C CB . LYS A-5 1 95 . 24.164 46.936 -29.349 1 7.48 ? CB LYS A-5 95 1 
ATOM 7875 C CG . LYS A-5 1 95 . 23.134 45.923 -29.785 1 8.92 ? CG LYS A-5 95 1 
ATOM 7876 C CD . LYS A-5 1 95 . 21.733 46.438 -29.662 1 10.99 ? CD LYS A-5 95 1 
ATOM 7877 C CE . LYS A-5 1 95 . 20.745 45.371 -30.219 1 13.89 ? CE LYS A-5 95 1 
ATOM 7878 N NZ . LYS A-5 1 95 . 19.357 45.782 -30.154 1 16.81 ? NZ LYS A-5 95 1 
ATOM 7879 N N . MET A-5 1 96 . 27.693 47.579 -29.747 1 7.44 ? N MET A-5 96 1 
ATOM 7880 C CA . MET A-5 1 96 . 28.839 48.451 -29.449 1 7.88 ? CA MET A-5 96 1 
ATOM 7881 C C . MET A-5 1 96 . 29.107 49.382 -30.63 1 6.52 ? C MET A-5 96 1 
ATOM 7882 O O . MET A-5 1 96 . 29.164 48.925 -31.759 1 7.33 ? O MET A-5 96 1 
ATOM 7883 C CB . MET A-5 1 96 . 30.134 47.563 -29.22 1 6.95 ? CB MET A-5 96 1 
ATOM 7884 C CG . MET A-5 1 96 . 31.36 48.442 -28.974 1 7.55 ? CG MET A-5 96 1 
ATOM 7885 S SD . MET A-5 1 96 . 32.764 47.386 -28.638 1 8.41 ? SD MET A-5 96 1 
ATOM 7886 C CE . MET A-5 1 96 . 33.959 48.588 -28.102 1 8.51 ? CE MET A-5 96 1 
ATOM 7887 N N A GLU A-5 1 97 . 29.356 50.623 -30.281 0.51 6.35 ? N GLU A-5 97 1 
ATOM 7888 N N B GLU A-5 1 97 . 29.437 50.651 -30.363 0.49 6.46 ? N GLU A-5 97 1 
ATOM 7889 C CA A GLU A-5 1 97 . 30.009 51.537 -31.155 0.51 6.89 ? CA GLU A-5 97 1 
ATOM 7890 C CA B GLU A-5 1 97 . 30.024 51.607 -31.296 0.49 6.58 ? CA GLU A-5 97 1 
ATOM 7891 C C A GLU A-5 1 97 . 31.456 51.717 -30.667 0.51 6.23 ? C GLU A-5 97 1 
ATOM 7892 C C B GLU A-5 1 97 . 31.415 51.89 -30.765 0.49 6.42 ? C GLU A-5 97 1 
ATOM 7893 O O A GLU A-5 1 97 . 31.698 51.834 -29.476 0.51 6.9 ? O GLU A-5 97 1 
ATOM 7894 O O B GLU A-5 1 97 . 31.595 52.3 -29.626 0.49 7.9 ? O GLU A-5 97 1 
ATOM 7895 C CB A GLU A-5 1 97 . 29.24 52.854 -31.169 0.51 10.65 ? CB GLU A-5 97 1 
ATOM 7896 C CB B GLU A-5 1 97 . 29.227 52.928 -31.278 0.49 7.89 ? CB GLU A-5 97 1 
ATOM 7897 C CG A GLU A-5 1 97 . 29.585 53.761 -32.401 0.51 10.77 ? CG GLU A-5 97 1 
ATOM 7898 C CG B GLU A-5 1 97 . 27.925 52.849 -31.767 0.49 12.45 ? CG GLU A-5 97 1 
ATOM 7899 C CD A GLU A-5 1 97 . 28.848 55.004 -32.53 0.51 15.18 ? CD GLU A-5 97 1 
ATOM 7900 C CD B GLU A-5 1 97 . 27.832 53.031 -33.197 0.49 14.09 ? CD GLU A-5 97 1 
ATOM 7901 O OE1 A GLU A-5 1 97 . 27.745 54.957 -33.144 0.51 18.96 ? OE1 GLU A-5 97 1 
ATOM 7902 O OE1 B GLU A-5 1 97 . 28.539 53.9 -33.752 0.49 17.04 ? OE1 GLU A-5 97 1 
ATOM 7903 O OE2 A GLU A-5 1 97 . 29.421 56.088 -32.211 0.51 18.85 ? OE2 GLU A-5 97 1 
ATOM 7904 O OE2 B GLU A-5 1 97 . 27 52.313 -33.907 0.49 12.3 ? OE2 GLU A-5 97 1 
ATOM 7905 N N . ASP A-5 1 98 . 32.394 51.685 -31.613 1 5.71 ? N ASP A-5 98 1 
ATOM 7906 C CA . ASP A-5 1 98 . 33.812 51.73 -31.26 1 5.81 ? CA ASP A-5 98 1 
ATOM 7907 C C . ASP A-5 1 98 . 34.468 52.836 -32.073 1 5.82 ? C ASP A-5 98 1 
ATOM 7908 O O . ASP A-5 1 98 . 34.547 52.713 -33.294 1 6.32 ? O ASP A-5 98 1 
ATOM 7909 C CB . ASP A-5 1 98 . 34.461 50.381 -31.552 1 6.38 ? CB ASP A-5 98 1 
ATOM 7910 C CG . ASP A-5 1 98 . 35.887 50.264 -31.12 1 6.82 ? CG ASP A-5 98 1 
ATOM 7911 O OD1 . ASP A-5 1 98 . 36.403 51.253 -30.533 1 12.86 ? OD1 ASP A-5 98 1 
ATOM 7912 O OD2 . ASP A-5 1 98 . 36.547 49.247 -31.339 1 6.32 ? OD2 ASP A-5 98 1 
ATOM 7913 N N . SER A-5 1 99 . 34.865 53.913 -31.438 1 6.27 ? N SER A-5 99 1 
ATOM 7914 C CA . SER A-5 1 99 . 35.529 55.024 -32.139 1 7.62 ? CA SER A-5 99 1 
ATOM 7915 C C . SER A-5 1 99 . 34.659 55.549 -33.273 1 6.9 ? C SER A-5 99 1 
ATOM 7916 O O . SER A-5 1 99 . 35.164 56.015 -34.297 1 8.04 ? O SER A-5 99 1 
ATOM 7917 C CB . SER A-5 1 99 . 36.928 54.563 -32.618 1 10.18 ? CB SER A-5 99 1 
ATOM 7918 O OG . SER A-5 1 99 . 37.724 54.123 -31.543 1 12.09 ? OG SER A-5 99 1 
ATOM 7919 N N . GLY A-5 1 100 . 33.342 55.531 -33.082 1 6.27 ? N GLY A-5 100 1 
ATOM 7920 C CA . GLY A-5 1 100 . 32.424 56.031 -34.083 1 7.13 ? CA GLY A-5 100 1 
ATOM 7921 C C . GLY A-5 1 100 . 31.915 55.02 -35.09 1 6.42 ? C GLY A-5 100 1 
ATOM 7922 O O . GLY A-5 1 100 . 31.018 55.368 -35.863 1 8.24 ? O GLY A-5 100 1 
ATOM 7923 N N . ASP A-5 1 101 . 32.443 53.812 -35.114 1 6.03 ? N ASP A-5 101 1 
ATOM 7924 C CA . ASP A-5 1 101 . 32.003 52.781 -36.034 1 6.22 ? CA ASP A-5 101 1 
ATOM 7925 C C . ASP A-5 1 101 . 31.07 51.808 -35.336 1 6.02 ? C ASP A-5 101 1 
ATOM 7926 O O . ASP A-5 1 101 . 31.345 51.321 -34.231 1 6.38 ? O ASP A-5 101 1 
ATOM 7927 C CB . ASP A-5 1 101 . 33.181 51.964 -36.555 1 7.2 ? CB ASP A-5 101 1 
ATOM 7928 C CG . ASP A-5 1 101 . 34.201 52.736 -37.297 1 8.76 ? CG ASP A-5 101 1 
ATOM 7929 O OD1 . ASP A-5 1 101 . 33.819 53.671 -38.031 1 9.13 ? OD1 ASP A-5 101 1 
ATOM 7930 O OD2 . ASP A-5 1 101 . 35.403 52.315 -37.17 1 10.67 ? OD2 ASP A-5 101 1 
ATOM 7931 N N . LYS A-5 1 102 . 30.023 51.392 -36.04 1 6.36 ? N LYS A-5 102 1 
ATOM 7932 C CA . LYS A-5 1 102 . 29.272 50.225 -35.586 1 6.02 ? CA LYS A-5 102 1 
ATOM 7933 C C . LYS A-5 1 102 . 30.281 49.068 -35.492 1 5.48 ? C LYS A-5 102 1 
ATOM 7934 O O . LYS A-5 1 102 . 31.084 48.84 -36.394 1 6.08 ? O LYS A-5 102 1 
ATOM 7935 C CB . LYS A-5 1 102 . 28.162 49.887 -36.575 1 6.86 ? CB LYS A-5 102 1 
ATOM 7936 C CG . LYS A-5 1 102 . 27.081 49.021 -36.002 1 6.63 ? CG LYS A-5 102 1 
ATOM 7937 C CD . LYS A-5 1 102 . 26.032 48.6 -37.031 1 7.89 ? CD LYS A-5 102 1 
ATOM 7938 C CE . LYS A-5 1 102 . 24.858 47.912 -36.378 1 8.66 ? CE LYS A-5 102 1 
ATOM 7939 N NZ . LYS A-5 1 102 . 23.902 47.377 -37.392 1 9.62 ? NZ LYS A-5 102 1 
ATOM 7940 N N . ASP A-5 1 103 . 30.189 48.31 -34.388 1 5.38 ? N ASP A-5 103 1 
ATOM 7941 C CA . ASP A-5 1 103 . 31.193 47.314 -34.077 1 4.93 ? CA ASP A-5 103 1 
ATOM 7942 C C . ASP A-5 1 103 . 30.585 46.268 -33.172 1 5.1 ? C ASP A-5 103 1 
ATOM 7943 O O . ASP A-5 1 103 . 31.193 45.79 -32.194 1 5.63 ? O ASP A-5 103 1 
ATOM 7944 C CB . ASP A-5 1 103 . 32.432 47.941 -33.473 1 5.2 ? CB ASP A-5 103 1 
ATOM 7945 C CG . ASP A-5 1 103 . 33.699 47.114 -33.472 1 4.98 ? CG ASP A-5 103 1 
ATOM 7946 O OD1 . ASP A-5 1 103 . 33.791 46.138 -34.258 1 5.3 ? OD1 ASP A-5 103 1 
ATOM 7947 O OD2 . ASP A-5 1 103 . 34.586 47.473 -32.702 1 5.65 ? OD2 ASP A-5 103 1 
ATOM 7948 N N . TRP A-5 1 104 . 29.356 45.89 -33.473 1 5.28 ? N TRP A-5 104 1 
ATOM 7949 C CA . TRP A-5 1 104 . 28.618 44.877 -32.739 1 5.36 ? CA TRP A-5 104 1 
ATOM 7950 C C . TRP A-5 1 104 . 29.355 43.549 -32.8 1 5.4 ? C TRP A-5 104 1 
ATOM 7951 O O . TRP A-5 1 104 . 30.077 43.278 -33.727 1 5.88 ? O TRP A-5 104 1 
ATOM 7952 C CB . TRP A-5 1 104 . 27.186 44.717 -33.323 1 5.75 ? CB TRP A-5 104 1 
ATOM 7953 C CG . TRP A-5 1 104 . 26.297 45.906 -33.175 1 6.12 ? CG TRP A-5 104 1 
ATOM 7954 C CD1 . TRP A-5 1 104 . 26.62 47.208 -32.854 1 6.05 ? CD1 TRP A-5 104 1 
ATOM 7955 C CD2 . TRP A-5 1 104 . 24.875 45.879 -33.31 1 7.21 ? CD2 TRP A-5 104 1 
ATOM 7956 N NE1 . TRP A-5 1 104 . 25.481 47.96 -32.781 1 7.24 ? NE1 TRP A-5 104 1 
ATOM 7957 C CE2 . TRP A-5 1 104 . 24.397 47.179 -33.06 1 7.44 ? CE2 TRP A-5 104 1 
ATOM 7958 C CE3 . TRP A-5 1 104 . 23.973 44.876 -33.652 1 8.46 ? CE3 TRP A-5 104 1 
ATOM 7959 C CZ2 . TRP A-5 1 104 . 23.052 47.489 -33.115 1 9.54 ? CZ2 TRP A-5 104 1 
ATOM 7960 C CZ3 . TRP A-5 1 104 . 22.615 45.2 -33.716 1 10.02 ? CZ3 TRP A-5 104 1 
ATOM 7961 C CH2 . TRP A-5 1 104 . 22.184 46.48 -33.439 1 10.56 ? CH2 TRP A-5 104 1 
ATOM 7962 N N . LYS A-5 1 105 . 29.084 42.711 -31.8 1 5.4 ? N LYS A-5 105 1 
ATOM 7963 C CA . LYS A-5 1 105 . 29.835 41.452 -31.669 1 5.79 ? CA LYS A-5 105 1 
ATOM 7964 C C . LYS A-5 1 105 . 28.917 40.338 -31.315 1 5.05 ? C LYS A-5 105 1 
ATOM 7965 O O . LYS A-5 1 105 . 28.162 40.398 -30.337 1 5.76 ? O LYS A-5 105 1 
ATOM 7966 C CB . LYS A-5 1 105 . 30.949 41.559 -30.653 1 5.85 ? CB LYS A-5 105 1 
ATOM 7967 C CG . LYS A-5 1 105 . 31.733 42.888 -30.793 1 6.04 ? CG LYS A-5 105 1 
ATOM 7968 C CD . LYS A-5 1 105 . 33.074 42.813 -30.103 1 5.87 ? CD LYS A-5 105 1 
ATOM 7969 C CE . LYS A-5 1 105 . 33.78 44.153 -30.027 1 5.53 ? CE LYS A-5 105 1 
ATOM 7970 N NZ . LYS A-5 1 105 . 33.863 44.808 -31.358 1 5.28 ? NZ LYS A-5 105 1 
ATOM 7971 N N . VAL A-5 1 106 . 28.909 39.259 -32.105 1 5.18 ? N VAL A-5 106 1 
ATOM 7972 C CA . VAL A-5 1 106 . 28.13 38.092 -31.785 1 5.46 ? CA VAL A-5 106 1 
ATOM 7973 C C . VAL A-5 1 106 . 28.621 37.474 -30.504 1 5.29 ? C VAL A-5 106 1 
ATOM 7974 O O . VAL A-5 1 106 . 29.836 37.361 -30.292 1 5.45 ? O VAL A-5 106 1 
ATOM 7975 C CB . VAL A-5 1 106 . 28.192 37.101 -32.93 1 6 ? CB VAL A-5 106 1 
ATOM 7976 C CG1 . VAL A-5 1 106 . 27.541 35.753 -32.581 1 6.49 ? CG1 VAL A-5 106 1 
ATOM 7977 C CG2 . VAL A-5 1 106 . 27.625 37.66 -34.229 1 7.83 ? CG2 VAL A-5 106 1 
ATOM 7978 N N . LEU A-5 1 107 . 27.696 37.024 -29.648 1 5.45 ? N LEU A-5 107 1 
ATOM 7979 C CA . LEU A-5 1 107 . 27.999 36.15 -28.507 1 5.03 ? CA LEU A-5 107 1 
ATOM 7980 C C . LEU A-5 1 107 . 27.539 34.757 -28.874 1 5.1 ? C LEU A-5 107 1 
ATOM 7981 O O . LEU A-5 1 107 . 26.384 34.583 -29.292 1 5.76 ? O LEU A-5 107 1 
ATOM 7982 C CB . LEU A-5 1 107 . 27.274 36.64 -27.247 1 6.15 ? CB LEU A-5 107 1 
ATOM 7983 C CG . LEU A-5 1 107 . 27.599 35.856 -25.986 1 6.87 ? CG LEU A-5 107 1 
ATOM 7984 C CD1 . LEU A-5 1 107 . 29.082 35.97 -25.573 1 9.06 ? CD1 LEU A-5 107 1 
ATOM 7985 C CD2 . LEU A-5 1 107 . 26.682 36.285 -24.863 1 9.34 ? CD2 LEU A-5 107 1 
ATOM 7986 N N . ALA A-5 1 108 . 28.421 33.773 -28.733 1 4.93 ? N ALA A-5 108 1 
ATOM 7987 C CA . ALA A-5 1 108 . 28.154 32.427 -29.162 1 5.09 ? CA ALA A-5 108 1 
ATOM 7988 C C . ALA A-5 1 108 . 28.705 31.429 -28.177 1 4.9 ? C ALA A-5 108 1 
ATOM 7989 O O . ALA A-5 1 108 . 29.6 31.74 -27.391 1 5.71 ? O ALA A-5 108 1 
ATOM 7990 C CB . ALA A-5 1 108 . 28.747 32.199 -30.535 1 6.16 ? CB ALA A-5 108 1 
ATOM 7991 N N . VAL A-5 1 109 . 28.205 30.196 -28.287 1 5.35 ? N VAL A-5 109 1 
ATOM 7992 C CA . VAL A-5 1 109 . 28.721 29.069 -27.517 1 5.67 ? CA VAL A-5 109 1 
ATOM 7993 C C . VAL A-5 1 109 . 29.197 27.997 -28.44 1 5.38 ? C VAL A-5 109 1 
ATOM 7994 O O . VAL A-5 1 109 . 28.689 27.841 -29.57 1 6.24 ? O VAL A-5 109 1 
ATOM 7995 C CB . VAL A-5 1 109 . 27.667 28.514 -26.519 1 6.31 ? CB VAL A-5 109 1 
ATOM 7996 C CG1 . VAL A-5 1 109 . 27.348 29.544 -25.42 1 7.55 ? CG1 VAL A-5 109 1 
ATOM 7997 C CG2 . VAL A-5 1 109 . 26.387 28.057 -27.224 1 6.79 ? CG2 VAL A-5 109 1 
ATOM 7998 N N . PRO A-5 1 110 . 30.157 27.178 -28.023 1 5.76 ? N PRO A-5 110 1 
ATOM 7999 C CA . PRO A-5 1 110 . 30.631 26.076 -28.871 1 5.83 ? CA PRO A-5 110 1 
ATOM 8000 C C . PRO A-5 1 110 . 29.56 25.021 -29.003 1 6.46 ? C PRO A-5 110 1 
ATOM 8001 O O . PRO A-5 1 110 . 29.03 24.534 -27.989 1 7.27 ? O PRO A-5 110 1 
ATOM 8002 C CB . PRO A-5 1 110 . 31.867 25.532 -28.11 1 6.89 ? CB PRO A-5 110 1 
ATOM 8003 C CG . PRO A-5 1 110 . 31.592 25.935 -26.666 1 7.94 ? CG PRO A-5 110 1 
ATOM 8004 C CD . PRO A-5 1 110 . 30.896 27.265 -26.746 1 6.7 ? CD PRO A-5 110 1 
ATOM 8005 N N . VAL A-5 1 111 . 29.302 24.576 -30.219 1 6.11 ? N VAL A-5 111 1 
ATOM 8006 C CA . VAL A-5 1 111 . 28.364 23.493 -30.458 1 7.1 ? CA VAL A-5 111 1 
ATOM 8007 C C . VAL A-5 1 111 . 28.845 22.216 -29.771 1 6.97 ? C VAL A-5 111 1 
ATOM 8008 O O . VAL A-5 1 111 . 27.986 21.418 -29.329 1 8.75 ? O VAL A-5 111 1 
ATOM 8009 C CB . VAL A-5 1 111 . 28.143 23.261 -31.966 1 10.46 ? CB VAL A-5 111 1 
ATOM 8010 C CG1 . VAL A-5 1 111 . 27.4 22.01 -32.303 1 14.55 ? CG1 VAL A-5 111 1 
ATOM 8011 C CG2 . VAL A-5 1 111 . 27.512 24.505 -32.586 1 11.66 ? CG2 VAL A-5 111 1 
ATOM 8012 N N A GLU A-5 1 112 . 30.122 21.989 -29.706 0.68 6.21 ? N GLU A-5 112 1 
ATOM 8013 N N B GLU A-5 1 112 . 30.199 22.001 -29.73 0.32 7.43 ? N GLU A-5 112 1 
ATOM 8014 C CA A GLU A-5 1 112 . 30.633 20.704 -29.278 0.68 6.76 ? CA GLU A-5 112 1 
ATOM 8015 C CA B GLU A-5 1 112 . 30.866 20.738 -29.222 0.32 7.98 ? CA GLU A-5 112 1 
ATOM 8016 C C A GLU A-5 1 112 . 31.222 20.76 -27.863 0.68 6.52 ? C GLU A-5 112 1 
ATOM 8017 C C B GLU A-5 1 112 . 31.012 20.613 -27.719 0.32 8.38 ? C GLU A-5 112 1 
ATOM 8018 O O A GLU A-5 1 112 . 32.084 19.968 -27.54 0.68 7.85 ? O GLU A-5 112 1 
ATOM 8019 O O B GLU A-5 1 112 . 31.455 19.584 -27.216 0.32 10.31 ? O GLU A-5 112 1 
ATOM 8020 C CB A GLU A-5 1 112 . 31.665 20.214 -30.285 0.68 7.42 ? CB GLU A-5 112 1 
ATOM 8021 C CB B GLU A-5 1 112 . 32.3 20.542 -29.761 0.32 9.3 ? CB GLU A-5 112 1 
ATOM 8022 C CG A GLU A-5 1 112 . 31.064 19.991 -31.656 0.68 9.27 ? CG GLU A-5 112 1 
ATOM 8023 C CG B GLU A-5 1 112 . 32.378 20.385 -31.254 0.32 10.72 ? CG GLU A-5 112 1 
ATOM 8024 C CD A GLU A-5 1 112 . 30.01 18.954 -31.765 0.68 12.08 ? CD GLU A-5 112 1 
ATOM 8025 C CD B GLU A-5 1 112 . 31.639 19.186 -31.814 0.32 11.17 ? CD GLU A-5 112 1 
ATOM 8026 O OE1 A GLU A-5 1 112 . 29.835 18.149 -30.846 0.68 14.63 ? OE1 GLU A-5 112 1 
ATOM 8027 O OE1 B GLU A-5 1 112 . 31.329 18.205 -31.049 0.32 13.11 ? OE1 GLU A-5 112 1 
ATOM 8028 O OE2 A GLU A-5 1 112 . 29.301 18.877 -32.802 0.68 17.51 ? OE2 GLU A-5 112 1 
ATOM 8029 O OE2 B GLU A-5 1 112 . 31.404 19.098 -33.017 0.32 12.44 ? OE2 GLU A-5 112 1 
ATOM 8030 N N . ASP A-5 1 113 . 30.68 21.624 -26.975 1 6.66 ? N ASP A-5 113 1 
ATOM 8031 C CA . ASP A-5 1 113 . 30.823 21.51 -25.529 1 6.75 ? CA ASP A-5 113 1 
ATOM 8032 C C . ASP A-5 1 113 . 29.441 21.289 -24.937 1 6.26 ? C ASP A-5 113 1 
ATOM 8033 O O . ASP A-5 1 113 . 28.629 22.22 -24.951 1 6.64 ? O ASP A-5 113 1 
ATOM 8034 C CB . ASP A-5 1 113 . 31.478 22.722 -24.92 1 6.88 ? CB ASP A-5 113 1 
ATOM 8035 C CG . ASP A-5 1 113 . 31.736 22.576 -23.439 1 6.94 ? CG ASP A-5 113 1 
ATOM 8036 O OD1 . ASP A-5 1 113 . 31.272 21.58 -22.846 1 7.21 ? OD1 ASP A-5 113 1 
ATOM 8037 O OD2 . ASP A-5 1 113 . 32.441 23.475 -22.865 1 7.37 ? OD2 ASP A-5 113 1 
ATOM 8038 N N . PRO A-5 1 114 . 29.159 20.106 -24.4 1 6.94 ? N PRO A-5 114 1 
ATOM 8039 C CA . PRO A-5 1 114 . 27.832 19.829 -23.898 1 7.18 ? CA PRO A-5 114 1 
ATOM 8040 C C . PRO A-5 1 114 . 27.452 20.671 -22.708 1 6.53 ? C PRO A-5 114 1 
ATOM 8041 O O . PRO A-5 1 114 . 26.245 20.817 -22.414 1 7.21 ? O PRO A-5 114 1 
ATOM 8042 C CB . PRO A-5 1 114 . 27.88 18.313 -23.572 1 8.19 ? CB PRO A-5 114 1 
ATOM 8043 C CG . PRO A-5 1 114 . 29.325 18.077 -23.191 1 9.14 ? CG PRO A-5 114 1 
ATOM 8044 C CD . PRO A-5 1 114 . 30.108 18.935 -24.196 1 8.43 ? CD PRO A-5 114 1 
ATOM 8045 N N . TYR A-5 1 115 . 28.402 21.294 -22.033 1 6.45 ? N TYR A-5 115 1 
ATOM 8046 C CA . TYR A-5 1 115 . 28.091 22.249 -20.946 1 6.22 ? CA TYR A-5 115 1 
ATOM 8047 C C . TYR A-5 1 115 . 27.079 23.271 -21.415 1 6.34 ? C TYR A-5 115 1 
ATOM 8048 O O . TYR A-5 1 115 . 26.251 23.722 -20.63 1 7.45 ? O TYR A-5 115 1 
ATOM 8049 C CB . TYR A-5 1 115 . 29.39 22.914 -20.507 1 6.58 ? CB TYR A-5 115 1 
ATOM 8050 C CG . TYR A-5 1 115 . 29.232 23.811 -19.307 1 6.3 ? CG TYR A-5 115 1 
ATOM 8051 C CD1 . TYR A-5 1 115 . 28.886 25.141 -19.468 1 7.18 ? CD1 TYR A-5 115 1 
ATOM 8052 C CD2 . TYR A-5 1 115 . 29.492 23.341 -18.031 1 6.78 ? CD2 TYR A-5 115 1 
ATOM 8053 C CE1 . TYR A-5 1 115 . 28.757 25.967 -18.353 1 8.14 ? CE1 TYR A-5 115 1 
ATOM 8054 C CE2 . TYR A-5 1 115 . 29.406 24.174 -16.942 1 8.1 ? CE2 TYR A-5 115 1 
ATOM 8055 C CZ . TYR A-5 1 115 . 28.988 25.481 -17.108 1 8.5 ? CZ TYR A-5 115 1 
ATOM 8056 O OH . TYR A-5 1 115 . 28.843 26.281 -15.988 1 11.03 ? OH TYR A-5 115 1 
ATOM 8057 N N . PHE A-5 1 116 . 27.193 23.705 -22.683 1 6.4 ? N PHE A-5 116 1 
ATOM 8058 C CA . PHE A-5 1 116 . 26.391 24.803 -23.221 1 6.99 ? CA PHE A-5 116 1 
ATOM 8059 C C . PHE A-5 1 116 . 25.161 24.33 -24 1 7.8 ? C PHE A-5 116 1 
ATOM 8060 O O . PHE A-5 1 116 . 24.518 25.151 -24.65 1 8.48 ? O PHE A-5 116 1 
ATOM 8061 C CB . PHE A-5 1 116 . 27.259 25.746 -24.07 1 7.8 ? CB PHE A-5 116 1 
ATOM 8062 C CG . PHE A-5 1 116 . 28.344 26.392 -23.287 1 6.87 ? CG PHE A-5 116 1 
ATOM 8063 C CD1 . PHE A-5 1 116 . 29.643 25.946 -23.376 1 7.33 ? CD1 PHE A-5 116 1 
ATOM 8064 C CD2 . PHE A-5 1 116 . 28.066 27.454 -22.436 1 7.83 ? CD2 PHE A-5 116 1 
ATOM 8065 C CE1 . PHE A-5 1 116 . 30.659 26.539 -22.629 1 8.12 ? CE1 PHE A-5 116 1 
ATOM 8066 C CE2 . PHE A-5 1 116 . 29.1 28.068 -21.671 1 7.83 ? CE2 PHE A-5 116 1 
ATOM 8067 C CZ . PHE A-5 1 116 . 30.369 27.584 -21.794 1 8.23 ? CZ PHE A-5 116 1 
ATOM 8068 N N . ASN A-5 1 117 . 24.803 23.051 -23.912 1 8.52 ? N ASN A-5 117 1 
ATOM 8069 C CA . ASN A-5 1 117 . 23.744 22.511 -24.763 1 9.83 ? CA ASN A-5 117 1 
ATOM 8070 C C . ASN A-5 1 117 . 22.448 23.293 -24.614 1 11.44 ? C ASN A-5 117 1 
ATOM 8071 O O . ASN A-5 1 117 . 21.713 23.406 -25.61 1 13.82 ? O ASN A-5 117 1 
ATOM 8072 C CB . ASN A-5 1 117 . 23.48 21.035 -24.467 1 11.42 ? CB ASN A-5 117 1 
ATOM 8073 C CG . ASN A-5 1 117 . 24.486 20.114 -25.116 1 12.81 ? CG ASN A-5 117 1 
ATOM 8074 O OD1 . ASN A-5 1 117 . 25.24 20.485 -26.02 1 14.65 ? OD1 ASN A-5 117 1 
ATOM 8075 N ND2 . ASN A-5 1 117 . 24.489 18.86 -24.625 1 16.66 ? ND2 ASN A-5 117 1 
ATOM 8076 N N . ASP A-5 1 118 . 22.127 23.756 -23.424 0.85 9.6 ? N ASP A-5 118 1 
ATOM 8077 C CA . ASP A-5 1 118 . 20.89 24.446 -23.168 0.85 11.44 ? CA ASP A-5 118 1 
ATOM 8078 C C . ASP A-5 1 118 . 21.01 25.987 -23.288 0.85 12.72 ? C ASP A-5 118 1 
ATOM 8079 O O . ASP A-5 1 118 . 20.068 26.688 -23.019 0.85 15.86 ? O ASP A-5 118 1 
ATOM 8080 C CB . ASP A-5 1 118 . 20.278 23.998 -21.86 0.85 13.44 ? CB ASP A-5 118 1 
ATOM 8081 C CG . ASP A-5 1 118 . 20.001 22.469 -21.851 0.85 18.97 ? CG ASP A-5 118 1 
ATOM 8082 O OD1 . ASP A-5 1 118 . 19.515 21.884 -22.845 0.85 24.02 ? OD1 ASP A-5 118 1 
ATOM 8083 O OD2 . ASP A-5 1 118 . 20.366 21.757 -20.926 0.85 23.93 ? OD2 ASP A-5 118 1 
ATOM 8084 N N . TRP A-5 1 119 . 22.144 26.498 -23.722 1 11.67 ? N TRP A-5 119 1 
ATOM 8085 C CA . TRP A-5 1 119 . 22.352 27.931 -23.985 1 11.02 ? CA TRP A-5 119 1 
ATOM 8086 C C . TRP A-5 1 119 . 21.987 28.195 -25.406 1 9.51 ? C TRP A-5 119 1 
ATOM 8087 O O . TRP A-5 1 119 . 22.738 27.821 -26.297 1 9.97 ? O TRP A-5 119 1 
ATOM 8088 C CB . TRP A-5 1 119 . 23.767 28.394 -23.696 1 10.49 ? CB TRP A-5 119 1 
ATOM 8089 C CG . TRP A-5 1 119 . 24.223 28.354 -22.273 1 13.41 ? CG TRP A-5 119 1 
ATOM 8090 C CD1 . TRP A-5 1 119 . 23.945 27.372 -21.378 1 18.44 ? CD1 TRP A-5 119 1 
ATOM 8091 C CD2 . TRP A-5 1 119 . 25.033 29.303 -21.615 1 13.33 ? CD2 TRP A-5 119 1 
ATOM 8092 N NE1 . TRP A-5 1 119 . 24.63 27.663 -20.181 1 20.76 ? NE1 TRP A-5 119 1 
ATOM 8093 C CE2 . TRP A-5 1 119 . 25.231 28.886 -20.266 1 17.13 ? CE2 TRP A-5 119 1 
ATOM 8094 C CE3 . TRP A-5 1 119 . 25.612 30.441 -22.019 1 12.72 ? CE3 TRP A-5 119 1 
ATOM 8095 C CZ2 . TRP A-5 1 119 . 26.119 29.531 -19.425 1 18.76 ? CZ2 TRP A-5 119 1 
ATOM 8096 C CZ3 . TRP A-5 1 119 . 26.411 31.122 -21.161 1 13.99 ? CZ3 TRP A-5 119 1 
ATOM 8097 C CH2 . TRP A-5 1 119 . 26.644 30.694 -19.873 1 15.54 ? CH2 TRP A-5 119 1 
ATOM 8098 N N . LYS A-5 1 120 . 20.838 28.857 -25.605 0.85 8.86 ? N LYS A-5 120 1 
ATOM 8099 C CA . LYS A-5 1 120 . 20.282 29.094 -26.938 1 9.93 ? CA LYS A-5 120 1 
ATOM 8100 C C . LYS A-5 1 120 . 19.909 30.547 -27.185 1 8.83 ? C LYS A-5 120 1 
ATOM 8101 O O . LYS A-5 1 120 . 19.697 30.933 -28.35 0.87 8.69 ? O LYS A-5 120 1 
ATOM 8102 C CB . LYS A-5 1 120 . 19.062 28.214 -27.129 1 12.63 ? CB LYS A-5 120 1 
ATOM 8103 C CG . LYS A-5 1 120 . 19.476 26.716 -27.092 1 15.58 ? CG LYS A-5 120 1 
ATOM 8104 C CD . LYS A-5 1 120 . 18.355 25.868 -27.184 1 21.8 ? CD LYS A-5 120 1 
ATOM 8105 C CE . LYS A-5 1 120 . 18.764 24.362 -27.052 0.8 37.82 ? CE LYS A-5 120 1 
ATOM 8106 N NZ . LYS A-5 1 120 . 17.591 23.433 -26.883 1 50.17 ? NZ LYS A-5 120 1 
ATOM 8107 N N . ASP A-5 1 121 . 19.841 31.361 -26.183 1 8.97 ? N ASP A-5 121 1 
ATOM 8108 C CA . ASP A-5 1 121 . 19.467 32.767 -26.357 1 8.83 ? CA ASP A-5 121 1 
ATOM 8109 C C . ASP A-5 1 121 . 20.058 33.579 -25.234 1 8.95 ? C ASP A-5 121 1 
ATOM 8110 O O . ASP A-5 1 121 . 20.618 33.021 -24.246 1 8.9 ? O ASP A-5 121 1 
ATOM 8111 C CB . ASP A-5 1 121 . 17.939 32.937 -26.498 0.84 8.97 ? CB ASP A-5 121 1 
ATOM 8112 C CG . ASP A-5 1 121 . 17.495 34.125 -27.375 0.89 10.23 ? CG ASP A-5 121 1 
ATOM 8113 O OD1 . ASP A-5 1 121 . 18.257 35.007 -27.656 0.96 9.73 ? OD1 ASP A-5 121 1 
ATOM 8114 O OD2 . ASP A-5 1 121 . 16.349 34.085 -27.842 0.74 12.37 ? OD2 ASP A-5 121 1 
ATOM 8115 N N . ILE A-5 1 122 . 19.934 34.885 -25.359 1 8.9 ? N ILE A-5 122 1 
ATOM 8116 C CA . ILE A-5 1 122 . 20.637 35.792 -24.496 1 9.96 ? CA ILE A-5 122 1 
ATOM 8117 C C . ILE A-5 1 122 . 20.186 35.671 -23.045 1 9.77 ? C ILE A-5 122 1 
ATOM 8118 O O . ILE A-5 1 122 . 20.96 35.879 -22.135 1 11.34 ? O ILE A-5 122 1 
ATOM 8119 C CB . ILE A-5 1 122 . 20.499 37.23 -25.093 1 11.1 ? CB ILE A-5 122 1 
ATOM 8120 C CG1 . ILE A-5 1 122 . 21.461 38.22 -24.462 1 14.03 ? CG1 ILE A-5 122 1 
ATOM 8121 C CG2 . ILE A-5 1 122 . 19.123 37.779 -25.068 1 12.56 ? CG2 ILE A-5 122 1 
ATOM 8122 C CD1 . ILE A-5 1 122 . 22.873 37.911 -24.687 1 15.59 ? CD1 ILE A-5 122 1 
ATOM 8123 N N . SER A-5 1 123 . 18.931 35.241 -22.822 1 10.45 ? N SER A-5 123 1 
ATOM 8124 C CA . SER A-5 1 123 . 18.386 34.978 -21.484 1 11.92 ? CA SER A-5 123 1 
ATOM 8125 C C . SER A-5 1 123 . 18.994 33.785 -20.806 1 11.31 ? C SER A-5 123 1 
ATOM 8126 O O . SER A-5 1 123 . 18.776 33.662 -19.572 1 13.56 ? O SER A-5 123 1 
ATOM 8127 C CB . SER A-5 1 123 . 16.852 34.804 -21.566 1 15.55 ? CB SER A-5 123 1 
ATOM 8128 O OG . SER A-5 1 123 . 16.54 33.81 -22.511 1 21.22 ? OG SER A-5 123 1 
ATOM 8129 N N . ASP A-5 1 124 . 19.73 32.943 -21.454 1 8.95 ? N ASP A-5 124 1 
ATOM 8130 C CA . ASP A-5 1 124 . 20.355 31.811 -20.843 1 9.27 ? CA ASP A-5 124 1 
ATOM 8131 C C . ASP A-5 1 124 . 21.702 32.154 -20.174 1 9.42 ? C ASP A-5 124 1 
ATOM 8132 O O . ASP A-5 1 124 . 22.274 31.31 -19.486 1 11.43 ? O ASP A-5 124 1 
ATOM 8133 C CB . ASP A-5 1 124 . 20.552 30.734 -21.884 1 9.94 ? CB ASP A-5 124 1 
ATOM 8134 C CG . ASP A-5 1 124 . 19.258 30.173 -22.418 1 10.3 ? CG ASP A-5 124 1 
ATOM 8135 O OD1 . ASP A-5 1 124 . 18.336 29.958 -21.58 1 12.9 ? OD1 ASP A-5 124 1 
ATOM 8136 O OD2 . ASP A-5 1 124 . 19.135 29.99 -23.621 1 9.65 ? OD2 ASP A-5 124 1 
ATOM 8137 N N . VAL A-5 1 125 . 22.208 33.341 -20.437 1 8.97 ? N VAL A-5 125 1 
ATOM 8138 C CA . VAL A-5 1 125 . 23.512 33.724 -19.918 1 8.19 ? CA VAL A-5 125 1 
ATOM 8139 C C . VAL A-5 1 125 . 23.349 34.402 -18.547 1 8.89 ? C VAL A-5 125 1 
ATOM 8140 O O . VAL A-5 1 125 . 22.463 35.242 -18.361 1 9.9 ? O VAL A-5 125 1 
ATOM 8141 C CB . VAL A-5 1 125 . 24.158 34.76 -20.879 1 8.33 ? CB VAL A-5 125 1 
ATOM 8142 C CG1 . VAL A-5 1 125 . 25.571 35.079 -20.371 1 8.14 ? CG1 VAL A-5 125 1 
ATOM 8143 C CG2 . VAL A-5 1 125 . 24.18 34.204 -22.307 1 9.03 ? CG2 VAL A-5 125 1 
ATOM 8144 N N . PRO A-5 1 126 . 24.212 34.089 -17.571 1 9.05 ? N PRO A-5 126 1 
ATOM 8145 C CA . PRO A-5 1 126 . 24.142 34.833 -16.296 1 9.13 ? CA PRO A-5 126 1 
ATOM 8146 C C . PRO A-5 1 126 . 24.222 36.335 -16.524 1 8.47 ? C PRO A-5 126 1 
ATOM 8147 O O . PRO A-5 1 126 . 25.075 36.828 -17.242 1 8.06 ? O PRO A-5 126 1 
ATOM 8148 C CB . PRO A-5 1 126 . 25.307 34.323 -15.52 1 10.28 ? CB PRO A-5 126 1 
ATOM 8149 C CG . PRO A-5 1 126 . 25.471 32.933 -16.014 1 12.04 ? CG PRO A-5 126 1 
ATOM 8150 C CD . PRO A-5 1 126 . 25.247 33.036 -17.527 1 10.15 ? CD PRO A-5 126 1 
ATOM 8151 N N . LYS A-5 1 127 . 23.315 37.089 -15.875 1 9.37 ? N LYS A-5 127 1 
ATOM 8152 C CA . LYS A-5 1 127 . 23.283 38.528 -16.09 1 10.12 ? CA LYS A-5 127 1 
ATOM 8153 C C . LYS A-5 1 127 . 24.621 39.181 -15.759 1 8.05 ? C LYS A-5 127 1 
ATOM 8154 O O . LYS A-5 1 127 . 25.069 40.104 -16.469 1 8.74 ? O LYS A-5 127 1 
ATOM 8155 C CB . LYS A-5 1 127 . 22.159 39.154 -15.204 1 19.4 ? CB LYS A-5 127 1 
ATOM 8156 C CG . LYS A-5 1 127 . 21.959 40.619 -15.486 1 55.16 ? CG LYS A-5 127 1 
ATOM 8157 C CD . LYS A-5 1 127 . 21.83 40.895 -16.996 1 90.61 ? CD LYS A-5 127 1 
ATOM 8158 C CE . LYS A-5 1 127 . 21.509 42.35 -17.309 1 122.15 ? CE LYS A-5 127 1 
ATOM 8159 N NZ . LYS A-5 1 127 . 21.262 42.532 -18.761 1 151.23 ? NZ LYS A-5 127 1 
ATOM 8160 N N . ALA A-5 1 128 . 25.281 38.726 -14.672 1 6.97 ? N ALA A-5 128 1 
ATOM 8161 C CA . ALA A-5 1 128 . 26.518 39.336 -14.3 1 6.77 ? CA ALA A-5 128 1 
ATOM 8162 C C . ALA A-5 1 128 . 27.599 39.114 -15.368 1 6.08 ? C ALA A-5 128 1 
ATOM 8163 O O . ALA A-5 1 128 . 28.527 39.945 -15.473 1 6.5 ? O ALA A-5 128 1 
ATOM 8164 C CB . ALA A-5 1 128 . 27.004 38.817 -12.976 1 7.98 ? CB ALA A-5 128 1 
ATOM 8165 N N . PHE A-5 1 129 . 27.518 38.053 -16.12 1 5.95 ? N PHE A-5 129 1 
ATOM 8166 C CA . PHE A-5 1 129 . 28.476 37.779 -17.16 1 5.88 ? CA PHE A-5 129 1 
ATOM 8167 C C . PHE A-5 1 129 . 28.273 38.738 -18.345 1 5.89 ? C PHE A-5 129 1 
ATOM 8168 O O . PHE A-5 1 129 . 29.244 39.28 -18.879 1 5.78 ? O PHE A-5 129 1 
ATOM 8169 C CB . PHE A-5 1 129 . 28.411 36.311 -17.597 1 6.44 ? CB PHE A-5 129 1 
ATOM 8170 C CG . PHE A-5 1 129 . 29.521 35.882 -18.511 1 6.34 ? CG PHE A-5 129 1 
ATOM 8171 C CD1 . PHE A-5 1 129 . 30.845 35.948 -18.126 1 7.99 ? CD1 PHE A-5 129 1 
ATOM 8172 C CD2 . PHE A-5 1 129 . 29.254 35.422 -19.773 1 7.95 ? CD2 PHE A-5 129 1 
ATOM 8173 C CE1 . PHE A-5 1 129 . 31.85 35.554 -18.993 1 8.99 ? CE1 PHE A-5 129 1 
ATOM 8174 C CE2 . PHE A-5 1 129 . 30.272 34.994 -20.626 1 10.32 ? CE2 PHE A-5 129 1 
ATOM 8175 C CZ . PHE A-5 1 129 . 31.579 35.061 -20.2 1 9.68 ? CZ PHE A-5 129 1 
ATOM 8176 N N . LEU A-5 1 130 . 27.024 38.937 -18.757 1 5.84 ? N LEU A-5 130 1 
ATOM 8177 C CA . LEU A-5 1 130 . 26.777 39.96 -19.771 1 5.78 ? CA LEU A-5 130 1 
ATOM 8178 C C . LEU A-5 1 130 . 27.273 41.297 -19.321 1 5.7 ? C LEU A-5 130 1 
ATOM 8179 O O . LEU A-5 1 130 . 27.884 42.052 -20.08 1 6.45 ? O LEU A-5 130 1 
ATOM 8180 C CB . LEU A-5 1 130 . 25.286 40.007 -20.095 1 6.96 ? CB LEU A-5 130 1 
ATOM 8181 C CG . LEU A-5 1 130 . 24.694 38.764 -20.736 1 7.2 ? CG LEU A-5 130 1 
ATOM 8182 C CD1 . LEU A-5 1 130 . 23.23 38.976 -21.029 1 9.8 ? CD1 LEU A-5 130 1 
ATOM 8183 C CD2 . LEU A-5 1 130 . 25.422 38.362 -22.011 1 8.35 ? CD2 LEU A-5 130 1 
ATOM 8184 N N . ASP A-5 1 131 . 27.049 41.65 -18.053 1 6.12 ? N ASP A-5 131 1 
ATOM 8185 C CA . ASP A-5 1 131 . 27.514 42.926 -17.534 1 6.35 ? CA ASP A-5 131 1 
ATOM 8186 C C . ASP A-5 1 131 . 29.039 43.02 -17.563 1 5.75 ? C ASP A-5 131 1 
ATOM 8187 O O . ASP A-5 1 131 . 29.574 44.081 -17.869 1 6.12 ? O ASP A-5 131 1 
ATOM 8188 C CB . ASP A-5 1 131 . 27.015 43.142 -16.112 1 8.56 ? CB ASP A-5 131 1 
ATOM 8189 C CG . ASP A-5 1 131 . 25.58 43.388 -15.998 1 14.46 ? CG ASP A-5 131 1 
ATOM 8190 O OD1 . ASP A-5 1 131 . 24.854 43.568 -16.975 1 15.16 ? OD1 ASP A-5 131 1 
ATOM 8191 O OD2 . ASP A-5 1 131 . 25.119 43.276 -14.82 1 20.29 ? OD2 ASP A-5 131 1 
ATOM 8192 N N . GLU A-5 1 132 . 29.731 41.93 -17.234 1 5.63 ? N GLU A-5 132 1 
ATOM 8193 C CA . GLU A-5 1 132 . 31.181 41.954 -17.2 1 5.6 ? CA GLU A-5 132 1 
ATOM 8194 C C . GLU A-5 1 132 . 31.736 42.187 -18.614 1 5.33 ? C GLU A-5 132 1 
ATOM 8195 O O . GLU A-5 1 132 . 32.746 42.907 -18.797 1 5.66 ? O GLU A-5 132 1 
ATOM 8196 C CB . GLU A-5 1 132 . 31.776 40.694 -16.551 1 6.15 ? CB GLU A-5 132 1 
ATOM 8197 C CG . GLU A-5 1 132 . 32.249 39.595 -17.477 1 6.84 ? CG GLU A-5 132 1 
ATOM 8198 C CD . GLU A-5 1 132 . 32.959 38.501 -16.695 1 6.48 ? CD GLU A-5 132 1 
ATOM 8199 O OE1 . GLU A-5 1 132 . 32.412 38.07 -15.643 1 6.69 ? OE1 GLU A-5 132 1 
ATOM 8200 O OE2 . GLU A-5 1 132 . 34.048 38.051 -17.146 1 6.97 ? OE2 GLU A-5 132 1 
ATOM 8201 N N . ILE A-5 1 133 . 31.121 41.568 -19.608 1 5.42 ? N ILE A-5 133 1 
ATOM 8202 C CA . ILE A-5 1 133 . 31.576 41.721 -20.98 1 5.34 ? CA ILE A-5 133 1 
ATOM 8203 C C . ILE A-5 1 133 . 31.337 43.17 -21.428 1 5.33 ? C ILE A-5 133 1 
ATOM 8204 O O . ILE A-5 1 133 . 32.24 43.816 -21.972 1 5.65 ? O ILE A-5 133 1 
ATOM 8205 C CB . ILE A-5 1 133 . 30.891 40.715 -21.937 1 5.79 ? CB ILE A-5 133 1 
ATOM 8206 C CG1 . ILE A-5 1 133 . 31.236 39.278 -21.561 1 6.07 ? CG1 ILE A-5 133 1 
ATOM 8207 C CG2 . ILE A-5 1 133 . 31.261 41.029 -23.363 1 7.06 ? CG2 ILE A-5 133 1 
ATOM 8208 C CD1 . ILE A-5 1 133 . 30.351 38.25 -22.275 1 7.92 ? CD1 ILE A-5 133 1 
ATOM 8209 N N . ALA A-5 1 134 . 30.142 43.67 -21.213 1 5.41 ? N ALA A-5 134 1 
ATOM 8210 C CA . ALA A-5 1 134 . 29.839 45.048 -21.614 1 5.92 ? CA ALA A-5 134 1 
ATOM 8211 C C . ALA A-5 1 134 . 30.784 46.025 -20.927 1 5.6 ? C ALA A-5 134 1 
ATOM 8212 O O . ALA A-5 1 134 . 31.227 46.986 -21.545 1 6.1 ? O ALA A-5 134 1 
ATOM 8213 C CB . ALA A-5 1 134 . 28.378 45.351 -21.299 1 7.1 ? CB ALA A-5 134 1 
ATOM 8214 N N . HIS A-5 1 135 . 31.039 45.824 -19.622 1 5.58 ? N HIS A-5 135 1 
ATOM 8215 C CA . HIS A-5 1 135 . 31.884 46.746 -18.888 1 5.72 ? CA HIS A-5 135 1 
ATOM 8216 C C . HIS A-5 1 135 . 33.319 46.772 -19.439 1 5.59 ? C HIS A-5 135 1 
ATOM 8217 O O . HIS A-5 1 135 . 33.95 47.819 -19.559 1 5.62 ? O HIS A-5 135 1 
ATOM 8218 C CB . HIS A-5 1 135 . 31.869 46.422 -17.414 1 6.16 ? CB HIS A-5 135 1 
ATOM 8219 C CG . HIS A-5 1 135 . 32.522 47.443 -16.565 1 5.81 ? CG HIS A-5 135 1 
ATOM 8220 N ND1 . HIS A-5 1 135 . 33.444 47.117 -15.614 1 6.31 ? ND1 HIS A-5 135 1 
ATOM 8221 C CD2 . HIS A-5 1 135 . 32.325 48.778 -16.531 1 7.03 ? CD2 HIS A-5 135 1 
ATOM 8222 C CE1 . HIS A-5 1 135 . 33.806 48.249 -15.043 1 6.99 ? CE1 HIS A-5 135 1 
ATOM 8223 N NE2 . HIS A-5 1 135 . 33.144 49.266 -15.578 1 7.1 ? NE2 HIS A-5 135 1 
ATOM 8224 N N . PHE A-5 1 136 . 33.834 45.576 -19.761 1 5.36 ? N PHE A-5 136 1 
ATOM 8225 C CA . PHE A-5 1 136 . 35.135 45.51 -20.419 1 5.33 ? CA PHE A-5 136 1 
ATOM 8226 C C . PHE A-5 1 136 . 35.182 46.395 -21.662 1 5.22 ? C PHE A-5 136 1 
ATOM 8227 O O . PHE A-5 1 136 . 36.096 47.207 -21.825 1 5.59 ? O PHE A-5 136 1 
ATOM 8228 C CB . PHE A-5 1 136 . 35.42 44.031 -20.76 1 5.6 ? CB PHE A-5 136 1 
ATOM 8229 C CG . PHE A-5 1 136 . 36.667 43.808 -21.588 1 5.68 ? CG PHE A-5 136 1 
ATOM 8230 C CD1 . PHE A-5 1 136 . 37.937 43.743 -21.003 1 6.1 ? CD1 PHE A-5 136 1 
ATOM 8231 C CD2 . PHE A-5 1 136 . 36.567 43.646 -22.949 1 6.18 ? CD2 PHE A-5 136 1 
ATOM 8232 C CE1 . PHE A-5 1 136 . 39.044 43.518 -21.825 1 6.38 ? CE1 PHE A-5 136 1 
ATOM 8233 C CE2 . PHE A-5 1 136 . 37.689 43.442 -23.747 1 7.41 ? CE2 PHE A-5 136 1 
ATOM 8234 C CZ . PHE A-5 1 136 . 38.927 43.371 -23.148 1 6.09 ? CZ PHE A-5 136 1 
ATOM 8235 N N . PHE A-5 1 137 . 34.19 46.236 -22.544 1 5.22 ? N PHE A-5 137 1 
ATOM 8236 C CA . PHE A-5 1 137 . 34.195 47.03 -23.775 1 5.53 ? CA PHE A-5 137 1 
ATOM 8237 C C . PHE A-5 1 137 . 33.901 48.497 -23.506 1 5.81 ? C PHE A-5 137 1 
ATOM 8238 O O . PHE A-5 1 137 . 34.333 49.345 -24.298 1 6.75 ? O PHE A-5 137 1 
ATOM 8239 C CB . PHE A-5 1 137 . 33.28 46.394 -24.815 1 6.28 ? CB PHE A-5 137 1 
ATOM 8240 C CG . PHE A-5 1 137 . 33.833 45.092 -25.385 1 5.99 ? CG PHE A-5 137 1 
ATOM 8241 C CD1 . PHE A-5 1 137 . 34.892 45.144 -26.261 1 6.04 ? CD1 PHE A-5 137 1 
ATOM 8242 C CD2 . PHE A-5 1 137 . 33.401 43.859 -24.959 1 6.63 ? CD2 PHE A-5 137 1 
ATOM 8243 C CE1 . PHE A-5 1 137 . 35.454 43.983 -26.774 1 6.64 ? CE1 PHE A-5 137 1 
ATOM 8244 C CE2 . PHE A-5 1 137 . 33.971 42.681 -25.439 1 6.81 ? CE2 PHE A-5 137 1 
ATOM 8245 C CZ . PHE A-5 1 137 . 35.004 42.749 -26.363 1 7.09 ? CZ PHE A-5 137 1 
ATOM 8246 N N . GLN A-5 1 138 . 33.22 48.824 -22.435 1 5.69 ? N GLN A-5 138 1 
ATOM 8247 C CA A GLN A-5 1 138 . 32.973 50.188 -22.047 0.58 5.18 ? CA GLN A-5 138 1 
ATOM 8248 C CA B GLN A-5 1 138 . 32.98 50.212 -22.089 0.42 8.58 ? CA GLN A-5 138 1 
ATOM 8249 C C . GLN A-5 1 138 . 34.26 50.909 -21.625 1 5.78 ? C GLN A-5 138 1 
ATOM 8250 O O . GLN A-5 1 138 . 34.36 52.116 -21.846 1 6.9 ? O GLN A-5 138 1 
ATOM 8251 C CB A GLN A-5 1 138 . 31.952 50.228 -20.883 0.58 5 ? CB GLN A-5 138 1 
ATOM 8252 C CB B GLN A-5 1 138 . 31.977 50.345 -20.957 0.42 12.08 ? CB GLN A-5 138 1 
ATOM 8253 C CG A GLN A-5 1 138 . 31.466 51.583 -20.518 0.58 7.28 ? CG GLN A-5 138 1 
ATOM 8254 C CG B GLN A-5 1 138 . 30.6 50.086 -21.362 0.42 12.47 ? CG GLN A-5 138 1 
ATOM 8255 C CD A GLN A-5 1 138 . 30.487 51.658 -19.422 0.58 11.27 ? CD GLN A-5 138 1 
ATOM 8256 C CD B GLN A-5 1 138 . 29.621 50.206 -20.223 0.42 15.04 ? CD GLN A-5 138 1 
ATOM 8257 O OE1 A GLN A-5 1 138 . 29.726 52.626 -19.378 0.58 18.8 ? OE1 GLN A-5 138 1 
ATOM 8258 O OE1 B GLN A-5 1 138 . 28.532 50.794 -20.395 0.42 18.94 ? OE1 GLN A-5 138 1 
ATOM 8259 N NE2 A GLN A-5 1 138 . 30.485 50.776 -18.577 0.58 12.35 ? NE2 GLN A-5 138 1 
ATOM 8260 N NE2 B GLN A-5 1 138 . 29.972 49.723 -19.065 0.42 14.43 ? NE2 GLN A-5 138 1 
ATOM 8261 N N . ARG A-5 1 139 . 35.171 50.216 -20.947 1 5.69 ? N ARG A-5 139 1 
ATOM 8262 C CA A ARG A-5 1 139 . 36.299 50.848 -20.224 0.57 5.65 ? CA ARG A-5 139 1 
ATOM 8263 C CA B ARG A-5 1 139 . 36.311 50.889 -20.344 0.43 7.1 ? CA ARG A-5 139 1 
ATOM 8264 C C . ARG A-5 1 139 . 37.667 50.526 -20.842 1 5.81 ? C ARG A-5 139 1 
ATOM 8265 O O . ARG A-5 1 139 . 38.647 51.244 -20.527 1 6.48 ? O ARG A-5 139 1 
ATOM 8266 C CB A ARG A-5 1 139 . 36.238 50.624 -18.7 0.57 5.73 ? CB ARG A-5 139 1 
ATOM 8267 C CB B ARG A-5 1 139 . 36.335 50.567 -18.851 0.43 7.85 ? CB ARG A-5 139 1 
ATOM 8268 C CG A ARG A-5 1 139 . 34.961 51.104 -18.05 0.57 6.63 ? CG ARG A-5 139 1 
ATOM 8269 C CG B ARG A-5 1 139 . 35.172 51.182 -18.038 0.43 9.66 ? CG ARG A-5 139 1 
ATOM 8270 C CD A ARG A-5 1 139 . 34.762 52.607 -18.239 0.57 8.67 ? CD ARG A-5 139 1 
ATOM 8271 C CD B ARG A-5 1 139 . 35.01 52.672 -18.266 0.43 8.53 ? CD ARG A-5 139 1 
ATOM 8272 N NE A ARG A-5 1 139 . 33.575 53.037 -17.523 0.57 9.6 ? NE ARG A-5 139 1 
ATOM 8273 N NE B ARG A-5 1 139 . 34.13 53.29 -17.287 0.43 7.91 ? NE ARG A-5 139 1 
ATOM 8274 C CZ A ARG A-5 1 139 . 32.838 54.054 -17.866 0.57 12.06 ? CZ ARG A-5 139 1 
ATOM 8275 C CZ B ARG A-5 1 139 . 33.809 54.561 -17.33 0.43 8.48 ? CZ ARG A-5 139 1 
ATOM 8276 N NH1 A ARG A-5 1 139 . 33.11 54.753 -18.958 0.57 14.03 ? NH1 ARG A-5 139 1 
ATOM 8277 N NH1 B ARG A-5 1 139 . 34.286 55.37 -18.291 0.43 11.47 ? NH1 ARG A-5 139 1 
ATOM 8278 N NH2 A ARG A-5 1 139 . 31.794 54.342 -17.092 0.57 14.24 ? NH2 ARG A-5 139 1 
ATOM 8279 N NH2 B ARG A-5 1 139 . 33.063 55.102 -16.362 0.43 10.75 ? NH2 ARG A-5 139 1 
ATOM 8280 N N . TYR A-5 1 140 . 37.815 49.461 -21.613 1 5.75 ? N TYR A-5 140 1 
ATOM 8281 C CA . TYR A-5 1 140 . 39.147 48.995 -21.952 1 6.16 ? CA TYR A-5 140 1 
ATOM 8282 C C . TYR A-5 1 140 . 39.982 49.94 -22.826 1 6.02 ? C TYR A-5 140 1 
ATOM 8283 O O . TYR A-5 1 140 . 41.205 49.776 -22.818 1 7.17 ? O TYR A-5 140 1 
ATOM 8284 C CB . TYR A-5 1 140 . 39.118 47.591 -22.604 1 6.11 ? CB TYR A-5 140 1 
ATOM 8285 C CG . TYR A-5 1 140 . 38.676 47.519 -24.042 1 5.87 ? CG TYR A-5 140 1 
ATOM 8286 C CD1 . TYR A-5 1 140 . 37.571 48.255 -24.518 1 5.89 ? CD1 TYR A-5 140 1 
ATOM 8287 C CD2 . TYR A-5 1 140 . 39.302 46.642 -24.918 1 7.11 ? CD2 TYR A-5 140 1 
ATOM 8288 C CE1 . TYR A-5 1 140 . 37.171 48.087 -25.851 1 6.5 ? CE1 TYR A-5 140 1 
ATOM 8289 C CE2 . TYR A-5 1 140 . 38.904 46.471 -26.211 1 7.2 ? CE2 TYR A-5 140 1 
ATOM 8290 C CZ . TYR A-5 1 140 . 37.805 47.193 -26.678 1 6.47 ? CZ TYR A-5 140 1 
ATOM 8291 O OH . TYR A-5 1 140 . 37.341 47.022 -27.955 1 7.76 ? OH TYR A-5 140 1 
ATOM 8292 N N A LYS A-5 1 141 . 39.334 50.93 -23.408 0.65 6.54 ? N LYS A-5 141 1 
ATOM 8293 N N B LYS A-5 1 141 . 39.399 50.823 -23.696 0.35 4.65 ? N LYS A-5 141 1 
ATOM 8294 C CA A LYS A-5 1 141 . 40.08 51.902 -24.235 0.65 6.74 ? CA LYS A-5 141 1 
ATOM 8295 C CA B LYS A-5 1 141 . 40.138 51.747 -24.577 0.35 4.38 ? CA LYS A-5 141 1 
ATOM 8296 C C A LYS A-5 1 141 . 40.154 53.245 -23.547 0.65 5.45 ? C LYS A-5 141 1 
ATOM 8297 C C B LYS A-5 1 141 . 40.247 53.167 -23.958 0.35 4.67 ? C LYS A-5 141 1 
ATOM 8298 O O A LYS A-5 1 141 . 40.627 54.214 -24.13 0.65 6.34 ? O LYS A-5 141 1 
ATOM 8299 O O B LYS A-5 1 141 . 40.745 54.099 -24.617 0.35 4.3 ? O LYS A-5 141 1 
ATOM 8300 C CB A LYS A-5 1 141 . 39.454 52.06 -25.644 0.65 7.81 ? CB LYS A-5 141 1 
ATOM 8301 C CB B LYS A-5 1 141 . 39.489 51.826 -25.959 0.35 5.84 ? CB LYS A-5 141 1 
ATOM 8302 C CG A LYS A-5 1 141 . 39.61 50.84 -26.528 0.65 8.83 ? CG LYS A-5 141 1 
ATOM 8303 C CG B LYS A-5 1 141 . 39.714 50.555 -26.67 0.35 6.48 ? CG LYS A-5 141 1 
ATOM 8304 C CD A LYS A-5 1 141 . 39.119 51.102 -28.006 0.65 11.13 ? CD LYS A-5 141 1 
ATOM 8305 C CD B LYS A-5 1 141 . 39.016 50.517 -28.015 0.35 5.7 ? CD LYS A-5 141 1 
ATOM 8306 C CE A LYS A-5 1 141 . 39.189 49.806 -28.831 0.65 12.78 ? CE LYS A-5 141 1 
ATOM 8307 C CE B LYS A-5 1 141 . 39.3 51.75 -28.86 0.35 8 ? CE LYS A-5 141 1 
ATOM 8308 N NZ A LYS A-5 1 141 . 39.154 50.126 -30.332 0.65 12.01 ? NZ LYS A-5 141 1 
ATOM 8309 N NZ B LYS A-5 1 141 . 38.626 51.566 -30.19 0.35 6.96 ? NZ LYS A-5 141 1 
ATOM 8310 N N A GLU A-5 1 142 . 39.749 53.345 -22.303 0.65 6.12 ? N GLU A-5 142 1 
ATOM 8311 N N B GLU A-5 1 142 . 39.839 53.318 -22.701 0.35 4.14 ? N GLU A-5 142 1 
ATOM 8312 C CA A GLU A-5 1 142 . 39.705 54.679 -21.684 0.65 6.63 ? CA GLU A-5 142 1 
ATOM 8313 C CA B GLU A-5 1 142 . 39.874 54.617 -22.053 0.35 5.65 ? CA GLU A-5 142 1 
ATOM 8314 C C A GLU A-5 1 142 . 41.117 55.313 -21.681 0.65 5.71 ? C GLU A-5 142 1 
ATOM 8315 C C B GLU A-5 1 142 . 41.232 55.286 -22.06 0.35 7.42 ? C GLU A-5 142 1 
ATOM 8316 O O A GLU A-5 1 142 . 41.273 56.49 -21.992 0.65 6.22 ? O GLU A-5 142 1 
ATOM 8317 O O B GLU A-5 1 142 . 41.361 56.515 -22.412 0.35 14.7 ? O GLU A-5 142 1 
ATOM 8318 C CB A GLU A-5 1 142 . 39.096 54.602 -20.334 0.65 6.24 ? CB GLU A-5 142 1 
ATOM 8319 C CB B GLU A-5 1 142 . 39.381 54.484 -20.602 0.35 8.82 ? CB GLU A-5 142 1 
ATOM 8320 C CG A GLU A-5 1 142 . 38.883 55.836 -19.761 0.65 8.74 ? CG GLU A-5 142 1 
ATOM 8321 C CG B GLU A-5 1 142 . 37.822 54.574 -20.495 0.35 14.22 ? CG GLU A-5 142 1 
ATOM 8322 C CD A GLU A-5 1 142 . 38.07 55.803 -18.445 0.65 9.36 ? CD GLU A-5 142 1 
ATOM 8323 C CD B GLU A-5 1 142 . 37.179 54.862 -19.103 0.35 13.68 ? CD GLU A-5 142 1 
ATOM 8324 O OE1 A GLU A-5 1 142 . 37.772 54.643 -17.887 0.65 7.7 ? OE1 GLU A-5 142 1 
ATOM 8325 O OE1 B GLU A-5 1 142 . 37.809 54.788 -18.041 0.35 16.25 ? OE1 GLU A-5 142 1 
ATOM 8326 O OE2 A GLU A-5 1 142 . 37.7 56.914 -18.03 0.65 15.28 ? OE2 GLU A-5 142 1 
ATOM 8327 O OE2 B GLU A-5 1 142 . 36.032 55.366 -19.175 0.35 15.47 ? OE2 GLU A-5 142 1 
ATOM 8328 N N . LEU A-5 1 143 . 42.211 54.566 -21.473 1 7.31 ? N LEU A-5 143 1 
ATOM 8329 C CA . LEU A-5 1 143 . 43.538 55.153 -21.41 1 7.31 ? CA LEU A-5 143 1 
ATOM 8330 C C . LEU A-5 1 143 . 44.123 55.436 -22.793 1 8.47 ? C LEU A-5 143 1 
ATOM 8331 O O . LEU A-5 1 143 . 45.105 56.18 -22.901 1 10.57 ? O LEU A-5 143 1 
ATOM 8332 C CB . LEU A-5 1 143 . 44.513 54.274 -20.627 1 7.31 ? CB LEU A-5 143 1 
ATOM 8333 C CG . LEU A-5 1 143 . 44.216 54.145 -19.116 1 8.14 ? CG LEU A-5 143 1 
ATOM 8334 C CD1 . LEU A-5 1 143 . 45.325 53.285 -18.506 1 7.91 ? CD1 LEU A-5 143 1 
ATOM 8335 C CD2 . LEU A-5 1 143 . 44.14 55.499 -18.453 1 11.51 ? CD2 LEU A-5 143 1 
ATOM 8336 N N . GLN A-5 1 144 . 43.546 54.862 -23.833 1 8.41 ? N GLN A-5 144 1 
ATOM 8337 C CA . GLN A-5 1 144 . 43.897 55.259 -25.187 1 10.9 ? CA GLN A-5 144 1 
ATOM 8338 C C . GLN A-5 1 144 . 43.221 56.518 -25.653 1 11.54 ? C GLN A-5 144 1 
ATOM 8339 O O . GLN A-5 1 144 . 43.522 57.051 -26.711 1 14.83 ? O GLN A-5 144 1 
ATOM 8340 C CB . GLN A-5 1 144 . 43.543 54.175 -26.171 1 10.83 ? CB GLN A-5 144 1 
ATOM 8341 C CG . GLN A-5 1 144 . 44.272 52.882 -25.954 1 11.64 ? CG GLN A-5 144 1 
ATOM 8342 C CD . GLN A-5 1 144 . 43.851 51.759 -26.938 1 12.36 ? CD GLN A-5 144 1 
ATOM 8343 O OE1 . GLN A-5 1 144 . 43.342 50.669 -26.585 1 13.75 ? OE1 GLN A-5 144 1 
ATOM 8344 N NE2 . GLN A-5 1 144 . 44.116 52.015 -28.191 1 15.89 ? NE2 GLN A-5 144 1 
ATOM 8345 N N . GLY A-5 1 145 . 42.281 57.014 -24.893 1 11.6 ? N GLY A-5 145 1 
ATOM 8346 C CA . GLY A-5 1 145 . 41.565 58.22 -25.305 1 13.97 ? CA GLY A-5 145 1 
ATOM 8347 C C . GLY A-5 1 145 . 40.613 57.941 -26.459 1 14.34 ? C GLY A-5 145 1 
ATOM 8348 O O . GLY A-5 1 145 . 40.325 58.869 -27.184 1 20.37 ? O GLY A-5 145 1 
ATOM 8349 N N . LYS A-5 1 146 . 40.101 56.738 -26.587 1 10.17 ? N LYS A-5 146 1 
ATOM 8350 C CA . LYS A-5 1 146 . 39.186 56.389 -27.646 1 10 ? CA LYS A-5 146 1 
ATOM 8351 C C . LYS A-5 1 146 . 37.823 56.108 -27.066 1 11.72 ? C LYS A-5 146 1 
ATOM 8352 O O . LYS A-5 1 146 . 37.723 55.459 -26.06 1 22.27 ? O LYS A-5 146 1 
ATOM 8353 C CB . LYS A-5 1 146 . 39.671 55.24 -28.449 1 12.21 ? CB LYS A-5 146 1 
ATOM 8354 C CG . LYS A-5 1 146 . 41.003 55.59 -29.168 1 22.54 ? CG LYS A-5 146 1 
ATOM 8355 C CD . LYS A-5 1 146 . 41.524 54.471 -30.028 1 52.94 ? CD LYS A-5 146 1 
ATOM 8356 C CE . LYS A-5 1 146 . 42.639 54.944 -30.894 1 80.4 ? CE LYS A-5 146 1 
ATOM 8357 N NZ . LYS A-5 1 146 . 43.106 53.877 -31.811 1 103.43 ? NZ LYS A-5 146 1 
ATOM 8358 N N . THR A-5 1 147 . 36.784 56.548 -27.693 1 7.27 ? N THR A-5 147 1 
ATOM 8359 C CA . THR A-5 1 147 . 35.42 56.414 -27.18 1 6.89 ? CA THR A-5 147 1 
ATOM 8360 C C . THR A-5 1 147 . 34.774 55.135 -27.64 1 6.26 ? C THR A-5 147 1 
ATOM 8361 O O . THR A-5 1 147 . 34.794 54.799 -28.798 1 8.18 ? O THR A-5 147 1 
ATOM 8362 C CB . THR A-5 1 147 . 34.597 57.615 -27.678 1 7.69 ? CB THR A-5 147 1 
ATOM 8363 O OG1 . THR A-5 1 147 . 35.183 58.776 -27.049 1 9.78 ? OG1 THR A-5 147 1 
ATOM 8364 C CG2 . THR A-5 1 147 . 33.14 57.492 -27.376 1 9.33 ? CG2 THR A-5 147 1 
ATOM 8365 N N . THR A-5 1 148 . 34.136 54.467 -26.678 1 6.5 ? N THR A-5 148 1 
ATOM 8366 C CA . THR A-5 1 148 . 33.266 53.343 -26.993 1 6.74 ? CA THR A-5 148 1 
ATOM 8367 C C . THR A-5 1 148 . 31.907 53.597 -26.344 1 6.73 ? C THR A-5 148 1 
ATOM 8368 O O . THR A-5 1 148 . 31.8 54.306 -25.323 1 8.17 ? O THR A-5 148 1 
ATOM 8369 C CB . THR A-5 1 148 . 33.824 52.001 -26.5 1 7.06 ? CB THR A-5 148 1 
ATOM 8370 O OG1 . THR A-5 1 148 . 33.75 51.997 -25.064 1 8.84 ? OG1 THR A-5 148 1 
ATOM 8371 C CG2 . THR A-5 1 148 . 35.242 51.765 -26.977 1 7.62 ? CG2 THR A-5 148 1 
ATOM 8372 N N . LYS A-5 1 149 . 30.881 53.015 -26.923 1 7.22 ? N LYS A-5 149 1 
ATOM 8373 C CA . LYS A-5 1 149 . 29.53 53.11 -26.374 1 8.59 ? CA LYS A-5 149 1 
ATOM 8374 C C . LYS A-5 1 149 . 28.897 51.736 -26.47 1 8.3 ? C LYS A-5 149 1 
ATOM 8375 O O . LYS A-5 1 149 . 28.881 51.14 -27.54 1 9.71 ? O LYS A-5 149 1 
ATOM 8376 C CB . LYS A-5 1 149 . 28.687 54.109 -27.126 1 11.47 ? CB LYS A-5 149 1 
ATOM 8377 C CG . LYS A-5 1 149 . 27.368 54.378 -26.54 1 18.91 ? CG LYS A-5 149 1 
ATOM 8378 C CD . LYS A-5 1 149 . 26.596 55.556 -27.217 1 24.49 ? CD LYS A-5 149 1 
ATOM 8379 C CE . LYS A-5 1 149 . 27.384 56.857 -27.246 1 27.79 ? CE LYS A-5 149 1 
ATOM 8380 N NZ . LYS A-5 1 149 . 26.351 57.984 -27.584 1 30.16 ? NZ LYS A-5 149 1 
ATOM 8381 N N . ILE A-5 1 150 . 28.334 51.252 -25.363 1 8.1 ? N ILE A-5 150 1 
ATOM 8382 C CA . ILE A-5 1 150 . 27.657 49.992 -25.349 1 8.49 ? CA ILE A-5 150 1 
ATOM 8383 C C . ILE A-5 1 150 . 26.166 50.259 -25.14 1 9.29 ? C ILE A-5 150 1 
ATOM 8384 O O . ILE A-5 1 150 . 25.778 50.81 -24.114 1 14.86 ? O ILE A-5 150 1 
ATOM 8385 C CB . ILE A-5 1 150 . 28.226 49.027 -24.252 1 12.17 ? CB ILE A-5 150 1 
ATOM 8386 C CG1 . ILE A-5 1 150 . 29.738 49.029 -24.222 1 16.32 ? CG1 ILE A-5 150 1 
ATOM 8387 C CG2 . ILE A-5 1 150 . 27.537 47.622 -24.402 1 15.08 ? CG2 ILE A-5 150 1 
ATOM 8388 C CD1 . ILE A-5 1 150 . 30.33 48.531 -25.431 1 20.28 ? CD1 ILE A-5 150 1 
ATOM 8389 N N . GLU A-5 1 151 . 25.385 49.917 -26.09 0.79 7.82 ? N GLU A-5 151 1 
ATOM 8390 C CA . GLU A-5 1 151 . 23.935 50.129 -26.046 0.79 10.79 ? CA GLU A-5 151 1 
ATOM 8391 C C . GLU A-5 1 151 . 23.166 49.123 -25.295 0.79 13.76 ? C GLU A-5 151 1 
ATOM 8392 O O . GLU A-5 1 151 . 22.192 49.501 -24.573 0.79 17.94 ? O GLU A-5 151 1 
ATOM 8393 C CB . GLU A-5 1 151 . 23.398 50.377 -27.468 0.79 14.75 ? CB GLU A-5 151 1 
ATOM 8394 C CG . GLU A-5 1 151 . 21.932 50.301 -27.606 0.79 27.48 ? CG GLU A-5 151 1 
ATOM 8395 C CD . GLU A-5 1 151 . 21.425 50.182 -29.101 0.79 29.46 ? CD GLU A-5 151 1 
ATOM 8396 O OE1 . GLU A-5 1 151 . 20.216 49.926 -29.219 0.79 29.14 ? OE1 GLU A-5 151 1 
ATOM 8397 O OE2 . GLU A-5 1 151 . 22.136 50.367 -30.181 0.79 29.71 ? OE2 GLU A-5 151 1 
ATOM 8398 N N . GLY A-5 1 152 . 23.634 47.949 -25.235 1 11.58 ? N GLY A-5 152 1 
ATOM 8399 C CA . GLY A-5 1 152 . 23.001 46.77 -24.613 1 11.7 ? CA GLY A-5 152 1 
ATOM 8400 C C . GLY A-5 1 152 . 23.197 45.549 -25.512 1 8.45 ? C GLY A-5 152 1 
ATOM 8401 O O . GLY A-5 1 152 . 24.15 45.479 -26.259 1 9.67 ? O GLY A-5 152 1 
ATOM 8402 N N . TRP A-5 1 153 . 22.282 44.605 -25.315 1 8.01 ? N TRP A-5 153 1 
ATOM 8403 C CA . TRP A-5 1 153 . 22.364 43.296 -25.931 1 8.04 ? CA TRP A-5 153 1 
ATOM 8404 C C . TRP A-5 1 153 . 21.127 43.051 -26.782 1 8.17 ? C TRP A-5 153 1 
ATOM 8405 O O . TRP A-5 1 153 . 20.009 43.389 -26.377 1 12.71 ? O TRP A-5 153 1 
ATOM 8406 C CB . TRP A-5 1 153 . 22.472 42.182 -24.861 1 8.95 ? CB TRP A-5 153 1 
ATOM 8407 C CG . TRP A-5 1 153 . 23.7 42.261 -24.051 1 8.38 ? CG TRP A-5 153 1 
ATOM 8408 C CD1 . TRP A-5 1 153 . 23.909 42.993 -22.937 1 8.87 ? CD1 TRP A-5 153 1 
ATOM 8409 C CD2 . TRP A-5 1 153 . 24.938 41.622 -24.358 1 7.11 ? CD2 TRP A-5 153 1 
ATOM 8410 N NE1 . TRP A-5 1 153 . 25.213 42.852 -22.506 1 9.09 ? NE1 TRP A-5 153 1 
ATOM 8411 C CE2 . TRP A-5 1 153 . 25.861 42.016 -23.37 1 7.9 ? CE2 TRP A-5 153 1 
ATOM 8412 C CE3 . TRP A-5 1 153 . 25.38 40.75 -25.363 1 7.32 ? CE3 TRP A-5 153 1 
ATOM 8413 C CZ2 . TRP A-5 1 153 . 27.165 41.552 -23.357 1 8.09 ? CZ2 TRP A-5 153 1 
ATOM 8414 C CZ3 . TRP A-5 1 153 . 26.666 40.282 -25.319 1 7.54 ? CZ3 TRP A-5 153 1 
ATOM 8415 C CH2 . TRP A-5 1 153 . 27.55 40.699 -24.312 1 7.81 ? CH2 TRP A-5 153 1 
ATOM 8416 N N . GLY A-5 1 154 . 21.316 42.413 -27.884 1 7.35 ? N GLY A-5 154 1 
ATOM 8417 C CA . GLY A-5 1 154 . 20.256 41.832 -28.68 1 7.77 ? CA GLY A-5 154 1 
ATOM 8418 C C . GLY A-5 1 154 . 20.202 40.324 -28.564 1 6.88 ? C GLY A-5 154 1 
ATOM 8419 O O . GLY A-5 1 154 . 21.18 39.682 -28.135 1 7.17 ? O GLY A-5 154 1 
ATOM 8420 N N . ASN A-5 1 155 . 19.073 39.754 -28.94 1 7.28 ? N ASN A-5 155 1 
ATOM 8421 C CA . ASN A-5 1 155 . 18.852 38.361 -28.841 1 7.43 ? CA ASN A-5 155 1 
ATOM 8422 C C . ASN A-5 1 155 . 19.435 37.587 -30.011 1 6.97 ? C ASN A-5 155 1 
ATOM 8423 O O . ASN A-5 1 155 . 20.091 38.135 -30.925 1 7.57 ? O ASN A-5 155 1 
ATOM 8424 C CB . ASN A-5 1 155 . 17.362 38.071 -28.63 1 8.61 ? CB ASN A-5 155 1 
ATOM 8425 C CG . ASN A-5 1 155 . 16.487 38.42 -29.798 1 10.04 ? CG ASN A-5 155 1 
ATOM 8426 O OD1 . ASN A-5 1 155 . 15.221 38.485 -29.562 1 14.72 ? OD1 ASN A-5 155 1 
ATOM 8427 N ND2 . ASN A-5 1 155 . 16.958 38.58 -30.926 1 8.45 ? ND2 ASN A-5 155 1 
ATOM 8428 N N . ALA A-5 1 156 . 19.254 36.293 -30.002 1 7.3 ? N ALA A-5 156 1 
ATOM 8429 C CA . ALA A-5 1 156 . 19.864 35.438 -31.008 1 7.65 ? CA ALA A-5 156 1 
ATOM 8430 C C . ALA A-5 1 156 . 19.349 35.762 -32.386 1 7.83 ? C ALA A-5 156 1 
ATOM 8431 O O . ALA A-5 1 156 . 20.101 35.678 -33.383 1 8.21 ? O ALA A-5 156 1 
ATOM 8432 C CB . ALA A-5 1 156 . 19.604 33.959 -30.66 1 9.3 ? CB ALA A-5 156 1 
ATOM 8433 N N A GLU A-5 1 157 . 18.068 36.047 -32.578 0.56 8.06 ? N GLU A-5 157 1 
ATOM 8434 N N B GLU A-5 1 157 . 18.088 36.146 -32.451 0.44 7.89 ? N GLU A-5 157 1 
ATOM 8435 C CA A GLU A-5 1 157 . 17.569 36.45 -33.893 0.56 9.17 ? CA GLU A-5 157 1 
ATOM 8436 C CA B GLU A-5 1 157 . 17.516 36.467 -33.734 0.44 8.8 ? CA GLU A-5 157 1 
ATOM 8437 C C A GLU A-5 1 157 . 18.277 37.714 -34.357 0.56 8.6 ? C GLU A-5 157 1 
ATOM 8438 C C B GLU A-5 1 157 . 18.115 37.725 -34.347 0.44 8.83 ? C GLU A-5 157 1 
ATOM 8439 O O A GLU A-5 1 157 . 18.672 37.785 -35.529 0.56 8.06 ? O GLU A-5 157 1 
ATOM 8440 O O B GLU A-5 1 157 . 18.347 37.81 -35.559 0.44 9.77 ? O GLU A-5 157 1 
ATOM 8441 C CB A GLU A-5 1 157 . 16.036 36.636 -33.836 0.56 10.69 ? CB GLU A-5 157 1 
ATOM 8442 C CB B GLU A-5 1 157 . 16.02 36.637 -33.621 0.44 10.6 ? CB GLU A-5 157 1 
ATOM 8443 C CG A GLU A-5 1 157 . 15.272 35.326 -33.529 0.56 14.71 ? CG GLU A-5 157 1 
ATOM 8444 C CG B GLU A-5 1 157 . 15.467 37.086 -34.928 0.44 11.73 ? CG GLU A-5 157 1 
ATOM 8445 C CD A GLU A-5 1 157 . 15.392 34.169 -34.592 0.56 18.56 ? CD GLU A-5 157 1 
ATOM 8446 C CD B GLU A-5 1 157 . 15.548 36.081 -36.046 0.44 15.17 ? CD GLU A-5 157 1 
ATOM 8447 O OE1 A GLU A-5 1 157 . 15.565 32.912 -34.28 0.56 19.99 ? OE1 GLU A-5 157 1 
ATOM 8448 O OE1 B GLU A-5 1 157 . 15.153 36.467 -37.216 0.44 21.23 ? OE1 GLU A-5 157 1 
ATOM 8449 O OE2 A GLU A-5 1 157 . 15.207 34.409 -35.781 0.56 22.25 ? OE2 GLU A-5 157 1 
ATOM 8450 O OE2 B GLU A-5 1 157 . 15.924 34.92 -35.856 0.44 17.97 ? OE2 GLU A-5 157 1 
ATOM 8451 N N . GLU A-5 1 158 . 18.411 38.717 -33.52 1 8.26 ? N GLU A-5 158 1 
ATOM 8452 C CA . GLU A-5 1 158 . 19.071 39.914 -33.979 1 8.54 ? CA GLU A-5 158 1 
ATOM 8453 C C . GLU A-5 1 158 . 20.528 39.625 -34.36 1 8.14 ? C GLU A-5 158 1 
ATOM 8454 O O . GLU A-5 1 158 . 21.066 40.193 -35.315 1 8.62 ? O GLU A-5 158 1 
ATOM 8455 C CB . GLU A-5 1 158 . 19.017 41.002 -32.884 1 9.5 ? CB GLU A-5 158 1 
ATOM 8456 C CG . GLU A-5 1 158 . 19.377 42.35 -33.403 1 10.88 ? CG GLU A-5 158 1 
ATOM 8457 C CD . GLU A-5 1 158 . 19.017 43.534 -32.523 1 11.68 ? CD GLU A-5 158 1 
ATOM 8458 O OE1 . GLU A-5 1 158 . 18.579 43.348 -31.344 1 12.82 ? OE1 GLU A-5 158 1 
ATOM 8459 O OE2 . GLU A-5 1 158 . 19.144 44.671 -33.037 1 14.3 ? OE2 GLU A-5 158 1 
ATOM 8460 N N . ALA A-5 1 159 . 21.173 38.73 -33.6 1 6.98 ? N ALA A-5 159 1 
ATOM 8461 C CA . ALA A-5 1 159 . 22.54 38.335 -33.934 1 7.04 ? CA ALA A-5 159 1 
ATOM 8462 C C . ALA A-5 1 159 . 22.622 37.684 -35.299 1 7.02 ? C ALA A-5 159 1 
ATOM 8463 O O . ALA A-5 1 159 . 23.504 37.983 -36.11 1 7.41 ? O ALA A-5 159 1 
ATOM 8464 C CB . ALA A-5 1 159 . 23.046 37.352 -32.872 1 7.75 ? CB ALA A-5 159 1 
ATOM 8465 N N . LYS A-5 1 160 . 21.709 36.74 -35.558 1 6.96 ? N LYS A-5 160 1 
ATOM 8466 C CA . LYS A-5 1 160 . 21.672 36.038 -36.828 1 7.49 ? CA LYS A-5 160 1 
ATOM 8467 C C . LYS A-5 1 160 . 21.444 36.989 -37.998 1 7.88 ? C LYS A-5 160 1 
ATOM 8468 O O . LYS A-5 1 160 . 22.077 36.853 -39.045 1 8.26 ? O LYS A-5 160 1 
ATOM 8469 C CB . LYS A-5 1 160 . 20.668 34.912 -36.794 1 8.24 ? CB LYS A-5 160 1 
ATOM 8470 C CG . LYS A-5 1 160 . 21.112 33.779 -35.86 1 9 ? CG LYS A-5 160 1 
ATOM 8471 C CD . LYS A-5 1 160 . 20.15 32.63 -35.811 1 11.31 ? CD LYS A-5 160 1 
ATOM 8472 C CE . LYS A-5 1 160 . 18.851 32.973 -35.297 1 14.26 ? CE LYS A-5 160 1 
ATOM 8473 N NZ . LYS A-5 1 160 . 17.942 31.761 -35.248 1 17.19 ? NZ LYS A-5 160 1 
ATOM 8474 N N . ARG A-5 1 161 . 20.536 37.958 -37.821 1 7.94 ? N ARG A-5 161 1 
ATOM 8475 C CA . ARG A-5 1 161 . 20.344 38.944 -38.887 1 9.02 ? CA ARG A-5 161 1 
ATOM 8476 C C . ARG A-5 1 161 . 21.613 39.723 -39.153 1 7.95 ? C ARG A-5 161 1 
ATOM 8477 O O . ARG A-5 1 161 . 21.936 40.051 -40.312 1 8.5 ? O ARG A-5 161 1 
ATOM 8478 C CB . ARG A-5 1 161 . 19.196 39.861 -38.51 1 10.76 ? CB ARG A-5 161 1 
ATOM 8479 C CG . ARG A-5 1 161 . 17.845 39.184 -38.541 1 15.91 ? CG ARG A-5 161 1 
ATOM 8480 C CD . ARG A-5 1 161 . 16.637 40.187 -38.488 1 26.83 ? CD ARG A-5 161 1 
ATOM 8481 N NE . ARG A-5 1 161 . 16.56 40.965 -37.228 1 35.18 ? NE ARG A-5 161 1 
ATOM 8482 C CZ . ARG A-5 1 161 . 15.9 40.587 -36.111 1 46.06 ? CZ ARG A-5 161 1 
ATOM 8483 N NH1 . ARG A-5 1 161 . 15.173 39.472 -36.126 1 61.49 ? NH1 ARG A-5 161 1 
ATOM 8484 N NH2 . ARG A-5 1 161 . 15.921 41.353 -35.032 1 51.06 ? NH2 ARG A-5 161 1 
ATOM 8485 N N . GLU A-5 1 162 . 22.373 40.071 -38.112 1 7.13 ? N GLU A-5 162 1 
ATOM 8486 C CA . GLU A-5 1 162 . 23.582 40.817 -38.296 1 7.33 ? CA GLU A-5 162 1 
ATOM 8487 C C . GLU A-5 1 162 . 24.67 39.993 -38.98 1 6.76 ? C GLU A-5 162 1 
ATOM 8488 O O . GLU A-5 1 162 . 25.438 40.52 -39.795 1 7.13 ? O GLU A-5 162 1 
ATOM 8489 C CB . GLU A-5 1 162 . 24.076 41.44 -37.007 1 7.46 ? CB GLU A-5 162 1 
ATOM 8490 C CG . GLU A-5 1 162 . 24.987 42.652 -37.22 1 7.52 ? CG GLU A-5 162 1 
ATOM 8491 C CD . GLU A-5 1 162 . 24.294 43.875 -37.781 1 8.3 ? CD GLU A-5 162 1 
ATOM 8492 O OE1 . GLU A-5 1 162 . 23.035 43.859 -37.87 1 10.45 ? OE1 GLU A-5 162 1 
ATOM 8493 O OE2 . GLU A-5 1 162 . 25.009 44.854 -38.053 1 8.26 ? OE2 GLU A-5 162 1 
ATOM 8494 N N . ILE A-5 1 163 . 24.741 38.704 -38.664 1 6.57 ? N ILE A-5 163 1 
ATOM 8495 C CA . ILE A-5 1 163 . 25.657 37.812 -39.364 1 6.37 ? CA ILE A-5 163 1 
ATOM 8496 C C . ILE A-5 1 163 . 25.345 37.841 -40.864 1 6.92 ? C ILE A-5 163 1 
ATOM 8497 O O . ILE A-5 1 163 . 26.263 37.948 -41.687 1 7.33 ? O ILE A-5 163 1 
ATOM 8498 C CB . ILE A-5 1 163 . 25.545 36.393 -38.797 1 7.08 ? CB ILE A-5 163 1 
ATOM 8499 C CG1 . ILE A-5 1 163 . 26.109 36.318 -37.373 1 6.6 ? CG1 ILE A-5 163 1 
ATOM 8500 C CG2 . ILE A-5 1 163 . 26.2 35.373 -39.717 1 7.57 ? CG2 ILE A-5 163 1 
ATOM 8501 C CD1 . ILE A-5 1 163 . 25.735 35.092 -36.593 1 7.43 ? CD1 ILE A-5 163 1 
ATOM 8502 N N . LEU A-5 1 164 . 24.077 37.745 -41.234 1 7.17 ? N LEU A-5 164 1 
ATOM 8503 C CA . LEU A-5 1 164 . 23.746 37.771 -42.67 1 7.92 ? CA LEU A-5 164 1 
ATOM 8504 C C . LEU A-5 1 164 . 24.159 39.071 -43.276 1 7.73 ? C LEU A-5 164 1 
ATOM 8505 O O . LEU A-5 1 164 . 24.699 39.044 -44.424 1 8.39 ? O LEU A-5 164 1 
ATOM 8506 C CB . LEU A-5 1 164 . 22.241 37.545 -42.824 1 9.68 ? CB LEU A-5 164 1 
ATOM 8507 C CG . LEU A-5 1 164 . 21.761 36.167 -42.422 1 10.69 ? CG LEU A-5 164 1 
ATOM 8508 C CD1 . LEU A-5 1 164 . 20.235 36.115 -42.522 1 14.89 ? CD1 LEU A-5 164 1 
ATOM 8509 C CD2 . LEU A-5 1 164 . 22.38 35.059 -43.212 1 13.66 ? CD2 LEU A-5 164 1 
ATOM 8510 N N . ARG A-5 1 165 . 23.996 40.196 -42.619 1 7.53 ? N ARG A-5 165 1 
ATOM 8511 C CA . ARG A-5 1 165 . 24.457 41.488 -43.151 1 7.54 ? CA ARG A-5 165 1 
ATOM 8512 C C . ARG A-5 1 165 . 25.955 41.468 -43.367 1 7.52 ? C ARG A-5 165 1 
ATOM 8513 O O . ARG A-5 1 165 . 26.437 41.923 -44.429 1 8.14 ? O ARG A-5 165 1 
ATOM 8514 C CB . ARG A-5 1 165 . 24.085 42.59 -42.176 1 8.17 ? CB ARG A-5 165 1 
ATOM 8515 C CG . ARG A-5 1 165 . 24.695 43.931 -42.539 1 9.58 ? CG ARG A-5 165 1 
ATOM 8516 C CD . ARG A-5 1 165 . 24.214 45.05 -41.645 1 10.42 ? CD ARG A-5 165 1 
ATOM 8517 N NE . ARG A-5 1 165 . 24.85 46.325 -42.055 0.93 10.16 ? NE ARG A-5 165 1 
ATOM 8518 C CZ . ARG A-5 1 165 . 25.89 46.939 -41.462 0.88 8.73 ? CZ ARG A-5 165 1 
ATOM 8519 N NH1 . ARG A-5 1 165 . 26.424 48.008 -42.013 1 10.57 ? NH1 ARG A-5 165 1 
ATOM 8520 N NH2 . ARG A-5 1 165 . 26.325 46.528 -40.278 1 10.08 ? NH2 ARG A-5 165 1 
ATOM 8521 N N . ALA A-5 1 166 . 26.721 41 -42.391 1 7.02 ? N ALA A-5 166 1 
ATOM 8522 C CA . ALA A-5 1 166 . 28.183 41.031 -42.465 1 6.68 ? CA ALA A-5 166 1 
ATOM 8523 C C . ALA A-5 1 166 . 28.701 40.146 -43.596 1 6.82 ? C ALA A-5 166 1 
ATOM 8524 O O . ALA A-5 1 166 . 29.713 40.456 -44.234 1 7.05 ? O ALA A-5 166 1 
ATOM 8525 C CB . ALA A-5 1 166 . 28.758 40.646 -41.127 1 7.28 ? CB ALA A-5 166 1 
ATOM 8526 N N . ILE A-5 1 167 . 28.029 39.009 -43.827 1 7.08 ? N ILE A-5 167 1 
ATOM 8527 C CA . ILE A-5 1 167 . 28.371 38.132 -44.931 1 7.36 ? CA ILE A-5 167 1 
ATOM 8528 C C . ILE A-5 1 167 . 28.184 38.875 -46.283 1 7.73 ? C ILE A-5 167 1 
ATOM 8529 O O . ILE A-5 1 167 . 29.045 38.767 -47.162 1 8.71 ? O ILE A-5 167 1 
ATOM 8530 C CB . ILE A-5 1 167 . 27.52 36.866 -44.878 1 8 ? CB ILE A-5 167 1 
ATOM 8531 C CG1 . ILE A-5 1 167 . 28.011 36.008 -43.695 1 8.5 ? CG1 ILE A-5 167 1 
ATOM 8532 C CG2 . ILE A-5 1 167 . 27.494 36.098 -46.173 1 9.65 ? CG2 ILE A-5 167 1 
ATOM 8533 C CD1 . ILE A-5 1 167 . 27.173 34.804 -43.425 1 10.01 ? CD1 ILE A-5 167 1 
ATOM 8534 N N . GLU A-5 1 168 . 27.099 39.633 -46.405 1 8.34 ? N GLU A-5 168 1 
ATOM 8535 C CA . GLU A-5 1 168 . 26.887 40.396 -47.64 1 8.74 ? CA GLU A-5 168 1 
ATOM 8536 C C . GLU A-5 1 168 . 27.895 41.547 -47.767 1 8.52 ? C GLU A-5 168 1 
ATOM 8537 O O . GLU A-5 1 168 . 28.299 41.859 -48.898 1 10.05 ? O GLU A-5 168 1 
ATOM 8538 C CB . GLU A-5 1 168 . 25.464 40.937 -47.699 1 9.72 ? CB GLU A-5 168 1 
ATOM 8539 C CG . GLU A-5 1 168 . 24.433 39.823 -47.745 1 11.73 ? CG GLU A-5 168 1 
ATOM 8540 C CD . GLU A-5 1 168 . 24.657 38.823 -48.866 1 12.77 ? CD GLU A-5 168 1 
ATOM 8541 O OE1 . GLU A-5 1 168 . 24.596 37.561 -48.616 1 16.08 ? OE1 GLU A-5 168 1 
ATOM 8542 O OE2 . GLU A-5 1 168 . 25.027 39.229 -49.987 1 12.98 ? OE2 GLU A-5 168 1 
ATOM 8543 N N . MET A-5 1 169 . 28.311 42.134 -46.665 1 8.29 ? N MET A-5 169 1 
ATOM 8544 C CA . MET A-5 1 169 . 29.325 43.204 -46.736 1 8.29 ? CA MET A-5 169 1 
ATOM 8545 C C . MET A-5 1 169 . 30.644 42.691 -47.282 1 8.32 ? C MET A-5 169 1 
ATOM 8546 O O . MET A-5 1 169 . 31.33 43.375 -48.043 1 9.23 ? O MET A-5 169 1 
ATOM 8547 C CB . MET A-5 1 169 . 29.516 43.878 -45.374 1 8.62 ? CB MET A-5 169 1 
ATOM 8548 C CG . MET A-5 1 169 . 28.309 44.646 -44.877 1 10.2 ? CG MET A-5 169 1 
ATOM 8549 S SD . MET A-5 1 169 . 28.471 45.342 -43.239 1 11.37 ? SD MET A-5 169 1 
ATOM 8550 C CE . MET A-5 1 169 . 29.623 46.571 -43.561 1 14.74 ? CE MET A-5 169 1 
ATOM 8551 N N . TYR A-5 1 170 . 31.023 41.468 -46.92 1 7.89 ? N TYR A-5 170 1 
ATOM 8552 C CA . TYR A-5 1 170 . 32.21 40.861 -47.499 1 7.78 ? CA TYR A-5 170 1 
ATOM 8553 C C . TYR A-5 1 170 . 32.076 40.636 -48.983 1 9.1 ? C TYR A-5 170 1 
ATOM 8554 O O . TYR A-5 1 170 . 32.982 40.91 -49.756 1 10.18 ? O TYR A-5 170 1 
ATOM 8555 C CB . TYR A-5 1 170 . 32.493 39.517 -46.776 1 8.41 ? CB TYR A-5 170 1 
ATOM 8556 C CG . TYR A-5 1 170 . 33.672 38.754 -47.357 1 8.3 ? CG TYR A-5 170 1 
ATOM 8557 C CD1 . TYR A-5 1 170 . 33.507 37.921 -48.446 1 9.52 ? CD1 TYR A-5 170 1 
ATOM 8558 C CD2 . TYR A-5 1 170 . 34.944 38.904 -46.84 1 8.66 ? CD2 TYR A-5 170 1 
ATOM 8559 C CE1 . TYR A-5 1 170 . 34.592 37.232 -48.974 1 10.76 ? CE1 TYR A-5 170 1 
ATOM 8560 C CE2 . TYR A-5 1 170 . 36.028 38.216 -47.377 1 9.44 ? CE2 TYR A-5 170 1 
ATOM 8561 C CZ . TYR A-5 1 170 . 35.858 37.439 -48.49 1 10.21 ? CZ TYR A-5 170 1 
ATOM 8562 O OH . TYR A-5 1 170 . 36.881 36.745 -49.074 1 12.23 ? OH TYR A-5 170 1 
ATOM 8563 N N . LYS A-5 1 171 . 30.917 40.093 -49.43 1 10 ? N LYS A-5 171 1 
ATOM 8564 C CA . LYS A-5 1 171 . 30.711 39.868 -50.861 1 12.97 ? CA LYS A-5 171 1 
ATOM 8565 C C . LYS A-5 1 171 . 30.841 41.176 -51.634 1 14.25 ? C LYS A-5 171 1 
ATOM 8566 O O . LYS A-5 1 171 . 31.403 41.15 -52.723 1 16.52 ? O LYS A-5 171 1 
ATOM 8567 C CB . LYS A-5 1 171 . 29.371 39.192 -51.078 1 13.85 ? CB LYS A-5 171 1 
ATOM 8568 C CG . LYS A-5 1 171 . 29.276 37.813 -50.575 1 14.74 ? CG LYS A-5 171 1 
ATOM 8569 C CD . LYS A-5 1 171 . 27.856 37.266 -50.717 1 24.07 ? CD LYS A-5 171 1 
ATOM 8570 C CE . LYS A-5 1 171 . 27.663 35.933 -50.076 1 44.24 ? CE LYS A-5 171 1 
ATOM 8571 N NZ . LYS A-5 1 171 . 26.253 35.501 -50.144 1 60.91 ? NZ LYS A-5 171 1 
ATOM 8572 N N . GLU A-5 1 172 . 30.3 42.243 -51.078 1 13.58 ? N GLU A-5 172 1 
ATOM 8573 C CA . GLU A-5 1 172 . 30.323 43.494 -51.767 1 14.99 ? CA GLU A-5 172 1 
ATOM 8574 C C . GLU A-5 1 172 . 31.716 44.023 -51.821 1 17.08 ? C GLU A-5 172 1 
ATOM 8575 O O . GLU A-5 1 172 . 32.193 44.539 -52.864 1 22.94 ? O GLU A-5 172 1 
ATOM 8576 C CB . GLU A-5 1 172 . 29.353 44.438 -51.087 1 14.62 ? CB GLU A-5 172 1 
ATOM 8577 C CG . GLU A-5 1 172 . 29.29 45.783 -51.709 1 14.81 ? CG GLU A-5 172 1 
ATOM 8578 C CD . GLU A-5 1 172 . 28.857 45.774 -53.219 1 15.18 ? CD GLU A-5 172 1 
ATOM 8579 O OE1 . GLU A-5 1 172 . 29.213 46.799 -53.857 1 18.01 ? OE1 GLU A-5 172 1 
ATOM 8580 O OE2 . GLU A-5 1 172 . 28.181 44.799 -53.64 1 18.82 ? OE2 GLU A-5 172 1 
ATOM 8581 N N . LYS A-5 1 173 . 32.481 43.879 -50.725 1 16.19 ? N LYS A-5 173 1 
ATOM 8582 C CA . LYS A-5 1 173 . 33.822 44.403 -50.693 1 19.04 ? CA LYS A-5 173 1 
ATOM 8583 C C . LYS A-5 1 173 . 34.84 43.623 -51.559 1 18.27 ? C LYS A-5 173 1 
ATOM 8584 O O . LYS A-5 1 173 . 35.641 44.185 -52.291 1 24.3 ? O LYS A-5 173 1 
ATOM 8585 C CB . LYS A-5 1 173 . 34.373 44.501 -49.276 1 30.69 ? CB LYS A-5 173 1 
ATOM 8586 C CG . LYS A-5 1 173 . 35.837 44.933 -49.205 1 54.54 ? CG LYS A-5 173 1 
ATOM 8587 C CD . LYS A-5 1 173 . 36.15 45.889 -48.134 1 76.44 ? CD LYS A-5 173 1 
ATOM 8588 C CE . LYS A-5 1 173 . 37.575 46.322 -48.217 1 97.97 ? CE LYS A-5 173 1 
ATOM 8589 N NZ . LYS A-5 1 173 . 37.698 47.72 -48.623 1 119.88 ? NZ LYS A-5 173 1 
ATOM 8590 N N . PHE A-5 1 174 . 34.791 42.335 -51.434 1 15.43 ? N PHE A-5 174 1 
ATOM 8591 C CA . PHE A-5 1 174 . 35.79 41.459 -52.045 1 18.59 ? CA PHE A-5 174 1 
ATOM 8592 C C . PHE A-5 1 174 . 35.143 40.772 -53.289 1 27.35 ? C PHE A-5 174 1 
ATOM 8593 C CB . PHE A-5 1 174 . 36.291 40.46 -51.068 1 16.46 ? CB PHE A-5 174 1 
ATOM 8594 C CG . PHE A-5 1 174 . 37.038 41.111 -49.966 1 15.09 ? CG PHE A-5 174 1 
ATOM 8595 C CD1 . PHE A-5 1 174 . 38.372 41.53 -50.109 1 16.67 ? CD1 PHE A-5 174 1 
ATOM 8596 C CD2 . PHE A-5 1 174 . 36.414 41.309 -48.717 1 15.63 ? CD2 PHE A-5 174 1 
ATOM 8597 C CE1 . PHE A-5 1 174 . 39.025 42.139 -49.126 1 18.55 ? CE1 PHE A-5 174 1 
ATOM 8598 C CE2 . PHE A-5 1 174 . 37.108 41.864 -47.667 1 16.2 ? CE2 PHE A-5 174 1 
ATOM 8599 C CZ . PHE A-5 1 174 . 38.415 42.329 -47.808 1 18.16 ? CZ PHE A-5 174 1 
ATOM 8600 N N . GLY A-5 1 175 . 34.019 41.236 -53.821 1 29.76 ? N GLY A-5 175 1 
ATOM 8601 C CA . GLY A-5 1 175 . 33.648 40.847 -55.208 1 29.86 ? CA GLY A-5 175 1 
ATOM 8602 C C . GLY A-5 1 175 . 34.475 41.753 -56.117 1 30.3 ? C GLY A-5 175 1 
ATOM 8603 O O . GLY A-5 1 175 . 34.978 41.367 -57.21 1 30.14 ? O GLY A-5 175 1 
ATOM 8604 N N . LYS A-5 1 176 . 34.65 43.018 -55.711 0.82 37.57 ? N LYS A-5 176 1 
ATOM 8605 C CA . LYS A-5 1 176 . 35.511 43.962 -56.434 0.85 33.27 ? CA LYS A-5 176 1 
ATOM 8606 C C . LYS A-5 1 176 . 36.922 43.89 -55.844 0.84 33.34 ? C LYS A-5 176 1 
ATOM 8607 O O . LYS A-5 1 176 . 37.9 43.738 -56.609 0.73 34.6 ? O LYS A-5 176 1 
ATOM 8608 C CB . LYS A-5 1 176 . 34.96 45.387 -56.389 0.85 30.77 ? CB LYS A-5 176 1 
ATOM 8609 C CG . LYS A-5 1 176 . 33.469 45.549 -56.126 0.87 28.43 ? CG LYS A-5 176 1 
ATOM 8610 C CD . LYS A-5 1 176 . 33.296 45.773 -54.677 0.83 27.66 ? CD LYS A-5 176 1 
ATOM 8611 C CE . LYS A-5 1 176 . 32.754 47.148 -54.405 0.81 27.26 ? CE LYS A-5 176 1 
ATOM 8612 N NZ . LYS A-5 1 176 . 31.809 47.445 -55.566 0.85 28.19 ? NZ LYS A-5 176 1 
ATOM 8613 N N . GLU A-5 1 177 . 37.046 43.952 -54.496 0.81 33.42 ? N GLU A-5 177 1 
ATOM 8614 C CA . GLU A-5 1 177 . 38.414 43.88 -53.872 0.85 31.59 ? CA GLU A-5 177 1 
ATOM 8615 C C . GLU A-5 1 177 . 39.022 42.513 -54.212 0.83 32.11 ? C GLU A-5 177 1 
ATOM 8616 O O . GLU A-5 1 177 . 39.331 42.233 -55.387 0.69 34.38 ? O GLU A-5 177 1 
ATOM 8617 C CB . GLU A-5 1 177 . 38.4 44.037 -52.364 0.85 28.63 ? CB GLU A-5 177 1 
ATOM 8618 C CG . GLU A-5 1 177 . 38.782 45.374 -51.725 0.89 29.06 ? CG GLU A-5 177 1 
ATOM 8619 C CD . GLU A-5 1 177 . 40.27 45.383 -51.348 0.85 30.59 ? CD GLU A-5 177 1 
ATOM 8620 O OE1 . GLU A-5 1 177 . 40.916 46.447 -51.275 0.7 33.43 ? OE1 GLU A-5 177 1 
ATOM 8621 O OE2 . GLU A-5 1 177 . 40.869 44.283 -51.135 0.73 32.65 ? OE2 GLU A-5 177 1 
ATOM 8622 N N . GLU A-5 1 178 . 39.17 41.665 -53.201 0.74 30.04 ? N GLU A-5 178 1 
ATOM 8623 C CA . GLU A-5 1 178 . 39.678 40.316 -53.404 0.87 29.37 ? CA GLU A-5 178 1 
ATOM 8624 C C . GLU A-5 1 178 . 38.567 39.386 -53.885 0.81 29.87 ? C GLU A-5 178 1 
ATOM 8625 O O . GLU A-5 1 178 . 38.6 38.18 -53.639 0.7 29.95 ? O GLU A-5 178 1 
ATOM 8626 C CB . GLU A-5 1 178 . 40.303 39.783 -52.113 0.54 20.61 ? CB GLU A-5 178 1 
ATOM 8627 C CG . GLU A-5 1 178 . 40.015 38.32 -51.833 0.63 20.13 ? CG GLU A-5 178 1 
ATOM 8628 C CD . GLU A-5 1 178 . 41.153 37.421 -52.257 0.56 20.13 ? CD GLU A-5 178 1 
ATOM 8629 O OE1 . GLU A-5 1 178 . 40.997 36.7 -53.264 0.2 20.18 ? OE1 GLU A-5 178 1 
ATOM 8630 O OE2 . GLU A-5 1 178 . 42.206 37.441 -51.588 0.25 20.19 ? OE2 GLU A-5 178 1 
ATOM 8631 N N A MET A-6 1 1 . 50.672 32.619 -46.239 0.36 40.14 ? N MET A-6 1 1 
ATOM 8632 N N B MET A-6 1 1 . 50.723 33.117 -46.32 0.25 40.26 ? N MET A-6 1 1 
ATOM 8633 C CA A MET A-6 1 1 . 51.904 33.113 -46.822 0.36 35.49 ? CA MET A-6 1 1 
ATOM 8634 C CA B MET A-6 1 1 . 52.049 33.355 -46.867 0.25 35.98 ? CA MET A-6 1 1 
ATOM 8635 C CA C MET A-6 1 1 . 53.545 31.764 -48.268 0.28 34.51 ? CA MET A-6 1 1 
ATOM 8636 C CA D MET A-6 1 1 . 53.599 31.865 -48.32 0.11 34.38 ? CA MET A-6 1 1 
ATOM 8637 C C A MET A-6 1 1 . 53.029 32.912 -45.842 0.36 32.17 ? C MET A-6 1 1 
ATOM 8638 C C B MET A-6 1 1 . 53.079 32.74 -45.942 0.25 32.13 ? C MET A-6 1 1 
ATOM 8639 C C C MET A-6 1 1 . 54.413 31.83 -47.03 0.28 32.62 ? C MET A-6 1 1 
ATOM 8640 C C D MET A-6 1 1 . 54.407 31.853 -47.031 0.11 32.43 ? C MET A-6 1 1 
ATOM 8641 O O A MET A-6 1 1 . 52.839 33.117 -44.7 0.36 29.44 ? O MET A-6 1 1 
ATOM 8642 O O B MET A-6 1 1 . 52.963 32.942 -44.768 0.25 29.37 ? O MET A-6 1 1 
ATOM 8643 O O C MET A-6 1 1 . 54.31 32.776 -46.236 0.28 31.69 ? O MET A-6 1 1 
ATOM 8644 O O D MET A-6 1 1 . 54.286 32.759 -46.205 0.11 31.49 ? O MET A-6 1 1 
ATOM 8645 C CB A MET A-6 1 1 . 51.771 34.598 -47.1 0.36 34.98 ? CB MET A-6 1 1 
ATOM 8646 C CB B MET A-6 1 1 . 52.309 34.864 -46.951 0.25 35.51 ? CB MET A-6 1 1 
ATOM 8647 C CB C MET A-6 1 1 . 54.293 30.997 -49.347 0.28 34.42 ? CB MET A-6 1 1 
ATOM 8648 C CB D MET A-6 1 1 . 54.485 32.371 -49.459 0.11 34.16 ? CB MET A-6 1 1 
ATOM 8649 C CG A MET A-6 1 1 . 50.449 34.933 -47.776 0.36 34.12 ? CG MET A-6 1 1 
ATOM 8650 C CG B MET A-6 1 1 . 51.337 35.599 -47.857 0.25 35.7 ? CG MET A-6 1 1 
ATOM 8651 C CG C MET A-6 1 1 . 53.597 30.999 -50.681 0.28 33.1 ? CG MET A-6 1 1 
ATOM 8652 C CG D MET A-6 1 1 . 54.414 33.868 -49.671 0.11 32.87 ? CG MET A-6 1 1 
ATOM 8653 S SD A MET A-6 1 1 . 50.615 36.523 -48.589 0.36 36.19 ? SD MET A-6 1 1 
ATOM 8654 S SD B MET A-6 1 1 . 51.68 37.365 -47.955 0.25 35.99 ? SD MET A-6 1 1 
ATOM 8655 S SD C MET A-6 1 1 . 54.786 31.146 -52.014 0.28 33.31 ? SD MET A-6 1 1 
ATOM 8656 S SD D MET A-6 1 1 . 55.899 34.767 -49.165 0.11 31.06 ? SD MET A-6 1 1 
ATOM 8657 C CE A MET A-6 1 1 . 52.213 36.347 -49.352 0.36 35.71 ? CE MET A-6 1 1 
ATOM 8658 C CE B MET A-6 1 1 . 50.687 37.854 -49.354 0.25 37.61 ? CE MET A-6 1 1 
ATOM 8659 C CE C MET A-6 1 1 . 54.027 32.352 -53.061 0.28 34.8 ? CE MET A-6 1 1 
ATOM 8660 C CE D MET A-6 1 1 . 56.835 34.796 -50.684 0.11 34.52 ? CE MET A-6 1 1 
ATOM 8661 N N A ASN A-6 1 2 . 54.211 32.551 -46.367 0.36 33.6 ? N ASN A-6 2 1 
ATOM 8662 N N B ASN A-6 1 2 . 54.067 32.008 -46.501 0.25 32.8 ? N ASN A-6 2 1 
ATOM 8663 N N C ASN A-6 1 2 . 55.251 30.823 -46.856 0.28 32.44 ? N ASN A-6 2 1 
ATOM 8664 N N D ASN A-6 1 2 . 55.223 30.82 -46.864 0.11 31.64 ? N ASN A-6 2 1 
ATOM 8665 C CA A ASN A-6 1 2 . 55.4 32.234 -45.562 0.36 34.36 ? CA ASN A-6 2 1 
ATOM 8666 C CA B ASN A-6 1 2 . 55.252 31.513 -45.752 0.25 33.95 ? CA ASN A-6 2 1 
ATOM 8667 C CA C ASN A-6 1 2 . 56.255 30.844 -45.776 0.28 33.7 ? CA ASN A-6 2 1 
ATOM 8668 C CA D ASN A-6 1 2 . 56.199 30.754 -45.766 0.11 33.1 ? CA ASN A-6 2 1 
ATOM 8669 C C A ASN A-6 1 2 . 55.85 33.451 -44.794 0.36 26.62 ? C ASN A-6 2 1 
ATOM 8670 C C B ASN A-6 1 2 . 55.999 32.635 -45.092 0.25 25.14 ? C ASN A-6 2 1 
ATOM 8671 C C C ASN A-6 1 2 . 56.465 32.242 -45.167 0.28 24.9 ? C ASN A-6 2 1 
ATOM 8672 C C D ASN A-6 1 2 . 56.575 32.123 -45.171 0.11 25.36 ? C ASN A-6 2 1 
ATOM 8673 O O A ASN A-6 1 2 . 56.116 34.515 -45.365 0.36 28.36 ? O ASN A-6 2 1 
ATOM 8674 O O B ASN A-6 1 2 . 56.602 33.42 -45.797 0.25 23.83 ? O ASN A-6 2 1 
ATOM 8675 O O C ASN A-6 1 2 . 56.88 33.142 -45.877 0.28 24.62 ? O ASN A-6 2 1 
ATOM 8676 O O D ASN A-6 1 2 . 56.993 33.012 -45.902 0.11 23.05 ? O ASN A-6 2 1 
ATOM 8677 C CB A ASN A-6 1 2 . 56.508 31.706 -46.473 0.36 44.1 ? CB ASN A-6 2 1 
ATOM 8678 C CB B ASN A-6 1 2 . 56.229 30.79 -46.683 0.25 43.76 ? CB ASN A-6 2 1 
ATOM 8679 C CB C ASN A-6 1 2 . 57.598 30.293 -46.287 0.28 43.96 ? CB ASN A-6 2 1 
ATOM 8680 C CB D ASN A-6 1 2 . 57.465 30.039 -46.253 0.11 43.6 ? CB ASN A-6 2 1 
ATOM 8681 C CG A ASN A-6 1 2 . 57.67 31.059 -45.707 0.36 49.12 ? CG ASN A-6 2 1 
ATOM 8682 C CG B ASN A-6 1 2 . 57.627 30.593 -46.058 0.25 48.37 ? CG ASN A-6 2 1 
ATOM 8683 C CG C ASN A-6 1 2 . 58.56 29.954 -45.166 0.28 48.56 ? CG ASN A-6 2 1 
ATOM 8684 C CG D ASN A-6 1 2 . 58.504 29.861 -45.161 0.11 48.28 ? CG ASN A-6 2 1 
ATOM 8685 O OD1 A ASN A-6 1 2 . 58.376 31.706 -44.96 0.36 42.33 ? OD1 ASN A-6 2 1 
ATOM 8686 O OD1 B ASN A-6 1 2 . 58.267 31.54 -45.555 0.25 42.07 ? OD1 ASN A-6 2 1 
ATOM 8687 O OD1 C ASN A-6 1 2 . 58.618 30.632 -44.15 0.28 40.84 ? OD1 ASN A-6 2 1 
ATOM 8688 O OD1 D ASN A-6 1 2 . 58.556 30.617 -44.195 0.11 40.32 ? OD1 ASN A-6 2 1 
ATOM 8689 N ND2 A ASN A-6 1 2 . 57.867 29.778 -45.919 0.36 59.17 ? ND2 ASN A-6 2 1 
ATOM 8690 N ND2 B ASN A-6 1 2 . 58.102 29.37 -46.086 0.25 59.12 ? ND2 ASN A-6 2 1 
ATOM 8691 N ND2 C ASN A-6 1 2 . 59.338 28.897 -45.361 0.28 59.36 ? ND2 ASN A-6 2 1 
ATOM 8692 N ND2 D ASN A-6 1 2 . 59.357 28.856 -45.325 0.11 59.28 ? ND2 ASN A-6 2 1 
ATOM 8693 N N A PRO A-6 1 3 . 55.967 33.308 -43.471 0.36 21.88 ? N PRO A-6 3 1 
ATOM 8694 N N B PRO A-6 1 3 . 55.991 32.648 -43.765 0.25 19.02 ? N PRO A-6 3 1 
ATOM 8695 N N C PRO A-6 1 3 . 56.149 32.393 -43.882 0.28 19.35 ? N PRO A-6 3 1 
ATOM 8696 C CA A PRO A-6 1 3 . 56.232 34.527 -42.688 0.36 22.47 ? CA PRO A-6 3 1 
ATOM 8697 C CA B PRO A-6 1 3 . 56.292 33.879 -43.044 0.25 18.02 ? CA PRO A-6 3 1 
ATOM 8698 C CA C PRO A-6 1 3 . 56.251 33.705 -43.24 0.28 19.53 ? CA PRO A-6 3 1 
ATOM 8699 C C A PRO A-6 1 3 . 57.713 34.855 -42.63 0.36 20.39 ? C PRO A-6 3 1 
ATOM 8700 C C B PRO A-6 1 3 . 57.649 34.457 -43.331 0.25 11.06 ? C PRO A-6 3 1 
ATOM 8701 C C C PRO A-6 1 3 . 57.603 34.377 -43.4 0.28 14.57 ? C PRO A-6 3 1 
ATOM 8702 O O A PRO A-6 1 3 . 58.066 35.755 -41.943 0.36 22.55 ? O PRO A-6 3 1 
ATOM 8703 O O B PRO A-6 1 3 . 57.783 35.632 -43.483 0.25 10.59 ? O PRO A-6 3 1 
ATOM 8704 O O C PRO A-6 1 3 . 57.74 35.594 -43.509 0.28 14.5 ? O PRO A-6 3 1 
ATOM 8705 C CB A PRO A-6 1 3 . 55.789 34.129 -41.309 0.36 23.61 ? CB PRO A-6 3 1 
ATOM 8706 C CB B PRO A-6 1 3 . 56.149 33.435 -41.561 0.25 21.61 ? CB PRO A-6 3 1 
ATOM 8707 C CB C PRO A-6 1 3 . 55.983 33.362 -41.746 0.28 22.9 ? CB PRO A-6 3 1 
ATOM 8708 C CG A PRO A-6 1 3 . 55.893 32.606 -41.306 0.36 23.1 ? CG PRO A-6 3 1 
ATOM 8709 C CG B PRO A-6 1 3 . 55.437 32.181 -41.577 0.25 22.53 ? CG PRO A-6 3 1 
ATOM 8710 C CG C PRO A-6 1 3 . 55.281 32.069 -41.754 0.28 23.91 ? CG PRO A-6 3 1 
ATOM 8711 C CD A PRO A-6 1 3 . 55.507 32.161 -42.626 0.36 21.97 ? CD PRO A-6 3 1 
ATOM 8712 C CD B PRO A-6 1 3 . 55.654 31.521 -42.859 0.25 17.71 ? CD PRO A-6 3 1 
ATOM 8713 C CD C PRO A-6 1 3 . 55.746 31.323 -42.932 0.28 20.95 ? CD PRO A-6 3 1 
ATOM 8714 N N A PHE A-6 1 4 . 58.515 34.088 -43.365 0.36 17.27 ? N PHE A-6 4 1 
ATOM 8715 N N B PHE A-6 1 4 . 58.66 33.615 -43.302 0.25 9.76 ? N PHE A-6 4 1 
ATOM 8716 N N C PHE A-6 1 4 . 58.639 33.566 -43.337 0.28 10.24 ? N PHE A-6 4 1 
ATOM 8717 C CA A PHE A-6 1 4 . 59.947 34.37 -43.473 0.36 13.99 ? CA PHE A-6 4 1 
ATOM 8718 C CA B PHE A-6 1 4 . 60.021 34.078 -43.459 0.25 9.85 ? CA PHE A-6 4 1 
ATOM 8719 C CA C PHE A-6 1 4 . 60.012 34.084 -43.461 0.28 10.21 ? CA PHE A-6 4 1 
ATOM 8720 C C A PHE A-6 1 4 . 60.293 34.903 -44.884 0.36 12.25 ? C PHE A-6 4 1 
ATOM 8721 C C B PHE A-6 1 4 . 60.222 34.843 -44.802 0.25 9.54 ? C PHE A-6 4 1 
ATOM 8722 C C C PHE A-6 1 4 . 60.259 34.834 -44.814 0.28 10.14 ? C PHE A-6 4 1 
ATOM 8723 O O A PHE A-6 1 4 . 61.111 35.81 -45.053 0.36 18.17 ? O PHE A-6 4 1 
ATOM 8724 O O B PHE A-6 1 4 . 60.843 35.886 -44.838 0.25 6.57 ? O PHE A-6 4 1 
ATOM 8725 O O C PHE A-6 1 4 . 60.962 35.863 -44.862 0.28 8.76 ? O PHE A-6 4 1 
ATOM 8726 C CB A PHE A-6 1 4 . 60.682 33.08 -43.2 0.36 15.15 ? CB PHE A-6 4 1 
ATOM 8727 C CB B PHE A-6 1 4 . 60.878 32.856 -43.311 0.25 11.01 ? CB PHE A-6 4 1 
ATOM 8728 C CB C PHE A-6 1 4 . 60.914 32.903 -43.229 0.28 11.46 ? CB PHE A-6 4 1 
ATOM 8729 C CG A PHE A-6 1 4 . 62.126 33.084 -43.668 0.36 14.46 ? CG PHE A-6 4 1 
ATOM 8730 C CG B PHE A-6 1 4 . 62.317 33.048 -43.745 0.25 10.49 ? CG PHE A-6 4 1 
ATOM 8731 C CG C PHE A-6 1 4 . 62.347 33.084 -43.733 0.28 11.5 ? CG PHE A-6 4 1 
ATOM 8732 C CD1 A PHE A-6 1 4 . 63.01 34.094 -43.277 0.36 15 ? CD1 PHE A-6 4 1 
ATOM 8733 C CD1 B PHE A-6 1 4 . 62.91 32.126 -44.625 0.25 13.65 ? CD1 PHE A-6 4 1 
ATOM 8734 C CD1 C PHE A-6 1 4 . 63.093 34.215 -43.459 0.28 13.71 ? CD1 PHE A-6 4 1 
ATOM 8735 C CD2 A PHE A-6 1 4 . 62.572 32.083 -44.551 0.36 17.16 ? CD2 PHE A-6 4 1 
ATOM 8736 C CD2 B PHE A-6 1 4 . 63.044 34.155 -43.379 0.25 8.78 ? CD2 PHE A-6 4 1 
ATOM 8737 C CD2 C PHE A-6 1 4 . 62.917 32.104 -44.564 0.28 11.9 ? CD2 PHE A-6 4 1 
ATOM 8738 C CE1 A PHE A-6 1 4 . 64.346 34.088 -43.725 0.36 16.5 ? CE1 PHE A-6 4 1 
ATOM 8739 C CE1 B PHE A-6 1 4 . 64.221 32.264 -45.051 0.25 13.74 ? CE1 PHE A-6 4 1 
ATOM 8740 C CE1 C PHE A-6 1 4 . 64.406 34.335 -43.94 0.28 13.78 ? CE1 PHE A-6 4 1 
ATOM 8741 C CE2 A PHE A-6 1 4 . 63.884 32.066 -45.006 0.36 18.34 ? CE2 PHE A-6 4 1 
ATOM 8742 C CE2 B PHE A-6 1 4 . 64.37 34.328 -43.826 0.25 9.68 ? CE2 PHE A-6 4 1 
ATOM 8743 C CE2 C PHE A-6 1 4 . 64.202 32.198 -45.021 0.28 12.79 ? CE2 PHE A-6 4 1 
ATOM 8744 C CZ A PHE A-6 1 4 . 64.774 33.087 -44.591 0.36 16.8 ? CZ PHE A-6 4 1 
ATOM 8745 C CZ B PHE A-6 1 4 . 64.918 33.379 -44.675 0.25 11.74 ? CZ PHE A-6 4 1 
ATOM 8746 C CZ C PHE A-6 1 4 . 64.916 33.337 -44.732 0.28 12.79 ? CZ PHE A-6 4 1 
ATOM 8747 N N . HIS A-6 1 5 . 59.686 34.281 -45.892 0.88 10.61 ? N HIS A-6 5 1 
ATOM 8748 C CA . HIS A-6 1 5 . 59.845 34.844 -47.24 0.88 10.48 ? CA HIS A-6 5 1 
ATOM 8749 C C . HIS A-6 1 5 . 58.787 35.867 -47.584 0.88 11.8 ? C HIS A-6 5 1 
ATOM 8750 O O . HIS A-6 1 5 . 59.038 36.766 -48.378 0.88 14.12 ? O HIS A-6 5 1 
ATOM 8751 C CB . HIS A-6 1 5 . 59.838 33.707 -48.288 0.88 11.97 ? CB HIS A-6 5 1 
ATOM 8752 C CG . HIS A-6 1 5 . 61.008 32.796 -48.153 0.88 12.95 ? CG HIS A-6 5 1 
ATOM 8753 N ND1 . HIS A-6 1 5 . 62.296 33.248 -48.344 0.88 13.88 ? ND1 HIS A-6 5 1 
ATOM 8754 C CD2 . HIS A-6 1 5 . 61.071 31.438 -47.927 0.88 13.3 ? CD2 HIS A-6 5 1 
ATOM 8755 C CE1 . HIS A-6 1 5 . 63.098 32.2 -48.238 0.88 13.77 ? CE1 HIS A-6 5 1 
ATOM 8756 N NE2 . HIS A-6 1 5 . 62.401 31.085 -47.947 0.88 15.05 ? NE2 HIS A-6 5 1 
ATOM 8757 N N A GLU A-6 1 6 . 57.608 35.778 -47.04 0.62 11.43 ? N GLU A-6 6 1 
ATOM 8758 N N B GLU A-6 1 6 . 57.593 35.723 -47.021 0.38 12.39 ? N GLU A-6 6 1 
ATOM 8759 C CA A GLU A-6 1 6 . 56.58 36.6 -47.573 0.62 15.19 ? CA GLU A-6 6 1 
ATOM 8760 C CA B GLU A-6 1 6 . 56.451 36.565 -47.367 0.38 15.6 ? CA GLU A-6 6 1 
ATOM 8761 C C A GLU A-6 1 6 . 56.243 37.806 -46.749 0.62 13.6 ? C GLU A-6 6 1 
ATOM 8762 C C B GLU A-6 1 6 . 56.429 37.889 -46.637 0.38 15.58 ? C GLU A-6 6 1 
ATOM 8763 O O A GLU A-6 1 6 . 55.772 38.638 -47.422 0.62 18.14 ? O GLU A-6 6 1 
ATOM 8764 O O B GLU A-6 1 6 . 56.013 38.876 -47.218 0.38 18.6 ? O GLU A-6 6 1 
ATOM 8765 C CB A GLU A-6 1 6 . 55.361 35.673 -47.85 0.62 18.67 ? CB GLU A-6 6 1 
ATOM 8766 C CB B GLU A-6 1 6 . 55.142 35.755 -47.028 0.38 18.73 ? CB GLU A-6 6 1 
ATOM 8767 N N A LEU A-6 1 7 . 56.606 37.902 -45.47 0.62 13.54 ? N LEU A-6 7 1 
ATOM 8768 N N B LEU A-6 1 7 . 56.875 37.909 -45.41 0.38 16.64 ? N LEU A-6 7 1 
ATOM 8769 C CA A LEU A-6 1 7 . 56.607 39.16 -44.736 0.62 13.63 ? CA LEU A-6 7 1 
ATOM 8770 C CA B LEU A-6 1 7 . 56.822 39.15 -44.68 0.38 20.47 ? CA LEU A-6 7 1 
ATOM 8771 C C A LEU A-6 1 7 . 57.805 40.033 -45.084 0.62 12.89 ? C LEU A-6 7 1 
ATOM 8772 C C B LEU A-6 1 7 . 57.995 40.018 -45.149 0.38 15.58 ? C LEU A-6 7 1 
ATOM 8773 O O A LEU A-6 1 7 . 58.841 39.571 -45.065 0.62 11.25 ? O LEU A-6 7 1 
ATOM 8774 O O B LEU A-6 1 7 . 58.991 39.465 -45.511 0.38 13.67 ? O LEU A-6 7 1 
ATOM 8775 C CB A LEU A-6 1 7 . 56.605 38.906 -43.275 0.62 18.62 ? CB LEU A-6 7 1 
ATOM 8776 C CB B LEU A-6 1 7 . 56.958 38.833 -43.203 0.38 32.14 ? CB LEU A-6 7 1 
ATOM 8777 C CG A LEU A-6 1 7 . 55.385 38.397 -42.575 0.62 39.31 ? CG LEU A-6 7 1 
ATOM 8778 C CG B LEU A-6 1 7 . 55.913 39.258 -42.173 0.38 47.02 ? CG LEU A-6 7 1 
ATOM 8779 C CD1 A LEU A-6 1 7 . 55.73 37.993 -41.156 0.62 46.43 ? CD1 LEU A-6 7 1 
ATOM 8780 C CD1 B LEU A-6 1 7 . 54.581 39.648 -42.806 0.38 52.14 ? CD1 LEU A-6 7 1 
ATOM 8781 C CD2 A LEU A-6 1 7 . 54.318 39.507 -42.576 0.62 52.8 ? CD2 LEU A-6 7 1 
ATOM 8782 C CD2 B LEU A-6 1 7 . 55.731 38.175 -41.12 0.38 56.97 ? CD2 LEU A-6 7 1 
ATOM 8783 N N A GLU A-6 1 8 . 57.637 41.349 -45.232 0.62 13.39 ? N GLU A-6 8 1 
ATOM 8784 N N B GLU A-6 1 8 . 57.845 41.353 -45.018 0.38 17.54 ? N GLU A-6 8 1 
ATOM 8785 C CA A GLU A-6 1 8 . 58.794 42.27 -45.323 0.62 14.22 ? CA GLU A-6 8 1 
ATOM 8786 C CA B GLU A-6 1 8 . 58.875 42.318 -45.441 0.38 17.23 ? CA GLU A-6 8 1 
ATOM 8787 C C A GLU A-6 1 8 . 59.605 42.328 -44.007 0.62 8.36 ? C GLU A-6 8 1 
ATOM 8788 C C B GLU A-6 1 8 . 59.533 42.703 -44.119 0.38 14.86 ? C GLU A-6 8 1 
ATOM 8789 O O A GLU A-6 1 8 . 59.079 41.974 -42.959 0.62 7.86 ? O GLU A-6 8 1 
ATOM 8790 O O B GLU A-6 1 8 . 58.835 42.824 -43.212 0.38 20.08 ? O GLU A-6 8 1 
ATOM 8791 C CB A GLU A-6 1 8 . 58.331 43.684 -45.691 0.62 18.66 ? CB GLU A-6 8 1 
ATOM 8792 C CB B GLU A-6 1 8 . 58.231 43.549 -46.105 0.38 22.1 ? CB GLU A-6 8 1 
ATOM 8793 C CG A GLU A-6 1 8 . 57.741 43.815 -47.083 0.62 22.7 ? CG GLU A-6 8 1 
ATOM 8794 C CG B GLU A-6 1 8 . 57.305 44.35 -45.246 0.38 26.07 ? CG GLU A-6 8 1 
ATOM 8795 C CD A GLU A-6 1 8 . 58.68 43.315 -48.158 0.62 24.7 ? CD GLU A-6 8 1 
ATOM 8796 C CD B GLU A-6 1 8 . 57.252 45.812 -45.688 0.38 28.27 ? CD GLU A-6 8 1 
ATOM 8797 O OE1 A GLU A-6 1 8 . 58.255 42.455 -48.957 0.62 25.67 ? OE1 GLU A-6 8 1 
ATOM 8798 O OE1 B GLU A-6 1 8 . 57.994 46.191 -46.634 0.38 29.43 ? OE1 GLU A-6 8 1 
ATOM 8799 O OE2 A GLU A-6 1 8 . 59.837 43.779 -48.205 0.62 26.17 ? OE2 GLU A-6 8 1 
ATOM 8800 O OE2 B GLU A-6 1 8 . 56.452 46.61 -45.137 0.38 29.5 ? OE2 GLU A-6 8 1 
ATOM 8801 N N . PRO A-6 1 9 . 60.84 42.852 -44.042 1 10.23 ? N PRO A-6 9 1 
ATOM 8802 C CA . PRO A-6 1 9 . 61.552 42.96 -42.735 1 9.19 ? CA PRO A-6 9 1 
ATOM 8803 C C . PRO A-6 1 9 . 60.843 43.862 -41.771 1 8.97 ? C PRO A-6 9 1 
ATOM 8804 O O . PRO A-6 1 9 . 61.05 43.693 -40.546 1 9.65 ? O PRO A-6 9 1 
ATOM 8805 C CB . PRO A-6 1 9 . 62.942 43.399 -43.139 1 10.04 ? CB PRO A-6 9 1 
ATOM 8806 C CG . PRO A-6 1 9 . 63.135 42.964 -44.545 1 11.28 ? CG PRO A-6 9 1 
ATOM 8807 C CD . PRO A-6 1 9 . 61.744 43.145 -45.163 1 12.21 ? CD PRO A-6 9 1 
ATOM 8808 N N . GLY A-6 1 10 . 60.104 44.865 -42.201 1 8.68 ? N GLY A-6 10 1 
ATOM 8809 C CA . GLY A-6 1 10 . 59.512 45.762 -41.277 1 9.71 ? CA GLY A-6 10 1 
ATOM 8810 C C . GLY A-6 1 10 . 58.717 46.831 -42.03 1 9.57 ? C GLY A-6 10 1 
ATOM 8811 O O . GLY A-6 1 10 . 58.859 47.018 -43.24 1 11.97 ? O GLY A-6 10 1 
ATOM 8812 N N . PRO A-6 1 11 . 57.931 47.618 -41.29 1 10.16 ? N PRO A-6 11 1 
ATOM 8813 C CA . PRO A-6 1 11 . 57.18 48.72 -41.878 1 12.01 ? CA PRO A-6 11 1 
ATOM 8814 C C . PRO A-6 1 11 . 57.977 49.974 -42.005 1 11.05 ? C PRO A-6 11 1 
ATOM 8815 O O . PRO A-6 1 11 . 57.589 50.863 -42.808 1 14.23 ? O PRO A-6 11 1 
ATOM 8816 C CB . PRO A-6 1 11 . 56.001 48.856 -40.934 1 12.83 ? CB PRO A-6 11 1 
ATOM 8817 C CG . PRO A-6 1 11 . 56.604 48.52 -39.605 1 12.81 ? CG PRO A-6 11 1 
ATOM 8818 C CD . PRO A-6 1 11 . 57.507 47.318 -39.892 1 11 ? CD PRO A-6 11 1 
ATOM 8819 N N . GLU A-6 1 12 . 59.041 50.146 -41.221 1 10.84 ? N GLU A-6 12 1 
ATOM 8820 C CA . GLU A-6 1 12 . 59.867 51.391 -41.311 1 11.83 ? CA GLU A-6 12 1 
ATOM 8821 C C . GLU A-6 1 12 . 61.339 51.004 -40.996 1 9.88 ? C GLU A-6 12 1 
ATOM 8822 O O . GLU A-6 1 12 . 61.918 51.437 -40.014 1 10.77 ? O GLU A-6 12 1 
ATOM 8823 C CB . GLU A-6 1 12 . 59.427 52.445 -40.328 1 13.11 ? CB GLU A-6 12 1 
ATOM 8824 C CG . GLU A-6 1 12 . 58.101 52.901 -40.343 1 21.98 ? CG GLU A-6 12 1 
ATOM 8825 C CD . GLU A-6 1 12 . 57.806 53.956 -39.254 1 25.94 ? CD GLU A-6 12 1 
ATOM 8826 O OE1 . GLU A-6 1 12 . 58.699 54.868 -38.937 1 27.73 ? OE1 GLU A-6 12 1 
ATOM 8827 O OE2 . GLU A-6 1 12 . 56.739 53.798 -38.687 1 31.25 ? OE2 GLU A-6 12 1 
ATOM 8828 N N . VAL A-6 1 13 . 61.894 50.153 -41.846 1 9.87 ? N VAL A-6 13 1 
ATOM 8829 C CA . VAL A-6 1 13 . 63.201 49.608 -41.586 1 9.74 ? CA VAL A-6 13 1 
ATOM 8830 C C . VAL A-6 1 13 . 64.223 50.693 -41.585 1 9.69 ? C VAL A-6 13 1 
ATOM 8831 O O . VAL A-6 1 13 . 64.214 51.548 -42.497 1 10.53 ? O VAL A-6 13 1 
ATOM 8832 C CB . VAL A-6 1 13 . 63.503 48.564 -42.666 1 11.11 ? CB VAL A-6 13 1 
ATOM 8833 C CG1 . VAL A-6 1 13 . 64.969 48.128 -42.676 1 13.51 ? CG1 VAL A-6 13 1 
ATOM 8834 C CG2 . VAL A-6 1 13 . 62.586 47.306 -42.546 1 13.73 ? CG2 VAL A-6 13 1 
ATOM 8835 N N . PRO A-6 1 14 . 65.201 50.683 -40.666 1 9.3 ? N PRO A-6 14 1 
ATOM 8836 C CA . PRO A-6 1 14 . 65.441 49.744 -39.576 1 9.51 ? CA PRO A-6 14 1 
ATOM 8837 C C . PRO A-6 1 14 . 64.89 50.24 -38.235 1 9.02 ? C PRO A-6 14 1 
ATOM 8838 O O . PRO A-6 1 14 . 65.132 49.558 -37.225 1 10.43 ? O PRO A-6 14 1 
ATOM 8839 C CB . PRO A-6 1 14 . 66.949 49.627 -39.556 1 9.81 ? CB PRO A-6 14 1 
ATOM 8840 C CG . PRO A-6 1 14 . 67.395 51.054 -39.835 1 10.63 ? CG PRO A-6 14 1 
ATOM 8841 C CD . PRO A-6 1 14 . 66.379 51.556 -40.9 1 9.98 ? CD PRO A-6 14 1 
ATOM 8842 N N . GLU A-6 1 15 . 64.214 51.391 -38.21 1 9.93 ? N GLU A-6 15 1 
ATOM 8843 C CA . GLU A-6 1 15 . 63.69 51.897 -36.925 1 12.14 ? CA GLU A-6 15 1 
ATOM 8844 C C . GLU A-6 1 15 . 62.539 51.116 -36.371 1 10.18 ? C GLU A-6 15 1 
ATOM 8845 O O . GLU A-6 1 15 . 62.386 51.075 -35.123 1 10.58 ? O GLU A-6 15 1 
ATOM 8846 C CB . GLU A-6 1 15 . 63.252 53.367 -37.066 1 14.92 ? CB GLU A-6 15 1 
ATOM 8847 C CG . GLU A-6 1 15 . 64.44 54.339 -37.366 1 19.13 ? CG GLU A-6 15 1 
ATOM 8848 C CD . GLU A-6 1 15 . 64.688 54.367 -38.778 1 16.96 ? CD GLU A-6 15 1 
ATOM 8849 O OE1 . GLU A-6 1 15 . 65.802 54.688 -39.062 1 21.22 ? OE1 GLU A-6 15 1 
ATOM 8850 O OE2 . GLU A-6 1 15 . 63.785 54.051 -39.518 1 20.35 ? OE2 GLU A-6 15 1 
ATOM 8851 N N . VAL A-6 1 16 . 61.716 50.501 -37.214 1 9.52 ? N VAL A-6 16 1 
ATOM 8852 C CA . VAL A-6 1 16 . 60.623 49.621 -36.812 1 9.2 ? CA VAL A-6 16 1 
ATOM 8853 C C . VAL A-6 1 16 . 60.702 48.418 -37.699 1 8.11 ? C VAL A-6 16 1 
ATOM 8854 O O . VAL A-6 1 16 . 60.655 48.567 -38.944 1 10.13 ? O VAL A-6 16 1 
ATOM 8855 C CB . VAL A-6 1 16 . 59.246 50.257 -36.889 1 11.17 ? CB VAL A-6 16 1 
ATOM 8856 C CG1 . VAL A-6 1 16 . 58.227 49.275 -36.397 1 12.09 ? CG1 VAL A-6 16 1 
ATOM 8857 C CG2 . VAL A-6 1 16 . 59.194 51.586 -36.073 1 13.96 ? CG2 VAL A-6 16 1 
ATOM 8858 N N . VAL A-6 1 17 . 60.83 47.264 -37.125 1 6.81 ? N VAL A-6 17 1 
ATOM 8859 C CA . VAL A-6 1 17 . 60.888 46.013 -37.827 1 6.7 ? CA VAL A-6 17 1 
ATOM 8860 C C . VAL A-6 1 17 . 59.726 45.134 -37.41 1 6.82 ? C VAL A-6 17 1 
ATOM 8861 O O . VAL A-6 1 17 . 59.101 45.335 -36.357 1 7.92 ? O VAL A-6 17 1 
ATOM 8862 C CB . VAL A-6 1 17 . 62.227 45.288 -37.611 1 7.7 ? CB VAL A-6 17 1 
ATOM 8863 C CG1 . VAL A-6 1 17 . 63.372 46.142 -38.198 1 9.56 ? CG1 VAL A-6 17 1 
ATOM 8864 C CG2 . VAL A-6 1 17 . 62.469 44.863 -36.203 1 8.28 ? CG2 VAL A-6 17 1 
ATOM 8865 N N . TYR A-6 1 18 . 59.471 44.084 -38.186 1 7.2 ? N TYR A-6 18 1 
ATOM 8866 C CA . TYR A-6 1 18 . 58.633 42.967 -37.736 1 7.62 ? CA TYR A-6 18 1 
ATOM 8867 C C . TYR A-6 1 18 . 59.482 41.932 -37.048 1 7.56 ? C TYR A-6 18 1 
ATOM 8868 O O . TYR A-6 1 18 . 60.536 41.486 -37.575 1 9.26 ? O TYR A-6 18 1 
ATOM 8869 C CB . TYR A-6 1 18 . 57.887 42.319 -38.887 1 8.7 ? CB TYR A-6 18 1 
ATOM 8870 C CG . TYR A-6 1 18 . 56.901 43.169 -39.52 1 9.74 ? CG TYR A-6 18 1 
ATOM 8871 C CD1 . TYR A-6 1 18 . 56.916 43.365 -40.915 1 12.56 ? CD1 TYR A-6 18 1 
ATOM 8872 C CD2 . TYR A-6 1 18 . 55.943 43.865 -38.845 1 10.23 ? CD2 TYR A-6 18 1 
ATOM 8873 C CE1 . TYR A-6 1 18 . 56.016 44.26 -41.585 1 15.07 ? CE1 TYR A-6 18 1 
ATOM 8874 C CE2 . TYR A-6 1 18 . 54.96 44.62 -39.475 1 13.52 ? CE2 TYR A-6 18 1 
ATOM 8875 C CZ . TYR A-6 1 18 . 55.006 44.831 -40.822 1 14.9 ? CZ TYR A-6 18 1 
ATOM 8876 O OH . TYR A-6 1 18 . 54.132 45.665 -41.453 1 19.53 ? OH TYR A-6 18 1 
ATOM 8877 N N . ALA A-6 1 19 . 59.046 41.522 -35.898 1 6.71 ? N ALA A-6 19 1 
ATOM 8878 C CA . ALA A-6 1 19 . 59.564 40.334 -35.237 1 6.98 ? CA ALA A-6 19 1 
ATOM 8879 C C . ALA A-6 1 19 . 58.543 39.232 -35.407 1 6.79 ? C ALA A-6 19 1 
ATOM 8880 O O . ALA A-6 1 19 . 57.384 39.392 -34.992 1 9.69 ? O ALA A-6 19 1 
ATOM 8881 C CB . ALA A-6 1 19 . 59.815 40.592 -33.788 1 7.22 ? CB ALA A-6 19 1 
ATOM 8882 N N . LEU A-6 1 20 . 58.936 38.129 -35.965 1 5.56 ? N LEU A-6 20 1 
ATOM 8883 C CA . LEU A-6 1 20 . 58.107 36.905 -36.042 1 5.58 ? CA LEU A-6 20 1 
ATOM 8884 C C . LEU A-6 1 20 . 58.586 36.044 -34.89 1 5.22 ? C LEU A-6 20 1 
ATOM 8885 O O . LEU A-6 1 20 . 59.711 35.502 -34.925 1 5.58 ? O LEU A-6 20 1 
ATOM 8886 C CB . LEU A-6 1 20 . 58.262 36.259 -37.373 1 6.33 ? CB LEU A-6 20 1 
ATOM 8887 C CG . LEU A-6 1 20 . 57.39 35.003 -37.553 1 8.44 ? CG LEU A-6 20 1 
ATOM 8888 C CD1 . LEU A-6 1 20 . 55.913 35.353 -37.58 1 9.53 ? CD1 LEU A-6 20 1 
ATOM 8889 C CD2 . LEU A-6 1 20 . 57.812 34.302 -38.832 1 15.85 ? CD2 LEU A-6 20 1 
ATOM 8890 N N . ILE A-6 1 21 . 57.774 35.924 -33.846 1 5.48 ? N ILE A-6 21 1 
ATOM 8891 C CA . ILE A-6 1 21 . 58.187 35.193 -32.649 1 5.2 ? CA ILE A-6 21 1 
ATOM 8892 C C . ILE A-6 1 21 . 58.105 33.721 -32.865 1 5.21 ? C ILE A-6 21 1 
ATOM 8893 O O . ILE A-6 1 21 . 57.118 33.195 -33.395 1 7.29 ? O ILE A-6 21 1 
ATOM 8894 C CB . ILE A-6 1 21 . 57.366 35.667 -31.423 1 5.8 ? CB ILE A-6 21 1 
ATOM 8895 C CG1 . ILE A-6 1 21 . 57.577 37.163 -31.195 1 6.59 ? CG1 ILE A-6 21 1 
ATOM 8896 C CG2 . ILE A-6 1 21 . 57.677 34.831 -30.205 1 6.11 ? CG2 ILE A-6 21 1 
ATOM 8897 C CD1 . ILE A-6 1 21 . 59.027 37.625 -31.096 1 7.65 ? CD1 ILE A-6 21 1 
ATOM 8898 N N . GLU A-6 1 22 . 59.15 33.022 -32.461 1 5.02 ? N GLU A-6 22 1 
ATOM 8899 C CA . GLU A-6 1 22 . 59.214 31.551 -32.43 1 5.03 ? CA GLU A-6 22 1 
ATOM 8900 C C . GLU A-6 1 22 . 59.011 30.99 -31.026 1 5.04 ? C GLU A-6 22 1 
ATOM 8901 O O . GLU A-6 1 22 . 58.412 29.938 -30.873 1 5.87 ? O GLU A-6 22 1 
ATOM 8902 C CB . GLU A-6 1 22 . 60.562 31.085 -33.008 1 5.37 ? CB GLU A-6 22 1 
ATOM 8903 C CG . GLU A-6 1 22 . 60.751 31.406 -34.482 1 5.95 ? CG GLU A-6 22 1 
ATOM 8904 C CD . GLU A-6 1 22 . 62.178 31.332 -34.941 1 5.27 ? CD GLU A-6 22 1 
ATOM 8905 O OE1 . GLU A-6 1 22 . 63.067 31.855 -34.22 1 5.65 ? OE1 GLU A-6 22 1 
ATOM 8906 O OE2 . GLU A-6 1 22 . 62.42 30.789 -36.058 1 6.15 ? OE2 GLU A-6 22 1 
ATOM 8907 N N . ILE A-6 1 23 . 59.584 31.659 -30.031 1 4.85 ? N ILE A-6 23 1 
ATOM 8908 C CA . ILE A-6 1 23 . 59.667 31.152 -28.673 1 4.97 ? CA ILE A-6 23 1 
ATOM 8909 C C . ILE A-6 1 23 . 59.086 32.186 -27.716 1 4.87 ? C ILE A-6 23 1 
ATOM 8910 O O . ILE A-6 1 23 . 59.671 33.256 -27.515 1 5.92 ? O ILE A-6 23 1 
ATOM 8911 C CB . ILE A-6 1 23 . 61.081 30.823 -28.215 1 5.14 ? CB ILE A-6 23 1 
ATOM 8912 C CG1 . ILE A-6 1 23 . 61.833 30.009 -29.258 1 6.35 ? CG1 ILE A-6 23 1 
ATOM 8913 C CG2 . ILE A-6 1 23 . 61.038 30.12 -26.868 1 6.16 ? CG2 ILE A-6 23 1 
ATOM 8914 C CD1 . ILE A-6 1 23 . 63.286 29.721 -28.861 1 6.53 ? CD1 ILE A-6 23 1 
ATOM 8915 N N . PRO A-6 1 24 . 57.972 31.903 -27.06 1 5.11 ? N PRO A-6 24 1 
ATOM 8916 C CA . PRO A-6 1 24 . 57.467 32.822 -26.015 1 5.7 ? CA PRO A-6 24 1 
ATOM 8917 C C . PRO A-6 1 24 . 58.427 32.844 -24.826 1 5.52 ? C PRO A-6 24 1 
ATOM 8918 O O . PRO A-6 1 24 . 58.957 31.817 -24.42 1 5.71 ? O PRO A-6 24 1 
ATOM 8919 C CB . PRO A-6 1 24 . 56.115 32.218 -25.631 1 6.68 ? CB PRO A-6 24 1 
ATOM 8920 C CG . PRO A-6 1 24 . 55.727 31.335 -26.838 1 7.48 ? CG PRO A-6 24 1 
ATOM 8921 C CD . PRO A-6 1 24 . 57.051 30.751 -27.285 1 6.62 ? CD PRO A-6 24 1 
ATOM 8922 N N . LYS A-6 1 25 . 58.576 34.015 -24.205 1 5.89 ? N LYS A-6 25 1 
ATOM 8923 C CA A LYS A-6 1 25 . 59.349 34.07 -22.991 0.44 5.63 ? CA LYS A-6 25 1 
ATOM 8924 C CA B LYS A-6 1 25 . 59.282 34.118 -22.911 0.56 5.33 ? CA LYS A-6 25 1 
ATOM 8925 C C . LYS A-6 1 25 . 58.759 33.041 -21.988 1 5.44 ? C LYS A-6 25 1 
ATOM 8926 O O . LYS A-6 1 25 . 57.55 32.868 -21.869 1 5.97 ? O LYS A-6 25 1 
ATOM 8927 C CB A LYS A-6 1 25 . 59.241 35.491 -22.41 0.44 7.25 ? CB LYS A-6 25 1 
ATOM 8928 C CB B LYS A-6 1 25 . 59.065 35.506 -22.23 0.56 7.17 ? CB LYS A-6 25 1 
ATOM 8929 C CG A LYS A-6 1 25 . 59.943 35.71 -21.059 0.44 8.32 ? CG LYS A-6 25 1 
ATOM 8930 C CG B LYS A-6 1 25 . 59.489 35.611 -20.822 0.56 6.78 ? CG LYS A-6 25 1 
ATOM 8931 C CD A LYS A-6 1 25 . 59.01 35.557 -19.867 0.44 10.38 ? CD LYS A-6 25 1 
ATOM 8932 C CD B LYS A-6 1 25 . 59.24 36.97 -20.29 0.56 7.51 ? CD LYS A-6 25 1 
ATOM 8933 C CE A LYS A-6 1 25 . 59.584 36.046 -18.576 0.44 15.53 ? CE LYS A-6 25 1 
ATOM 8934 C CE B LYS A-6 1 25 . 57.766 37.329 -20.18 0.56 10.42 ? CE LYS A-6 25 1 
ATOM 8935 N NZ A LYS A-6 1 25 . 58.548 35.856 -17.503 0.44 27.79 ? NZ LYS A-6 25 1 
ATOM 8936 N NZ B LYS A-6 1 25 . 57.399 38.598 -19.404 0.56 9.27 ? NZ LYS A-6 25 1 
ATOM 8937 N N . GLY A-6 1 26 . 59.683 32.388 -21.278 1 5.55 ? N GLY A-6 26 1 
ATOM 8938 C CA . GLY A-6 1 26 . 59.327 31.392 -20.3 1 5.49 ? CA GLY A-6 26 1 
ATOM 8939 C C . GLY A-6 1 26 . 59.416 29.964 -20.801 1 5.73 ? C GLY A-6 26 1 
ATOM 8940 O O . GLY A-6 1 26 . 59.264 29.041 -20.023 1 7.67 ? O GLY A-6 26 1 
ATOM 8941 N N . SER A-6 1 27 . 59.683 29.77 -22.09 1 5.42 ? N SER A-6 27 1 
ATOM 8942 C CA A SER A-6 1 27 . 59.771 28.436 -22.692 0.74 5.55 ? CA SER A-6 27 1 
ATOM 8943 C CA B SER A-6 1 27 . 59.764 28.446 -22.626 0.26 4.82 ? CA SER A-6 27 1 
ATOM 8944 C C . SER A-6 1 27 . 61.189 27.859 -22.52 1 4.77 ? C SER A-6 27 1 
ATOM 8945 O O . SER A-6 1 27 . 62.161 28.569 -22.706 1 5.65 ? O SER A-6 27 1 
ATOM 8946 C CB A SER A-6 1 27 . 59.542 28.516 -24.194 0.74 6.56 ? CB SER A-6 27 1 
ATOM 8947 C CB B SER A-6 1 27 . 59.313 28.487 -24.108 0.26 5.87 ? CB SER A-6 27 1 
ATOM 8948 O OG A SER A-6 1 27 . 58.263 29.168 -24.444 0.74 6.87 ? OG SER A-6 27 1 
ATOM 8949 O OG B SER A-6 1 27 . 59.536 27.274 -24.752 0.26 7.98 ? OG SER A-6 27 1 
ATOM 8950 N N . ARG A-6 1 28 . 61.238 26.568 -22.278 1 5.09 ? N ARG A-6 28 1 
ATOM 8951 C CA . ARG A-6 1 28 . 62.439 25.763 -22.372 1 5.37 ? CA ARG A-6 28 1 
ATOM 8952 C C . ARG A-6 1 28 . 62.573 25.054 -23.71 1 5.59 ? C ARG A-6 28 1 
ATOM 8953 O O . ARG A-6 1 28 . 63.662 24.595 -24.097 1 6.91 ? O ARG A-6 28 1 
ATOM 8954 C CB . ARG A-6 1 28 . 62.477 24.774 -21.225 1 6.42 ? CB ARG A-6 28 1 
ATOM 8955 C CG . ARG A-6 1 28 . 63.692 23.863 -21.2 1 6.95 ? CG ARG A-6 28 1 
ATOM 8956 C CD . ARG A-6 1 28 . 63.658 22.929 -20.031 1 7.78 ? CD ARG A-6 28 1 
ATOM 8957 N NE . ARG A-6 1 28 . 64.747 21.969 -20.115 1 6.37 ? NE ARG A-6 28 1 
ATOM 8958 C CZ . ARG A-6 1 28 . 65.141 21.217 -19.111 1 5.64 ? CZ ARG A-6 28 1 
ATOM 8959 N NH1 . ARG A-6 1 28 . 64.39 21.11 -18.016 1 7.13 ? NH1 ARG A-6 28 1 
ATOM 8960 N NH2 . ARG A-6 1 28 . 66.292 20.57 -19.193 1 5.92 ? NH2 ARG A-6 28 1 
ATOM 8961 N N . ASN A-6 1 29 . 61.487 24.911 -24.45 1 5.68 ? N ASN A-6 29 1 
ATOM 8962 C CA . ASN A-6 1 29 . 61.516 24.337 -25.797 1 6.22 ? CA ASN A-6 29 1 
ATOM 8963 C C . ASN A-6 1 29 . 62.039 25.388 -26.787 1 5.91 ? C ASN A-6 29 1 
ATOM 8964 O O . ASN A-6 1 29 . 61.524 26.485 -26.869 1 7.08 ? O ASN A-6 29 1 
ATOM 8965 C CB . ASN A-6 1 29 . 60.148 23.869 -26.211 1 5.89 ? CB ASN A-6 29 1 
ATOM 8966 C CG . ASN A-6 1 29 . 59.651 22.657 -25.45 1 6.16 ? CG ASN A-6 29 1 
ATOM 8967 O OD1 . ASN A-6 1 29 . 60.441 21.917 -24.834 1 7.04 ? OD1 ASN A-6 29 1 
ATOM 8968 N ND2 . ASN A-6 1 29 . 58.374 22.406 -25.564 1 6.83 ? ND2 ASN A-6 29 1 
ATOM 8969 N N A LYS A-6 1 30 . 63.076 24.995 -27.531 0.73 5.89 ? N LYS A-6 30 1 
ATOM 8970 N N B LYS A-6 1 30 . 63.119 25.02 -27.472 0.27 5.78 ? N LYS A-6 30 1 
ATOM 8971 C CA A LYS A-6 1 30 . 63.662 25.857 -28.554 0.73 5.88 ? CA LYS A-6 30 1 
ATOM 8972 C CA B LYS A-6 1 30 . 63.671 25.842 -28.546 0.27 5.82 ? CA LYS A-6 30 1 
ATOM 8973 C C A LYS A-6 1 30 . 62.992 25.608 -29.9 0.73 5.33 ? C LYS A-6 30 1 
ATOM 8974 C C B LYS A-6 1 30 . 62.968 25.568 -29.874 0.27 5.44 ? C LYS A-6 30 1 
ATOM 8975 O O A LYS A-6 1 30 . 63.358 24.694 -30.635 0.73 8.13 ? O LYS A-6 30 1 
ATOM 8976 O O B LYS A-6 1 30 . 63.482 24.825 -30.711 0.27 8.04 ? O LYS A-6 30 1 
ATOM 8977 C CB A LYS A-6 1 30 . 65.178 25.64 -28.647 0.73 7.06 ? CB LYS A-6 30 1 
ATOM 8978 C CB B LYS A-6 1 30 . 65.174 25.589 -28.694 0.27 7.08 ? CB LYS A-6 30 1 
ATOM 8979 C CG A LYS A-6 1 30 . 65.806 25.917 -30.024 0.73 10.97 ? CG LYS A-6 30 1 
ATOM 8980 C CG B LYS A-6 1 30 . 65.998 26.847 -28.907 0.27 9.72 ? CG LYS A-6 30 1 
ATOM 8981 C CD A LYS A-6 1 30 . 65.742 27.391 -30.403 0.73 5.69 ? CD LYS A-6 30 1 
ATOM 8982 C CD B LYS A-6 1 30 . 65.767 27.446 -30.282 0.27 8.17 ? CD LYS A-6 30 1 
ATOM 8983 C CE A LYS A-6 1 30 . 66.894 27.806 -31.32 0.73 10.85 ? CE LYS A-6 30 1 
ATOM 8984 C CE B LYS A-6 1 30 . 66.726 28.597 -30.538 0.27 9.73 ? CE LYS A-6 30 1 
ATOM 8985 N NZ A LYS A-6 1 30 . 66.724 29.182 -31.869 0.73 7.38 ? NZ LYS A-6 30 1 
ATOM 8986 N NZ B LYS A-6 1 30 . 66.548 29.191 -31.892 0.27 7.75 ? NZ LYS A-6 30 1 
ATOM 8987 N N . TYR A-6 1 31 . 61.908 26.327 -30.14 1 5.95 ? N TYR A-6 31 1 
ATOM 8988 C CA . TYR A-6 1 31 . 61.193 26.269 -31.417 1 6.3 ? CA TYR A-6 31 1 
ATOM 8989 C C . TYR A-6 1 31 . 61.913 27.106 -32.451 1 6.04 ? C TYR A-6 31 1 
ATOM 8990 O O . TYR A-6 1 31 . 62.465 28.142 -32.116 1 6.73 ? O TYR A-6 31 1 
ATOM 8991 C CB . TYR A-6 1 31 . 59.804 26.832 -31.251 1 6.66 ? CB TYR A-6 31 1 
ATOM 8992 C CG . TYR A-6 1 31 . 58.982 26.198 -30.154 1 6.12 ? CG TYR A-6 31 1 
ATOM 8993 C CD1 . TYR A-6 1 31 . 58.598 26.908 -29.034 1 6.39 ? CD1 TYR A-6 31 1 
ATOM 8994 C CD2 . TYR A-6 1 31 . 58.548 24.878 -30.256 1 7.17 ? CD2 TYR A-6 31 1 
ATOM 8995 C CE1 . TYR A-6 1 31 . 57.862 26.359 -28.027 1 6.75 ? CE1 TYR A-6 31 1 
ATOM 8996 C CE2 . TYR A-6 1 31 . 57.797 24.313 -29.252 1 7.68 ? CE2 TYR A-6 31 1 
ATOM 8997 C CZ . TYR A-6 1 31 . 57.462 25.064 -28.138 1 7.11 ? CZ TYR A-6 31 1 
ATOM 8998 O OH . TYR A-6 1 31 . 56.729 24.436 -27.148 1 8.29 ? OH TYR A-6 31 1 
ATOM 8999 N N . GLU A-6 1 32 . 61.832 26.683 -33.704 1 6.11 ? N GLU A-6 32 1 
ATOM 9000 C CA . GLU A-6 1 32 . 62.304 27.458 -34.829 1 6.34 ? CA GLU A-6 32 1 
ATOM 9001 C C . GLU A-6 1 32 . 61.298 27.319 -35.956 1 7 ? C GLU A-6 32 1 
ATOM 9002 O O . GLU A-6 1 32 . 60.681 26.292 -36.131 1 8.98 ? O GLU A-6 32 1 
ATOM 9003 C CB . GLU A-6 1 32 . 63.66 26.999 -35.356 1 7.23 ? CB GLU A-6 32 1 
ATOM 9004 C CG . GLU A-6 1 32 . 64.799 27.252 -34.359 1 7.38 ? CG GLU A-6 32 1 
ATOM 9005 C CD . GLU A-6 1 32 . 66.175 26.885 -34.87 1 7.62 ? CD GLU A-6 32 1 
ATOM 9006 O OE1 . GLU A-6 1 32 . 67.154 27.511 -34.387 1 9.9 ? OE1 GLU A-6 32 1 
ATOM 9007 O OE2 . GLU A-6 1 32 . 66.313 25.985 -35.738 1 9.21 ? OE2 GLU A-6 32 1 
ATOM 9008 N N A LEU A-6 1 33 . 61.285 28.363 -36.797 0.13 8.75 ? N LEU A-6 33 1 
ATOM 9009 N N B LEU A-6 1 33 . 61.174 28.37 -36.774 0.87 7.07 ? N LEU A-6 33 1 
ATOM 9010 C CA A LEU A-6 1 33 . 60.559 28.353 -38.068 0.13 13.4 ? CA LEU A-6 33 1 
ATOM 9011 C CA B LEU A-6 1 33 . 60.422 28.233 -38.007 0.87 8.33 ? CA LEU A-6 33 1 
ATOM 9012 C C A LEU A-6 1 33 . 61.28 27.517 -39.127 0.13 13.71 ? C LEU A-6 33 1 
ATOM 9013 C C B LEU A-6 1 33 . 61.132 27.237 -38.893 0.87 11.32 ? C LEU A-6 33 1 
ATOM 9014 O O A LEU A-6 1 33 . 62.282 27.926 -39.713 0.13 11.04 ? O LEU A-6 33 1 
ATOM 9015 O O B LEU A-6 1 33 . 62.379 27.219 -39.067 0.87 12.93 ? O LEU A-6 33 1 
ATOM 9016 C CB A LEU A-6 1 33 . 60.401 29.802 -38.554 0.13 18 ? CB LEU A-6 33 1 
ATOM 9017 C CB B LEU A-6 1 33 . 60.339 29.663 -38.671 0.87 9.47 ? CB LEU A-6 33 1 
ATOM 9018 C CG A LEU A-6 1 33 . 59.967 30.107 -39.99 0.13 24.71 ? CG LEU A-6 33 1 
ATOM 9019 C CG B LEU A-6 1 33 . 59.493 29.669 -39.951 0.87 11.47 ? CG LEU A-6 33 1 
ATOM 9020 C CD1 A LEU A-6 1 33 . 59.658 31.594 -40.103 0.13 26.72 ? CD1 LEU A-6 33 1 
ATOM 9021 C CD1 B LEU A-6 1 33 . 57.999 29.597 -39.493 0.87 15.16 ? CD1 LEU A-6 33 1 
ATOM 9022 C CD2 A LEU A-6 1 33 . 61.036 29.72 -41.007 0.13 29.05 ? CD2 LEU A-6 33 1 
ATOM 9023 C CD2 B LEU A-6 1 33 . 59.518 30.989 -40.546 0.87 16.24 ? CD2 LEU A-6 33 1 
ATOM 9024 N N A ASP A-6 1 34 . 60.734 26.343 -39.412 0.13 18.46 ? N ASP A-6 34 1 
ATOM 9025 N N B ASP A-6 1 34 . 60.31 26.342 -39.474 0.87 13.67 ? N ASP A-6 34 1 
ATOM 9026 C CA A ASP A-6 1 34 . 61.312 25.512 -40.461 0.13 23.8 ? CA ASP A-6 34 1 
ATOM 9027 C CA B ASP A-6 1 34 . 60.843 25.417 -40.495 0.87 16.96 ? CA ASP A-6 34 1 
ATOM 9028 C C A ASP A-6 1 34 . 61.372 26.317 -41.76 0.13 25.77 ? C ASP A-6 34 1 
ATOM 9029 C C B ASP A-6 1 34 . 60.996 26.203 -41.795 0.87 21.25 ? C ASP A-6 34 1 
ATOM 9030 O O A ASP A-6 1 34 . 60.416 26.969 -42.133 0.13 24.05 ? O ASP A-6 34 1 
ATOM 9031 O O B ASP A-6 1 34 . 60.016 26.545 -42.295 0.87 25.41 ? O ASP A-6 34 1 
ATOM 9032 C CB A ASP A-6 1 34 . 60.465 24.255 -40.645 0.13 26.59 ? CB ASP A-6 34 1 
ATOM 9033 C CB B ASP A-6 1 34 . 59.86 24.174 -40.592 0.87 18.99 ? CB ASP A-6 34 1 
ATOM 9034 C CG A ASP A-6 1 34 . 61.124 23.235 -41.549 0.13 25.83 ? CG ASP A-6 34 1 
ATOM 9035 C CG B ASP A-6 1 34 . 60.287 23.171 -41.659 0.87 25.66 ? CG ASP A-6 34 1 
ATOM 9036 O OD1 A ASP A-6 1 34 . 61.224 23.494 -42.771 0.13 24.87 ? OD1 ASP A-6 34 1 
ATOM 9037 O OD1 B ASP A-6 1 34 . 59.412 22.831 -42.473 0.87 27.67 ? OD1 ASP A-6 34 1 
ATOM 9038 O OD2 A ASP A-6 1 34 . 61.535 22.168 -41.049 0.13 25.29 ? OD2 ASP A-6 34 1 
ATOM 9039 O OD2 B ASP A-6 1 34 . 61.467 22.807 -41.685 0.87 30.06 ? OD2 ASP A-6 34 1 
ATOM 9040 N N A LYS A-6 1 35 . 62.512 26.275 -42.443 0.13 31.19 ? N LYS A-6 35 1 
ATOM 9041 N N B LYS A-6 1 35 . 62.213 26.326 -42.329 0.87 23.84 ? N LYS A-6 35 1 
ATOM 9042 C CA A LYS A-6 1 35 . 62.659 26.988 -43.702 0.13 38.08 ? CA LYS A-6 35 1 
ATOM 9043 C CA B LYS A-6 1 35 . 62.487 27.1 -43.513 0.87 32.14 ? CA LYS A-6 35 1 
ATOM 9044 C C A LYS A-6 1 35 . 61.867 26.286 -44.81 0.13 35.69 ? C LYS A-6 35 1 
ATOM 9045 C C B LYS A-6 1 35 . 61.732 26.415 -44.726 0.87 32.28 ? C LYS A-6 35 1 
ATOM 9046 O O A LYS A-6 1 35 . 61.286 26.936 -45.674 0.13 33.54 ? O LYS A-6 35 1 
ATOM 9047 O O B LYS A-6 1 35 . 61.081 27.083 -45.465 0.87 32.37 ? O LYS A-6 35 1 
ATOM 9048 C CB A LYS A-6 1 35 . 64.135 27.088 -44.087 0.13 48.24 ? CB LYS A-6 35 1 
ATOM 9049 C CB B LYS A-6 1 35 . 63.977 27.137 -43.829 0.87 45.29 ? CB LYS A-6 35 1 
ATOM 9050 C CG A LYS A-6 1 35 . 64.795 28.403 -43.705 0.13 56.16 ? CG LYS A-6 35 1 
ATOM 9051 C CG B LYS A-6 1 35 . 64.711 28.36 -43.314 0.87 54.48 ? CG LYS A-6 35 1 
ATOM 9052 C CD A LYS A-6 1 35 . 66.116 28.189 -42.981 0.13 62.07 ? CD LYS A-6 35 1 
ATOM 9053 C CD B LYS A-6 1 35 . 66.171 28.028 -43.115 0.87 60.05 ? CD LYS A-6 35 1 
ATOM 9054 C CE A LYS A-6 1 35 . 66.953 27.104 -43.629 0.13 67.75 ? CE LYS A-6 35 1 
ATOM 9055 C CE B LYS A-6 1 35 . 66.284 27.024 -41.998 0.87 66.06 ? CE LYS A-6 35 1 
ATOM 9056 N NZ A LYS A-6 1 35 . 68.336 27.078 -43.081 0.13 72.93 ? NZ LYS A-6 35 1 
ATOM 9057 N NZ B LYS A-6 1 35 . 67.64 26.554 -41.852 0.87 71.33 ? NZ LYS A-6 35 1 
ATOM 9058 N N A ALA A-6 1 36 . 61.841 24.957 -44.761 0.13 38.02 ? N ALA A-6 36 1 
ATOM 9059 N N B ALA A-6 1 36 . 61.745 25.081 -44.796 0.87 35.81 ? N ALA A-6 36 1 
ATOM 9060 C CA A ALA A-6 1 36 . 61.159 24.149 -45.775 0.13 41.53 ? CA ALA A-6 36 1 
ATOM 9061 C CA B ALA A-6 1 36 . 61.134 24.378 -45.964 0.87 41.15 ? CA ALA A-6 36 1 
ATOM 9062 C C A ALA A-6 1 36 . 59.712 24.567 -45.961 0.13 38.04 ? C ALA A-6 36 1 
ATOM 9063 C C B ALA A-6 1 36 . 59.674 24.625 -46.01 0.87 37.73 ? C ALA A-6 36 1 
ATOM 9064 O O A ALA A-6 1 36 . 59.282 24.899 -47.063 0.13 36.07 ? O ALA A-6 36 1 
ATOM 9065 O O B ALA A-6 1 36 . 59.122 24.804 -47.109 0.87 36.23 ? O ALA A-6 36 1 
ATOM 9066 C CB A ALA A-6 1 36 . 61.226 22.665 -45.392 0.13 48.73 ? CB ALA A-6 36 1 
ATOM 9067 C CB B ALA A-6 1 36 . 61.423 22.853 -45.888 0.87 48.66 ? CB ALA A-6 36 1 
ATOM 9068 N N . THR A-6 1 37 . 58.973 24.53 -44.862 1 39.66 ? N THR A-6 37 1 
ATOM 9069 C CA . THR A-6 1 37 . 57.534 24.682 -44.863 1 34.01 ? CA THR A-6 37 1 
ATOM 9070 C C . THR A-6 1 37 . 56.855 25.844 -44.287 1 30.32 ? C THR A-6 37 1 
ATOM 9071 O O . THR A-6 1 37 . 55.636 25.925 -44.389 1 29.69 ? O THR A-6 37 1 
ATOM 9072 C CB . THR A-6 1 37 . 56.843 23.569 -44.082 1 33.29 ? CB THR A-6 37 1 
ATOM 9073 O OG1 . THR A-6 1 37 . 57.018 23.757 -42.659 1 28.71 ? OG1 THR A-6 37 1 
ATOM 9074 C CG2 . THR A-6 1 37 . 57.324 22.153 -44.563 1 37.3 ? CG2 THR A-6 37 1 
ATOM 9075 N N . GLY A-6 1 38 . 57.479 26.619 -43.397 1 27.54 ? N GLY A-6 38 1 
ATOM 9076 C CA . GLY A-6 1 38 . 56.659 27.647 -42.754 1 30.59 ? CA GLY A-6 38 1 
ATOM 9077 C C . GLY A-6 1 38 . 56.091 27.297 -41.37 1 24.91 ? C GLY A-6 38 1 
ATOM 9078 O O . GLY A-6 1 38 . 55.532 28.14 -40.637 1 28.51 ? O GLY A-6 38 1 
ATOM 9079 N N . LEU A-6 1 39 . 56.177 26.018 -40.993 1 18.54 ? N LEU A-6 39 1 
ATOM 9080 C CA . LEU A-6 1 39 . 55.552 25.559 -39.723 1 15.79 ? CA LEU A-6 39 1 
ATOM 9081 C C . LEU A-6 1 39 . 56.526 25.752 -38.568 1 12.44 ? C LEU A-6 39 1 
ATOM 9082 O O . LEU A-6 1 39 . 57.771 25.789 -38.797 1 15.33 ? O LEU A-6 39 1 
ATOM 9083 C CB . LEU A-6 1 39 . 55.217 24.131 -39.82 1 18.53 ? CB LEU A-6 39 1 
ATOM 9084 C CG . LEU A-6 1 39 . 54.071 23.791 -40.801 1 48.12 ? CG LEU A-6 39 1 
ATOM 9085 C CD1 . LEU A-6 1 39 . 54.057 22.276 -41.07 1 64.95 ? CD1 LEU A-6 39 1 
ATOM 9086 C CD2 . LEU A-6 1 39 . 52.775 24.263 -40.268 1 67.63 ? CD2 LEU A-6 39 1 
ATOM 9087 N N . LEU A-6 1 40 . 56.049 25.818 -37.359 1 10.69 ? N LEU A-6 40 1 
ATOM 9088 C CA . LEU A-6 1 40 . 56.909 25.766 -36.174 1 8.78 ? CA LEU A-6 40 1 
ATOM 9089 C C . LEU A-6 1 40 . 57.454 24.344 -36.003 1 7.17 ? C LEU A-6 40 1 
ATOM 9090 O O . LEU A-6 1 40 . 56.715 23.39 -36.107 1 6.72 ? O LEU A-6 40 1 
ATOM 9091 C CB . LEU A-6 1 40 . 56.133 26.203 -34.936 1 9.06 ? CB LEU A-6 40 1 
ATOM 9092 C CG . LEU A-6 1 40 . 56.973 26.667 -33.753 1 9.95 ? CG LEU A-6 40 1 
ATOM 9093 C CD1 . LEU A-6 1 40 . 57.617 28.048 -34.077 1 9.81 ? CD1 LEU A-6 40 1 
ATOM 9094 C CD2 . LEU A-6 1 40 . 56.176 26.693 -32.476 1 10.28 ? CD2 LEU A-6 40 1 
ATOM 9095 N N . LYS A-6 1 41 . 58.726 24.252 -35.637 1 7.49 ? N LYS A-6 41 1 
ATOM 9096 C CA . LYS A-6 1 41 . 59.385 22.977 -35.395 1 7.14 ? CA LYS A-6 41 1 
ATOM 9097 C C . LYS A-6 1 41 . 60.111 23.056 -34.052 1 6.45 ? C LYS A-6 41 1 
ATOM 9098 O O . LYS A-6 1 41 . 60.681 24.092 -33.675 1 8.05 ? O LYS A-6 41 1 
ATOM 9099 C CB . LYS A-6 1 41 . 60.32 22.65 -36.483 1 9.51 ? CB LYS A-6 41 1 
ATOM 9100 C CG . LYS A-6 1 41 . 61 21.32 -36.398 1 15.34 ? CG LYS A-6 41 1 
ATOM 9101 C CD . LYS A-6 1 41 . 61.725 21.027 -37.724 1 48.26 ? CD LYS A-6 41 1 
ATOM 9102 C CE . LYS A-6 1 41 . 62.575 19.742 -37.642 1 80.95 ? CE LYS A-6 41 1 
ATOM 9103 N NZ . LYS A-6 1 41 . 63.141 19.398 -38.971 1 108.74 ? NZ LYS A-6 41 1 
ATOM 9104 N N . LEU A-6 1 42 . 60.13 21.951 -33.306 1 6.14 ? N LEU A-6 42 1 
ATOM 9105 C CA . LEU A-6 1 42 . 60.986 21.83 -32.156 1 6.13 ? CA LEU A-6 42 1 
ATOM 9106 C C . LEU A-6 1 42 . 62.408 21.595 -32.634 1 6.32 ? C LEU A-6 42 1 
ATOM 9107 O O . LEU A-6 1 42 . 62.716 20.527 -33.171 1 8.31 ? O LEU A-6 42 1 
ATOM 9108 C CB . LEU A-6 1 42 . 60.518 20.665 -31.276 1 6.73 ? CB LEU A-6 42 1 
ATOM 9109 C CG . LEU A-6 1 42 . 61.299 20.483 -30.013 1 7.26 ? CG LEU A-6 42 1 
ATOM 9110 C CD1 . LEU A-6 1 42 . 61.007 21.613 -28.978 1 8.59 ? CD1 LEU A-6 42 1 
ATOM 9111 C CD2 . LEU A-6 1 42 . 61.006 19.116 -29.39 1 8.3 ? CD2 LEU A-6 42 1 
ATOM 9112 N N . ASP A-6 1 43 . 63.29 22.557 -32.456 0.91 5.74 ? N ASP A-6 43 1 
ATOM 9113 C CA . ASP A-6 1 43 . 64.724 22.352 -32.772 0.91 6.25 ? CA ASP A-6 43 1 
ATOM 9114 C C . ASP A-6 1 43 . 65.366 21.488 -31.714 0.91 7.16 ? C ASP A-6 43 1 
ATOM 9115 O O . ASP A-6 1 43 . 65.981 20.445 -32.019 0.91 9.66 ? O ASP A-6 43 1 
ATOM 9116 C CB . ASP A-6 1 43 . 65.435 23.707 -32.831 0.91 8.57 ? CB ASP A-6 43 1 
ATOM 9117 C CG . ASP A-6 1 43 . 66.966 23.616 -32.931 0.91 13.17 ? CG ASP A-6 43 1 
ATOM 9118 O OD1 . ASP A-6 1 43 . 67.354 22.811 -33.821 0.91 19.08 ? OD1 ASP A-6 43 1 
ATOM 9119 O OD2 . ASP A-6 1 43 . 67.718 24.398 -32.315 0.91 13.49 ? OD2 ASP A-6 43 1 
ATOM 9120 N N A ARG A-6 1 44 . 65.195 21.852 -30.42 0.88 7.5 ? N ARG A-6 44 1 
ATOM 9121 N N B ARG A-6 1 44 . 64.868 21.722 -30.518 0.12 10.17 ? N ARG A-6 44 1 
ATOM 9122 C CA A ARG A-6 1 44 . 65.586 20.892 -29.321 0.88 9.02 ? CA ARG A-6 44 1 
ATOM 9123 C CA B ARG A-6 1 44 . 65.541 21.355 -29.293 0.12 10.27 ? CA ARG A-6 44 1 
ATOM 9124 C C A ARG A-6 1 44 . 64.954 21.489 -28.072 0.88 6.96 ? C ARG A-6 44 1 
ATOM 9125 C C B ARG A-6 1 44 . 64.507 21.017 -28.162 0.12 8.97 ? C ARG A-6 44 1 
ATOM 9126 O O A ARG A-6 1 44 . 64.277 22.488 -28.067 0.88 7.94 ? O ARG A-6 44 1 
ATOM 9127 O O B ARG A-6 1 44 . 63.328 20.86 -28.418 0.12 11 ? O ARG A-6 44 1 
ATOM 9128 C CB A ARG A-6 1 44 . 67.108 20.772 -29.096 0.88 10.81 ? CB ARG A-6 44 1 
ATOM 9129 C CB B ARG A-6 1 44 . 66.236 22.621 -28.92 0.12 12.35 ? CB ARG A-6 44 1 
ATOM 9130 C CG A ARG A-6 1 44 . 67.507 22.242 -28.824 0.88 16.06 ? CG ARG A-6 44 1 
ATOM 9131 C CG B ARG A-6 1 44 . 67.76 22.645 -29.037 0.12 15.56 ? CG ARG A-6 44 1 
ATOM 9132 C CD A ARG A-6 1 44 . 68.889 22.392 -29.039 0.88 19.5 ? CD ARG A-6 44 1 
ATOM 9133 C CD B ARG A-6 1 44 . 68.278 22.583 -30.452 0.12 17.61 ? CD ARG A-6 44 1 
ATOM 9134 N NE A ARG A-6 1 44 . 69.518 23.515 -28.291 0.88 17.14 ? NE ARG A-6 44 1 
ATOM 9135 N NE B ARG A-6 1 44 . 69.225 21.485 -30.603 0.12 17.66 ? NE ARG A-6 44 1 
ATOM 9136 C CZ A ARG A-6 1 44 . 69.691 24.754 -28.73 0.88 12.3 ? CZ ARG A-6 44 1 
ATOM 9137 C CZ B ARG A-6 1 44 . 70.034 21.31 -31.643 0.12 14.5 ? CZ ARG A-6 44 1 
ATOM 9138 N NH1 A ARG A-6 1 44 . 69.065 25.219 -29.785 0.88 14.44 ? NH1 ARG A-6 44 1 
ATOM 9139 N NH1 B ARG A-6 1 44 . 70.032 22.157 -32.659 0.12 14.11 ? NH1 ARG A-6 44 1 
ATOM 9140 N NH2 A ARG A-6 1 44 . 70.36 25.547 -27.872 0.88 13.08 ? NH2 ARG A-6 44 1 
ATOM 9141 N NH2 B ARG A-6 1 44 . 70.855 20.277 -31.648 0.12 14.3 ? NH2 ARG A-6 44 1 
ATOM 9142 N N . VAL A-6 1 45 . 65.04 20.632 -27.018 1 7.95 ? N VAL A-6 45 1 
ATOM 9143 C CA . VAL A-6 1 45 . 64.716 21.022 -25.661 1 6.98 ? CA VAL A-6 45 1 
ATOM 9144 C C . VAL A-6 1 45 . 66.022 21.467 -24.987 1 5.99 ? C VAL A-6 45 1 
ATOM 9145 O O . VAL A-6 1 45 . 67.005 20.756 -25.061 1 6.51 ? O VAL A-6 45 1 
ATOM 9146 C CB . VAL A-6 1 45 . 64.068 19.862 -24.892 1 8.01 ? CB VAL A-6 45 1 
ATOM 9147 C CG1 . VAL A-6 1 45 . 63.761 20.224 -23.461 1 8.04 ? CG1 VAL A-6 45 1 
ATOM 9148 C CG2 . VAL A-6 1 45 . 62.766 19.408 -25.624 1 8.74 ? CG2 VAL A-6 45 1 
ATOM 9149 N N . LEU A-6 1 46 . 66.045 22.641 -24.337 1 5.69 ? N LEU A-6 46 1 
ATOM 9150 C CA . LEU A-6 1 46 . 67.278 23.043 -23.692 1 5.49 ? CA LEU A-6 46 1 
ATOM 9151 C C . LEU A-6 1 46 . 67.702 21.98 -22.696 1 5.41 ? C LEU A-6 46 1 
ATOM 9152 O O . LEU A-6 1 46 . 66.877 21.401 -21.968 1 5.8 ? O LEU A-6 46 1 
ATOM 9153 C CB . LEU A-6 1 46 . 67.183 24.387 -23.007 1 6.35 ? CB LEU A-6 46 1 
ATOM 9154 C CG . LEU A-6 1 46 . 66.826 25.573 -23.889 1 6.78 ? CG LEU A-6 46 1 
ATOM 9155 C CD1 . LEU A-6 1 46 . 66.84 26.857 -23.033 1 7.51 ? CD1 LEU A-6 46 1 
ATOM 9156 C CD2 . LEU A-6 1 46 . 67.778 25.727 -25.062 1 7.52 ? CD2 LEU A-6 46 1 
ATOM 9157 N N A TYR A-6 1 47 . 69 21.823 -22.542 0.58 5.39 ? N TYR A-6 47 1 
ATOM 9158 N N B TYR A-6 1 47 . 68.978 21.637 -22.649 0.42 6.2 ? N TYR A-6 47 1 
ATOM 9159 C CA A TYR A-6 1 47 . 69.533 20.717 -21.812 0.58 5.76 ? CA TYR A-6 47 1 
ATOM 9160 C CA B TYR A-6 1 47 . 69.501 20.564 -21.713 0.42 6.19 ? CA TYR A-6 47 1 
ATOM 9161 C C A TYR A-6 1 47 . 69.618 21.046 -20.35 0.58 5.11 ? C TYR A-6 47 1 
ATOM 9162 C C B TYR A-6 1 47 . 69.374 20.956 -20.216 0.42 5.23 ? C TYR A-6 47 1 
ATOM 9163 O O A TYR A-6 1 47 . 69.893 20.17 -19.532 0.58 5.35 ? O TYR A-6 47 1 
ATOM 9164 O O B TYR A-6 1 47 . 69.465 20.118 -19.34 0.42 5.77 ? O TYR A-6 47 1 
ATOM 9165 C CB A TYR A-6 1 47 . 70.934 20.29 -22.321 0.58 5.3 ? CB TYR A-6 47 1 
ATOM 9166 C CB B TYR A-6 1 47 . 71.017 20.275 -21.977 0.42 6.51 ? CB TYR A-6 47 1 
ATOM 9167 C CG A TYR A-6 1 47 . 70.999 19.508 -23.591 0.58 5.44 ? CG TYR A-6 47 1 
ATOM 9168 C CG B TYR A-6 1 47 . 71.297 19.364 -23.163 0.42 6.61 ? CG TYR A-6 47 1 
ATOM 9169 C CD1 A TYR A-6 1 47 . 72.03 18.604 -23.76 0.58 5.84 ? CD1 TYR A-6 47 1 
ATOM 9170 C CD1 B TYR A-6 1 47 . 72.215 18.393 -23.079 0.42 7.13 ? CD1 TYR A-6 47 1 
ATOM 9171 C CD2 A TYR A-6 1 47 . 70.049 19.656 -24.626 0.58 6.24 ? CD2 TYR A-6 47 1 
ATOM 9172 C CD2 B TYR A-6 1 47 . 70.498 19.387 -24.275 0.42 8.83 ? CD2 TYR A-6 47 1 
ATOM 9173 C CE1 A TYR A-6 1 47 . 72.125 17.849 -24.879 0.58 6.41 ? CE1 TYR A-6 47 1 
ATOM 9174 C CE1 B TYR A-6 1 47 . 72.438 17.472 -24.123 0.42 10.16 ? CE1 TYR A-6 47 1 
ATOM 9175 C CE2 A TYR A-6 1 47 . 70.181 18.919 -25.782 0.58 7.02 ? CE2 TYR A-6 47 1 
ATOM 9176 C CE2 B TYR A-6 1 47 . 70.718 18.461 -25.414 0.42 9.94 ? CE2 TYR A-6 47 1 
ATOM 9177 C CZ A TYR A-6 1 47 . 71.201 17.993 -25.882 0.58 7.68 ? CZ TYR A-6 47 1 
ATOM 9178 C CZ B TYR A-6 1 47 . 71.693 17.523 -25.279 0.42 9.86 ? CZ TYR A-6 47 1 
ATOM 9179 O OH A TYR A-6 1 47 . 71.352 17.202 -26.995 0.58 10.27 ? OH TYR A-6 47 1 
ATOM 9180 O OH B TYR A-6 1 47 . 71.943 16.588 -26.256 0.42 14.03 ? OH TYR A-6 47 1 
ATOM 9181 N N . SER A-6 1 48 . 69.324 22.267 -19.972 1 5.85 ? N SER A-6 48 1 
ATOM 9182 C CA . SER A-6 1 48 . 69.344 22.812 -18.615 1 5.71 ? CA SER A-6 48 1 
ATOM 9183 C C . SER A-6 1 48 . 67.981 23.412 -18.312 1 5.4 ? C SER A-6 48 1 
ATOM 9184 O O . SER A-6 1 48 . 67.264 23.812 -19.241 1 5.44 ? O SER A-6 48 1 
ATOM 9185 C CB . SER A-6 1 48 . 70.423 23.869 -18.524 1 6.22 ? CB SER A-6 48 1 
ATOM 9186 O OG . SER A-6 1 48 . 71.663 23.284 -18.825 1 6.9 ? OG SER A-6 48 1 
ATOM 9187 N N . PRO A-6 1 49 . 67.627 23.577 -17.024 1 5.28 ? N PRO A-6 49 1 
ATOM 9188 C CA . PRO A-6 1 49 . 66.313 24.129 -16.647 1 5.38 ? CA PRO A-6 49 1 
ATOM 9189 C C . PRO A-6 1 49 . 66.355 25.649 -16.665 1 4.94 ? C PRO A-6 49 1 
ATOM 9190 O O . PRO A-6 1 49 . 66.311 26.348 -15.656 1 5.7 ? O PRO A-6 49 1 
ATOM 9191 C CB . PRO A-6 1 49 . 66.099 23.569 -15.249 1 5.93 ? CB PRO A-6 49 1 
ATOM 9192 C CG . PRO A-6 1 49 . 67.489 23.467 -14.695 1 6.3 ? CG PRO A-6 49 1 
ATOM 9193 C CD . PRO A-6 1 49 . 68.358 23.09 -15.849 1 6.46 ? CD PRO A-6 49 1 
ATOM 9194 N N . PHE A-6 1 50 . 66.526 26.159 -17.886 1 5.13 ? N PHE A-6 50 1 
ATOM 9195 C CA . PHE A-6 1 50 . 66.592 27.548 -18.209 1 5.13 ? CA PHE A-6 50 1 
ATOM 9196 C C . PHE A-6 1 50 . 65.427 27.882 -19.135 1 5.39 ? C PHE A-6 50 1 
ATOM 9197 O O . PHE A-6 1 50 . 64.925 26.987 -19.84 0.89 5.68 ? O PHE A-6 50 1 
ATOM 9198 C CB . PHE A-6 1 50 . 67.922 27.9 -18.896 1 5.97 ? CB PHE A-6 50 1 
ATOM 9199 C CG . PHE A-6 1 50 . 69.205 27.507 -18.16 1 5.75 ? CG PHE A-6 50 1 
ATOM 9200 C CD1 . PHE A-6 1 50 . 70.375 27.585 -18.867 1 6.42 ? CD1 PHE A-6 50 1 
ATOM 9201 C CD2 . PHE A-6 1 50 . 69.26 27.142 -16.828 1 5.44 ? CD2 PHE A-6 50 1 
ATOM 9202 C CE1 . PHE A-6 1 50 . 71.587 27.297 -18.248 1 6.95 ? CE1 PHE A-6 50 1 
ATOM 9203 C CE2 . PHE A-6 1 50 . 70.474 26.826 -16.223 0.94 5.48 ? CE2 PHE A-6 50 1 
ATOM 9204 C CZ . PHE A-6 1 50 . 71.657 26.917 -16.954 1 6.74 ? CZ PHE A-6 50 1 
ATOM 9205 N N . PHE A-6 1 51 . 65.009 29.135 -19.144 1 5.53 ? N PHE A-6 51 1 
ATOM 9206 C CA . PHE A-6 1 51 . 63.946 29.551 -19.989 1 5.8 ? CA PHE A-6 51 1 
ATOM 9207 C C . PHE A-6 1 51 . 64.319 30.801 -20.761 1 4.96 ? C PHE A-6 51 1 
ATOM 9208 O O . PHE A-6 1 51 . 65.075 31.635 -20.305 1 5.55 ? O PHE A-6 51 1 
ATOM 9209 C CB . PHE A-6 1 51 . 62.608 29.783 -19.232 1 7.14 ? CB PHE A-6 51 1 
ATOM 9210 C CG . PHE A-6 1 51 . 62.666 30.91 -18.166 1 7.22 ? CG PHE A-6 51 1 
ATOM 9211 C CD1 . PHE A-6 1 51 . 62.444 32.216 -18.537 1 7.41 ? CD1 PHE A-6 51 1 
ATOM 9212 C CD2 . PHE A-6 1 51 . 62.991 30.659 -16.839 1 9.04 ? CD2 PHE A-6 51 1 
ATOM 9213 C CE1 . PHE A-6 1 51 . 62.444 33.249 -17.595 1 8.62 ? CE1 PHE A-6 51 1 
ATOM 9214 C CE2 . PHE A-6 1 51 . 63.009 31.683 -15.905 1 9.33 ? CE2 PHE A-6 51 1 
ATOM 9215 C CZ . PHE A-6 1 51 . 62.729 32.962 -16.298 1 9.81 ? CZ PHE A-6 51 1 
ATOM 9216 N N . TYR A-6 1 52 . 63.764 30.924 -21.97 1 5.42 ? N TYR A-6 52 1 
ATOM 9217 C CA . TYR A-6 1 52 . 64.043 32.114 -22.753 1 5.74 ? CA TYR A-6 52 1 
ATOM 9218 C C . TYR A-6 1 52 . 63.568 33.338 -22.003 1 5.22 ? C TYR A-6 52 1 
ATOM 9219 O O . TYR A-6 1 52 . 62.387 33.413 -21.623 1 5.96 ? O TYR A-6 52 1 
ATOM 9220 C CB . TYR A-6 1 52 . 63.429 32.029 -24.161 1 5.87 ? CB TYR A-6 52 1 
ATOM 9221 C CG . TYR A-6 1 52 . 64.323 31.27 -25.091 1 5.84 ? CG TYR A-6 52 1 
ATOM 9222 C CD1 . TYR A-6 1 52 . 64.381 29.894 -25.093 1 6.03 ? CD1 TYR A-6 52 1 
ATOM 9223 C CD2 . TYR A-6 1 52 . 65.194 31.955 -25.963 1 7.15 ? CD2 TYR A-6 52 1 
ATOM 9224 C CE1 . TYR A-6 1 52 . 65.343 29.217 -25.865 1 7.03 ? CE1 TYR A-6 52 1 
ATOM 9225 C CE2 . TYR A-6 1 52 . 66.118 31.311 -26.73 1 7.62 ? CE2 TYR A-6 52 1 
ATOM 9226 C CZ . TYR A-6 1 52 . 66.194 29.958 -26.664 1 7.93 ? CZ TYR A-6 52 1 
ATOM 9227 O OH . TYR A-6 1 52 . 67.142 29.234 -27.391 1 9.99 ? OH TYR A-6 52 1 
ATOM 9228 N N . PRO A-6 1 53 . 64.416 34.352 -21.836 1 5.53 ? N PRO A-6 53 1 
ATOM 9229 C CA . PRO A-6 1 53 . 64.051 35.501 -20.984 1 5.57 ? CA PRO A-6 53 1 
ATOM 9230 C C . PRO A-6 1 53 . 63.256 36.568 -21.725 1 5.35 ? C PRO A-6 53 1 
ATOM 9231 O O . PRO A-6 1 53 . 62.876 37.582 -21.092 1 6.68 ? O PRO A-6 53 1 
ATOM 9232 C CB . PRO A-6 1 53 . 65.397 36.024 -20.504 1 6.23 ? CB PRO A-6 53 1 
ATOM 9233 C CG . PRO A-6 1 53 . 66.353 35.655 -21.624 1 6.11 ? CG PRO A-6 53 1 
ATOM 9234 C CD . PRO A-6 1 53 . 65.89 34.291 -22.071 1 6.01 ? CD PRO A-6 53 1 
ATOM 9235 N N . VAL A-6 1 54 . 63.087 36.404 -23.008 1 5.39 ? N VAL A-6 54 1 
ATOM 9236 C CA . VAL A-6 1 54 . 62.5 37.319 -23.975 1 5.44 ? CA VAL A-6 54 1 
ATOM 9237 C C . VAL A-6 1 54 . 61.639 36.52 -24.91 1 5.39 ? C VAL A-6 54 1 
ATOM 9238 O O . VAL A-6 1 54 . 61.832 35.301 -25.042 1 6.44 ? O VAL A-6 54 1 
ATOM 9239 C CB . VAL A-6 1 54 . 63.637 38.021 -24.781 1 6.82 ? CB VAL A-6 54 1 
ATOM 9240 C CG1 . VAL A-6 1 54 . 64.405 38.982 -23.877 1 9.09 ? CG1 VAL A-6 54 1 
ATOM 9241 C CG2 . VAL A-6 1 54 . 64.536 37.007 -25.46 1 8.42 ? CG2 VAL A-6 54 1 
ATOM 9242 N N . ASP A-6 1 55 . 60.709 37.168 -25.601 1 5.29 ? N ASP A-6 55 1 
ATOM 9243 C CA A ASP A-6 1 55 . 60.051 36.568 -26.751 0.78 4.96 ? CA ASP A-6 55 1 
ATOM 9244 C CA B ASP A-6 1 55 . 60.069 36.533 -26.71 0.22 6.41 ? CA ASP A-6 55 1 
ATOM 9245 C C . ASP A-6 1 55 . 61.091 36.556 -27.868 1 5.12 ? C ASP A-6 55 1 
ATOM 9246 O O . ASP A-6 1 55 . 61.703 37.6 -28.176 1 8.66 ? O ASP A-6 55 1 
ATOM 9247 C CB A ASP A-6 1 55 . 58.802 37.323 -27.152 0.78 5.2 ? CB ASP A-6 55 1 
ATOM 9248 C CB B ASP A-6 1 55 . 58.761 37.254 -26.971 0.22 9.13 ? CB ASP A-6 55 1 
ATOM 9249 C CG A ASP A-6 1 55 . 57.586 37.036 -26.253 0.78 4.81 ? CG ASP A-6 55 1 
ATOM 9250 C CG B ASP A-6 1 55 . 57.78 37.055 -25.845 0.22 11.3 ? CG ASP A-6 55 1 
ATOM 9251 O OD1 A ASP A-6 1 55 . 57.792 36.645 -25.049 0.78 5.48 ? OD1 ASP A-6 55 1 
ATOM 9252 O OD1 B ASP A-6 1 55 . 57.033 36.085 -25.874 0.22 10.07 ? OD1 ASP A-6 55 1 
ATOM 9253 O OD2 A ASP A-6 1 55 . 56.485 37.286 -26.732 0.78 7 ? OD2 ASP A-6 55 1 
ATOM 9254 O OD2 B ASP A-6 1 55 . 57.791 37.83 -24.884 0.22 12.83 ? OD2 ASP A-6 55 1 
ATOM 9255 N N . TYR A-6 1 56 . 61.34 35.431 -28.454 1 4.78 ? N TYR A-6 56 1 
ATOM 9256 C CA . TYR A-6 1 56 . 62.521 35.198 -29.28 1 4.68 ? CA TYR A-6 56 1 
ATOM 9257 C C . TYR A-6 1 56 . 62.098 34.776 -30.67 1 4.31 ? C TYR A-6 56 1 
ATOM 9258 O O . TYR A-6 1 56 . 61.252 33.884 -30.821 1 4.97 ? O TYR A-6 56 1 
ATOM 9259 C CB . TYR A-6 1 56 . 63.387 34.121 -28.611 1 4.94 ? CB TYR A-6 56 1 
ATOM 9260 C CG . TYR A-6 1 56 . 64.69 33.875 -29.251 1 4.86 ? CG TYR A-6 56 1 
ATOM 9261 C CD1 . TYR A-6 1 56 . 65.84 34.529 -28.837 1 5.72 ? CD1 TYR A-6 56 1 
ATOM 9262 C CD2 . TYR A-6 1 56 . 64.831 32.996 -30.333 1 5.33 ? CD2 TYR A-6 56 1 
ATOM 9263 C CE1 . TYR A-6 1 56 . 67.068 34.326 -29.488 1 6.02 ? CE1 TYR A-6 56 1 
ATOM 9264 C CE2 . TYR A-6 1 56 . 66.032 32.776 -30.972 1 5.41 ? CE2 TYR A-6 56 1 
ATOM 9265 C CZ . TYR A-6 1 56 . 67.162 33.476 -30.55 1 5.07 ? CZ TYR A-6 56 1 
ATOM 9266 O OH . TYR A-6 1 56 . 68.366 33.333 -31.176 1 5.73 ? OH TYR A-6 56 1 
ATOM 9267 N N . GLY A-6 1 57 . 62.684 35.368 -31.708 1 4.69 ? N GLY A-6 57 1 
ATOM 9268 C CA . GLY A-6 1 57 . 62.324 34.943 -33.058 1 5.09 ? CA GLY A-6 57 1 
ATOM 9269 C C . GLY A-6 1 57 . 63.241 35.524 -34.099 1 4.53 ? C GLY A-6 57 1 
ATOM 9270 O O . GLY A-6 1 57 . 64.461 35.606 -33.888 1 4.87 ? O GLY A-6 57 1 
ATOM 9271 N N . ILE A-6 1 58 . 62.66 35.889 -35.227 1 4.98 ? N ILE A-6 58 1 
ATOM 9272 C CA . ILE A-6 1 58 . 63.393 36.32 -36.418 1 5.03 ? CA ILE A-6 58 1 
ATOM 9273 C C . ILE A-6 1 58 . 62.823 37.598 -36.96 1 5.26 ? C ILE A-6 58 1 
ATOM 9274 O O . ILE A-6 1 58 . 61.646 37.946 -36.765 1 5.72 ? O ILE A-6 58 1 
ATOM 9275 C CB . ILE A-6 1 58 . 63.373 35.247 -37.526 1 5.51 ? CB ILE A-6 58 1 
ATOM 9276 C CG1 . ILE A-6 1 58 . 61.996 34.981 -38.097 1 7.51 ? CG1 ILE A-6 58 1 
ATOM 9277 C CG2 . ILE A-6 1 58 . 64.042 33.992 -37.014 1 6.69 ? CG2 ILE A-6 58 1 
ATOM 9278 C CD1 . ILE A-6 1 58 . 62.001 34.118 -39.331 1 10.43 ? CD1 ILE A-6 58 1 
ATOM 9279 N N . ILE A-6 1 59 . 63.652 38.284 -37.749 1 5.62 ? N ILE A-6 59 1 
ATOM 9280 C CA . ILE A-6 1 59 . 63.184 39.341 -38.643 1 5.55 ? CA ILE A-6 59 1 
ATOM 9281 C C . ILE A-6 1 59 . 62.958 38.685 -39.991 1 5.5 ? C ILE A-6 59 1 
ATOM 9282 O O . ILE A-6 1 59 . 63.862 38.028 -40.535 1 6.11 ? O ILE A-6 59 1 
ATOM 9283 C CB . ILE A-6 1 59 . 64.147 40.508 -38.717 1 5.91 ? CB ILE A-6 59 1 
ATOM 9284 C CG1 . ILE A-6 1 59 . 64.369 41.115 -37.313 1 6.79 ? CG1 ILE A-6 59 1 
ATOM 9285 C CG2 . ILE A-6 1 59 . 63.609 41.546 -39.72 1 6.66 ? CG2 ILE A-6 59 1 
ATOM 9286 C CD1 . ILE A-6 1 59 . 65.393 42.205 -37.274 1 7.69 ? CD1 ILE A-6 59 1 
ATOM 9287 N N . PRO A-6 1 60 . 61.766 38.802 -40.589 1 6.35 ? N PRO A-6 60 1 
ATOM 9288 C CA . PRO A-6 1 60 . 61.557 38.17 -41.91 1 7.24 ? CA PRO A-6 60 1 
ATOM 9289 C C . PRO A-6 1 60 . 62.482 38.765 -42.965 1 6.6 ? C PRO A-6 60 1 
ATOM 9290 O O . PRO A-6 1 60 . 62.939 39.898 -42.867 1 6.97 ? O PRO A-6 60 1 
ATOM 9291 C CB . PRO A-6 1 60 . 60.076 38.505 -42.243 1 9.61 ? CB PRO A-6 60 1 
ATOM 9292 C CG . PRO A-6 1 60 . 59.458 38.828 -40.885 1 10.49 ? CG PRO A-6 60 1 
ATOM 9293 C CD . PRO A-6 1 60 . 60.552 39.475 -40.108 1 7.12 ? CD PRO A-6 60 1 
ATOM 9294 N N . GLN A-6 1 61 . 62.741 37.955 -44.009 1 6.87 ? N GLN A-6 61 1 
ATOM 9295 C CA A GLN A-6 1 61 . 63.571 38.42 -45.143 0.64 7.58 ? CA GLN A-6 61 1 
ATOM 9296 C CA B GLN A-6 1 61 . 63.502 38.479 -45.146 0.36 7.2 ? CA GLN A-6 61 1 
ATOM 9297 C C . GLN A-6 1 61 . 64.891 38.961 -44.674 1 7 ? C GLN A-6 61 1 
ATOM 9298 O O . GLN A-6 1 61 . 65.422 39.945 -45.175 1 7.54 ? O GLN A-6 61 1 
ATOM 9299 C CB A GLN A-6 1 61 . 62.818 39.352 -46.079 0.64 7.99 ? CB GLN A-6 61 1 
ATOM 9300 C CB B GLN A-6 1 61 . 62.72 39.541 -45.955 0.36 8.22 ? CB GLN A-6 61 1 
ATOM 9301 C CG A GLN A-6 1 61 . 61.657 38.628 -46.783 0.64 9.71 ? CG GLN A-6 61 1 
ATOM 9302 C CG B GLN A-6 1 61 . 61.654 38.883 -46.817 0.36 7.81 ? CG GLN A-6 61 1 
ATOM 9303 C CD A GLN A-6 1 61 . 61.077 39.482 -47.853 0.64 11.76 ? CD GLN A-6 61 1 
ATOM 9304 C CD B GLN A-6 1 61 . 61.043 39.83 -47.798 0.36 10.2 ? CD GLN A-6 61 1 
ATOM 9305 O OE1 A GLN A-6 1 61 . 61.806 39.936 -48.752 0.64 14.59 ? OE1 GLN A-6 61 1 
ATOM 9306 O OE1 B GLN A-6 1 61 . 61.576 40.902 -48.018 0.36 11 ? OE1 GLN A-6 61 1 
ATOM 9307 N NE2 A GLN A-6 1 61 . 59.809 39.859 -47.742 0.64 13.79 ? NE2 GLN A-6 61 1 
ATOM 9308 N NE2 B GLN A-6 1 61 . 59.93 39.473 -48.377 0.36 10.17 ? NE2 GLN A-6 61 1 
ATOM 9309 N N . THR A-6 1 62 . 65.493 38.233 -43.731 1 6.69 ? N THR A-6 62 1 
ATOM 9310 C CA . THR A-6 1 62 . 66.867 38.435 -43.305 1 6.47 ? CA THR A-6 62 1 
ATOM 9311 C C . THR A-6 1 62 . 67.585 37.094 -43.369 1 6.75 ? C THR A-6 62 1 
ATOM 9312 O O . THR A-6 1 62 . 66.998 36.024 -43.382 1 7.05 ? O THR A-6 62 1 
ATOM 9313 C CB . THR A-6 1 62 . 66.984 39.024 -41.892 1 6.69 ? CB THR A-6 62 1 
ATOM 9314 O OG1 . THR A-6 1 62 . 66.54 38.085 -40.925 1 6.43 ? OG1 THR A-6 62 1 
ATOM 9315 C CG2 . THR A-6 1 62 . 66.318 40.358 -41.784 1 7.11 ? CG2 THR A-6 62 1 
ATOM 9316 N N . TRP A-6 1 63 . 68.932 37.196 -43.35 1 7.15 ? N TRP A-6 63 1 
ATOM 9317 C CA . TRP A-6 1 63 . 69.802 36.031 -43.262 1 6.75 ? CA TRP A-6 63 1 
ATOM 9318 C C . TRP A-6 1 63 . 70.996 36.41 -42.441 1 6.5 ? C TRP A-6 63 1 
ATOM 9319 O O . TRP A-6 1 63 . 71.25 37.577 -42.199 1 7.85 ? O TRP A-6 63 1 
ATOM 9320 C CB . TRP A-6 1 63 . 70.168 35.522 -44.661 1 8.04 ? CB TRP A-6 63 1 
ATOM 9321 C CG . TRP A-6 1 63 . 70.674 34.133 -44.716 1 8.78 ? CG TRP A-6 63 1 
ATOM 9322 C CD1 . TRP A-6 1 63 . 71.946 33.69 -45.036 1 10.6 ? CD1 TRP A-6 63 1 
ATOM 9323 C CD2 . TRP A-6 1 63 . 69.899 32.948 -44.473 1 9.48 ? CD2 TRP A-6 63 1 
ATOM 9324 N NE1 . TRP A-6 1 63 . 71.987 32.313 -44.966 1 11.67 ? NE1 TRP A-6 63 1 
ATOM 9325 C CE2 . TRP A-6 1 63 . 70.745 31.837 -44.666 1 10.29 ? CE2 TRP A-6 63 1 
ATOM 9326 C CE3 . TRP A-6 1 63 . 68.571 32.734 -44.124 1 10.16 ? CE3 TRP A-6 63 1 
ATOM 9327 C CZ2 . TRP A-6 1 63 . 70.28 30.528 -44.556 1 12.8 ? CZ2 TRP A-6 63 1 
ATOM 9328 C CZ3 . TRP A-6 1 63 . 68.114 31.472 -44.037 1 11.15 ? CZ3 TRP A-6 63 1 
ATOM 9329 C CH2 . TRP A-6 1 63 . 68.976 30.342 -44.27 1 12.69 ? CH2 TRP A-6 63 1 
ATOM 9330 N N . TYR A-6 1 64 . 71.744 35.432 -41.993 1 6.79 ? N TYR A-6 64 1 
ATOM 9331 C CA . TYR A-6 1 64 . 72.824 35.718 -41.039 1 7.2 ? CA TYR A-6 64 1 
ATOM 9332 C C . TYR A-6 1 64 . 73.874 34.63 -41.085 1 6.84 ? C TYR A-6 64 1 
ATOM 9333 O O . TYR A-6 1 64 . 73.708 33.576 -41.726 1 7.99 ? O TYR A-6 64 1 
ATOM 9334 C CB . TYR A-6 1 64 . 72.264 35.918 -39.618 1 6.65 ? CB TYR A-6 64 1 
ATOM 9335 C CG . TYR A-6 1 64 . 73.087 36.898 -38.848 1 6.51 ? CG TYR A-6 64 1 
ATOM 9336 C CD1 . TYR A-6 1 64 . 73.137 38.23 -39.223 1 7.3 ? CD1 TYR A-6 64 1 
ATOM 9337 C CD2 . TYR A-6 1 64 . 73.869 36.536 -37.745 1 6.84 ? CD2 TYR A-6 64 1 
ATOM 9338 C CE1 . TYR A-6 1 64 . 73.893 39.162 -38.544 1 7.15 ? CE1 TYR A-6 64 1 
ATOM 9339 C CE2 . TYR A-6 1 64 . 74.653 37.429 -37.109 1 6.98 ? CE2 TYR A-6 64 1 
ATOM 9340 C CZ . TYR A-6 1 64 . 74.628 38.762 -37.461 1 7.13 ? CZ TYR A-6 64 1 
ATOM 9341 O OH . TYR A-6 1 64 . 75.375 39.658 -36.732 1 7.61 ? OH TYR A-6 64 1 
ATOM 9342 N N . ASP A-6 1 65 . 74.962 34.869 -40.375 1 7.16 ? N ASP A-6 65 1 
ATOM 9343 C CA . ASP A-6 1 65 . 76.175 34.055 -40.479 1 7.38 ? CA ASP A-6 65 1 
ATOM 9344 C C . ASP A-6 1 65 . 75.999 32.639 -40 1 7.67 ? C ASP A-6 65 1 
ATOM 9345 O O . ASP A-6 1 65 . 76.807 31.786 -40.361 1 9.41 ? O ASP A-6 65 1 
ATOM 9346 C CB . ASP A-6 1 65 . 77.309 34.679 -39.667 1 8.1 ? CB ASP A-6 65 1 
ATOM 9347 C CG . ASP A-6 1 65 . 77.642 36.087 -40.128 1 9.92 ? CG ASP A-6 65 1 
ATOM 9348 O OD1 . ASP A-6 1 65 . 76.798 36.968 -40.086 1 11.41 ? OD1 ASP A-6 65 1 
ATOM 9349 O OD2 . ASP A-6 1 65 . 78.78 36.314 -40.509 1 18.8 ? OD2 ASP A-6 65 1 
ATOM 9350 N N . ASP A-6 1 66 . 75.004 32.374 -39.143 1 7.9 ? N ASP A-6 66 1 
ATOM 9351 C CA . ASP A-6 1 66 . 74.724 31.023 -38.685 1 7.53 ? CA ASP A-6 66 1 
ATOM 9352 C C . ASP A-6 1 66 . 73.799 30.276 -39.61 1 8.33 ? C ASP A-6 66 1 
ATOM 9353 O O . ASP A-6 1 66 . 73.339 29.172 -39.26 1 9.85 ? O ASP A-6 66 1 
ATOM 9354 C CB . ASP A-6 1 66 . 74.212 31.017 -37.252 1 7.95 ? CB ASP A-6 66 1 
ATOM 9355 C CG . ASP A-6 1 66 . 72.864 31.712 -37.073 1 6.05 ? CG ASP A-6 66 1 
ATOM 9356 O OD1 . ASP A-6 1 66 . 72.478 32.493 -37.953 1 7.24 ? OD1 ASP A-6 66 1 
ATOM 9357 O OD2 . ASP A-6 1 66 . 72.246 31.467 -35.991 1 5.76 ? OD2 ASP A-6 66 1 
ATOM 9358 N N . GLY A-6 1 67 . 73.574 30.775 -40.815 1 8.42 ? N GLY A-6 67 1 
ATOM 9359 C CA . GLY A-6 1 67 . 72.797 30 -41.762 1 9.79 ? CA GLY A-6 67 1 
ATOM 9360 C C . GLY A-6 1 67 . 71.326 29.946 -41.448 1 8.76 ? C GLY A-6 67 1 
ATOM 9361 O O . GLY A-6 1 67 . 70.679 28.897 -41.605 1 10.3 ? O GLY A-6 67 1 
ATOM 9362 N N . ASP A-6 1 68 . 70.781 31.06 -40.978 1 7.79 ? N ASP A-6 68 1 
ATOM 9363 C CA . ASP A-6 1 68 . 69.375 31.153 -40.624 1 7.88 ? CA ASP A-6 68 1 
ATOM 9364 C C . ASP A-6 1 68 . 69.04 32.648 -40.562 1 6.69 ? C ASP A-6 68 1 
ATOM 9365 O O . ASP A-6 1 68 . 69.925 33.498 -40.614 1 7.12 ? O ASP A-6 68 1 
ATOM 9366 C CB . ASP A-6 1 68 . 69.063 30.389 -39.32 1 8.23 ? CB ASP A-6 68 1 
ATOM 9367 C CG . ASP A-6 1 68 . 68.375 29.051 -39.579 1 9.4 ? CG ASP A-6 68 1 
ATOM 9368 O OD1 . ASP A-6 1 68 . 67.545 28.924 -40.496 1 10.77 ? OD1 ASP A-6 68 1 
ATOM 9369 O OD2 . ASP A-6 1 68 . 68.678 28.117 -38.775 1 11.24 ? OD2 ASP A-6 68 1 
ATOM 9370 N N . PRO A-6 1 69 . 67.74 32.972 -40.413 1 6.47 ? N PRO A-6 69 1 
ATOM 9371 C CA . PRO A-6 1 69 . 67.357 34.368 -40.323 1 6.24 ? CA PRO A-6 69 1 
ATOM 9372 C C . PRO A-6 1 69 . 67.983 35.055 -39.117 1 5.4 ? C PRO A-6 69 1 
ATOM 9373 O O . PRO A-6 1 69 . 68.296 34.425 -38.09 1 5.71 ? O PRO A-6 69 1 
ATOM 9374 C CB . PRO A-6 1 69 . 65.849 34.3 -40.233 1 7.11 ? CB PRO A-6 69 1 
ATOM 9375 C CG . PRO A-6 1 69 . 65.476 32.988 -40.888 1 8.02 ? CG PRO A-6 69 1 
ATOM 9376 C CD . PRO A-6 1 69 . 66.579 32.062 -40.465 1 7.55 ? CD PRO A-6 69 1 
ATOM 9377 N N . PHE A-6 1 70 . 68.088 36.358 -39.183 1 5.78 ? N PHE A-6 70 1 
ATOM 9378 C CA . PHE A-6 1 70 . 68.646 37.187 -38.105 1 5.49 ? CA PHE A-6 70 1 
ATOM 9379 C C . PHE A-6 1 70 . 67.7 37.163 -36.915 1 5.09 ? C PHE A-6 70 1 
ATOM 9380 O O . PHE A-6 1 70 . 66.484 37.306 -37.023 1 5.57 ? O PHE A-6 70 1 
ATOM 9381 C CB . PHE A-6 1 70 . 68.85 38.583 -38.683 1 6.16 ? CB PHE A-6 70 1 
ATOM 9382 C CG . PHE A-6 1 70 . 69.558 39.577 -37.797 1 5.66 ? CG PHE A-6 70 1 
ATOM 9383 C CD1 . PHE A-6 1 70 . 69.175 40.917 -37.82 1 6.83 ? CD1 PHE A-6 70 1 
ATOM 9384 C CD2 . PHE A-6 1 70 . 70.689 39.268 -37.057 1 6.46 ? CD2 PHE A-6 70 1 
ATOM 9385 C CE1 . PHE A-6 1 70 . 69.875 41.868 -37.109 1 7.3 ? CE1 PHE A-6 70 1 
ATOM 9386 C CE2 . PHE A-6 1 70 . 71.35 40.208 -36.313 1 6.67 ? CE2 PHE A-6 70 1 
ATOM 9387 C CZ . PHE A-6 1 70 . 70.957 41.516 -36.336 1 6.7 ? CZ PHE A-6 70 1 
ATOM 9388 N N . ASP A-6 1 71 . 68.308 37.003 -35.737 1 4.86 ? N ASP A-6 71 1 
ATOM 9389 C CA . ASP A-6 1 71 . 67.597 36.801 -34.498 0.93 4.19 ? CA ASP A-6 71 1 
ATOM 9390 C C . ASP A-6 1 71 . 67.198 38.123 -33.824 1 4.9 ? C ASP A-6 71 1 
ATOM 9391 O O . ASP A-6 1 71 . 67.972 39.078 -33.785 1 5.03 ? O ASP A-6 71 1 
ATOM 9392 C CB . ASP A-6 1 71 . 68.455 35.99 -33.518 1 5.03 ? CB ASP A-6 71 1 
ATOM 9393 C CG . ASP A-6 1 71 . 68.789 34.62 -34.033 1 4.56 ? CG ASP A-6 71 1 
ATOM 9394 O OD1 . ASP A-6 1 71 . 69.943 34.133 -33.79 1 4.86 ? OD1 ASP A-6 71 1 
ATOM 9395 O OD2 . ASP A-6 1 71 . 67.906 34.008 -34.666 1 4.97 ? OD2 ASP A-6 71 1 
ATOM 9396 N N . ILE A-6 1 72 . 65.992 38.116 -33.262 1 4.9 ? N ILE A-6 72 1 
ATOM 9397 C CA . ILE A-6 1 72 . 65.468 39.254 -32.522 1 4.73 ? CA ILE A-6 72 1 
ATOM 9398 C C . ILE A-6 1 72 . 64.826 38.788 -31.248 1 4.8 ? C ILE A-6 72 1 
ATOM 9399 O O . ILE A-6 1 72 . 64.162 37.742 -31.183 1 5.94 ? O ILE A-6 72 1 
ATOM 9400 C CB . ILE A-6 1 72 . 64.519 40.084 -33.418 1 5.17 ? CB ILE A-6 72 1 
ATOM 9401 C CG1 . ILE A-6 1 72 . 64.03 41.354 -32.691 1 5.54 ? CG1 ILE A-6 72 1 
ATOM 9402 C CG2 . ILE A-6 1 72 . 63.369 39.275 -33.954 1 5.7 ? CG2 ILE A-6 72 1 
ATOM 9403 C CD1 . ILE A-6 1 72 . 63.507 42.434 -33.648 1 6.31 ? CD1 ILE A-6 72 1 
ATOM 9404 N N . MET A-6 1 73 . 64.998 39.598 -30.233 1 4.76 ? N MET A-6 73 1 
ATOM 9405 C CA . MET A-6 1 73 . 64.509 39.411 -28.864 1 4.99 ? CA MET A-6 73 1 
ATOM 9406 C C . MET A-6 1 73 . 63.594 40.569 -28.539 1 5.58 ? C MET A-6 73 1 
ATOM 9407 O O . MET A-6 1 73 . 64.048 41.717 -28.57 1 7 ? O MET A-6 73 1 
ATOM 9408 C CB . MET A-6 1 73 . 65.707 39.405 -27.906 1 5.68 ? CB MET A-6 73 1 
ATOM 9409 C CG . MET A-6 1 73 . 66.781 38.382 -28.278 1 6.07 ? CG MET A-6 73 1 
ATOM 9410 S SD . MET A-6 1 73 . 68.122 38.226 -27.082 1 7.52 ? SD MET A-6 73 1 
ATOM 9411 C CE . MET A-6 1 73 . 68.883 39.863 -27.215 1 8.16 ? CE MET A-6 73 1 
ATOM 9412 N N . VAL A-6 1 74 . 62.321 40.298 -28.268 1 5.26 ? N VAL A-6 74 1 
ATOM 9413 C CA . VAL A-6 1 74 . 61.328 41.312 -27.974 1 5.11 ? CA VAL A-6 74 1 
ATOM 9414 C C . VAL A-6 1 74 . 60.929 41.187 -26.507 1 5.59 ? C VAL A-6 74 1 
ATOM 9415 O O . VAL A-6 1 74 . 60.579 40.114 -26.026 1 6.29 ? O VAL A-6 74 1 
ATOM 9416 C CB . VAL A-6 1 74 . 60.127 41.237 -28.874 1 5.78 ? CB VAL A-6 74 1 
ATOM 9417 C CG1 . VAL A-6 1 74 . 59.184 42.398 -28.556 1 6.92 ? CG1 VAL A-6 74 1 
ATOM 9418 C CG2 . VAL A-6 1 74 . 60.536 41.277 -30.337 1 6.87 ? CG2 VAL A-6 74 1 
ATOM 9419 N N . ILE A-6 1 75 . 60.971 42.316 -25.803 1 5.95 ? N ILE A-6 75 1 
ATOM 9420 C CA A ILE A-6 1 75 . 60.571 42.372 -24.444 0.24 6.15 ? CA ILE A-6 75 1 
ATOM 9421 C CA B ILE A-6 1 75 . 60.546 42.325 -24.393 0.76 6.32 ? CA ILE A-6 75 1 
ATOM 9422 C C . ILE A-6 1 75 . 59.018 42.523 -24.338 1 6.47 ? C ILE A-6 75 1 
ATOM 9423 O O . ILE A-6 1 75 . 58.512 43.59 -24.557 0.9 7.34 ? O ILE A-6 75 1 
ATOM 9424 C CB A ILE A-6 1 75 . 61.316 43.486 -23.734 0.24 9.65 ? CB ILE A-6 75 1 
ATOM 9425 C CB B ILE A-6 1 75 . 61.254 43.438 -23.617 0.76 6.06 ? CB ILE A-6 75 1 
ATOM 9426 C CG1 A ILE A-6 1 75 . 62.815 43.353 -24.068 0.24 8.58 ? CG1 ILE A-6 75 1 
ATOM 9427 C CG1 B ILE A-6 1 75 . 62.775 43.404 -23.798 0.76 8.44 ? CG1 ILE A-6 75 1 
ATOM 9428 C CG2 A ILE A-6 1 75 . 61.08 43.427 -22.205 0.24 14.17 ? CG2 ILE A-6 75 1 
ATOM 9429 C CG2 B ILE A-6 1 75 . 60.881 43.314 -22.146 0.76 7.07 ? CG2 ILE A-6 75 1 
ATOM 9430 C CD1 A ILE A-6 1 75 . 63.366 41.99 -23.76 0.24 8.05 ? CD1 ILE A-6 75 1 
ATOM 9431 C CD1 B ILE A-6 1 75 . 63.506 44.626 -23.198 0.76 9.61 ? CD1 ILE A-6 75 1 
ATOM 9432 N N . MET A-6 1 76 . 58.311 41.402 -24.097 1 7.14 ? N MET A-6 76 1 
ATOM 9433 C CA . MET A-6 1 76 . 56.85 41.365 -23.959 1 7.1 ? CA MET A-6 76 1 
ATOM 9434 C C . MET A-6 1 76 . 56.473 41.083 -22.483 1 7.57 ? C MET A-6 76 1 
ATOM 9435 O O . MET A-6 1 76 . 56.949 40.101 -21.929 1 9.76 ? O MET A-6 76 1 
ATOM 9436 C CB . MET A-6 1 76 . 56.17 40.342 -24.857 0.81 5.65 ? CB MET A-6 76 1 
ATOM 9437 C CG . MET A-6 1 76 . 56.194 40.692 -26.329 1 8.44 ? CG MET A-6 76 1 
ATOM 9438 S SD . MET A-6 1 76 . 55.159 42.171 -26.697 1 9.77 ? SD MET A-6 76 1 
ATOM 9439 C CE . MET A-6 1 76 . 53.532 41.533 -26.366 1 9.5 ? CE MET A-6 76 1 
ATOM 9440 N N . ARG A-6 1 77 . 55.58 41.865 -21.929 1 6.49 ? N ARG A-6 77 1 
ATOM 9441 C CA . ARG A-6 1 77 . 55.054 41.611 -20.605 1 6.33 ? CA ARG A-6 77 1 
ATOM 9442 C C . ARG A-6 1 77 . 54.23 40.33 -20.568 1 7.01 ? C ARG A-6 77 1 
ATOM 9443 O O . ARG A-6 1 77 . 54.497 39.443 -19.744 1 10.91 ? O ARG A-6 77 1 
ATOM 9444 C CB . ARG A-6 1 77 . 54.266 42.828 -20.08 1 7.12 ? CB ARG A-6 77 1 
ATOM 9445 C CG . ARG A-6 1 77 . 55.161 44.05 -19.912 1 7.08 ? CG ARG A-6 77 1 
ATOM 9446 C CD . ARG A-6 1 77 . 54.448 45.157 -19.174 1 7.8 ? CD ARG A-6 77 1 
ATOM 9447 N NE . ARG A-6 1 77 . 53.42 45.794 -19.993 1 7.04 ? NE ARG A-6 77 1 
ATOM 9448 C CZ . ARG A-6 1 77 . 52.407 46.513 -19.494 1 7.27 ? CZ ARG A-6 77 1 
ATOM 9449 N NH1 . ARG A-6 1 77 . 52.128 46.516 -18.189 1 7.82 ? NH1 ARG A-6 77 1 
ATOM 9450 N NH2 . ARG A-6 1 77 . 51.627 47.182 -20.333 1 7.52 ? NH2 ARG A-6 77 1 
ATOM 9451 N N . GLU A-6 1 78 . 53.246 40.196 -21.435 1 6.55 ? N GLU A-6 78 1 
ATOM 9452 C CA . GLU A-6 1 78 . 52.535 38.965 -21.648 1 6.08 ? CA GLU A-6 78 1 
ATOM 9453 C C . GLU A-6 1 78 . 53.16 38.311 -22.899 1 6.01 ? C GLU A-6 78 1 
ATOM 9454 O O . GLU A-6 1 78 . 53.1 38.938 -23.969 1 6.71 ? O GLU A-6 78 1 
ATOM 9455 C CB . GLU A-6 1 78 . 51.032 39.226 -21.898 1 6.87 ? CB GLU A-6 78 1 
ATOM 9456 C CG . GLU A-6 1 78 . 50.241 37.972 -22.167 1 7.07 ? CG GLU A-6 78 1 
ATOM 9457 C CD . GLU A-6 1 78 . 48.731 38.279 -22.323 1 7.94 ? CD GLU A-6 78 1 
ATOM 9458 O OE1 . GLU A-6 1 78 . 48.12 38.699 -21.355 1 8.79 ? OE1 GLU A-6 78 1 
ATOM 9459 O OE2 . GLU A-6 1 78 . 48.187 38.153 -23.436 1 8.75 ? OE2 GLU A-6 78 1 
ATOM 9460 N N . PRO A-6 1 79 . 53.746 37.15 -22.785 1 6.29 ? N PRO A-6 79 1 
ATOM 9461 C CA . PRO A-6 1 79 . 54.367 36.54 -23.986 1 7.4 ? CA PRO A-6 79 1 
ATOM 9462 C C . PRO A-6 1 79 . 53.322 36.291 -25.064 1 6.54 ? C PRO A-6 79 1 
ATOM 9463 O O . PRO A-6 1 79 . 52.166 36.028 -24.789 1 7.98 ? O PRO A-6 79 1 
ATOM 9464 C CB . PRO A-6 1 79 . 54.925 35.221 -23.444 1 9.58 ? CB PRO A-6 79 1 
ATOM 9465 C CG . PRO A-6 1 79 . 55.132 35.518 -21.961 1 11.99 ? CG PRO A-6 79 1 
ATOM 9466 C CD . PRO A-6 1 79 . 53.953 36.352 -21.582 1 9.34 ? CD PRO A-6 79 1 
ATOM 9467 N N . VAL A-6 1 80 . 53.793 36.367 -26.301 1 6.9 ? N VAL A-6 80 1 
ATOM 9468 C CA . VAL A-6 1 80 . 52.952 36.029 -27.421 1 6.39 ? CA VAL A-6 80 1 
ATOM 9469 C C . VAL A-6 1 80 . 53.022 34.572 -27.764 1 6.41 ? C VAL A-6 80 1 
ATOM 9470 O O . VAL A-6 1 80 . 53.926 33.881 -27.411 1 12.34 ? O VAL A-6 80 1 
ATOM 9471 C CB . VAL A-6 1 80 . 53.183 36.919 -28.667 1 7.07 ? CB VAL A-6 80 1 
ATOM 9472 C CG1 . VAL A-6 1 80 . 53.057 38.4 -28.32 1 7.7 ? CG1 VAL A-6 80 1 
ATOM 9473 C CG2 . VAL A-6 1 80 . 54.521 36.63 -29.374 1 7.07 ? CG2 VAL A-6 80 1 
ATOM 9474 N N . TYR A-6 1 81 . 52.131 34.114 -28.598 1 6.87 ? N TYR A-6 81 1 
ATOM 9475 C CA . TYR A-6 1 81 . 52.117 32.777 -29.123 1 6.61 ? CA TYR A-6 81 1 
ATOM 9476 C C . TYR A-6 1 81 . 53.142 32.637 -30.243 1 6.29 ? C TYR A-6 81 1 
ATOM 9477 O O . TYR A-6 1 81 . 53.389 33.622 -30.999 1 7.29 ? O TYR A-6 81 1 
ATOM 9478 C CB . TYR A-6 1 81 . 50.708 32.384 -29.62 1 6.91 ? CB TYR A-6 81 1 
ATOM 9479 C CG . TYR A-6 1 81 . 49.747 32.242 -28.507 1 6.95 ? CG TYR A-6 81 1 
ATOM 9480 C CD1 . TYR A-6 1 81 . 49.064 33.336 -27.966 1 7.61 ? CD1 TYR A-6 81 1 
ATOM 9481 C CD2 . TYR A-6 1 81 . 49.537 31.005 -27.903 1 6.69 ? CD2 TYR A-6 81 1 
ATOM 9482 C CE1 . TYR A-6 1 81 . 48.251 33.188 -26.877 1 8.61 ? CE1 TYR A-6 81 1 
ATOM 9483 C CE2 . TYR A-6 1 81 . 48.708 30.857 -26.805 1 7.91 ? CE2 TYR A-6 81 1 
ATOM 9484 C CZ . TYR A-6 1 81 . 48.075 31.988 -26.274 1 7.85 ? CZ TYR A-6 81 1 
ATOM 9485 O OH . TYR A-6 1 81 . 47.265 31.82 -25.189 1 9.9 ? OH TYR A-6 81 1 
ATOM 9486 N N . PRO A-6 1 82 . 53.7 31.461 -30.507 1 6.6 ? N PRO A-6 82 1 
ATOM 9487 C CA . PRO A-6 1 82 . 54.58 31.325 -31.663 1 6.49 ? CA PRO A-6 82 1 
ATOM 9488 C C . PRO A-6 1 82 . 53.866 31.694 -32.946 1 6.38 ? C PRO A-6 82 1 
ATOM 9489 O O . PRO A-6 1 82 . 52.663 31.459 -33.118 1 7.21 ? O PRO A-6 82 1 
ATOM 9490 C CB . PRO A-6 1 82 . 54.938 29.835 -31.657 1 8.01 ? CB PRO A-6 82 1 
ATOM 9491 C CG . PRO A-6 1 82 . 54.715 29.387 -30.23 1 8.51 ? CG PRO A-6 82 1 
ATOM 9492 C CD . PRO A-6 1 82 . 53.512 30.206 -29.763 1 7.51 ? CD PRO A-6 82 1 
ATOM 9493 N N . LEU A-6 1 83 . 54.658 32.254 -33.864 1 6.31 ? N LEU A-6 83 1 
ATOM 9494 C CA . LEU A-6 1 83 . 54.254 32.711 -35.174 1 6.74 ? CA LEU A-6 83 1 
ATOM 9495 C C . LEU A-6 1 83 . 53.422 33.97 -35.152 1 6.65 ? C LEU A-6 83 1 
ATOM 9496 O O . LEU A-6 1 83 . 52.794 34.319 -36.15 1 8.57 ? O LEU A-6 83 1 
ATOM 9497 C CB . LEU A-6 1 83 . 53.604 31.606 -36.032 1 9.23 ? CB LEU A-6 83 1 
ATOM 9498 C CG . LEU A-6 1 83 . 54.392 30.322 -36.112 1 13.43 ? CG LEU A-6 83 1 
ATOM 9499 C CD1 . LEU A-6 1 83 . 53.604 29.32 -37.035 1 19.69 ? CD1 LEU A-6 83 1 
ATOM 9500 C CD2 . LEU A-6 1 83 . 55.758 30.55 -36.603 1 16.76 ? CD2 LEU A-6 83 1 
ATOM 9501 N N . THR A-6 1 84 . 53.495 34.731 -34.046 1 6.22 ? N THR A-6 84 1 
ATOM 9502 C CA . THR A-6 1 84 . 52.858 36.042 -33.964 1 5.97 ? CA THR A-6 84 1 
ATOM 9503 C C . THR A-6 1 84 . 53.853 37.105 -34.479 1 5.51 ? C THR A-6 84 1 
ATOM 9504 O O . THR A-6 1 84 . 55.035 37.107 -34.096 1 6.08 ? O THR A-6 84 1 
ATOM 9505 C CB . THR A-6 1 84 . 52.465 36.355 -32.539 1 6.72 ? CB THR A-6 84 1 
ATOM 9506 O OG1 . THR A-6 1 84 . 51.608 35.344 -32.032 1 7.84 ? OG1 THR A-6 84 1 
ATOM 9507 C CG2 . THR A-6 1 84 . 51.725 37.679 -32.46 1 8.07 ? CG2 THR A-6 84 1 
ATOM 9508 N N . ILE A-6 1 85 . 53.333 38.047 -35.255 1 5.46 ? N ILE A-6 85 1 
ATOM 9509 C CA . ILE A-6 1 85 . 54.069 39.217 -35.704 1 5.41 ? CA ILE A-6 85 1 
ATOM 9510 C C . ILE A-6 1 85 . 53.957 40.33 -34.689 1 5.24 ? C ILE A-6 85 1 
ATOM 9511 O O . ILE A-6 1 85 . 52.852 40.683 -34.276 1 6.35 ? O ILE A-6 85 1 
ATOM 9512 C CB . ILE A-6 1 85 . 53.483 39.724 -37.028 1 7.14 ? CB ILE A-6 85 1 
ATOM 9513 C CG1 . ILE A-6 1 85 . 53.473 38.68 -38.123 1 8.97 ? CG1 ILE A-6 85 1 
ATOM 9514 C CG2 . ILE A-6 1 85 . 54.171 41.014 -37.449 1 8.84 ? CG2 ILE A-6 85 1 
ATOM 9515 C CD1 . ILE A-6 1 85 . 52.422 39.038 -39.222 1 12.02 ? CD1 ILE A-6 85 1 
ATOM 9516 N N . ILE A-6 1 86 . 55.079 40.914 -34.315 1 5.24 ? N ILE A-6 86 1 
ATOM 9517 C CA . ILE A-6 1 86 . 55.112 42.068 -33.428 1 5.71 ? CA ILE A-6 86 1 
ATOM 9518 C C . ILE A-6 1 86 . 55.833 43.21 -34.163 1 5.48 ? C ILE A-6 86 1 
ATOM 9519 O O . ILE A-6 1 86 . 56.969 43.007 -34.608 1 6.91 ? O ILE A-6 86 1 
ATOM 9520 C CB . ILE A-6 1 86 . 55.835 41.79 -32.098 1 5.78 ? CB ILE A-6 86 1 
ATOM 9521 C CG1 . ILE A-6 1 86 . 55.227 40.596 -31.364 1 6.45 ? CG1 ILE A-6 86 1 
ATOM 9522 C CG2 . ILE A-6 1 86 . 55.88 43.049 -31.217 1 6.8 ? CG2 ILE A-6 86 1 
ATOM 9523 C CD1 . ILE A-6 1 86 . 55.969 40.227 -30.108 1 6.96 ? CD1 ILE A-6 86 1 
ATOM 9524 N N . GLU A-6 1 87 . 55.261 44.394 -34.238 1 5.35 ? N GLU A-6 87 1 
ATOM 9525 C CA B GLU A-6 1 87 . 55.971 45.588 -34.665 0.52 5.91 ? CA GLU A-6 87 1 
ATOM 9526 C CA C GLU A-6 1 87 . 56.015 45.553 -34.68 0.16 4.53 ? CA GLU A-6 87 1 
ATOM 9527 C CA D GLU A-6 1 87 . 55.968 45.577 -34.683 0.32 6.15 ? CA GLU A-6 87 1 
ATOM 9528 C C . GLU A-6 1 87 . 56.899 46.025 -33.532 1 5.44 ? C GLU A-6 87 1 
ATOM 9529 O O . GLU A-6 1 87 . 56.422 46.316 -32.431 1 6.38 ? O GLU A-6 87 1 
ATOM 9530 C CB B GLU A-6 1 87 . 54.977 46.705 -34.956 0.52 6.91 ? CB GLU A-6 87 1 
ATOM 9531 C CB C GLU A-6 1 87 . 55.129 46.673 -35.221 0.16 6 ? CB GLU A-6 87 1 
ATOM 9532 C CB D GLU A-6 1 87 . 54.956 46.673 -35.058 0.32 6.84 ? CB GLU A-6 87 1 
ATOM 9533 C CG B GLU A-6 1 87 . 54.142 46.404 -36.095 0.52 8.71 ? CG GLU A-6 87 1 
ATOM 9534 C CG C GLU A-6 1 87 . 54.376 46.294 -36.477 0.16 8.87 ? CG GLU A-6 87 1 
ATOM 9535 C CG D GLU A-6 1 87 . 55.581 47.835 -35.744 0.32 6.84 ? CG GLU A-6 87 1 
ATOM 9536 C CD B GLU A-6 1 87 . 52.682 47.04 -36.004 0.52 13.19 ? CD GLU A-6 87 1 
ATOM 9537 C CD C GLU A-6 1 87 . 53.426 47.389 -36.938 0.16 11.76 ? CD GLU A-6 87 1 
ATOM 9538 C CD D GLU A-6 1 87 . 54.57 48.921 -36.189 0.32 10.09 ? CD GLU A-6 87 1 
ATOM 9539 O OE1 B GLU A-6 1 87 . 51.847 47.204 -34.91 0.52 13.17 ? OE1 GLU A-6 87 1 
ATOM 9540 O OE1 C GLU A-6 1 87 . 53.447 48.497 -36.361 0.16 14.6 ? OE1 GLU A-6 87 1 
ATOM 9541 O OE1 D GLU A-6 1 87 . 54.894 49.993 -36.67 0.32 9.99 ? OE1 GLU A-6 87 1 
ATOM 9542 O OE2 B GLU A-6 1 87 . 52.147 47.262 -37.132 0.52 17.98 ? OE2 GLU A-6 87 1 
ATOM 9543 O OE2 C GLU A-6 1 87 . 52.614 47.087 -37.86 0.16 12.42 ? OE2 GLU A-6 87 1 
ATOM 9544 O OE2 D GLU A-6 1 87 . 53.348 48.714 -36.084 0.32 16.66 ? OE2 GLU A-6 87 1 
ATOM 9545 N N . ALA A-6 1 88 . 58.187 46.052 -33.81 1 5.58 ? N ALA A-6 88 1 
ATOM 9546 C CA . ALA A-6 1 88 . 59.213 46.153 -32.753 1 6.66 ? CA ALA A-6 88 1 
ATOM 9547 C C . ALA A-6 1 88 . 60.201 47.268 -33.086 1 6.11 ? C ALA A-6 88 1 
ATOM 9548 O O . ALA A-6 1 88 . 60.623 47.447 -34.217 1 6.89 ? O ALA A-6 88 1 
ATOM 9549 C CB . ALA A-6 1 88 . 59.925 44.83 -32.631 1 8.29 ? CB ALA A-6 88 1 
ATOM 9550 N N . ARG A-6 1 89 . 60.573 47.994 -32.026 1 5.79 ? N ARG A-6 89 1 
ATOM 9551 C CA . ARG A-6 1 89 . 61.569 49.049 -32.076 1 5.79 ? CA ARG A-6 89 1 
ATOM 9552 C C . ARG A-6 1 89 . 62.893 48.52 -31.53 1 5.55 ? C ARG A-6 89 1 
ATOM 9553 O O . ARG A-6 1 89 . 63.002 48.226 -30.345 1 5.94 ? O ARG A-6 89 1 
ATOM 9554 C CB . ARG A-6 1 89 . 61.111 50.262 -31.199 1 6.92 ? CB ARG A-6 89 1 
ATOM 9555 C CG . ARG A-6 1 89 . 62.165 51.285 -30.988 1 8.75 ? CG ARG A-6 89 1 
ATOM 9556 C CD . ARG A-6 1 89 . 61.654 52.576 -30.339 1 10.31 ? CD ARG A-6 89 1 
ATOM 9557 N NE . ARG A-6 1 89 . 61.079 52.388 -28.949 1 9.21 ? NE ARG A-6 89 1 
ATOM 9558 C CZ . ARG A-6 1 89 . 59.761 52.345 -28.707 1 8.44 ? CZ ARG A-6 89 1 
ATOM 9559 N NH1 . ARG A-6 1 89 . 59.343 52.262 -27.479 1 9.12 ? NH1 ARG A-6 89 1 
ATOM 9560 N NH2 . ARG A-6 1 89 . 58.876 52.362 -29.712 1 10.1 ? NH2 ARG A-6 89 1 
ATOM 9561 N N . PRO A-6 1 90 . 63.913 48.405 -32.392 1 5.88 ? N PRO A-6 90 1 
ATOM 9562 C CA . PRO A-6 1 90 . 65.256 48.014 -31.917 1 6.06 ? CA PRO A-6 90 1 
ATOM 9563 C C . PRO A-6 1 90 . 65.79 49.063 -30.94 1 6.19 ? C PRO A-6 90 1 
ATOM 9564 O O . PRO A-6 1 90 . 65.751 50.253 -31.251 1 7.13 ? O PRO A-6 90 1 
ATOM 9565 C CB . PRO A-6 1 90 . 66.086 47.97 -33.208 1 6.57 ? CB PRO A-6 90 1 
ATOM 9566 C CG . PRO A-6 1 90 . 65.07 47.677 -34.287 1 7.36 ? CG PRO A-6 90 1 
ATOM 9567 C CD . PRO A-6 1 90 . 63.874 48.507 -33.862 1 7.96 ? CD PRO A-6 90 1 
ATOM 9568 N N . ILE A-6 1 91 . 66.338 48.573 -29.811 1 5.57 ? N ILE A-6 91 1 
ATOM 9569 C CA . ILE A-6 1 91 . 66.971 49.442 -28.824 1 6.35 ? CA ILE A-6 91 1 
ATOM 9570 C C . ILE A-6 1 91 . 68.399 49.063 -28.549 1 6.38 ? C ILE A-6 91 1 
ATOM 9571 O O . ILE A-6 1 91 . 69.087 49.809 -27.847 1 8.22 ? O ILE A-6 91 1 
ATOM 9572 C CB . ILE A-6 1 91 . 66.143 49.538 -27.515 1 6.85 ? CB ILE A-6 91 1 
ATOM 9573 C CG1 . ILE A-6 1 91 . 66.076 48.206 -26.774 1 7.48 ? CG1 ILE A-6 91 1 
ATOM 9574 C CG2 . ILE A-6 1 91 . 64.788 50.141 -27.83 1 7.64 ? CG2 ILE A-6 91 1 
ATOM 9575 C CD1 . ILE A-6 1 91 . 65.496 48.3 -25.4 1 8.92 ? CD1 ILE A-6 91 1 
ATOM 9576 N N . GLY A-6 1 92 . 68.904 47.93 -29.065 1 6.35 ? N GLY A-6 92 1 
ATOM 9577 C CA . GLY A-6 1 92 . 70.258 47.525 -28.788 1 6.45 ? CA GLY A-6 92 1 
ATOM 9578 C C . GLY A-6 1 92 . 70.486 46.172 -29.423 1 5.48 ? C GLY A-6 92 1 
ATOM 9579 O O . GLY A-6 1 92 . 69.616 45.636 -30.119 1 5.73 ? O GLY A-6 92 1 
ATOM 9580 N N . ILE A-6 1 93 . 71.665 45.615 -29.186 1 6.02 ? N ILE A-6 93 1 
ATOM 9581 C CA . ILE A-6 1 93 . 72.041 44.353 -29.831 1 5.79 ? CA ILE A-6 93 1 
ATOM 9582 C C . ILE A-6 1 93 . 72.999 43.593 -28.934 1 5.52 ? C ILE A-6 93 1 
ATOM 9583 O O . ILE A-6 1 93 . 73.982 44.147 -28.406 1 6.71 ? O ILE A-6 93 1 
ATOM 9584 C CB . ILE A-6 1 93 . 72.591 44.6 -31.265 1 6.21 ? CB ILE A-6 93 1 
ATOM 9585 C CG1 . ILE A-6 1 93 . 72.879 43.279 -31.987 1 6.27 ? CG1 ILE A-6 93 1 
ATOM 9586 C CG2 . ILE A-6 1 93 . 73.801 45.554 -31.295 1 7.06 ? CG2 ILE A-6 93 1 
ATOM 9587 C CD1 . ILE A-6 1 93 . 72.826 43.439 -33.488 1 7.5 ? CD1 ILE A-6 93 1 
ATOM 9588 N N . MET A-6 1 94 . 72.754 42.305 -28.744 1 5.89 ? N MET A-6 94 1 
ATOM 9589 C CA . MET A-6 1 94 . 73.626 41.424 -28.001 1 5.75 ? CA MET A-6 94 1 
ATOM 9590 C C . MET A-6 1 94 . 74.661 40.843 -28.97 1 5.75 ? C MET A-6 94 1 
ATOM 9591 O O . MET A-6 1 94 . 74.318 40.233 -29.976 1 6.5 ? O MET A-6 94 1 
ATOM 9592 C CB . MET A-6 1 94 . 72.82 40.28 -27.379 1 6.27 ? CB MET A-6 94 1 
ATOM 9593 C CG . MET A-6 1 94 . 73.64 39.394 -26.541 1 7.85 ? CG MET A-6 94 1 
ATOM 9594 S SD . MET A-6 1 94 . 72.725 38.008 -25.823 1 8.32 ? SD MET A-6 94 1 
ATOM 9595 C CE . MET A-6 1 94 . 72.304 37.14 -27.342 1 8.11 ? CE MET A-6 94 1 
ATOM 9596 N N . LYS A-6 1 95 . 75.928 41.018 -28.615 1 5.93 ? N LYS A-6 95 1 
ATOM 9597 C CA . LYS A-6 1 95 . 77.038 40.567 -29.484 1 6.61 ? CA LYS A-6 95 1 
ATOM 9598 C C . LYS A-6 1 95 . 77.43 39.187 -29.012 1 6.55 ? C LYS A-6 95 1 
ATOM 9599 O O . LYS A-6 1 95 . 78.074 39.002 -27.981 1 11.84 ? O LYS A-6 95 1 
ATOM 9600 C CB . LYS A-6 1 95 . 78.192 41.561 -29.349 1 7.48 ? CB LYS A-6 95 1 
ATOM 9601 C CG . LYS A-6 1 95 . 77.83 42.96 -29.785 1 8.92 ? CG LYS A-6 95 1 
ATOM 9602 C CD . LYS A-6 1 95 . 78.976 43.915 -29.662 1 10.99 ? CD LYS A-6 95 1 
ATOM 9603 C CE . LYS A-6 1 95 . 78.546 45.305 -30.219 1 13.89 ? CE LYS A-6 95 1 
ATOM 9604 N NZ . LYS A-6 1 95 . 79.596 46.301 -30.154 1 16.81 ? NZ LYS A-6 95 1 
ATOM 9605 N N . MET A-6 1 96 . 76.984 38.183 -29.747 1 7.44 ? N MET A-6 96 1 
ATOM 9606 C CA . MET A-6 1 96 . 77.167 36.755 -29.449 1 7.88 ? CA MET A-6 96 1 
ATOM 9607 C C . MET A-6 1 96 . 77.839 36.057 -30.63 1 6.52 ? C MET A-6 96 1 
ATOM 9608 O O . MET A-6 1 96 . 77.415 36.236 -31.759 1 7.33 ? O MET A-6 96 1 
ATOM 9609 C CB . MET A-6 1 96 . 75.75 36.077 -29.22 1 6.95 ? CB MET A-6 96 1 
ATOM 9610 C CG . MET A-6 1 96 . 75.898 34.576 -28.974 1 7.55 ? CG MET A-6 96 1 
ATOM 9611 S SD . MET A-6 1 96 . 74.282 33.888 -28.638 1 8.41 ? SD MET A-6 96 1 
ATOM 9612 C CE . MET A-6 1 96 . 74.725 32.252 -28.102 1 8.51 ? CE MET A-6 96 1 
ATOM 9613 N N A GLU A-6 1 97 . 78.789 35.221 -30.281 0.51 6.35 ? N GLU A-6 97 1 
ATOM 9614 N N B GLU A-6 1 97 . 78.773 35.137 -30.363 0.49 6.46 ? N GLU A-6 97 1 
ATOM 9615 C CA A GLU A-6 1 97 . 79.254 34.199 -31.155 0.51 6.89 ? CA GLU A-6 97 1 
ATOM 9616 C CA B GLU A-6 1 97 . 79.307 34.151 -31.296 0.49 6.58 ? CA GLU A-6 97 1 
ATOM 9617 C C A GLU A-6 1 97 . 78.687 32.856 -30.667 0.51 6.23 ? C GLU A-6 97 1 
ATOM 9618 C C B GLU A-6 1 97 . 78.857 32.805 -30.765 0.49 6.42 ? C GLU A-6 97 1 
ATOM 9619 O O A GLU A-6 1 97 . 78.667 32.587 -29.476 0.51 6.9 ? O GLU A-6 97 1 
ATOM 9620 O O B GLU A-6 1 97 . 79.122 32.444 -29.626 0.49 7.9 ? O GLU A-6 97 1 
ATOM 9621 C CB A GLU A-6 1 97 . 80.779 34.206 -31.169 0.51 10.65 ? CB GLU A-6 97 1 
ATOM 9622 C CB B GLU A-6 1 97 . 80.85 34.18 -31.278 0.49 7.89 ? CB GLU A-6 97 1 
ATOM 9623 C CG A GLU A-6 1 97 . 81.392 33.454 -32.401 0.51 10.77 ? CG GLU A-6 97 1 
ATOM 9624 C CG B GLU A-6 1 97 . 81.432 35.347 -31.767 0.49 12.45 ? CG GLU A-6 97 1 
ATOM 9625 C CD A GLU A-6 1 97 . 82.837 33.471 -32.53 0.51 15.18 ? CD GLU A-6 97 1 
ATOM 9626 C CD B GLU A-6 1 97 . 81.636 35.337 -33.197 0.49 14.09 ? CD GLU A-6 97 1 
ATOM 9627 O OE1 A GLU A-6 1 97 . 83.348 34.449 -33.144 0.51 18.96 ? OE1 GLU A-6 97 1 
ATOM 9628 O OE1 B GLU A-6 1 97 . 82.036 34.29 -33.752 0.49 17.04 ? OE1 GLU A-6 97 1 
ATOM 9629 O OE2 A GLU A-6 1 97 . 83.489 32.432 -32.211 0.51 18.85 ? OE2 GLU A-6 97 1 
ATOM 9630 O OE2 B GLU A-6 1 97 . 81.431 36.417 -33.907 0.49 12.3 ? OE2 GLU A-6 97 1 
ATOM 9631 N N . ASP A-6 1 98 . 78.19 32.059 -31.613 1 5.71 ? N ASP A-6 98 1 
ATOM 9632 C CA . ASP A-6 1 98 . 77.52 30.809 -31.26 1 5.81 ? CA ASP A-6 98 1 
ATOM 9633 C C . ASP A-6 1 98 . 78.15 29.688 -32.073 1 5.82 ? C ASP A-6 98 1 
ATOM 9634 O O . ASP A-6 1 98 . 78.004 29.681 -33.294 1 6.32 ? O ASP A-6 98 1 
ATOM 9635 C CB . ASP A-6 1 98 . 76.027 30.921 -31.552 1 6.38 ? CB ASP A-6 98 1 
ATOM 9636 C CG . ASP A-6 1 98 . 75.213 29.745 -31.12 1 6.82 ? CG ASP A-6 98 1 
ATOM 9637 O OD1 . ASP A-6 1 98 . 75.811 28.803 -30.533 1 12.86 ? OD1 ASP A-6 98 1 
ATOM 9638 O OD2 . ASP A-6 1 98 . 74.002 29.682 -31.339 1 6.32 ? OD2 ASP A-6 98 1 
ATOM 9639 N N . SER A-6 1 99 . 78.884 28.805 -31.438 1 6.27 ? N SER A-6 99 1 
ATOM 9640 C CA . SER A-6 1 99 . 79.514 27.675 -32.139 1 7.62 ? CA SER A-6 99 1 
ATOM 9641 C C . SER A-6 1 99 . 80.404 28.166 -33.273 1 6.9 ? C SER A-6 99 1 
ATOM 9642 O O . SER A-6 1 99 . 80.555 27.495 -34.297 1 8.04 ? O SER A-6 99 1 
ATOM 9643 C CB . SER A-6 1 99 . 78.415 26.694 -32.618 1 10.18 ? CB SER A-6 99 1 
ATOM 9644 O OG . SER A-6 1 99 . 77.636 26.224 -31.543 1 12.09 ? OG SER A-6 99 1 
ATOM 9645 N N . GLY A-6 1 100 . 81.047 29.315 -33.082 1 6.27 ? N GLY A-6 100 1 
ATOM 9646 C CA . GLY A-6 1 100 . 81.939 29.86 -34.083 1 7.13 ? CA GLY A-6 100 1 
ATOM 9647 C C . GLY A-6 1 100 . 81.317 30.807 -35.09 1 6.42 ? C GLY A-6 100 1 
ATOM 9648 O O . GLY A-6 1 100 . 82.067 31.409 -35.863 1 8.24 ? O GLY A-6 100 1 
ATOM 9649 N N . ASP A-6 1 101 . 80.007 30.953 -35.114 1 6.03 ? N ASP A-6 101 1 
ATOM 9650 C CA . ASP A-6 1 101 . 79.334 31.85 -36.034 1 6.22 ? CA ASP A-6 101 1 
ATOM 9651 C C . ASP A-6 1 101 . 78.958 33.144 -35.336 1 6.02 ? C ASP A-6 101 1 
ATOM 9652 O O . ASP A-6 1 101 . 78.399 33.15 -34.231 1 6.38 ? O ASP A-6 101 1 
ATOM 9653 C CB . ASP A-6 1 101 . 78.038 31.238 -36.555 1 7.2 ? CB ASP A-6 101 1 
ATOM 9654 C CG . ASP A-6 1 101 . 78.196 29.969 -37.297 1 8.76 ? CG ASP A-6 101 1 
ATOM 9655 O OD1 . ASP A-6 1 101 . 79.197 29.832 -38.031 1 9.13 ? OD1 ASP A-6 101 1 
ATOM 9656 O OD2 . ASP A-6 1 101 . 77.231 29.138 -37.17 1 10.67 ? OD2 ASP A-6 101 1 
ATOM 9657 N N . LYS A-6 1 102 . 79.122 34.259 -36.04 1 6.36 ? N LYS A-6 102 1 
ATOM 9658 C CA . LYS A-6 1 102 . 78.486 35.493 -35.586 1 6.02 ? CA LYS A-6 102 1 
ATOM 9659 C C . LYS A-6 1 102 . 76.98 35.198 -35.492 1 5.48 ? C LYS A-6 102 1 
ATOM 9660 O O . LYS A-6 1 102 . 76.381 34.616 -36.394 1 6.08 ? O LYS A-6 102 1 
ATOM 9661 C CB . LYS A-6 1 102 . 78.749 36.623 -36.575 1 6.86 ? CB LYS A-6 102 1 
ATOM 9662 C CG . LYS A-6 1 102 . 78.539 37.992 -36.002 1 6.63 ? CG LYS A-6 102 1 
ATOM 9663 C CD . LYS A-6 1 102 . 78.699 39.111 -37.031 1 7.89 ? CD LYS A-6 102 1 
ATOM 9664 C CE . LYS A-6 1 102 . 78.69 40.472 -36.378 1 8.66 ? CE LYS A-6 102 1 
ATOM 9665 N NZ . LYS A-6 1 102 . 78.705 41.568 -37.392 1 9.62 ? NZ LYS A-6 102 1 
ATOM 9666 N N . ASP A-6 1 103 . 76.369 35.656 -34.388 1 5.38 ? N ASP A-6 103 1 
ATOM 9667 C CA . ASP A-6 1 103 . 75.005 35.285 -34.077 1 4.93 ? CA ASP A-6 103 1 
ATOM 9668 C C . ASP A-6 1 103 . 74.403 36.334 -33.172 1 5.1 ? C ASP A-6 103 1 
ATOM 9669 O O . ASP A-6 1 103 . 73.685 36.047 -32.194 1 5.63 ? O ASP A-6 103 1 
ATOM 9670 C CB . ASP A-6 1 103 . 74.928 33.898 -33.473 1 5.2 ? CB ASP A-6 103 1 
ATOM 9671 C CG . ASP A-6 1 103 . 73.579 33.215 -33.472 1 4.98 ? CG ASP A-6 103 1 
ATOM 9672 O OD1 . ASP A-6 1 103 . 72.687 33.623 -34.258 1 5.3 ? OD1 ASP A-6 103 1 
ATOM 9673 O OD2 . ASP A-6 1 103 . 73.446 32.267 -32.702 1 5.65 ? OD2 ASP A-6 103 1 
ATOM 9674 N N . TRP A-6 1 104 . 74.69 37.588 -33.473 1 5.28 ? N TRP A-6 104 1 
ATOM 9675 C CA . TRP A-6 1 104 . 74.182 38.733 -32.739 1 5.36 ? CA TRP A-6 104 1 
ATOM 9676 C C . TRP A-6 1 104 . 72.663 38.759 -32.8 1 5.4 ? C TRP A-6 104 1 
ATOM 9677 O O . TRP A-6 1 104 . 72.068 38.269 -33.727 1 5.88 ? O TRP A-6 104 1 
ATOM 9678 C CB . TRP A-6 1 104 . 74.759 40.053 -33.323 1 5.75 ? CB TRP A-6 104 1 
ATOM 9679 C CG . TRP A-6 1 104 . 76.234 40.229 -33.175 1 6.12 ? CG TRP A-6 104 1 
ATOM 9680 C CD1 . TRP A-6 1 104 . 77.2 39.298 -32.854 1 6.05 ? CD1 TRP A-6 104 1 
ATOM 9681 C CD2 . TRP A-6 1 104 . 76.921 41.474 -33.31 1 7.21 ? CD2 TRP A-6 104 1 
ATOM 9682 N NE1 . TRP A-6 1 104 . 78.42 39.909 -32.781 1 7.24 ? NE1 TRP A-6 104 1 
ATOM 9683 C CE2 . TRP A-6 1 104 . 78.286 41.238 -33.06 1 7.44 ? CE2 TRP A-6 104 1 
ATOM 9684 C CE3 . TRP A-6 1 104 . 76.504 42.757 -33.652 1 8.46 ? CE3 TRP A-6 104 1 
ATOM 9685 C CZ2 . TRP A-6 1 104 . 79.227 42.248 -33.115 1 9.54 ? CZ2 TRP A-6 104 1 
ATOM 9686 C CZ3 . TRP A-6 1 104 . 77.463 43.771 -33.716 1 10.02 ? CZ3 TRP A-6 104 1 
ATOM 9687 C CH2 . TRP A-6 1 104 . 78.787 43.504 -33.439 1 10.56 ? CH2 TRP A-6 104 1 
ATOM 9688 N N . LYS A-6 1 105 . 72.073 39.413 -31.8 1 5.4 ? N LYS A-6 105 1 
ATOM 9689 C CA . LYS A-6 1 105 . 70.607 39.392 -31.669 1 5.79 ? CA LYS A-6 105 1 
ATOM 9690 C C . LYS A-6 1 105 . 70.102 40.744 -31.315 1 5.05 ? C LYS A-6 105 1 
ATOM 9691 O O . LYS A-6 1 105 . 70.531 41.368 -30.337 1 5.76 ? O LYS A-6 105 1 
ATOM 9692 C CB . LYS A-6 1 105 . 70.143 38.374 -30.653 1 5.85 ? CB LYS A-6 105 1 
ATOM 9693 C CG . LYS A-6 1 105 . 70.902 37.03 -30.793 1 6.04 ? CG LYS A-6 105 1 
ATOM 9694 C CD . LYS A-6 1 105 . 70.166 35.906 -30.103 1 5.87 ? CD LYS A-6 105 1 
ATOM 9695 C CE . LYS A-6 1 105 . 70.974 34.625 -30.027 1 5.53 ? CE LYS A-6 105 1 
ATOM 9696 N NZ . LYS A-6 1 105 . 71.5 34.226 -31.358 1 5.28 ? NZ LYS A-6 105 1 
ATOM 9697 N N . VAL A-6 1 106 . 69.171 41.29 -32.105 1 5.18 ? N VAL A-6 106 1 
ATOM 9698 C CA . VAL A-6 1 106 . 68.55 42.548 -31.785 1 5.46 ? CA VAL A-6 106 1 
ATOM 9699 C C . VAL A-6 1 106 . 67.769 42.432 -30.504 1 5.29 ? C VAL A-6 106 1 
ATOM 9700 O O . VAL A-6 1 106 . 67.064 41.437 -30.292 1 5.45 ? O VAL A-6 106 1 
ATOM 9701 C CB . VAL A-6 1 106 . 67.661 42.99 -32.93 1 6 ? CB VAL A-6 106 1 
ATOM 9702 C CG1 . VAL A-6 1 106 . 66.819 44.228 -32.581 1 6.49 ? CG1 VAL A-6 106 1 
ATOM 9703 C CG2 . VAL A-6 1 106 . 68.428 43.202 -34.229 1 7.83 ? CG2 VAL A-6 106 1 
ATOM 9704 N N . LEU A-6 1 107 . 67.842 43.458 -29.648 1 5.45 ? N LEU A-6 107 1 
ATOM 9705 C CA . LEU A-6 1 107 . 66.934 43.633 -28.507 1 5.03 ? CA LEU A-6 107 1 
ATOM 9706 C C . LEU A-6 1 107 . 65.957 44.728 -28.874 1 5.1 ? C LEU A-6 107 1 
ATOM 9707 O O . LEU A-6 1 107 . 66.384 45.815 -29.292 1 5.76 ? O LEU A-6 107 1 
ATOM 9708 C CB . LEU A-6 1 107 . 67.72 44.016 -27.247 1 6.15 ? CB LEU A-6 107 1 
ATOM 9709 C CG . LEU A-6 1 107 . 66.879 44.126 -25.986 1 6.87 ? CG LEU A-6 107 1 
ATOM 9710 C CD1 . LEU A-6 1 107 . 66.236 42.785 -25.573 1 9.06 ? CD1 LEU A-6 107 1 
ATOM 9711 C CD2 . LEU A-6 1 107 . 67.709 44.706 -24.863 1 9.34 ? CD2 LEU A-6 107 1 
ATOM 9712 N N . ALA A-6 1 108 . 64.664 44.456 -28.733 1 4.93 ? N ALA A-6 108 1 
ATOM 9713 C CA . ALA A-6 1 108 . 63.632 45.36 -29.162 1 5.09 ? CA ALA A-6 108 1 
ATOM 9714 C C . ALA A-6 1 108 . 62.492 45.382 -28.177 1 4.9 ? C ALA A-6 108 1 
ATOM 9715 O O . ALA A-6 1 108 . 62.314 44.451 -27.391 1 5.71 ? O ALA A-6 108 1 
ATOM 9716 C CB . ALA A-6 1 108 . 63.138 44.961 -30.535 1 6.16 ? CB ALA A-6 108 1 
ATOM 9717 N N . VAL A-6 1 109 . 61.674 46.431 -28.287 1 5.35 ? N VAL A-6 109 1 
ATOM 9718 C CA . VAL A-6 1 109 . 60.44 46.548 -27.517 1 5.67 ? CA VAL A-6 109 1 
ATOM 9719 C C . VAL A-6 1 109 . 59.274 46.672 -28.44 1 5.38 ? C VAL A-6 109 1 
ATOM 9720 O O . VAL A-6 1 109 . 59.393 47.19 -29.57 1 6.24 ? O VAL A-6 109 1 
ATOM 9721 C CB . VAL A-6 1 109 . 60.487 47.738 -26.519 1 6.31 ? CB VAL A-6 109 1 
ATOM 9722 C CG1 . VAL A-6 1 109 . 61.538 47.5 -25.42 1 7.55 ? CG1 VAL A-6 109 1 
ATOM 9723 C CG2 . VAL A-6 1 109 . 60.731 49.075 -27.224 1 6.79 ? CG2 VAL A-6 109 1 
ATOM 9724 N N . PRO A-6 1 110 . 58.085 46.25 -28.023 1 5.76 ? N PRO A-6 110 1 
ATOM 9725 C CA . PRO A-6 1 110 . 56.893 46.391 -28.871 1 5.83 ? CA PRO A-6 110 1 
ATOM 9726 C C . PRO A-6 1 110 . 56.515 47.846 -29.003 1 6.46 ? C PRO A-6 110 1 
ATOM 9727 O O . PRO A-6 1 110 . 56.358 48.548 -27.989 1 7.27 ? O PRO A-6 110 1 
ATOM 9728 C CB . PRO A-6 1 110 . 55.804 45.592 -28.11 1 6.89 ? CB PRO A-6 110 1 
ATOM 9729 C CG . PRO A-6 1 110 . 56.291 45.629 -26.666 1 7.94 ? CG PRO A-6 110 1 
ATOM 9730 C CD . PRO A-6 1 110 . 57.79 45.567 -26.746 1 6.7 ? CD PRO A-6 110 1 
ATOM 9731 N N . VAL A-6 1 111 . 56.259 48.291 -30.219 1 6.11 ? N VAL A-6 111 1 
ATOM 9732 C CA . VAL A-6 1 111 . 55.79 49.645 -30.458 1 7.1 ? CA VAL A-6 111 1 
ATOM 9733 C C . VAL A-6 1 111 . 54.443 49.867 -29.771 1 6.97 ? C VAL A-6 111 1 
ATOM 9734 O O . VAL A-6 1 111 . 54.182 51.01 -29.329 1 8.75 ? O VAL A-6 111 1 
ATOM 9735 C CB . VAL A-6 1 111 . 55.699 49.953 -31.966 1 10.46 ? CB VAL A-6 111 1 
ATOM 9736 C CG1 . VAL A-6 1 111 . 54.987 51.222 -32.303 1 14.55 ? CG1 VAL A-6 111 1 
ATOM 9737 C CG2 . VAL A-6 1 111 . 57.092 49.877 -32.586 1 11.66 ? CG2 VAL A-6 111 1 
ATOM 9738 N N A GLU A-6 1 112 . 53.608 48.875 -29.706 0.68 6.21 ? N GLU A-6 112 1 
ATOM 9739 N N B GLU A-6 1 112 . 53.58 48.802 -29.73 0.32 7.43 ? N GLU A-6 112 1 
ATOM 9740 C CA A GLU A-6 1 112 . 52.24 49.075 -29.278 0.68 6.76 ? CA GLU A-6 112 1 
ATOM 9741 C CA B GLU A-6 1 112 . 52.153 48.856 -29.222 0.32 7.98 ? CA GLU A-6 112 1 
ATOM 9742 C C A GLU A-6 1 112 . 51.994 48.537 -27.863 0.68 6.52 ? C GLU A-6 112 1 
ATOM 9743 C C B GLU A-6 1 112 . 51.972 48.792 -27.719 0.32 8.38 ? C GLU A-6 112 1 
ATOM 9744 O O A GLU A-6 1 112 . 50.877 48.186 -27.54 0.68 7.85 ? O GLU A-6 112 1 
ATOM 9745 O O B GLU A-6 1 112 . 50.859 48.923 -27.216 0.32 10.31 ? O GLU A-6 112 1 
ATOM 9746 C CB A GLU A-6 1 112 . 51.3 48.426 -30.285 0.68 7.42 ? CB GLU A-6 112 1 
ATOM 9747 C CB B GLU A-6 1 112 . 51.266 47.712 -29.761 0.32 9.3 ? CB GLU A-6 112 1 
ATOM 9748 C CG A GLU A-6 1 112 . 51.407 49.058 -31.656 0.68 9.27 ? CG GLU A-6 112 1 
ATOM 9749 C CG B GLU A-6 1 112 . 51.091 47.723 -31.254 0.32 10.72 ? CG GLU A-6 112 1 
ATOM 9750 C CD A GLU A-6 1 112 . 51.036 50.489 -31.765 0.68 12.08 ? CD GLU A-6 112 1 
ATOM 9751 C CD B GLU A-6 1 112 . 50.422 48.963 -31.814 0.32 11.17 ? CD GLU A-6 112 1 
ATOM 9752 O OE1 A GLU A-6 1 112 . 50.426 51.043 -30.846 0.68 14.63 ? OE1 GLU A-6 112 1 
ATOM 9753 O OE1 B GLU A-6 1 112 . 49.728 49.722 -31.049 0.32 13.11 ? OE1 GLU A-6 112 1 
ATOM 9754 O OE2 A GLU A-6 1 112 . 51.324 51.142 -32.802 0.68 17.51 ? OE2 GLU A-6 112 1 
ATOM 9755 O OE2 B GLU A-6 1 112 . 50.464 49.21 -33.017 0.32 12.44 ? OE2 GLU A-6 112 1 
ATOM 9756 N N . ASP A-6 1 113 . 53.013 48.574 -26.975 1 6.66 ? N ASP A-6 113 1 
ATOM 9757 C CA . ASP A-6 1 113 . 52.843 48.507 -25.529 1 6.75 ? CA ASP A-6 113 1 
ATOM 9758 C C . ASP A-6 1 113 . 53.343 49.815 -24.937 1 6.26 ? C ASP A-6 113 1 
ATOM 9759 O O . ASP A-6 1 113 . 54.555 50.052 -24.951 1 6.64 ? O ASP A-6 113 1 
ATOM 9760 C CB . ASP A-6 1 113 . 53.565 47.334 -24.92 1 6.88 ? CB ASP A-6 113 1 
ATOM 9761 C CG . ASP A-6 1 113 . 53.31 47.184 -23.439 1 6.94 ? CG ASP A-6 113 1 
ATOM 9762 O OD1 . ASP A-6 1 113 . 52.679 48.083 -22.846 1 7.21 ? OD1 ASP A-6 113 1 
ATOM 9763 O OD2 . ASP A-6 1 113 . 53.736 46.124 -22.865 1 7.37 ? OD2 ASP A-6 113 1 
ATOM 9764 N N . PRO A-6 1 114 . 52.459 50.65 -24.4 1 6.94 ? N PRO A-6 114 1 
ATOM 9765 C CA . PRO A-6 1 114 . 52.883 51.938 -23.898 1 7.18 ? CA PRO A-6 114 1 
ATOM 9766 C C . PRO A-6 1 114 . 53.802 51.846 -22.708 1 6.53 ? C PRO A-6 114 1 
ATOM 9767 O O . PRO A-6 1 114 . 54.532 52.818 -22.414 1 7.21 ? O PRO A-6 114 1 
ATOM 9768 C CB . PRO A-6 1 114 . 51.546 52.654 -23.572 1 8.19 ? CB PRO A-6 114 1 
ATOM 9769 C CG . PRO A-6 1 114 . 50.619 51.521 -23.191 1 9.14 ? CG PRO A-6 114 1 
ATOM 9770 C CD . PRO A-6 1 114 . 50.97 50.414 -24.196 1 8.43 ? CD PRO A-6 114 1 
ATOM 9771 N N . TYR A-6 1 115 . 53.866 50.712 -22.033 1 6.45 ? N TYR A-6 115 1 
ATOM 9772 C CA . TYR A-6 1 115 . 54.849 50.504 -20.946 1 6.22 ? CA TYR A-6 115 1 
ATOM 9773 C C . TYR A-6 1 115 . 56.24 50.869 -21.415 1 6.34 ? C TYR A-6 115 1 
ATOM 9774 O O . TYR A-6 1 115 . 57.045 51.361 -20.63 1 7.45 ? O TYR A-6 115 1 
ATOM 9775 C CB . TYR A-6 1 115 . 54.775 49.046 -20.507 1 6.58 ? CB TYR A-6 115 1 
ATOM 9776 C CG . TYR A-6 1 115 . 55.631 48.735 -19.307 1 6.3 ? CG TYR A-6 115 1 
ATOM 9777 C CD1 . TYR A-6 1 115 . 56.956 48.369 -19.468 1 7.18 ? CD1 TYR A-6 115 1 
ATOM 9778 C CD2 . TYR A-6 1 115 . 55.094 48.744 -18.031 1 6.78 ? CD2 TYR A-6 115 1 
ATOM 9779 C CE1 . TYR A-6 1 115 . 57.736 48.068 -18.353 1 8.14 ? CE1 TYR A-6 115 1 
ATOM 9780 C CE2 . TYR A-6 1 115 . 55.859 48.402 -16.942 1 8.1 ? CE2 TYR A-6 115 1 
ATOM 9781 C CZ . TYR A-6 1 115 . 57.199 48.111 -17.108 1 8.5 ? CZ TYR A-6 115 1 
ATOM 9782 O OH . TYR A-6 1 115 . 57.965 47.836 -15.988 1 11.03 ? OH TYR A-6 115 1 
ATOM 9783 N N . PHE A-6 1 116 . 56.559 50.553 -22.683 1 6.4 ? N PHE A-6 116 1 
ATOM 9784 C CA . PHE A-6 1 116 . 57.911 50.699 -23.221 1 6.99 ? CA PHE A-6 116 1 
ATOM 9785 C C . PHE A-6 1 116 . 58.116 52.001 -24 1 7.8 ? C PHE A-6 116 1 
ATOM 9786 O O . PHE A-6 1 116 . 59.149 52.147 -24.65 1 8.48 ? O PHE A-6 116 1 
ATOM 9787 C CB . PHE A-6 1 116 . 58.293 49.476 -24.07 1 7.8 ? CB PHE A-6 116 1 
ATOM 9788 C CG . PHE A-6 1 116 . 58.31 48.213 -23.287 1 6.87 ? CG PHE A-6 116 1 
ATOM 9789 C CD1 . PHE A-6 1 116 . 57.275 47.311 -23.376 1 7.33 ? CD1 PHE A-6 116 1 
ATOM 9790 C CD2 . PHE A-6 1 116 . 59.369 47.923 -22.436 1 7.83 ? CD2 PHE A-6 116 1 
ATOM 9791 C CE1 . PHE A-6 1 116 . 57.28 46.135 -22.629 1 8.12 ? CE1 PHE A-6 116 1 
ATOM 9792 C CE2 . PHE A-6 1 116 . 59.384 46.72 -21.671 1 7.83 ? CE2 PHE A-6 116 1 
ATOM 9793 C CZ . PHE A-6 1 116 . 58.33 45.863 -21.794 1 8.23 ? CZ PHE A-6 116 1 
ATOM 9794 N N . ASN A-6 1 117 . 57.188 52.95 -23.912 1 8.52 ? N ASN A-6 117 1 
ATOM 9795 C CA . ASN A-6 1 117 . 57.249 54.137 -24.763 1 9.83 ? CA ASN A-6 117 1 
ATOM 9796 C C . ASN A-6 1 117 . 58.575 54.869 -24.614 1 11.44 ? C ASN A-6 117 1 
ATOM 9797 O O . ASN A-6 1 117 . 59.04 55.449 -25.61 1 13.82 ? O ASN A-6 117 1 
ATOM 9798 C CB . ASN A-6 1 117 . 56.103 55.104 -24.467 1 11.42 ? CB ASN A-6 117 1 
ATOM 9799 C CG . ASN A-6 1 117 . 54.803 54.693 -25.116 1 12.81 ? CG ASN A-6 117 1 
ATOM 9800 O OD1 . ASN A-6 1 117 . 54.747 53.855 -26.02 1 14.65 ? OD1 ASN A-6 117 1 
ATOM 9801 N ND2 . ASN A-6 1 117 . 53.715 55.318 -24.625 1 16.66 ? ND2 ASN A-6 117 1 
ATOM 9802 N N . ASP A-6 1 118 . 59.136 54.915 -23.424 0.85 9.6 ? N ASP A-6 118 1 
ATOM 9803 C CA . ASP A-6 1 118 . 60.352 55.641 -23.168 0.85 11.44 ? CA ASP A-6 118 1 
ATOM 9804 C C . ASP A-6 1 118 . 61.627 54.767 -23.288 0.85 12.72 ? C ASP A-6 118 1 
ATOM 9805 O O . ASP A-6 1 118 . 62.705 55.232 -23.019 0.85 15.86 ? O ASP A-6 118 1 
ATOM 9806 C CB . ASP A-6 1 118 . 60.27 56.395 -21.86 0.85 13.44 ? CB ASP A-6 118 1 
ATOM 9807 C CG . ASP A-6 1 118 . 59.085 57.4 -21.851 0.85 18.97 ? CG ASP A-6 118 1 
ATOM 9808 O OD1 . ASP A-6 1 118 . 58.821 58.113 -22.845 0.85 24.02 ? OD1 ASP A-6 118 1 
ATOM 9809 O OD2 . ASP A-6 1 118 . 58.285 57.44 -20.926 0.85 23.93 ? OD2 ASP A-6 118 1 
ATOM 9810 N N . TRP A-6 1 119 . 61.502 53.529 -23.722 1 11.67 ? N TRP A-6 119 1 
ATOM 9811 C CA . TRP A-6 1 119 . 62.639 52.633 -23.985 1 11.02 ? CA TRP A-6 119 1 
ATOM 9812 C C . TRP A-6 1 119 . 63.05 52.817 -25.406 1 9.51 ? C TRP A-6 119 1 
ATOM 9813 O O . TRP A-6 1 119 . 62.351 52.354 -26.297 1 9.97 ? O TRP A-6 119 1 
ATOM 9814 C CB . TRP A-6 1 119 . 62.333 51.176 -23.696 1 10.49 ? CB TRP A-6 119 1 
ATOM 9815 C CG . TRP A-6 1 119 . 62.07 50.801 -22.273 1 13.41 ? CG TRP A-6 119 1 
ATOM 9816 C CD1 . TRP A-6 1 119 . 61.359 51.533 -21.378 1 18.44 ? CD1 TRP A-6 119 1 
ATOM 9817 C CD2 . TRP A-6 1 119 . 62.487 49.625 -21.615 1 13.33 ? CD2 TRP A-6 119 1 
ATOM 9818 N NE1 . TRP A-6 1 119 . 61.268 50.794 -20.181 1 20.76 ? NE1 TRP A-6 119 1 
ATOM 9819 C CE2 . TRP A-6 1 119 . 62.027 49.662 -20.266 1 17.13 ? CE2 TRP A-6 119 1 
ATOM 9820 C CE3 . TRP A-6 1 119 . 63.183 48.555 -22.019 1 12.72 ? CE3 TRP A-6 119 1 
ATOM 9821 C CZ2 . TRP A-6 1 119 . 62.141 48.571 -19.425 1 18.76 ? CZ2 TRP A-6 119 1 
ATOM 9822 C CZ3 . TRP A-6 1 119 . 63.373 47.522 -21.161 1 13.99 ? CZ3 TRP A-6 119 1 
ATOM 9823 C CH2 . TRP A-6 1 119 . 62.886 47.534 -19.873 1 15.54 ? CH2 TRP A-6 119 1 
ATOM 9824 N N . LYS A-6 1 120 . 64.198 53.481 -25.605 0.85 8.86 ? N LYS A-6 120 1 
ATOM 9825 C CA . LYS A-6 1 120 . 64.681 53.844 -26.938 1 9.93 ? CA LYS A-6 120 1 
ATOM 9826 C C . LYS A-6 1 120 . 66.126 53.441 -27.185 1 8.83 ? C LYS A-6 120 1 
ATOM 9827 O O . LYS A-6 1 120 . 66.567 53.431 -28.35 0.87 8.69 ? O LYS A-6 120 1 
ATOM 9828 C CB . LYS A-6 1 120 . 64.529 55.341 -27.129 1 12.63 ? CB LYS A-6 120 1 
ATOM 9829 C CG . LYS A-6 1 120 . 63.025 55.731 -27.092 1 15.58 ? CG LYS A-6 120 1 
ATOM 9830 C CD . LYS A-6 1 120 . 62.851 57.126 -27.184 1 21.8 ? CD LYS A-6 120 1 
ATOM 9831 C CE . LYS A-6 1 120 . 61.342 57.525 -27.052 0.8 37.82 ? CE LYS A-6 120 1 
ATOM 9832 N NZ . LYS A-6 1 120 . 61.124 59.005 -26.883 1 50.17 ? NZ LYS A-6 120 1 
ATOM 9833 N N . ASP A-6 1 121 . 66.865 53.092 -26.183 1 8.97 ? N ASP A-6 121 1 
ATOM 9834 C CA . ASP A-6 1 121 . 68.27 52.713 -26.357 1 8.83 ? CA ASP A-6 121 1 
ATOM 9835 C C . ASP A-6 1 121 . 68.678 51.796 -25.234 1 8.95 ? C ASP A-6 121 1 
ATOM 9836 O O . ASP A-6 1 121 . 67.914 51.59 -24.246 1 8.9 ? O ASP A-6 121 1 
ATOM 9837 C CB . ASP A-6 1 121 . 69.181 53.952 -26.498 0.84 8.97 ? CB ASP A-6 121 1 
ATOM 9838 C CG . ASP A-6 1 121 . 70.432 53.742 -27.375 0.89 10.23 ? CG ASP A-6 121 1 
ATOM 9839 O OD1 . ASP A-6 1 121 . 70.815 52.641 -27.656 0.96 9.73 ? OD1 ASP A-6 121 1 
ATOM 9840 O OD2 . ASP A-6 1 121 . 70.97 54.755 -27.842 0.74 12.37 ? OD2 ASP A-6 121 1 
ATOM 9841 N N . ILE A-6 1 122 . 69.871 51.25 -25.359 1 8.9 ? N ILE A-6 122 1 
ATOM 9842 C CA . ILE A-6 1 122 . 70.305 50.188 -24.496 1 9.96 ? CA ILE A-6 122 1 
ATOM 9843 C C . ILE A-6 1 122 . 70.425 50.639 -23.045 1 9.77 ? C ILE A-6 122 1 
ATOM 9844 O O . ILE A-6 1 122 . 70.218 49.864 -22.135 1 11.34 ? O ILE A-6 122 1 
ATOM 9845 C CB . ILE A-6 1 122 . 71.619 49.588 -25.093 1 11.1 ? CB ILE A-6 122 1 
ATOM 9846 C CG1 . ILE A-6 1 122 . 71.995 48.26 -24.462 1 14.03 ? CG1 ILE A-6 122 1 
ATOM 9847 C CG2 . ILE A-6 1 122 . 72.782 50.505 -25.068 1 12.56 ? CG2 ILE A-6 122 1 
ATOM 9848 C CD1 . ILE A-6 1 122 . 71.022 47.192 -24.687 1 15.59 ? CD1 ILE A-6 122 1 
ATOM 9849 N N . SER A-6 1 123 . 70.68 51.941 -22.822 1 10.45 ? N SER A-6 123 1 
ATOM 9850 C CA . SER A-6 1 123 . 70.725 52.544 -21.484 1 11.92 ? CA SER A-6 123 1 
ATOM 9851 C C . SER A-6 1 123 . 69.388 52.614 -20.806 1 11.31 ? C SER A-6 123 1 
ATOM 9852 O O . SER A-6 1 123 . 69.39 52.864 -19.572 1 13.56 ? O SER A-6 123 1 
ATOM 9853 C CB . SER A-6 1 123 . 71.341 53.959 -21.566 1 15.55 ? CB SER A-6 123 1 
ATOM 9854 O OG . SER A-6 1 123 . 70.637 54.727 -22.511 1 21.22 ? OG SER A-6 123 1 
ATOM 9855 N N . ASP A-6 1 124 . 68.291 52.398 -21.454 1 8.95 ? N ASP A-6 124 1 
ATOM 9856 C CA . ASP A-6 1 124 . 66.998 52.422 -20.843 1 9.27 ? CA ASP A-6 124 1 
ATOM 9857 C C . ASP A-6 1 124 . 66.621 51.084 -20.174 1 9.42 ? C ASP A-6 124 1 
ATOM 9858 O O . ASP A-6 1 124 . 65.605 51.011 -19.486 1 11.43 ? O ASP A-6 124 1 
ATOM 9859 C CB . ASP A-6 1 124 . 65.967 52.79 -21.884 1 9.94 ? CB ASP A-6 124 1 
ATOM 9860 C CG . ASP A-6 1 124 . 66.128 54.191 -22.418 1 10.3 ? CG ASP A-6 124 1 
ATOM 9861 O OD1 . ASP A-6 1 124 . 66.403 55.097 -21.58 1 12.9 ? OD1 ASP A-6 124 1 
ATOM 9862 O OD2 . ASP A-6 1 124 . 66.031 54.389 -23.621 1 9.65 ? OD2 ASP A-6 124 1 
ATOM 9863 N N . VAL A-6 1 125 . 67.396 50.053 -20.437 1 8.97 ? N VAL A-6 125 1 
ATOM 9864 C CA . VAL A-6 1 125 . 67.076 48.732 -19.918 1 8.19 ? CA VAL A-6 125 1 
ATOM 9865 C C . VAL A-6 1 125 . 67.745 48.534 -18.547 1 8.89 ? C VAL A-6 125 1 
ATOM 9866 O O . VAL A-6 1 125 . 68.915 48.881 -18.361 1 9.9 ? O VAL A-6 125 1 
ATOM 9867 C CB . VAL A-6 1 125 . 67.65 47.654 -20.879 1 8.33 ? CB VAL A-6 125 1 
ATOM 9868 C CG1 . VAL A-6 1 125 . 67.22 46.271 -20.371 1 8.14 ? CG1 VAL A-6 125 1 
ATOM 9869 C CG2 . VAL A-6 1 125 . 67.158 47.913 -22.307 1 9.03 ? CG2 VAL A-6 125 1 
ATOM 9870 N N . PRO A-6 1 126 . 67.042 47.943 -17.571 1 9.05 ? N PRO A-6 126 1 
ATOM 9871 C CA . PRO A-6 1 126 . 67.722 47.632 -16.296 1 9.13 ? CA PRO A-6 126 1 
ATOM 9872 C C . PRO A-6 1 126 . 68.982 46.811 -16.524 1 8.47 ? C PRO A-6 126 1 
ATOM 9873 O O . PRO A-6 1 126 . 68.983 45.826 -17.242 1 8.06 ? O PRO A-6 126 1 
ATOM 9874 C CB . PRO A-6 1 126 . 66.697 46.878 -15.52 1 10.28 ? CB PRO A-6 126 1 
ATOM 9875 C CG . PRO A-6 1 126 . 65.412 47.431 -16.014 1 12.04 ? CG PRO A-6 126 1 
ATOM 9876 C CD . PRO A-6 1 126 . 65.613 47.573 -17.527 1 10.15 ? CD PRO A-6 126 1 
ATOM 9877 N N . LYS A-6 1 127 . 70.089 47.22 -15.875 1 9.37 ? N LYS A-6 127 1 
ATOM 9878 C CA . LYS A-6 1 127 . 71.351 46.528 -16.09 1 10.12 ? CA LYS A-6 127 1 
ATOM 9879 C C . LYS A-6 1 127 . 71.248 45.043 -15.759 1 8.05 ? C LYS A-6 127 1 
ATOM 9880 O O . LYS A-6 1 127 . 71.823 44.193 -16.469 1 8.74 ? O LYS A-6 127 1 
ATOM 9881 C CB . LYS A-6 1 127 . 72.455 47.188 -15.204 1 19.4 ? CB LYS A-6 127 1 
ATOM 9882 C CG . LYS A-6 1 127 . 73.824 46.629 -15.486 1 55.16 ? CG LYS A-6 127 1 
ATOM 9883 C CD . LYS A-6 1 127 . 74.127 46.603 -16.996 1 90.61 ? CD LYS A-6 127 1 
ATOM 9884 C CE . LYS A-6 1 127 . 75.548 46.153 -17.309 1 122.15 ? CE LYS A-6 127 1 
ATOM 9885 N NZ . LYS A-6 1 127 . 75.829 46.276 -18.761 1 151.23 ? NZ LYS A-6 127 1 
ATOM 9886 N N . ALA A-6 1 128 . 70.523 44.699 -14.672 1 6.97 ? N ALA A-6 128 1 
ATOM 9887 C CA . ALA A-6 1 128 . 70.433 43.322 -14.3 1 6.77 ? CA ALA A-6 128 1 
ATOM 9888 C C . ALA A-6 1 128 . 69.701 42.497 -15.368 1 6.08 ? C ALA A-6 128 1 
ATOM 9889 O O . ALA A-6 1 128 . 69.956 41.278 -15.473 1 6.5 ? O ALA A-6 128 1 
ATOM 9890 C CB . ALA A-6 1 128 . 69.741 43.161 -12.976 1 7.98 ? CB ALA A-6 128 1 
ATOM 9891 N N . PHE A-6 1 129 . 68.822 43.098 -16.12 1 5.95 ? N PHE A-6 129 1 
ATOM 9892 C CA . PHE A-6 1 129 . 68.106 42.405 -17.16 1 5.88 ? CA PHE A-6 129 1 
ATOM 9893 C C . PHE A-6 1 129 . 69.038 42.102 -18.345 1 5.89 ? C PHE A-6 129 1 
ATOM 9894 O O . PHE A-6 1 129 . 69.022 40.99 -18.879 1 5.78 ? O PHE A-6 129 1 
ATOM 9895 C CB . PHE A-6 1 129 . 66.867 43.196 -17.597 1 6.44 ? CB PHE A-6 129 1 
ATOM 9896 C CG . PHE A-6 1 129 . 65.941 42.449 -18.511 1 6.34 ? CG PHE A-6 129 1 
ATOM 9897 C CD1 . PHE A-6 1 129 . 65.336 41.269 -18.126 1 7.99 ? CD1 PHE A-6 129 1 
ATOM 9898 C CD2 . PHE A-6 1 129 . 65.676 42.91 -19.773 1 7.95 ? CD2 PHE A-6 129 1 
ATOM 9899 C CE1 . PHE A-6 1 129 . 64.492 40.596 -18.993 1 8.99 ? CE1 PHE A-6 129 1 
ATOM 9900 C CE2 . PHE A-6 1 129 . 64.796 42.242 -20.626 1 10.32 ? CE2 PHE A-6 129 1 
ATOM 9901 C CZ . PHE A-6 1 129 . 64.201 41.077 -20.2 1 9.68 ? CZ PHE A-6 129 1 
ATOM 9902 N N . LEU A-6 1 130 . 69.835 43.084 -18.757 1 5.84 ? N LEU A-6 130 1 
ATOM 9903 C CA . LEU A-6 1 130 . 70.844 42.786 -19.771 1 5.78 ? CA LEU A-6 130 1 
ATOM 9904 C C . LEU A-6 1 130 . 71.754 41.688 -19.321 1 5.7 ? C LEU A-6 130 1 
ATOM 9905 O O . LEU A-6 1 130 . 72.102 40.781 -20.08 1 6.45 ? O LEU A-6 130 1 
ATOM 9906 C CB . LEU A-6 1 130 . 71.63 44.054 -20.095 1 6.96 ? CB LEU A-6 130 1 
ATOM 9907 C CG . LEU A-6 1 130 . 70.85 45.188 -20.736 1 7.2 ? CG LEU A-6 130 1 
ATOM 9908 C CD1 . LEU A-6 1 130 . 71.765 46.35 -21.029 1 9.8 ? CD1 LEU A-6 130 1 
ATOM 9909 C CD2 . LEU A-6 1 130 . 70.138 44.759 -22.011 1 8.35 ? CD2 LEU A-6 130 1 
ATOM 9910 N N . ASP A-6 1 131 . 72.172 41.706 -18.053 1 6.12 ? N ASP A-6 131 1 
ATOM 9911 C CA . ASP A-6 1 131 . 73.044 40.665 -17.534 1 6.35 ? CA ASP A-6 131 1 
ATOM 9912 C C . ASP A-6 1 131 . 72.363 39.297 -17.563 1 5.75 ? C ASP A-6 131 1 
ATOM 9913 O O . ASP A-6 1 131 . 73.015 38.303 -17.869 1 6.12 ? O ASP A-6 131 1 
ATOM 9914 C CB . ASP A-6 1 131 . 73.481 40.989 -16.112 1 8.56 ? CB ASP A-6 131 1 
ATOM 9915 C CG . ASP A-6 1 131 . 74.411 42.109 -15.998 1 14.46 ? CG ASP A-6 131 1 
ATOM 9916 O OD1 . ASP A-6 1 131 . 74.93 42.648 -16.975 1 15.16 ? OD1 ASP A-6 131 1 
ATOM 9917 O OD2 . ASP A-6 1 131 . 74.545 42.564 -14.82 1 20.29 ? OD2 ASP A-6 131 1 
ATOM 9918 N N . GLU A-6 1 132 . 71.073 39.243 -17.234 1 5.63 ? N GLU A-6 132 1 
ATOM 9919 C CA . GLU A-6 1 132 . 70.369 37.975 -17.2 1 5.6 ? CA GLU A-6 132 1 
ATOM 9920 C C . GLU A-6 1 132 . 70.293 37.378 -18.614 1 5.33 ? C GLU A-6 132 1 
ATOM 9921 O O . GLU A-6 1 132 . 70.412 36.143 -18.797 1 5.66 ? O GLU A-6 132 1 
ATOM 9922 C CB . GLU A-6 1 132 . 68.98 38.09 -16.551 1 6.15 ? CB GLU A-6 132 1 
ATOM 9923 C CG . GLU A-6 1 132 . 67.792 38.23 -17.477 1 6.84 ? CG GLU A-6 132 1 
ATOM 9924 C CD . GLU A-6 1 132 . 66.49 38.162 -16.695 1 6.48 ? CD GLU A-6 132 1 
ATOM 9925 O OE1 . GLU A-6 1 132 . 66.39 38.851 -15.643 1 6.69 ? OE1 GLU A-6 132 1 
ATOM 9926 O OE2 . GLU A-6 1 132 . 65.555 37.444 -17.146 1 6.97 ? OE2 GLU A-6 132 1 
ATOM 9927 N N . ILE A-6 1 133 . 70.065 38.22 -19.608 1 5.42 ? N ILE A-6 133 1 
ATOM 9928 C CA . ILE A-6 1 133 . 69.97 37.75 -20.98 1 5.34 ? CA ILE A-6 133 1 
ATOM 9929 C C . ILE A-6 1 133 . 71.344 37.232 -21.428 1 5.33 ? C ILE A-6 133 1 
ATOM 9930 O O . ILE A-6 1 133 . 71.452 36.127 -21.972 1 5.65 ? O ILE A-6 133 1 
ATOM 9931 C CB . ILE A-6 1 133 . 69.441 38.846 -21.937 1 5.79 ? CB ILE A-6 133 1 
ATOM 9932 C CG1 . ILE A-6 1 133 . 68.024 39.266 -21.561 1 6.07 ? CG1 ILE A-6 133 1 
ATOM 9933 C CG2 . ILE A-6 1 133 . 69.528 38.368 -23.363 1 7.06 ? CG2 ILE A-6 133 1 
ATOM 9934 C CD1 . ILE A-6 1 133 . 67.576 40.546 -22.275 1 7.92 ? CD1 ILE A-6 133 1 
ATOM 9935 N N . ALA A-6 1 134 . 72.375 38.017 -21.213 1 5.41 ? N ALA A-6 134 1 
ATOM 9936 C CA . ALA A-6 1 134 . 73.719 37.59 -21.614 1 5.92 ? CA ALA A-6 134 1 
ATOM 9937 C C . ALA A-6 1 134 . 74.093 36.284 -20.927 1 5.6 ? C ALA A-6 134 1 
ATOM 9938 O O . ALA A-6 1 134 . 74.704 35.419 -21.545 1 6.1 ? O ALA A-6 134 1 
ATOM 9939 C CB . ALA A-6 1 134 . 74.712 38.704 -21.299 1 7.1 ? CB ALA A-6 134 1 
ATOM 9940 N N . HIS A-6 1 135 . 73.792 36.163 -19.622 1 5.58 ? N HIS A-6 135 1 
ATOM 9941 C CA . HIS A-6 1 135 . 74.168 34.97 -18.888 1 5.72 ? CA HIS A-6 135 1 
ATOM 9942 C C . HIS A-6 1 135 . 73.473 33.715 -19.439 1 5.59 ? C HIS A-6 135 1 
ATOM 9943 O O . HIS A-6 1 135 . 74.064 32.645 -19.559 1 5.62 ? O HIS A-6 135 1 
ATOM 9944 C CB . HIS A-6 1 135 . 73.894 35.145 -17.414 1 6.16 ? CB HIS A-6 135 1 
ATOM 9945 C CG . HIS A-6 1 135 . 74.452 34.069 -16.565 1 5.81 ? CG HIS A-6 135 1 
ATOM 9946 N ND1 . HIS A-6 1 135 . 73.709 33.434 -15.614 1 6.31 ? ND1 HIS A-6 135 1 
ATOM 9947 C CD2 . HIS A-6 1 135 . 75.707 33.572 -16.531 1 7.03 ? CD2 HIS A-6 135 1 
ATOM 9948 C CE1 . HIS A-6 1 135 . 74.508 32.554 -15.043 1 6.99 ? CE1 HIS A-6 135 1 
ATOM 9949 N NE2 . HIS A-6 1 135 . 75.72 32.619 -15.578 1 7.1 ? NE2 HIS A-6 135 1 
ATOM 9950 N N . PHE A-6 1 136 . 72.179 33.867 -19.761 1 5.36 ? N PHE A-6 136 1 
ATOM 9951 C CA . PHE A-6 1 136 . 71.472 32.773 -20.419 1 5.33 ? CA PHE A-6 136 1 
ATOM 9952 C C . PHE A-6 1 136 . 72.215 32.29 -21.662 1 5.22 ? C PHE A-6 136 1 
ATOM 9953 O O . PHE A-6 1 136 . 72.461 31.092 -21.825 1 5.59 ? O PHE A-6 136 1 
ATOM 9954 C CB . PHE A-6 1 136 . 70.048 33.266 -20.76 1 5.6 ? CB PHE A-6 136 1 
ATOM 9955 C CG . PHE A-6 1 136 . 69.232 32.297 -21.588 1 5.68 ? CG PHE A-6 136 1 
ATOM 9956 C CD1 . PHE A-6 1 136 . 68.54 31.23 -21.003 1 6.1 ? CD1 PHE A-6 136 1 
ATOM 9957 C CD2 . PHE A-6 1 136 . 69.141 32.465 -22.949 1 6.18 ? CD2 PHE A-6 136 1 
ATOM 9958 C CE1 . PHE A-6 1 136 . 67.792 30.384 -21.825 1 6.38 ? CE1 PHE A-6 136 1 
ATOM 9959 C CE2 . PHE A-6 1 136 . 68.404 31.595 -23.747 1 7.41 ? CE2 PHE A-6 136 1 
ATOM 9960 C CZ . PHE A-6 1 136 . 67.723 30.558 -23.148 1 6.09 ? CZ PHE A-6 136 1 
ATOM 9961 N N . PHE A-6 1 137 . 72.573 33.228 -22.544 1 5.22 ? N PHE A-6 137 1 
ATOM 9962 C CA . PHE A-6 1 137 . 73.258 32.827 -23.775 1 5.53 ? CA PHE A-6 137 1 
ATOM 9963 C C . PHE A-6 1 137 . 74.675 32.348 -23.506 1 5.81 ? C PHE A-6 137 1 
ATOM 9964 O O . PHE A-6 1 137 . 75.194 31.55 -24.298 1 6.75 ? O PHE A-6 137 1 
ATOM 9965 C CB . PHE A-6 1 137 . 73.165 33.937 -24.815 1 6.28 ? CB PHE A-6 137 1 
ATOM 9966 C CG . PHE A-6 1 137 . 71.761 34.11 -25.385 1 5.99 ? CG PHE A-6 137 1 
ATOM 9967 C CD1 . PHE A-6 1 137 . 71.276 33.166 -26.261 1 6.04 ? CD1 PHE A-6 137 1 
ATOM 9968 C CD2 . PHE A-6 1 137 . 70.909 35.1 -24.959 1 6.63 ? CD2 PHE A-6 137 1 
ATOM 9969 C CE1 . PHE A-6 1 137 . 69.99 33.26 -26.774 1 6.64 ? CE1 PHE A-6 137 1 
ATOM 9970 C CE2 . PHE A-6 1 137 . 69.604 35.195 -25.439 1 6.81 ? CE2 PHE A-6 137 1 
ATOM 9971 C CZ . PHE A-6 1 137 . 69.146 34.267 -26.363 1 7.09 ? CZ PHE A-6 137 1 
ATOM 9972 N N . GLN A-6 1 138 . 75.299 32.774 -22.435 1 5.69 ? N GLN A-6 138 1 
ATOM 9973 C CA A GLN A-6 1 138 . 76.604 32.306 -22.047 0.58 5.18 ? CA GLN A-6 138 1 
ATOM 9974 C CA B GLN A-6 1 138 . 76.621 32.288 -22.089 0.42 8.58 ? CA GLN A-6 138 1 
ATOM 9975 C C . GLN A-6 1 138 . 76.585 30.831 -21.625 1 5.78 ? C GLN A-6 138 1 
ATOM 9976 O O . GLN A-6 1 138 . 77.58 30.141 -21.846 1 6.9 ? O GLN A-6 138 1 
ATOM 9977 C CB A GLN A-6 1 138 . 77.149 33.171 -20.883 0.58 5 ? CB GLN A-6 138 1 
ATOM 9978 C CB B GLN A-6 1 138 . 77.238 33.09 -20.957 0.42 12.08 ? CB GLN A-6 138 1 
ATOM 9979 C CG A GLN A-6 1 138 . 78.565 32.914 -20.518 0.58 7.28 ? CG GLN A-6 138 1 
ATOM 9980 C CG B GLN A-6 1 138 . 77.702 34.412 -21.362 0.42 12.47 ? CG GLN A-6 138 1 
ATOM 9981 C CD A GLN A-6 1 138 . 79.12 33.724 -19.422 0.58 11.27 ? CD GLN A-6 138 1 
ATOM 9982 C CD B GLN A-6 1 138 . 78.295 35.2 -20.223 0.42 15.04 ? CD GLN A-6 138 1 
ATOM 9983 O OE1 A GLN A-6 1 138 . 80.339 33.899 -19.378 0.58 18.8 ? OE1 GLN A-6 138 1 
ATOM 9984 O OE1 B GLN A-6 1 138 . 79.349 35.849 -20.395 0.42 18.94 ? OE1 GLN A-6 138 1 
ATOM 9985 N NE2 A GLN A-6 1 138 . 78.357 34.167 -18.577 0.58 12.35 ? NE2 GLN A-6 138 1 
ATOM 9986 N NE2 B GLN A-6 1 138 . 77.702 35.138 -19.065 0.42 14.43 ? NE2 GLN A-6 138 1 
ATOM 9987 N N . ARG A-6 1 139 . 75.529 30.389 -20.947 1 5.69 ? N ARG A-6 139 1 
ATOM 9988 C CA A ARG A-6 1 139 . 75.512 29.096 -20.224 0.57 5.65 ? CA ARG A-6 139 1 
ATOM 9989 C CA B ARG A-6 1 139 . 75.542 29.065 -20.344 0.43 7.1 ? CA ARG A-6 139 1 
ATOM 9990 C C . ARG A-6 1 139 . 74.55 28.072 -20.842 1 5.81 ? C ARG A-6 139 1 
ATOM 9991 O O . ARG A-6 1 139 . 74.681 26.864 -20.527 1 6.48 ? O ARG A-6 139 1 
ATOM 9992 C CB A ARG A-6 1 139 . 75.349 29.261 -18.7 0.57 5.73 ? CB ARG A-6 139 1 
ATOM 9993 C CB B ARG A-6 1 139 . 75.251 29.205 -18.851 0.43 7.85 ? CB ARG A-6 139 1 
ATOM 9994 C CG A ARG A-6 1 139 . 76.403 30.127 -18.05 0.57 6.63 ? CG ARG A-6 139 1 
ATOM 9995 C CG B ARG A-6 1 139 . 76.365 29.905 -18.038 0.43 9.66 ? CG ARG A-6 139 1 
ATOM 9996 C CD A ARG A-6 1 139 . 77.804 29.547 -18.239 0.57 8.67 ? CD ARG A-6 139 1 
ATOM 9997 C CD B ARG A-6 1 139 . 77.737 29.3 -18.266 0.43 8.53 ? CD ARG A-6 139 1 
ATOM 9998 N NE A ARG A-6 1 139 . 78.77 30.36 -17.523 0.57 9.6 ? NE ARG A-6 139 1 
ATOM 9999 N NE B ARG A-6 1 139 . 78.712 29.753 -17.287 0.43 7.91 ? NE ARG A-6 139 1 
ATOM 10000 C CZ A ARG A-6 1 139 . 80.019 30.49 -17.866 0.57 12.06 ? CZ ARG A-6 139 1 
ATOM 10001 C CZ B ARG A-6 1 139 . 79.973 29.396 -17.33 0.43 8.48 ? CZ ARG A-6 139 1 
ATOM 10002 N NH1 A ARG A-6 1 139 . 80.489 29.905 -18.958 0.57 14.03 ? NH1 ARG A-6 139 1 
ATOM 10003 N NH1 B ARG A-6 1 139 . 80.435 28.578 -18.291 0.43 11.47 ? NH1 ARG A-6 139 1 
ATOM 10004 N NH2 A ARG A-6 1 139 . 80.791 31.25 -17.092 0.57 14.24 ? NH2 ARG A-6 139 1 
ATOM 10005 N NH2 B ARG A-6 1 139 . 80.815 29.771 -16.362 0.43 10.75 ? NH2 ARG A-6 139 1 
ATOM 10006 N N . TYR A-6 1 140 . 73.553 28.476 -21.613 1 5.75 ? N TYR A-6 140 1 
ATOM 10007 C CA . TYR A-6 1 140 . 72.484 27.556 -21.952 1 6.16 ? CA TYR A-6 140 1 
ATOM 10008 C C . TYR A-6 1 140 . 72.885 26.36 -22.826 1 6.02 ? C TYR A-6 140 1 
ATOM 10009 O O . TYR A-6 1 140 . 72.131 25.383 -22.818 1 7.17 ? O TYR A-6 140 1 
ATOM 10010 C CB . TYR A-6 1 140 . 71.282 28.283 -22.604 1 6.11 ? CB TYR A-6 140 1 
ATOM 10011 C CG . TYR A-6 1 140 . 71.441 28.702 -24.042 1 5.87 ? CG TYR A-6 140 1 
ATOM 10012 C CD1 . TYR A-6 1 140 . 72.631 29.291 -24.518 1 5.89 ? CD1 TYR A-6 140 1 
ATOM 10013 C CD2 . TYR A-6 1 140 . 70.368 28.598 -24.918 1 7.11 ? CD2 TYR A-6 140 1 
ATOM 10014 C CE1 . TYR A-6 1 140 . 72.685 29.721 -25.851 1 6.5 ? CE1 TYR A-6 140 1 
ATOM 10015 C CE2 . TYR A-6 1 140 . 70.419 29.028 -26.211 1 7.2 ? CE2 TYR A-6 140 1 
ATOM 10016 C CZ . TYR A-6 1 140 . 71.594 29.619 -26.678 1 6.47 ? CZ TYR A-6 140 1 
ATOM 10017 O OH . TYR A-6 1 140 . 71.678 30.106 -27.955 1 7.76 ? OH TYR A-6 140 1 
ATOM 10018 N N A LYS A-6 1 141 . 74.066 26.427 -23.408 0.65 6.54 ? N LYS A-6 141 1 
ATOM 10019 N N B LYS A-6 1 141 . 73.941 26.424 -23.696 0.35 4.65 ? N LYS A-6 141 1 
ATOM 10020 C CA A LYS A-6 1 141 . 74.535 25.294 -24.235 0.65 6.74 ? CA LYS A-6 141 1 
ATOM 10021 C CA B LYS A-6 1 141 . 74.371 25.322 -24.577 0.35 4.38 ? CA LYS A-6 141 1 
ATOM 10022 C C A LYS A-6 1 141 . 75.661 24.559 -23.547 0.65 5.45 ? C LYS A-6 141 1 
ATOM 10023 C C B LYS A-6 1 141 . 75.547 24.517 -23.958 0.35 4.67 ? C LYS A-6 141 1 
ATOM 10024 O O A LYS A-6 1 141 . 76.263 23.665 -24.13 0.65 6.34 ? O LYS A-6 141 1 
ATOM 10025 O O B LYS A-6 1 141 . 76.105 23.62 -24.617 0.35 4.3 ? O LYS A-6 141 1 
ATOM 10026 C CB A LYS A-6 1 141 . 74.985 25.758 -25.644 0.65 7.81 ? CB LYS A-6 141 1 
ATOM 10027 C CB B LYS A-6 1 141 . 74.764 25.844 -25.959 0.35 5.84 ? CB LYS A-6 141 1 
ATOM 10028 C CG A LYS A-6 1 141 . 73.85 26.232 -26.528 0.65 8.83 ? CG LYS A-6 141 1 
ATOM 10029 C CG B LYS A-6 1 141 . 73.551 26.285 -26.67 0.35 6.48 ? CG LYS A-6 141 1 
ATOM 10030 C CD A LYS A-6 1 141 . 74.322 26.527 -28.006 0.65 11.13 ? CD LYS A-6 141 1 
ATOM 10031 C CD B LYS A-6 1 141 . 73.867 26.908 -28.015 0.35 5.7 ? CD LYS A-6 141 1 
ATOM 10032 C CE A LYS A-6 1 141 . 73.165 27.114 -28.831 0.65 12.78 ? CE LYS A-6 141 1 
ATOM 10033 C CE B LYS A-6 1 141 . 74.793 26.046 -28.86 0.35 8 ? CE LYS A-6 141 1 
ATOM 10034 N NZ A LYS A-6 1 141 . 73.46 26.984 -30.332 0.65 12.01 ? NZ LYS A-6 141 1 
ATOM 10035 N NZ B LYS A-6 1 141 . 74.971 26.722 -30.19 0.35 6.96 ? NZ LYS A-6 141 1 
ATOM 10036 N N A GLU A-6 1 142 . 75.95 24.86 -22.303 0.65 6.12 ? N GLU A-6 142 1 
ATOM 10037 N N B GLU A-6 1 142 . 75.882 24.795 -22.701 0.35 4.14 ? N GLU A-6 142 1 
ATOM 10038 C CA A GLU A-6 1 142 . 77.127 24.231 -21.684 0.65 6.63 ? CA GLU A-6 142 1 
ATOM 10039 C CA B GLU A-6 1 142 . 76.989 24.115 -22.053 0.35 5.65 ? CA GLU A-6 142 1 
ATOM 10040 C C A GLU A-6 1 142 . 76.97 22.691 -21.681 0.65 5.71 ? C GLU A-6 142 1 
ATOM 10041 C C B GLU A-6 1 142 . 76.889 22.605 -22.06 0.35 7.42 ? C GLU A-6 142 1 
ATOM 10042 O O A GLU A-6 1 142 . 77.912 21.967 -21.992 0.65 6.22 ? O GLU A-6 142 1 
ATOM 10043 O O B GLU A-6 1 142 . 77.889 21.879 -22.412 0.35 14.7 ? O GLU A-6 142 1 
ATOM 10044 C CB A GLU A-6 1 142 . 77.365 24.797 -20.334 0.65 6.24 ? CB GLU A-6 142 1 
ATOM 10045 C CB B GLU A-6 1 142 . 77.12 24.609 -20.602 0.35 8.82 ? CB GLU A-6 142 1 
ATOM 10046 C CG A GLU A-6 1 142 . 78.54 24.364 -19.761 0.65 8.74 ? CG GLU A-6 142 1 
ATOM 10047 C CG B GLU A-6 1 142 . 77.978 25.914 -20.495 0.35 14.22 ? CG GLU A-6 142 1 
ATOM 10048 C CD A GLU A-6 1 142 . 78.918 25.085 -18.445 0.65 9.36 ? CD GLU A-6 142 1 
ATOM 10049 C CD B GLU A-6 1 142 . 78.549 26.327 -19.103 0.35 13.68 ? CD GLU A-6 142 1 
ATOM 10050 O OE1 A GLU A-6 1 142 . 78.063 25.923 -17.887 0.65 7.7 ? OE1 GLU A-6 142 1 
ATOM 10051 O OE1 B GLU A-6 1 142 . 78.17 25.818 -18.041 0.35 16.25 ? OE1 GLU A-6 142 1 
ATOM 10052 O OE2 A GLU A-6 1 142 . 80.065 24.85 -18.03 0.65 15.28 ? OE2 GLU A-6 142 1 
ATOM 10053 O OE2 B GLU A-6 1 142 . 79.559 27.068 -19.175 0.35 15.47 ? OE2 GLU A-6 142 1 
ATOM 10054 N N . LEU A-6 1 143 . 75.776 22.117 -21.473 1 7.31 ? N LEU A-6 143 1 
ATOM 10055 C CA . LEU A-6 1 143 . 75.621 20.674 -21.41 1 7.31 ? CA LEU A-6 143 1 
ATOM 10056 C C . LEU A-6 1 143 . 75.574 20.026 -22.793 1 8.47 ? C LEU A-6 143 1 
ATOM 10057 O O . LEU A-6 1 143 . 75.727 18.804 -22.901 1 10.57 ? O LEU A-6 143 1 
ATOM 10058 C CB . LEU A-6 1 143 . 74.372 20.269 -20.627 1 7.31 ? CB LEU A-6 143 1 
ATOM 10059 C CG . LEU A-6 1 143 . 74.409 20.591 -19.116 1 8.14 ? CG LEU A-6 143 1 
ATOM 10060 C CD1 . LEU A-6 1 143 . 73.11 20.061 -18.506 1 7.91 ? CD1 LEU A-6 143 1 
ATOM 10061 C CD2 . LEU A-6 1 143 . 75.62 19.98 -18.453 1 11.51 ? CD2 LEU A-6 143 1 
ATOM 10062 N N . GLN A-6 1 144 . 75.365 20.813 -23.833 1 8.41 ? N GLN A-6 144 1 
ATOM 10063 C CA . GLN A-6 1 144 . 75.533 20.31 -25.187 1 10.9 ? CA GLN A-6 144 1 
ATOM 10064 C C . GLN A-6 1 144 . 76.962 20.266 -25.653 1 11.54 ? C GLN A-6 144 1 
ATOM 10065 O O . GLN A-6 1 144 . 77.273 19.739 -26.711 1 14.83 ? O GLN A-6 144 1 
ATOM 10066 C CB . GLN A-6 1 144 . 74.772 21.159 -26.171 1 10.83 ? CB GLN A-6 144 1 
ATOM 10067 C CG . GLN A-6 1 144 . 73.287 21.174 -25.954 1 11.64 ? CG GLN A-6 144 1 
ATOM 10068 C CD . GLN A-6 1 144 . 72.525 22.1 -26.938 1 12.36 ? CD GLN A-6 144 1 
ATOM 10069 O OE1 . GLN A-6 1 144 . 71.836 23.086 -26.585 1 13.75 ? OE1 GLN A-6 144 1 
ATOM 10070 N NE2 . GLN A-6 1 144 . 72.615 21.743 -28.191 1 15.89 ? NE2 GLN A-6 144 1 
ATOM 10071 N N . GLY A-6 1 145 . 77.861 20.832 -24.893 1 11.6 ? N GLY A-6 145 1 
ATOM 10072 C CA . GLY A-6 1 145 . 79.264 20.849 -25.305 1 13.97 ? CA GLY A-6 145 1 
ATOM 10073 C C . GLY A-6 1 145 . 79.498 21.813 -26.459 1 14.34 ? C GLY A-6 145 1 
ATOM 10074 O O . GLY A-6 1 145 . 80.446 21.599 -27.184 1 20.37 ? O GLY A-6 145 1 
ATOM 10075 N N . LYS A-6 1 146 . 78.712 22.858 -26.587 1 10.17 ? N LYS A-6 146 1 
ATOM 10076 C CA . LYS A-6 1 146 . 78.868 23.825 -27.646 1 10 ? CA LYS A-6 146 1 
ATOM 10077 C C . LYS A-6 1 146 . 79.306 25.146 -27.066 1 11.72 ? C LYS A-6 146 1 
ATOM 10078 O O . LYS A-6 1 146 . 78.794 25.557 -26.06 1 22.27 ? O LYS A-6 146 1 
ATOM 10079 C CB . LYS A-6 1 146 . 77.63 23.98 -28.449 1 12.21 ? CB LYS A-6 146 1 
ATOM 10080 C CG . LYS A-6 1 146 . 77.267 22.651 -29.168 1 22.54 ? CG LYS A-6 146 1 
ATOM 10081 C CD . LYS A-6 1 146 . 76.038 22.759 -30.028 1 52.94 ? CD LYS A-6 146 1 
ATOM 10082 C CE . LYS A-6 1 146 . 75.89 21.557 -30.894 1 80.4 ? CE LYS A-6 146 1 
ATOM 10083 N NZ . LYS A-6 1 146 . 74.732 21.686 -31.811 1 103.43 ? NZ LYS A-6 146 1 
ATOM 10084 N N . THR A-6 1 147 . 80.206 25.826 -27.693 1 7.27 ? N THR A-6 147 1 
ATOM 10085 C CA . THR A-6 1 147 . 80.772 27.074 -27.18 1 6.89 ? CA THR A-6 147 1 
ATOM 10086 C C . THR A-6 1 147 . 79.988 28.273 -27.64 1 6.26 ? C THR A-6 147 1 
ATOM 10087 O O . THR A-6 1 147 . 79.687 28.424 -28.798 1 8.18 ? O THR A-6 147 1 
ATOM 10088 C CB . THR A-6 1 147 . 82.224 27.186 -27.678 1 7.69 ? CB THR A-6 147 1 
ATOM 10089 O OG1 . THR A-6 1 147 . 82.936 26.098 -27.049 1 9.78 ? OG1 THR A-6 147 1 
ATOM 10090 C CG2 . THR A-6 1 147 . 82.846 28.51 -27.376 1 9.33 ? CG2 THR A-6 147 1 
ATOM 10091 N N . THR A-6 1 148 . 79.728 29.16 -26.678 1 6.5 ? N THR A-6 148 1 
ATOM 10092 C CA . THR A-6 1 148 . 79.19 30.475 -26.993 1 6.74 ? CA THR A-6 148 1 
ATOM 10093 C C . THR A-6 1 148 . 80.089 31.525 -26.344 1 6.73 ? C THR A-6 148 1 
ATOM 10094 O O . THR A-6 1 148 . 80.757 31.263 -25.323 1 8.17 ? O THR A-6 148 1 
ATOM 10095 C CB . THR A-6 1 148 . 77.748 30.663 -26.5 1 7.06 ? CB THR A-6 148 1 
ATOM 10096 O OG1 . THR A-6 1 148 . 77.782 30.729 -25.064 1 8.84 ? OG1 THR A-6 148 1 
ATOM 10097 C CG2 . THR A-6 1 148 . 76.835 29.553 -26.977 1 7.62 ? CG2 THR A-6 148 1 
ATOM 10098 N N . LYS A-6 1 149 . 80.098 32.705 -26.923 1 7.22 ? N LYS A-6 149 1 
ATOM 10099 C CA . LYS A-6 1 149 . 80.856 33.827 -26.374 1 8.59 ? CA LYS A-6 149 1 
ATOM 10100 C C . LYS A-6 1 149 . 79.982 35.062 -26.47 1 8.3 ? C LYS A-6 149 1 
ATOM 10101 O O . LYS A-6 1 149 . 79.474 35.374 -27.54 1 9.71 ? O LYS A-6 149 1 
ATOM 10102 C CB . LYS A-6 1 149 . 82.143 34.058 -27.126 1 11.47 ? CB LYS A-6 149 1 
ATOM 10103 C CG . LYS A-6 1 149 . 83.035 35.065 -26.54 1 18.91 ? CG LYS A-6 149 1 
ATOM 10104 C CD . LYS A-6 1 149 . 84.441 35.145 -27.217 1 24.49 ? CD LYS A-6 149 1 
ATOM 10105 C CE . LYS A-6 1 149 . 85.174 33.812 -27.246 1 27.79 ? CE LYS A-6 149 1 
ATOM 10106 N NZ . LYS A-6 1 149 . 86.666 34.143 -27.584 1 30.16 ? NZ LYS A-6 149 1 
ATOM 10107 N N . ILE A-6 1 150 . 79.845 35.792 -25.363 1 8.1 ? N ILE A-6 150 1 
ATOM 10108 C CA . ILE A-6 1 150 . 79.092 37.008 -25.349 1 8.49 ? CA ILE A-6 150 1 
ATOM 10109 C C . ILE A-6 1 150 . 80.069 38.166 -25.14 1 9.29 ? C ILE A-6 150 1 
ATOM 10110 O O . ILE A-6 1 150 . 80.74 38.226 -24.114 1 14.86 ? O ILE A-6 150 1 
ATOM 10111 C CB . ILE A-6 1 150 . 77.972 36.998 -24.252 1 12.17 ? CB ILE A-6 150 1 
ATOM 10112 C CG1 . ILE A-6 1 150 . 77.218 35.687 -24.222 1 16.32 ? CG1 ILE A-6 150 1 
ATOM 10113 C CG2 . ILE A-6 1 150 . 77.1 38.297 -24.402 1 15.08 ? CG2 ILE A-6 150 1 
ATOM 10114 C CD1 . ILE A-6 1 150 . 76.49 35.424 -25.431 1 20.28 ? CD1 ILE A-6 150 1 
ATOM 10115 N N . GLU A-6 1 151 . 80.163 39.013 -26.09 0.79 7.82 ? N GLU A-6 151 1 
ATOM 10116 C CA . GLU A-6 1 151 . 81.072 40.163 -26.046 0.79 10.79 ? CA GLU A-6 151 1 
ATOM 10117 C C . GLU A-6 1 151 . 80.585 41.332 -25.295 0.79 13.76 ? C GLU A-6 151 1 
ATOM 10118 O O . GLU A-6 1 151 . 81.399 41.986 -24.573 0.79 17.94 ? O GLU A-6 151 1 
ATOM 10119 C CB . GLU A-6 1 151 . 81.555 40.504 -27.468 0.79 14.75 ? CB GLU A-6 151 1 
ATOM 10120 C CG . GLU A-6 1 151 . 82.222 41.812 -27.606 0.79 27.48 ? CG GLU A-6 151 1 
ATOM 10121 C CD . GLU A-6 1 151 . 82.373 42.31 -29.101 0.79 29.46 ? CD GLU A-6 151 1 
ATOM 10122 O OE1 . GLU A-6 1 151 . 82.755 43.485 -29.219 0.79 29.14 ? OE1 GLU A-6 151 1 
ATOM 10123 O OE2 . GLU A-6 1 151 . 82.177 41.602 -30.181 0.79 29.71 ? OE2 GLU A-6 151 1 
ATOM 10124 N N . GLY A-6 1 152 . 79.334 41.514 -25.235 1 11.58 ? N GLY A-6 152 1 
ATOM 10125 C CA . GLY A-6 1 152 . 78.63 42.651 -24.613 1 11.7 ? CA GLY A-6 152 1 
ATOM 10126 C C . GLY A-6 1 152 . 77.474 43.092 -25.512 1 8.45 ? C GLY A-6 152 1 
ATOM 10127 O O . GLY A-6 1 152 . 76.937 42.302 -26.259 1 9.67 ? O GLY A-6 152 1 
ATOM 10128 N N . TRP A-6 1 153 . 77.114 44.356 -25.315 1 8.01 ? N TRP A-6 153 1 
ATOM 10129 C CA . TRP A-6 1 153 . 75.94 44.94 -25.931 1 8.04 ? CA TRP A-6 153 1 
ATOM 10130 C C . TRP A-6 1 153 . 76.346 46.134 -26.782 1 8.17 ? C TRP A-6 153 1 
ATOM 10131 O O . TRP A-6 1 153 . 77.198 46.933 -26.377 1 12.71 ? O TRP A-6 153 1 
ATOM 10132 C CB . TRP A-6 1 153 . 74.921 45.403 -24.861 1 8.95 ? CB TRP A-6 153 1 
ATOM 10133 C CG . TRP A-6 1 153 . 74.375 44.3 -24.051 1 8.38 ? CG TRP A-6 153 1 
ATOM 10134 C CD1 . TRP A-6 1 153 . 74.905 43.753 -22.937 1 8.87 ? CD1 TRP A-6 153 1 
ATOM 10135 C CD2 . TRP A-6 1 153 . 73.203 43.548 -24.358 1 7.11 ? CD2 TRP A-6 153 1 
ATOM 10136 N NE1 . TRP A-6 1 153 . 74.131 42.695 -22.506 1 9.09 ? NE1 TRP A-6 153 1 
ATOM 10137 C CE2 . TRP A-6 1 153 . 73.083 42.551 -23.37 1 7.9 ? CE2 TRP A-6 153 1 
ATOM 10138 C CE3 . TRP A-6 1 153 . 72.227 43.601 -25.363 1 7.32 ? CE3 TRP A-6 153 1 
ATOM 10139 C CZ2 . TRP A-6 1 153 . 72.029 41.654 -23.357 1 8.09 ? CZ2 TRP A-6 153 1 
ATOM 10140 C CZ3 . TRP A-6 1 153 . 71.179 42.721 -25.319 1 7.54 ? CZ3 TRP A-6 153 1 
ATOM 10141 C CH2 . TRP A-6 1 153 . 71.098 41.747 -24.312 1 7.81 ? CH2 TRP A-6 153 1 
ATOM 10142 N N . GLY A-6 1 154 . 75.699 46.289 -27.884 1 7.35 ? N GLY A-6 154 1 
ATOM 10143 C CA . GLY A-6 1 154 . 75.726 47.498 -28.68 1 7.77 ? CA GLY A-6 154 1 
ATOM 10144 C C . GLY A-6 1 154 . 74.447 48.298 -28.564 1 6.88 ? C GLY A-6 154 1 
ATOM 10145 O O . GLY A-6 1 154 . 73.402 47.772 -28.135 1 7.17 ? O GLY A-6 154 1 
ATOM 10146 N N . ASN A-6 1 155 . 74.518 49.561 -28.94 1 7.28 ? N ASN A-6 155 1 
ATOM 10147 C CA . ASN A-6 1 155 . 73.422 50.449 -28.841 1 7.43 ? CA ASN A-6 155 1 
ATOM 10148 C C . ASN A-6 1 155 . 72.46 50.331 -30.011 1 6.97 ? C ASN A-6 155 1 
ATOM 10149 O O . ASN A-6 1 155 . 72.607 49.489 -30.925 1 7.57 ? O ASN A-6 155 1 
ATOM 10150 C CB . ASN A-6 1 155 . 73.916 51.884 -28.63 1 8.61 ? CB ASN A-6 155 1 
ATOM 10151 C CG . ASN A-6 1 155 . 74.655 52.468 -29.798 1 10.04 ? CG ASN A-6 155 1 
ATOM 10152 O OD1 . ASN A-6 1 155 . 75.345 53.531 -29.562 1 14.72 ? OD1 ASN A-6 155 1 
ATOM 10153 N ND2 . ASN A-6 1 155 . 74.559 51.98 -30.926 1 8.45 ? ND2 ASN A-6 155 1 
ATOM 10154 N N . ALA A-6 1 156 . 71.43 51.135 -30.002 1 7.3 ? N ALA A-6 156 1 
ATOM 10155 C CA . ALA A-6 1 156 . 70.384 51.034 -31.008 1 7.65 ? CA ALA A-6 156 1 
ATOM 10156 C C . ALA A-6 1 156 . 70.923 51.318 -32.386 1 7.83 ? C ALA A-6 156 1 
ATOM 10157 O O . ALA A-6 1 156 . 70.474 50.709 -33.383 1 8.21 ? O ALA A-6 156 1 
ATOM 10158 C CB . ALA A-6 1 156 . 69.234 51.999 -30.66 1 9.3 ? CB ALA A-6 156 1 
ATOM 10159 N N A GLU A-6 1 157 . 71.81 52.285 -32.578 0.56 8.06 ? N GLU A-6 157 1 
ATOM 10160 N N B GLU A-6 1 157 . 71.886 52.218 -32.451 0.44 7.89 ? N GLU A-6 157 1 
ATOM 10161 C CA A GLU A-6 1 157 . 72.408 52.516 -33.893 0.56 9.17 ? CA GLU A-6 157 1 
ATOM 10162 C CA B GLU A-6 1 157 . 72.45 52.553 -33.734 0.44 8.8 ? CA GLU A-6 157 1 
ATOM 10163 C C A GLU A-6 1 157 . 73.149 51.27 -34.357 0.56 8.6 ? C GLU A-6 157 1 
ATOM 10164 C C B GLU A-6 1 157 . 73.24 51.405 -34.347 0.44 8.83 ? C GLU A-6 157 1 
ATOM 10165 O O A GLU A-6 1 157 . 73.013 50.893 -35.529 0.56 8.06 ? O GLU A-6 157 1 
ATOM 10166 O O B GLU A-6 1 157 . 73.197 51.162 -35.559 0.44 9.77 ? O GLU A-6 157 1 
ATOM 10167 C CB A GLU A-6 1 157 . 73.336 53.75 -33.836 0.56 10.69 ? CB GLU A-6 157 1 
ATOM 10168 C CB B GLU A-6 1 157 . 73.345 53.764 -33.621 0.44 10.6 ? CB GLU A-6 157 1 
ATOM 10169 C CG A GLU A-6 1 157 . 72.583 55.067 -33.529 0.56 14.71 ? CG GLU A-6 157 1 
ATOM 10170 C CG B GLU A-6 1 157 . 74.01 54.018 -34.928 0.44 11.73 ? CG GLU A-6 157 1 
ATOM 10171 C CD A GLU A-6 1 157 . 71.521 55.541 -34.592 0.56 18.56 ? CD GLU A-6 157 1 
ATOM 10172 C CD B GLU A-6 1 157 . 73.099 54.45 -36.046 0.44 15.17 ? CD GLU A-6 157 1 
ATOM 10173 O OE1 A GLU A-6 1 157 . 70.346 56.02 -34.28 0.56 19.99 ? OE1 GLU A-6 157 1 
ATOM 10174 O OE1 B GLU A-6 1 157 . 73.631 54.599 -37.216 0.44 21.23 ? OE1 GLU A-6 157 1 
ATOM 10175 O OE2 A GLU A-6 1 157 . 71.822 55.582 -35.781 0.56 22.25 ? OE2 GLU A-6 157 1 
ATOM 10176 O OE2 B GLU A-6 1 157 . 71.906 54.705 -35.856 0.44 17.97 ? OE2 GLU A-6 157 1 
ATOM 10177 N N . GLU A-6 1 158 . 73.951 50.653 -33.52 1 8.26 ? N GLU A-6 158 1 
ATOM 10178 C CA . GLU A-6 1 158 . 74.657 49.483 -33.979 1 8.54 ? CA GLU A-6 158 1 
ATOM 10179 C C . GLU A-6 1 158 . 73.679 48.365 -34.36 1 8.14 ? C GLU A-6 158 1 
ATOM 10180 O O . GLU A-6 1 158 . 73.901 47.616 -35.315 1 8.62 ? O GLU A-6 158 1 
ATOM 10181 C CB . GLU A-6 1 158 . 75.627 48.986 -32.884 1 9.5 ? CB GLU A-6 158 1 
ATOM 10182 C CG . GLU A-6 1 158 . 76.614 48 -33.403 1 10.88 ? CG GLU A-6 158 1 
ATOM 10183 C CD . GLU A-6 1 158 . 77.819 47.72 -32.523 1 11.68 ? CD GLU A-6 158 1 
ATOM 10184 O OE1 . GLU A-6 1 158 . 77.877 48.192 -31.344 1 12.82 ? OE1 GLU A-6 158 1 
ATOM 10185 O OE2 . GLU A-6 1 158 . 78.741 47.041 -33.037 1 14.3 ? OE2 GLU A-6 158 1 
ATOM 10186 N N . ALA A-6 1 159 . 72.581 48.254 -33.6 1 6.98 ? N ALA A-6 159 1 
ATOM 10187 C CA . ALA A-6 1 159 . 71.555 47.268 -33.934 1 7.04 ? CA ALA A-6 159 1 
ATOM 10188 C C . ALA A-6 1 159 . 70.951 47.523 -35.299 1 7.02 ? C ALA A-6 159 1 
ATOM 10189 O O . ALA A-6 1 159 . 70.769 46.609 -36.11 1 7.41 ? O ALA A-6 159 1 
ATOM 10190 C CB . ALA A-6 1 159 . 70.451 47.321 -32.872 1 7.75 ? CB ALA A-6 159 1 
ATOM 10191 N N . LYS A-6 1 160 . 70.59 48.785 -35.558 1 6.96 ? N LYS A-6 160 1 
ATOM 10192 C CA . LYS A-6 1 160 . 70 49.168 -36.828 1 7.49 ? CA LYS A-6 160 1 
ATOM 10193 C C . LYS A-6 1 160 . 70.938 48.89 -37.998 1 7.88 ? C LYS A-6 160 1 
ATOM 10194 O O . LYS A-6 1 160 . 70.503 48.41 -39.045 1 8.26 ? O LYS A-6 160 1 
ATOM 10195 C CB . LYS A-6 1 160 . 69.527 50.601 -36.794 1 8.24 ? CB LYS A-6 160 1 
ATOM 10196 C CG . LYS A-6 1 160 . 68.324 50.783 -35.86 1 9 ? CG LYS A-6 160 1 
ATOM 10197 C CD . LYS A-6 1 160 . 67.81 52.19 -35.811 1 11.31 ? CD LYS A-6 160 1 
ATOM 10198 C CE . LYS A-6 1 160 . 68.756 53.144 -35.297 1 14.26 ? CE LYS A-6 160 1 
ATOM 10199 N NZ . LYS A-6 1 160 . 68.161 54.537 -35.248 1 17.19 ? NZ LYS A-6 160 1 
ATOM 10200 N N . ARG A-6 1 161 . 72.231 49.192 -37.821 1 7.94 ? N ARG A-6 161 1 
ATOM 10201 C CA . ARG A-6 1 161 . 73.181 48.865 -38.887 1 9.02 ? CA ARG A-6 161 1 
ATOM 10202 C C . ARG A-6 1 161 . 73.221 47.377 -39.153 1 7.95 ? C ARG A-6 161 1 
ATOM 10203 O O . ARG A-6 1 161 . 73.343 46.933 -40.312 1 8.5 ? O ARG A-6 161 1 
ATOM 10204 C CB . ARG A-6 1 161 . 74.549 49.401 -38.51 1 10.76 ? CB ARG A-6 161 1 
ATOM 10205 C CG . ARG A-6 1 161 . 74.638 50.91 -38.541 1 15.91 ? CG ARG A-6 161 1 
ATOM 10206 C CD . ARG A-6 1 161 . 76.111 51.454 -38.488 1 26.83 ? CD ARG A-6 161 1 
ATOM 10207 N NE . ARG A-6 1 161 . 76.823 51.132 -37.228 1 35.18 ? NE ARG A-6 161 1 
ATOM 10208 C CZ . ARG A-6 1 161 . 76.826 51.892 -36.111 1 46.06 ? CZ ARG A-6 161 1 
ATOM 10209 N NH1 . ARG A-6 1 161 . 76.224 53.08 -36.126 1 61.49 ? NH1 ARG A-6 161 1 
ATOM 10210 N NH2 . ARG A-6 1 161 . 77.479 51.491 -35.032 1 51.06 ? NH2 ARG A-6 161 1 
ATOM 10211 N N . GLU A-6 1 162 . 73.142 46.545 -38.112 1 7.13 ? N GLU A-6 162 1 
ATOM 10212 C CA . GLU A-6 1 162 . 73.184 45.125 -38.296 1 7.33 ? CA GLU A-6 162 1 
ATOM 10213 C C . GLU A-6 1 162 . 71.926 44.594 -38.98 1 6.76 ? C GLU A-6 162 1 
ATOM 10214 O O . GLU A-6 1 162 . 71.999 43.666 -39.795 1 7.13 ? O GLU A-6 162 1 
ATOM 10215 C CB . GLU A-6 1 162 . 73.476 44.385 -37.007 1 7.46 ? CB GLU A-6 162 1 
ATOM 10216 C CG . GLU A-6 1 162 . 74.07 42.99 -37.22 1 7.52 ? CG GLU A-6 162 1 
ATOM 10217 C CD . GLU A-6 1 162 . 75.476 42.979 -37.781 1 8.3 ? CD GLU A-6 162 1 
ATOM 10218 O OE1 . GLU A-6 1 162 . 76.092 44.077 -37.87 1 10.45 ? OE1 GLU A-6 162 1 
ATOM 10219 O OE2 . GLU A-6 1 162 . 75.966 41.87 -38.053 1 8.26 ? OE2 GLU A-6 162 1 
ATOM 10220 N N . ILE A-6 1 163 . 70.774 45.177 -38.664 1 6.57 ? N ILE A-6 163 1 
ATOM 10221 C CA . ILE A-6 1 163 . 69.544 44.83 -39.364 1 6.37 ? CA ILE A-6 163 1 
ATOM 10222 C C . ILE A-6 1 163 . 69.725 45.086 -40.864 1 6.92 ? C ILE A-6 163 1 
ATOM 10223 O O . ILE A-6 1 163 . 69.359 44.237 -41.687 1 7.33 ? O ILE A-6 163 1 
ATOM 10224 C CB . ILE A-6 1 163 . 68.371 45.637 -38.797 1 7.08 ? CB ILE A-6 163 1 
ATOM 10225 C CG1 . ILE A-6 1 163 . 68.024 45.186 -37.373 1 6.6 ? CG1 ILE A-6 163 1 
ATOM 10226 C CG2 . ILE A-6 1 163 . 67.16 45.579 -39.717 1 7.57 ? CG2 ILE A-6 163 1 
ATOM 10227 C CD1 . ILE A-6 1 163 . 67.149 46.123 -36.593 1 7.43 ? CD1 ILE A-6 163 1 
ATOM 10228 N N . LEU A-6 1 164 . 70.276 46.232 -41.234 1 7.17 ? N LEU A-6 164 1 
ATOM 10229 C CA . LEU A-6 1 164 . 70.464 46.506 -42.67 1 7.92 ? CA LEU A-6 164 1 
ATOM 10230 C C . LEU A-6 1 164 . 71.383 45.498 -43.276 1 7.73 ? C LEU A-6 164 1 
ATOM 10231 O O . LEU A-6 1 164 . 71.09 45.044 -44.424 1 8.39 ? O LEU A-6 164 1 
ATOM 10232 C CB . LEU A-6 1 164 . 71.021 47.922 -42.824 1 9.68 ? CB LEU A-6 164 1 
ATOM 10233 C CG . LEU A-6 1 164 . 70.067 49.027 -42.422 1 10.69 ? CG LEU A-6 164 1 
ATOM 10234 C CD1 . LEU A-6 1 164 . 70.785 50.374 -42.522 1 14.89 ? CD1 LEU A-6 164 1 
ATOM 10235 C CD2 . LEU A-6 1 164 . 68.798 49.045 -43.212 1 13.66 ? CD2 LEU A-6 164 1 
ATOM 10236 N N . ARG A-6 1 165 . 72.439 45.077 -42.619 1 7.53 ? N ARG A-6 165 1 
ATOM 10237 C CA . ARG A-6 1 165 . 73.327 44.031 -43.151 1 7.54 ? CA ARG A-6 165 1 
ATOM 10238 C C . ARG A-6 1 165 . 72.561 42.744 -43.367 1 7.52 ? C ARG A-6 165 1 
ATOM 10239 O O . ARG A-6 1 165 . 72.714 42.099 -44.429 1 8.14 ? O ARG A-6 165 1 
ATOM 10240 C CB . ARG A-6 1 165 . 74.468 43.803 -42.176 1 8.17 ? CB ARG A-6 165 1 
ATOM 10241 C CG . ARG A-6 1 165 . 75.324 42.604 -42.539 1 9.58 ? CG ARG A-6 165 1 
ATOM 10242 C CD . ARG A-6 1 165 . 76.534 42.461 -41.645 1 10.42 ? CD ARG A-6 165 1 
ATOM 10243 N NE . ARG A-6 1 165 . 77.32 41.273 -42.055 0.93 10.16 ? NE ARG A-6 165 1 
ATOM 10244 C CZ . ARG A-6 1 165 . 77.332 40.065 -41.462 0.88 8.73 ? CZ ARG A-6 165 1 
ATOM 10245 N NH1 . ARG A-6 1 165 . 77.99 39.068 -42.013 1 10.57 ? NH1 ARG A-6 165 1 
ATOM 10246 N NH2 . ARG A-6 1 165 . 76.758 39.894 -40.278 1 10.08 ? NH2 ARG A-6 165 1 
ATOM 10247 N N . ALA A-6 1 166 . 71.773 42.315 -42.391 1 7.02 ? N ALA A-6 166 1 
ATOM 10248 C CA . ALA A-6 1 166 . 71.069 41.033 -42.465 1 6.68 ? CA ALA A-6 166 1 
ATOM 10249 C C . ALA A-6 1 166 . 70.043 41.027 -43.596 1 6.82 ? C ALA A-6 166 1 
ATOM 10250 O O . ALA A-6 1 166 . 69.806 39.996 -44.234 1 7.05 ? O ALA A-6 166 1 
ATOM 10251 C CB . ALA A-6 1 166 . 70.448 40.728 -41.127 1 7.28 ? CB ALA A-6 166 1 
ATOM 10252 N N . ILE A-6 1 167 . 69.395 42.177 -43.827 1 7.08 ? N ILE A-6 167 1 
ATOM 10253 C CA . ILE A-6 1 167 . 68.464 42.32 -44.931 1 7.36 ? CA ILE A-6 167 1 
ATOM 10254 C C . ILE A-6 1 167 . 69.201 42.11 -46.283 1 7.73 ? C ILE A-6 167 1 
ATOM 10255 O O . ILE A-6 1 167 . 68.677 41.419 -47.162 1 8.71 ? O ILE A-6 167 1 
ATOM 10256 C CB . ILE A-6 1 167 . 67.793 43.69 -44.878 1 8 ? CB ILE A-6 167 1 
ATOM 10257 C CG1 . ILE A-6 1 167 . 66.805 43.694 -43.695 1 8.5 ? CG1 ILE A-6 167 1 
ATOM 10258 C CG2 . ILE A-6 1 167 . 67.141 44.096 -46.173 1 9.65 ? CG2 ILE A-6 167 1 
ATOM 10259 C CD1 . ILE A-6 1 167 . 66.181 45.021 -43.425 1 10.01 ? CD1 ILE A-6 167 1 
ATOM 10260 N N . GLU A-6 1 168 . 70.4 42.671 -46.405 1 8.34 ? N GLU A-6 168 1 
ATOM 10261 C CA . GLU A-6 1 168 . 71.167 42.473 -47.64 1 8.74 ? CA GLU A-6 168 1 
ATOM 10262 C C . GLU A-6 1 168 . 71.66 41.024 -47.767 1 8.52 ? C GLU A-6 168 1 
ATOM 10263 O O . GLU A-6 1 168 . 71.728 40.519 -48.898 1 10.05 ? O GLU A-6 168 1 
ATOM 10264 C CB . GLU A-6 1 168 . 72.347 43.435 -47.699 1 9.72 ? CB GLU A-6 168 1 
ATOM 10265 C CG . GLU A-6 1 168 . 71.898 44.885 -47.745 1 11.73 ? CG GLU A-6 168 1 
ATOM 10266 C CD . GLU A-6 1 168 . 70.919 45.191 -48.866 1 12.77 ? CD GLU A-6 168 1 
ATOM 10267 O OE1 . GLU A-6 1 168 . 69.857 45.874 -48.616 1 16.08 ? OE1 GLU A-6 168 1 
ATOM 10268 O OE2 . GLU A-6 1 168 . 71.086 44.667 -49.987 1 12.98 ? OE2 GLU A-6 168 1 
ATOM 10269 N N . MET A-6 1 169 . 71.96 40.371 -46.665 1 8.29 ? N MET A-6 169 1 
ATOM 10270 C CA . MET A-6 1 169 . 72.38 38.958 -46.736 1 8.29 ? CA MET A-6 169 1 
ATOM 10271 C C . MET A-6 1 169 . 71.276 38.072 -47.282 1 8.32 ? C MET A-6 169 1 
ATOM 10272 O O . MET A-6 1 169 . 71.525 37.136 -48.043 1 9.23 ? O MET A-6 169 1 
ATOM 10273 C CB . MET A-6 1 169 . 72.868 38.455 -45.374 1 8.62 ? CB MET A-6 169 1 
ATOM 10274 C CG . MET A-6 1 169 . 74.136 39.116 -44.877 1 10.2 ? CG MET A-6 169 1 
ATOM 10275 S SD . MET A-6 1 169 . 74.658 38.628 -43.239 1 11.37 ? SD MET A-6 169 1 
ATOM 10276 C CE . MET A-6 1 169 . 75.146 37.016 -43.561 1 14.74 ? CE MET A-6 169 1 
ATOM 10277 N N . TYR A-6 1 170 . 70.027 38.355 -46.92 1 7.89 ? N TYR A-6 170 1 
ATOM 10278 C CA . TYR A-6 1 170 . 68.908 37.631 -47.499 1 7.78 ? CA TYR A-6 170 1 
ATOM 10279 C C . TYR A-6 1 170 . 68.78 37.859 -48.983 1 9.1 ? C TYR A-6 170 1 
ATOM 10280 O O . TYR A-6 1 170 . 68.564 36.937 -49.756 1 10.18 ? O TYR A-6 170 1 
ATOM 10281 C CB . TYR A-6 1 170 . 67.603 38.057 -46.776 1 8.41 ? CB TYR A-6 170 1 
ATOM 10282 C CG . TYR A-6 1 170 . 66.352 37.418 -47.357 1 8.3 ? CG TYR A-6 170 1 
ATOM 10283 C CD1 . TYR A-6 1 170 . 65.713 37.977 -48.446 1 9.52 ? CD1 TYR A-6 170 1 
ATOM 10284 C CD2 . TYR A-6 1 170 . 65.846 36.241 -46.84 1 8.66 ? CD2 TYR A-6 170 1 
ATOM 10285 C CE1 . TYR A-6 1 170 . 64.574 37.382 -48.974 1 10.76 ? CE1 TYR A-6 170 1 
ATOM 10286 C CE2 . TYR A-6 1 170 . 64.708 35.647 -47.377 1 9.44 ? CE2 TYR A-6 170 1 
ATOM 10287 C CZ . TYR A-6 1 170 . 64.12 36.182 -48.49 1 10.21 ? CZ TYR A-6 170 1 
ATOM 10288 O OH . TYR A-6 1 170 . 63.008 35.643 -49.074 1 12.23 ? OH TYR A-6 170 1 
ATOM 10289 N N . LYS A-6 1 171 . 68.889 39.134 -49.43 1 10 ? N LYS A-6 171 1 
ATOM 10290 C CA . LYS A-6 1 171 . 68.797 39.425 -50.861 1 12.97 ? CA LYS A-6 171 1 
ATOM 10291 C C . LYS A-6 1 171 . 69.865 38.659 -51.634 1 14.25 ? C LYS A-6 171 1 
ATOM 10292 O O . LYS A-6 1 171 . 69.562 38.185 -52.723 1 16.52 ? O LYS A-6 171 1 
ATOM 10293 C CB . LYS A-6 1 171 . 68.882 40.924 -51.078 1 13.85 ? CB LYS A-6 171 1 
ATOM 10294 C CG . LYS A-6 1 171 . 67.735 41.695 -50.575 1 14.74 ? CG LYS A-6 171 1 
ATOM 10295 C CD . LYS A-6 1 171 . 67.972 43.199 -50.717 1 24.07 ? CD LYS A-6 171 1 
ATOM 10296 C CE . LYS A-6 1 171 . 66.914 44.032 -50.076 1 44.24 ? CE LYS A-6 171 1 
ATOM 10297 N NZ . LYS A-6 1 171 . 67.245 45.469 -50.144 1 60.91 ? NZ LYS A-6 171 1 
ATOM 10298 N N . GLU A-6 1 172 . 71.06 38.594 -51.078 1 13.58 ? N GLU A-6 172 1 
ATOM 10299 C CA . GLU A-6 1 172 . 72.132 37.948 -51.767 1 14.99 ? CA GLU A-6 172 1 
ATOM 10300 C C . GLU A-6 1 172 . 71.893 36.477 -51.821 1 17.08 ? C GLU A-6 172 1 
ATOM 10301 O O . GLU A-6 1 172 . 72.102 35.806 -52.864 1 22.94 ? O GLU A-6 172 1 
ATOM 10302 C CB . GLU A-6 1 172 . 73.434 38.316 -51.087 1 14.62 ? CB GLU A-6 172 1 
ATOM 10303 C CG . GLU A-6 1 172 . 74.631 37.698 -51.709 1 14.81 ? CG GLU A-6 172 1 
ATOM 10304 C CD . GLU A-6 1 172 . 74.839 38.078 -53.219 1 15.18 ? CD GLU A-6 172 1 
ATOM 10305 O OE1 . GLU A-6 1 172 . 75.549 37.257 -53.857 1 18.01 ? OE1 GLU A-6 172 1 
ATOM 10306 O OE2 . GLU A-6 1 172 . 74.333 39.151 -53.64 1 18.82 ? OE2 GLU A-6 172 1 
ATOM 10307 N N . LYS A-6 1 173 . 71.386 35.887 -50.725 1 16.19 ? N LYS A-6 173 1 
ATOM 10308 C CA . LYS A-6 1 173 . 71.169 34.464 -50.693 1 19.04 ? CA LYS A-6 173 1 
ATOM 10309 C C . LYS A-6 1 173 . 69.985 33.972 -51.559 1 18.27 ? C LYS A-6 173 1 
ATOM 10310 O O . LYS A-6 1 173 . 70.071 32.997 -52.291 1 24.3 ? O LYS A-6 173 1 
ATOM 10311 C CB . LYS A-6 1 173 . 70.979 33.937 -49.276 1 30.69 ? CB LYS A-6 173 1 
ATOM 10312 C CG . LYS A-6 1 173 . 70.621 32.453 -49.205 1 54.54 ? CG LYS A-6 173 1 
ATOM 10313 C CD . LYS A-6 1 173 . 71.292 31.704 -48.134 1 76.44 ? CD LYS A-6 173 1 
ATOM 10314 C CE . LYS A-6 1 173 . 70.955 30.254 -48.217 1 97.97 ? CE LYS A-6 173 1 
ATOM 10315 N NZ . LYS A-6 1 173 . 72.104 29.448 -48.623 1 119.88 ? NZ LYS A-6 173 1 
ATOM 10316 N N . PHE A-6 1 174 . 68.894 34.658 -51.434 1 15.43 ? N PHE A-6 174 1 
ATOM 10317 C CA . PHE A-6 1 174 . 67.636 34.231 -52.045 1 18.59 ? CA PHE A-6 174 1 
ATOM 10318 C C . PHE A-6 1 174 . 67.364 35.135 -53.289 1 27.35 ? C PHE A-6 174 1 
ATOM 10319 C CB . PHE A-6 1 174 . 66.52 34.297 -51.068 1 16.46 ? CB PHE A-6 174 1 
ATOM 10320 C CG . PHE A-6 1 174 . 66.71 33.324 -49.966 1 15.09 ? CG PHE A-6 174 1 
ATOM 10321 C CD1 . PHE A-6 1 174 . 66.406 31.96 -50.109 1 16.67 ? CD1 PHE A-6 174 1 
ATOM 10322 C CD2 . PHE A-6 1 174 . 67.194 33.766 -48.717 1 15.63 ? CD2 PHE A-6 174 1 
ATOM 10323 C CE1 . PHE A-6 1 174 . 66.607 31.09 -49.126 1 18.55 ? CE1 PHE A-6 174 1 
ATOM 10324 C CE2 . PHE A-6 1 174 . 67.328 32.887 -47.667 1 16.2 ? CE2 PHE A-6 174 1 
ATOM 10325 C CZ . PHE A-6 1 174 . 67.077 31.523 -47.808 1 18.16 ? CZ PHE A-6 174 1 
ATOM 10326 N N . GLY A-6 1 175 . 68.328 35.876 -53.821 1 29.76 ? N GLY A-6 175 1 
ATOM 10327 C CA . GLY A-6 1 175 . 68.177 36.392 -55.208 1 29.86 ? CA GLY A-6 175 1 
ATOM 10328 C C . GLY A-6 1 175 . 68.548 35.223 -56.117 1 30.3 ? C GLY A-6 175 1 
ATOM 10329 O O . GLY A-6 1 175 . 67.962 34.98 -57.21 1 30.14 ? O GLY A-6 175 1 
ATOM 10330 N N . LYS A-6 1 176 . 69.556 34.439 -55.711 0.82 37.57 ? N LYS A-6 176 1 
ATOM 10331 C CA . LYS A-6 1 176 . 69.943 33.221 -56.434 0.85 33.27 ? CA LYS A-6 176 1 
ATOM 10332 C C . LYS A-6 1 176 . 69.175 32.035 -55.844 0.84 33.34 ? C LYS A-6 176 1 
ATOM 10333 O O . LYS A-6 1 176 . 68.554 31.264 -56.609 0.73 34.6 ? O LYS A-6 176 1 
ATOM 10334 C CB . LYS A-6 1 176 . 71.453 32.986 -56.389 0.85 30.77 ? CB LYS A-6 176 1 
ATOM 10335 C CG . LYS A-6 1 176 . 72.338 34.196 -56.126 0.87 28.43 ? CG LYS A-6 176 1 
ATOM 10336 C CD . LYS A-6 1 176 . 72.619 34.234 -54.677 0.83 27.66 ? CD LYS A-6 176 1 
ATOM 10337 C CE . LYS A-6 1 176 . 74.081 34.016 -54.405 0.81 27.26 ? CE LYS A-6 176 1 
ATOM 10338 N NZ . LYS A-6 1 176 . 74.81 34.686 -55.566 0.85 28.19 ? NZ LYS A-6 176 1 
ATOM 10339 N N . GLU A-6 1 177 . 69.167 31.897 -54.496 0.81 33.42 ? N GLU A-6 177 1 
ATOM 10340 C CA . GLU A-6 1 177 . 68.42 30.748 -53.872 0.85 31.59 ? CA GLU A-6 177 1 
ATOM 10341 C C . GLU A-6 1 177 . 66.933 30.905 -54.212 0.83 32.11 ? C GLU A-6 177 1 
ATOM 10342 O O . GLU A-6 1 177 . 66.536 30.778 -55.387 0.69 34.38 ? O GLU A-6 177 1 
ATOM 10343 C CB . GLU A-6 1 177 . 68.563 30.682 -52.364 0.85 28.63 ? CB GLU A-6 177 1 
ATOM 10344 C CG . GLU A-6 1 177 . 69.53 29.683 -51.725 0.89 29.06 ? CG GLU A-6 177 1 
ATOM 10345 C CD . GLU A-6 1 177 . 68.794 28.389 -51.348 0.85 30.59 ? CD GLU A-6 177 1 
ATOM 10346 O OE1 . GLU A-6 1 177 . 69.393 27.298 -51.275 0.7 33.43 ? OE1 GLU A-6 177 1 
ATOM 10347 O OE2 . GLU A-6 1 177 . 67.542 28.421 -51.135 0.73 32.65 ? OE2 GLU A-6 177 1 
ATOM 10348 N N . GLU A-6 1 178 . 66.124 31.201 -53.201 0.74 30.04 ? N GLU A-6 178 1 
ATOM 10349 C CA . GLU A-6 1 178 . 64.702 31.436 -53.404 0.87 29.37 ? CA GLU A-6 178 1 
ATOM 10350 C C . GLU A-6 1 178 . 64.452 32.863 -53.885 0.81 29.87 ? C GLU A-6 178 1 
ATOM 10351 O O . GLU A-6 1 178 . 63.391 33.437 -53.639 0.7 29.95 ? O GLU A-6 178 1 
ATOM 10352 C CB . GLU A-6 1 178 . 63.928 31.161 -52.113 0.54 20.61 ? CB GLU A-6 178 1 
ATOM 10353 C CG . GLU A-6 1 178 . 62.805 32.142 -51.833 0.63 20.13 ? CG GLU A-6 178 1 
ATOM 10354 C CD . GLU A-6 1 178 . 61.457 31.606 -52.257 0.56 20.13 ? CD GLU A-6 178 1 
ATOM 10355 O OE1 . GLU A-6 1 178 . 60.911 32.101 -53.264 0.2 20.18 ? OE1 GLU A-6 178 1 
ATOM 10356 O OE2 . GLU A-6 1 178 . 60.948 30.684 -51.588 0.25 20.19 ? OE2 GLU A-6 178 1 
HETATM 10357 P P . PO4 B 2 . . 37.908 12.55 0.809 1 5.28 ? P PO4 A 301 1 
HETATM 10358 O O1 . PO4 B 2 . . 37.987 13.914 0.106 1 5.3 ? O1 PO4 A 301 1 
HETATM 10359 O O2 . PO4 B 2 . . 36.751 11.671 0.334 1 5.32 ? O2 PO4 A 301 1 
HETATM 10360 O O3 . PO4 B 2 . . 39.239 11.821 0.7 1 5.92 ? O3 PO4 A 301 1 
HETATM 10361 O O4 . PO4 B 2 . . 37.526 12.921 2.261 1 5.37 ? O4 PO4 A 301 1 
HETATM 10362 P P . PO4 B-2 2 . . 69.43 26.554 0.809 1 5.28 ? P PO4 A-2 301 1 
HETATM 10363 O O1 . PO4 B-2 2 . . 68.21 25.941 0.106 1 5.3 ? O1 PO4 A-2 301 1 
HETATM 10364 O O2 . PO4 B-2 2 . . 70.77 25.992 0.334 1 5.32 ? O2 PO4 A-2 301 1 
HETATM 10365 O O3 . PO4 B-2 2 . . 69.396 28.071 0.7 1 5.92 ? O3 PO4 A-2 301 1 
HETATM 10366 O O4 . PO4 B-2 2 . . 69.3 26.038 2.261 1 5.37 ? O4 PO4 A-2 301 1 
HETATM 10367 P P . PO4 B-3 2 . . 41.541 46.851 0.809 1 5.28 ? P PO4 A-3 301 1 
HETATM 10368 O O1 . PO4 B-3 2 . . 42.683 46.101 0.106 1 5.3 ? O1 PO4 A-3 301 1 
HETATM 10369 O O2 . PO4 B-3 2 . . 41.358 48.293 0.334 1 5.32 ? O2 PO4 A-3 301 1 
HETATM 10370 O O3 . PO4 B-3 2 . . 40.244 46.063 0.7 1 5.92 ? O3 PO4 A-3 301 1 
HETATM 10371 O O4 . PO4 B-3 2 . . 42.053 46.997 2.261 1 5.37 ? O4 PO4 A-3 301 1 
HETATM 10372 P P . PO4 B-4 2 . . 41.541 10.452 -33.661 1 5.28 ? P PO4 A-4 301 1 
HETATM 10373 O O1 . PO4 B-4 2 . . 42.683 11.203 -32.958 1 5.3 ? O1 PO4 A-4 301 1 
HETATM 10374 O O2 . PO4 B-4 2 . . 41.358 9.011 -33.186 1 5.32 ? O2 PO4 A-4 301 1 
HETATM 10375 O O3 . PO4 B-4 2 . . 40.244 11.241 -33.552 1 5.92 ? O3 PO4 A-4 301 1 
HETATM 10376 O O4 . PO4 B-4 2 . . 42.053 10.307 -35.113 1 5.37 ? O4 PO4 A-4 301 1 
HETATM 10377 P P . PO4 B-5 2 . . 37.908 44.754 -33.661 1 5.28 ? P PO4 A-5 301 1 
HETATM 10378 O O1 . PO4 B-5 2 . . 37.987 43.39 -32.958 1 5.3 ? O1 PO4 A-5 301 1 
HETATM 10379 O O2 . PO4 B-5 2 . . 36.751 45.633 -33.186 1 5.32 ? O2 PO4 A-5 301 1 
HETATM 10380 O O3 . PO4 B-5 2 . . 39.239 45.483 -33.552 1 5.92 ? O3 PO4 A-5 301 1 
HETATM 10381 O O4 . PO4 B-5 2 . . 37.526 44.383 -35.113 1 5.37 ? O4 PO4 A-5 301 1 
HETATM 10382 P P . PO4 B-6 2 . . 69.43 30.749 -33.661 1 5.28 ? P PO4 A-6 301 1 
HETATM 10383 O O1 . PO4 B-6 2 . . 68.21 31.363 -32.958 1 5.3 ? O1 PO4 A-6 301 1 
HETATM 10384 O O2 . PO4 B-6 2 . . 70.77 31.312 -33.186 1 5.32 ? O2 PO4 A-6 301 1 
HETATM 10385 O O3 . PO4 B-6 2 . . 69.396 29.232 -33.552 1 5.92 ? O3 PO4 A-6 301 1 
HETATM 10386 O O4 . PO4 B-6 2 . . 69.3 31.266 -35.113 1 5.37 ? O4 PO4 A-6 301 1 
HETATM 10387 MG MG . MG C 3 . . 37.802 15.006 2 1 5.01 ? MG MG A 305 1 
HETATM 10388 MG MG . MG D 3 . . 35.488 12.192 2.025 1 4.99 ? MG MG A 306 1 
HETATM 10389 MG MG . MG E 3 . . 36.575 9.822 -0.537 1 5.54 ? MG MG A 307 1 
HETATM 10390 MG MG . MG F 3 . . 40.764 11.16 1.839 1 7.18 ? MG MG A 308 1 
HETATM 10391 MG MG . MG C-2 3 . . 67.356 25.234 2 1 5.01 ? MG MG A-2 305 1 
HETATM 10392 MG MG . MG D-2 3 . . 70.95 24.638 2.025 1 4.99 ? MG MG A-2 306 1 
HETATM 10393 MG MG . MG E-2 3 . . 72.459 26.764 -0.537 1 5.54 ? MG MG A-2 307 1 
HETATM 10394 MG MG . MG F-2 3 . . 69.206 29.723 1.839 1 7.18 ? MG MG A-2 308 1 
HETATM 10395 MG MG . MG C-3 3 . . 43.721 45.715 2 1 5.01 ? MG MG A-3 305 1 
HETATM 10396 MG MG . MG D-3 3 . . 42.441 49.126 2.025 1 4.99 ? MG MG A-3 306 1 
HETATM 10397 MG MG . MG E-3 3 . . 39.845 49.37 -0.537 1 5.54 ? MG MG A-3 307 1 
HETATM 10398 MG MG . MG F-3 3 . . 38.909 45.073 1.839 1 7.18 ? MG MG A-3 308 1 
HETATM 10399 MG MG . MG C-4 3 . . 43.721 11.589 -34.852 1 5.01 ? MG MG A-4 305 1 
HETATM 10400 MG MG . MG D-4 3 . . 42.441 8.178 -34.877 1 4.99 ? MG MG A-4 306 1 
HETATM 10401 MG MG . MG E-4 3 . . 39.845 7.934 -32.315 1 5.54 ? MG MG A-4 307 1 
HETATM 10402 MG MG . MG F-4 3 . . 38.909 12.231 -34.691 1 7.18 ? MG MG A-4 308 1 
HETATM 10403 MG MG . MG C-5 3 . . 37.802 42.298 -34.852 1 5.01 ? MG MG A-5 305 1 
HETATM 10404 MG MG . MG D-5 3 . . 35.488 45.112 -34.877 1 4.99 ? MG MG A-5 306 1 
HETATM 10405 MG MG . MG E-5 3 . . 36.575 47.482 -32.315 1 5.54 ? MG MG A-5 307 1 
HETATM 10406 MG MG . MG F-5 3 . . 40.764 46.144 -34.691 1 7.18 ? MG MG A-5 308 1 
HETATM 10407 MG MG . MG C-6 3 . . 67.356 32.069 -34.852 1 5.01 ? MG MG A-6 305 1 
HETATM 10408 MG MG . MG D-6 3 . . 70.95 32.666 -34.877 1 4.99 ? MG MG A-6 306 1 
HETATM 10409 MG MG . MG E-6 3 . . 72.459 30.54 -32.315 1 5.54 ? MG MG A-6 307 1 
HETATM 10410 MG MG . MG F-6 3 . . 69.206 27.581 -34.691 1 7.18 ? MG MG A-6 308 1 
HETATM 10411 N N1 . EPE G 4 . . 39.349 4.747 3.273 0.59 11.13 ? N1 EPE A 309 1 
HETATM 10412 C C2 . EPE G 4 . . 38.788 5.878 4.167 0.55 10.6 ? C2 EPE A 309 1 
HETATM 10413 C C3 . EPE G 4 . . 38.512 5.422 5.562 0.56 11.49 ? C3 EPE A 309 1 
HETATM 10414 N N4 . EPE G 4 . . 37.59 4.228 5.54 0.59 10.39 ? N4 EPE A 309 1 
HETATM 10415 C C5 . EPE G 4 . . 38.024 3.188 4.643 0.69 12.02 ? C5 EPE A 309 1 
HETATM 10416 C C6 . EPE G 4 . . 38.38 3.618 3.272 0.64 12.98 ? C6 EPE A 309 1 
HETATM 10417 C C7 . EPE G 4 . . 37.313 3.772 6.963 0.56 12.26 ? C7 EPE A 309 1 
HETATM 10418 C C8 . EPE G 4 . . 36.101 4.556 7.681 0.8 16.83 ? C8 EPE A 309 1 
HETATM 10419 O O8 . EPE G 4 . . 36.541 5.751 8.107 0.43 16.23 ? O8 EPE A 309 1 
HETATM 10420 C C9 . EPE G 4 . . 39.396 5.239 1.859 0.71 12.41 ? C9 EPE A 309 1 
HETATM 10421 C C10 . EPE G 4 . . 40.659 6.1 1.716 0.5 11.34 ? C10 EPE A 309 1 
HETATM 10422 S S . EPE G 4 . . 40.931 6.566 0 0.33 7.95 ? S EPE A 309 1 
HETATM 10423 O O1S . EPE G 4 . . 41.178 5.404 -0.784 0.4 9.64 ? O1S EPE A 309 1 
HETATM 10424 O O2S . EPE G 4 . . 42.03 7.49 0.193 0.4 9.92 ? O2S EPE A 309 1 
HETATM 10425 O O3S . EPE G 4 . . 39.706 7.233 -0.434 0.39 9.5 ? O3S EPE A 309 1 
HETATM 10426 N N1 . EPE G-2 4 . . 75.467 31.704 3.273 0.59 11.13 ? N1 EPE A-2 309 1 
HETATM 10427 C C2 . EPE G-2 4 . . 74.769 30.652 4.167 0.55 10.6 ? C2 EPE A-2 309 1 
HETATM 10428 C C3 . EPE G-2 4 . . 75.301 30.641 5.562 0.56 11.49 ? C3 EPE A-2 309 1 
HETATM 10429 N N4 . EPE G-2 4 . . 76.796 30.44 5.54 0.59 10.39 ? N4 EPE A-2 309 1 
HETATM 10430 C C5 . EPE G-2 4 . . 77.48 31.336 4.643 0.69 12.02 ? C5 EPE A-2 309 1 
HETATM 10431 C C6 . EPE G-2 4 . . 76.93 31.429 3.272 0.64 12.98 ? C6 EPE A-2 309 1 
HETATM 10432 C C7 . EPE G-2 4 . . 77.33 30.428 6.963 0.56 12.26 ? C7 EPE A-2 309 1 
HETATM 10433 C C8 . EPE G-2 4 . . 77.257 28.986 7.681 0.8 16.83 ? C8 EPE A-2 309 1 
HETATM 10434 O O8 . EPE G-2 4 . . 76.002 28.77 8.107 0.43 16.23 ? O8 EPE A-2 309 1 
HETATM 10435 C C9 . EPE G-2 4 . . 75.018 31.498 1.859 0.71 12.41 ? C9 EPE A-2 309 1 
HETATM 10436 C C10 . EPE G-2 4 . . 73.641 32.162 1.716 0.5 11.34 ? C10 EPE A-2 309 1 
HETATM 10437 S S . EPE G-2 4 . . 73.101 32.164 0 0.33 7.95 ? S EPE A-2 309 1 
HETATM 10438 O O1S . EPE G-2 4 . . 73.984 32.959 -0.784 0.4 9.64 ? O1S EPE A-2 309 1 
HETATM 10439 O O2S . EPE G-2 4 . . 71.751 32.654 0.193 0.4 9.92 ? O2S EPE A-2 309 1 
HETATM 10440 O O3S . EPE G-2 4 . . 73.136 30.77 -0.434 0.39 9.5 ? O3S EPE A-2 309 1 
HETATM 10441 N N1 . EPE G-3 4 . . 34.063 49.505 3.273 0.59 11.13 ? N1 EPE A-3 309 1 
HETATM 10442 C C2 . EPE G-3 4 . . 35.323 49.425 4.167 0.55 10.6 ? C2 EPE A-3 309 1 
HETATM 10443 C C3 . EPE G-3 4 . . 35.066 49.892 5.562 0.56 11.49 ? C3 EPE A-3 309 1 
HETATM 10444 N N4 . EPE G-3 4 . . 34.493 51.288 5.54 0.59 10.39 ? N4 EPE A-3 309 1 
HETATM 10445 C C5 . EPE G-3 4 . . 33.375 51.432 4.643 0.69 12.02 ? C5 EPE A-3 309 1 
HETATM 10446 C C6 . EPE G-3 4 . . 33.57 50.909 3.272 0.64 12.98 ? C6 EPE A-3 309 1 
HETATM 10447 C C7 . EPE G-3 4 . . 34.237 51.756 6.963 0.56 12.26 ? C7 EPE A-3 309 1 
HETATM 10448 C C8 . EPE G-3 4 . . 35.522 52.413 7.681 0.8 16.83 ? C8 EPE A-3 309 1 
HETATM 10449 O O8 . EPE G-3 4 . . 36.337 51.435 8.107 0.43 16.23 ? O8 EPE A-3 309 1 
HETATM 10450 C C9 . EPE G-3 4 . . 34.466 49.218 1.859 0.71 12.41 ? C9 EPE A-3 309 1 
HETATM 10451 C C10 . EPE G-3 4 . . 34.58 47.694 1.716 0.5 11.34 ? C10 EPE A-3 309 1 
HETATM 10452 S S . EPE G-3 4 . . 34.847 47.225 0 0.33 7.95 ? S EPE A-3 309 1 
HETATM 10453 O O1S . EPE G-3 4 . . 33.717 47.592 -0.784 0.4 9.64 ? O1S EPE A-3 309 1 
HETATM 10454 O O2S . EPE G-3 4 . . 35.098 45.812 0.193 0.4 9.92 ? O2S EPE A-3 309 1 
HETATM 10455 O O3S . EPE G-3 4 . . 36.037 47.953 -0.434 0.39 9.5 ? O3S EPE A-3 309 1 
HETATM 10456 N N1 . EPE G-4 4 . . 34.063 7.799 -36.125 0.59 11.13 ? N1 EPE A-4 309 1 
HETATM 10457 C C2 . EPE G-4 4 . . 35.323 7.879 -37.019 0.55 10.6 ? C2 EPE A-4 309 1 
HETATM 10458 C C3 . EPE G-4 4 . . 35.066 7.411 -38.414 0.56 11.49 ? C3 EPE A-4 309 1 
HETATM 10459 N N4 . EPE G-4 4 . . 34.493 6.016 -38.392 0.59 10.39 ? N4 EPE A-4 309 1 
HETATM 10460 C C5 . EPE G-4 4 . . 33.375 5.872 -37.495 0.69 12.02 ? C5 EPE A-4 309 1 
HETATM 10461 C C6 . EPE G-4 4 . . 33.57 6.395 -36.124 0.64 12.98 ? C6 EPE A-4 309 1 
HETATM 10462 C C7 . EPE G-4 4 . . 34.237 5.548 -39.815 0.56 12.26 ? C7 EPE A-4 309 1 
HETATM 10463 C C8 . EPE G-4 4 . . 35.522 4.891 -40.533 0.8 16.83 ? C8 EPE A-4 309 1 
HETATM 10464 O O8 . EPE G-4 4 . . 36.337 5.869 -40.959 0.43 16.23 ? O8 EPE A-4 309 1 
HETATM 10465 C C9 . EPE G-4 4 . . 34.466 8.086 -34.711 0.71 12.41 ? C9 EPE A-4 309 1 
HETATM 10466 C C10 . EPE G-4 4 . . 34.58 9.61 -34.568 0.5 11.34 ? C10 EPE A-4 309 1 
HETATM 10467 S S . EPE G-4 4 . . 34.847 10.078 -32.852 0.33 7.95 ? S EPE A-4 309 1 
HETATM 10468 O O1S . EPE G-4 4 . . 33.717 9.711 -32.068 0.4 9.64 ? O1S EPE A-4 309 1 
HETATM 10469 O O2S . EPE G-4 4 . . 35.098 11.492 -33.045 0.4 9.92 ? O2S EPE A-4 309 1 
HETATM 10470 O O3S . EPE G-4 4 . . 36.037 9.351 -32.418 0.39 9.5 ? O3S EPE A-4 309 1 
HETATM 10471 N N1 . EPE G-5 4 . . 39.349 52.557 -36.125 0.59 11.13 ? N1 EPE A-5 309 1 
HETATM 10472 C C2 . EPE G-5 4 . . 38.788 51.426 -37.019 0.55 10.6 ? C2 EPE A-5 309 1 
HETATM 10473 C C3 . EPE G-5 4 . . 38.512 51.882 -38.414 0.56 11.49 ? C3 EPE A-5 309 1 
HETATM 10474 N N4 . EPE G-5 4 . . 37.59 53.076 -38.392 0.59 10.39 ? N4 EPE A-5 309 1 
HETATM 10475 C C5 . EPE G-5 4 . . 38.024 54.116 -37.495 0.69 12.02 ? C5 EPE A-5 309 1 
HETATM 10476 C C6 . EPE G-5 4 . . 38.38 53.686 -36.124 0.64 12.98 ? C6 EPE A-5 309 1 
HETATM 10477 C C7 . EPE G-5 4 . . 37.313 53.532 -39.815 0.56 12.26 ? C7 EPE A-5 309 1 
HETATM 10478 C C8 . EPE G-5 4 . . 36.101 52.748 -40.533 0.8 16.83 ? C8 EPE A-5 309 1 
HETATM 10479 O O8 . EPE G-5 4 . . 36.541 51.553 -40.959 0.43 16.23 ? O8 EPE A-5 309 1 
HETATM 10480 C C9 . EPE G-5 4 . . 39.396 52.065 -34.711 0.71 12.41 ? C9 EPE A-5 309 1 
HETATM 10481 C C10 . EPE G-5 4 . . 40.659 51.204 -34.568 0.5 11.34 ? C10 EPE A-5 309 1 
HETATM 10482 S S . EPE G-5 4 . . 40.931 50.738 -32.852 0.33 7.95 ? S EPE A-5 309 1 
HETATM 10483 O O1S . EPE G-5 4 . . 41.178 51.9 -32.068 0.4 9.64 ? O1S EPE A-5 309 1 
HETATM 10484 O O2S . EPE G-5 4 . . 42.03 49.814 -33.045 0.4 9.92 ? O2S EPE A-5 309 1 
HETATM 10485 O O3S . EPE G-5 4 . . 39.706 50.071 -32.418 0.39 9.5 ? O3S EPE A-5 309 1 
HETATM 10486 N N1 . EPE G-6 4 . . 75.467 25.6 -36.125 0.59 11.13 ? N1 EPE A-6 309 1 
HETATM 10487 C C2 . EPE G-6 4 . . 74.769 26.651 -37.019 0.55 10.6 ? C2 EPE A-6 309 1 
HETATM 10488 C C3 . EPE G-6 4 . . 75.301 26.662 -38.414 0.56 11.49 ? C3 EPE A-6 309 1 
HETATM 10489 N N4 . EPE G-6 4 . . 76.796 26.864 -38.392 0.59 10.39 ? N4 EPE A-6 309 1 
HETATM 10490 C C5 . EPE G-6 4 . . 77.48 25.968 -37.495 0.69 12.02 ? C5 EPE A-6 309 1 
HETATM 10491 C C6 . EPE G-6 4 . . 76.93 25.875 -36.124 0.64 12.98 ? C6 EPE A-6 309 1 
HETATM 10492 C C7 . EPE G-6 4 . . 77.33 26.876 -39.815 0.56 12.26 ? C7 EPE A-6 309 1 
HETATM 10493 C C8 . EPE G-6 4 . . 77.257 28.317 -40.533 0.8 16.83 ? C8 EPE A-6 309 1 
HETATM 10494 O O8 . EPE G-6 4 . . 76.002 28.534 -40.959 0.43 16.23 ? O8 EPE A-6 309 1 
HETATM 10495 C C9 . EPE G-6 4 . . 75.018 25.805 -34.711 0.71 12.41 ? C9 EPE A-6 309 1 
HETATM 10496 C C10 . EPE G-6 4 . . 73.641 25.142 -34.568 0.5 11.34 ? C10 EPE A-6 309 1 
HETATM 10497 S S . EPE G-6 4 . . 73.101 25.139 -32.852 0.33 7.95 ? S EPE A-6 309 1 
HETATM 10498 O O1S . EPE G-6 4 . . 73.984 24.345 -32.068 0.4 9.64 ? O1S EPE A-6 309 1 
HETATM 10499 O O2S . EPE G-6 4 . . 71.751 24.65 -33.045 0.4 9.92 ? O2S EPE A-6 309 1 
HETATM 10500 O O3S . EPE G-6 4 . . 73.136 26.534 -32.418 0.39 9.5 ? O3S EPE A-6 309 1 
HETATM 10501 CL CL . CL H 5 . . 38.27 12.803 -3.491 0.91 8.79 ? CL CL A 310 1 
HETATM 10502 CL CL . CL H-2 5 . . 69.03 26.741 -3.491 0.91 8.79 ? CL CL A-2 310 1 
HETATM 10503 CL CL . CL H-3 5 . . 41.579 46.411 -3.491 0.91 8.79 ? CL CL A-3 310 1 
HETATM 10504 CL CL . CL H-4 5 . . 41.579 10.892 -29.361 0.91 8.79 ? CL CL A-4 310 1 
HETATM 10505 CL CL . CL H-5 5 . . 38.27 44.501 -29.361 0.91 8.79 ? CL CL A-5 310 1 
HETATM 10506 CL CL . CL H-6 5 . . 69.03 30.562 -29.361 0.91 8.79 ? CL CL A-6 310 1 
HETATM 10507 O O . HOH I 6 . . 32.248 2.888 9.023 0.25 13.9 ? O HOH A 179 1 
HETATM 10508 O O . HOH I 6 . . 31.668 24.427 19.293 0.62 26.57 ? O HOH A 180 1 
HETATM 10509 O O . HOH I 6 . . 27.458 15.685 20.739 0.6 26.35 ? O HOH A 181 1 
HETATM 10510 O O . HOH I 6 . . 26.669 34.917 5.611 0.48 23.99 ? O HOH A 182 1 
HETATM 10511 O O . HOH I 6 . . 29.519 15.704 22.09 0.75 33.89 ? O HOH A 183 1 
HETATM 10512 O O . HOH I 6 . . 37.756 15.344 4.031 1 5.77 ? O HOH A 184 1 
HETATM 10513 O O . HOH I 6 . . 39.881 14.925 2.22 1 5.76 ? O HOH A 185 1 
HETATM 10514 O O . HOH I 6 . . 20.707 20.311 -13.326 0.71 13.09 ? O HOH A 186 1 
HETATM 10515 O O . HOH I 6 . . 22.847 29.159 11.709 0.5 24.79 ? O HOH A 187 1 
HETATM 10516 O O . HOH I 6 . . 39.901 31.6 -14.616 0.59 31.06 ? O HOH A 188 1 
HETATM 10517 O O . HOH I 6 . . 36.472 8.235 12.754 1 20.27 ? O HOH A 189 1 
HETATM 10518 O O . HOH I 6 . . 15.209 16.892 -0.451 0.49 21.06 ? O HOH A 190 1 
HETATM 10519 O O . HOH I 6 . . 32.098 13.895 2.761 1 5.98 ? O HOH A 191 1 
HETATM 10520 O O . HOH I 6 . . 38.806 7.416 11.802 0.44 25.29 ? O HOH A 192 1 
HETATM 10521 O O . HOH I 6 . . 40.976 16.88 -0.654 0.88 6.01 ? O HOH A 193 1 
HETATM 10522 O O . HOH I 6 . . 17.773 31.825 2.167 0.26 16.69 ? O HOH A 194 1 
HETATM 10523 O O . HOH I 6 . . 20.335 7.959 1.872 1 41.67 ? O HOH A 195 1 
HETATM 10524 O O . HOH I 6 . . 52.047 14.576 8.025 0.68 33.26 ? O HOH A 196 1 
HETATM 10525 O O . HOH I 6 . . 50.175 26.107 5.977 0.67 12.25 ? O HOH A 197 1 
HETATM 10526 O O . HOH I 6 . . 34.227 32.131 -9.111 1 6.89 ? O HOH A 198 1 
HETATM 10527 O O . HOH I 6 . . 14.476 25.874 -9.095 0.72 42.23 ? O HOH A 199 1 
HETATM 10528 O O . HOH I 6 . . 35.333 31.336 12.072 1 28.75 ? O HOH A 200 1 
HETATM 10529 O O . HOH I 6 . . 31.174 11.11 15.102 0.9 19.82 ? O HOH A 201 1 
HETATM 10530 O O . HOH I 6 . . 44.754 24.427 -11.1 0.42 20.13 ? O HOH A 202 1 
HETATM 10531 O O . HOH I 6 . . 37.716 -0.408 -9.625 0.94 31.19 ? O HOH A 203 1 
HETATM 10532 O O . HOH I 6 . . 17.3 27.393 11.651 0.18 10.24 ? O HOH A 204 1 
HETATM 10533 O O . HOH I 6 . . 35.942 29.264 -15.653 0.66 31.37 ? O HOH A 205 1 
HETATM 10534 O O . HOH I 6 . . 44.939 11.016 6.397 0.53 28.14 ? O HOH A 206 1 
HETATM 10535 O O . HOH I 6 . . 30.445 19.846 21.391 0.71 30.43 ? O HOH A 207 1 
HETATM 10536 O O . HOH I 6 . . 40.22 8.007 8.235 0.67 32.61 ? O HOH A 208 1 
HETATM 10537 O O . HOH I 6 . . 52.031 15.027 -9.784 0.9 6.78 ? O HOH A 209 1 
HETATM 10538 O O . HOH I 6 . . 42.642 16.32 14.649 1 32.24 ? O HOH A 210 1 
HETATM 10539 O O . HOH I 6 . . 36.182 10.818 -2.353 1 7.1 ? O HOH A 211 1 
HETATM 10540 O O . HOH I 6 . . 41.807 13.643 14.159 0.71 27.9 ? O HOH A 212 1 
HETATM 10541 O O . HOH I 6 . . 37.033 8.905 1.31 1 6.84 ? O HOH A 213 1 
HETATM 10542 O O . HOH I 6 . . 19.563 30.306 -16.679 0.73 29.41 ? O HOH A 214 1 
HETATM 10543 O O . HOH I 6 . . 31.342 33.213 10.936 0.69 35.79 ? O HOH A 215 1 
HETATM 10544 O O . HOH I 6 . . 40.24 16.493 4.379 0.91 6.19 ? O HOH A 216 1 
HETATM 10545 O O . HOH I 6 . . 22.922 8.462 9.777 0.72 33.33 ? O HOH A 217 1 
HETATM 10546 O O . HOH I 6 . . 38.635 9.827 -0.934 0.96 7.56 ? O HOH A 218 1 
HETATM 10547 O O . HOH I 6 . . 32.155 2.154 -2.368 1 8.78 ? O HOH A 219 1 
HETATM 10548 O O . HOH I 6 . . 27.11 25.117 13.477 0.92 14.41 ? O HOH A 220 1 
HETATM 10549 O O . HOH I 6 . . 35.39 21.419 -14.617 1 8.09 ? O HOH A 221 1 
HETATM 10550 O O . HOH I 6 . . 21.71 35.491 -13.595 0.82 21 ? O HOH A 222 1 
HETATM 10551 O O . HOH I 6 . . 16.048 24.541 -1.453 0.77 22.15 ? O HOH A 223 1 
HETATM 10552 O O . HOH I 6 . . 14.646 25.276 -0.023 0.13 8.18 ? O HOH A 224 1 
HETATM 10553 O O . HOH I 6 . . 19.493 9.625 -6.672 0.87 30.47 ? O HOH A 225 1 
HETATM 10554 O O . HOH I 6 . . 22.828 31.519 11.635 0.59 24.12 ? O HOH A 226 1 
HETATM 10555 O O . HOH I 6 . . 32.187 33.709 -1.782 0.91 6.92 ? O HOH A 227 1 
HETATM 10556 O O . HOH I 6 . . 18.808 11.572 -5.58 0.51 20.67 ? O HOH A 228 1 
HETATM 10557 O O . HOH I 6 . . 43.655 7.736 -8.65 1 8.93 ? O HOH A 229 1 
HETATM 10558 O O . HOH I 6 . . 52.591 12.168 0.392 1 7.53 ? O HOH A 230 1 
HETATM 10559 O O . HOH I 6 . . 22.33 32.032 -14.172 1 9.3 ? O HOH A 231 1 
HETATM 10560 O O . HOH I 6 . . 42.235 10.543 3.134 1 9.26 ? O HOH A 232 1 
HETATM 10561 O O . HOH I 6 . . 32.864 3.525 -9.803 1 12.66 ? O HOH A 233 1 
HETATM 10562 O O . HOH I 6 . . 42.529 5.601 -11.68 0.9 6.97 ? O HOH A 234 1 
HETATM 10563 O O . HOH I 6 . . 21.453 28.772 -14.036 0.7 16.56 ? O HOH A 235 1 
HETATM 10564 O O . HOH I 6 . . 43.968 8.502 1.97 0.42 14.12 ? O HOH A 236 1 
HETATM 10565 O O . HOH I 6 . . 45.105 14.309 8.427 1 30.87 ? O HOH A 237 1 
HETATM 10566 O O . HOH I 6 . . 15.806 27.368 0.032 0.24 15.64 ? O HOH A 238 1 
HETATM 10567 O O . HOH I 6 . . 16.113 22.131 -2.415 0.8 11.06 ? O HOH A 239 1 
HETATM 10568 O O . HOH I 6 . . 20.666 32.29 2.701 0.59 24.24 ? O HOH A 240 1 
HETATM 10569 O O . HOH I 6 . . 29.147 5.573 9.586 0.7 27.71 ? O HOH A 241 1 
HETATM 10570 O O . HOH I 6 . . 36.345 25.588 -9.554 0.7 5.9 ? O HOH A 242 1 
HETATM 10571 O O A HOH I 6 . . 49.604 28.659 11.205 0.49 37.53 ? O HOH A 243 1 
HETATM 10572 O O B HOH I 6 . . 49.667 28.623 9.063 0.51 34.9 ? O HOH A 243 1 
HETATM 10573 O O . HOH I 6 . . 25.479 27.779 13.393 0.58 23.66 ? O HOH A 244 1 
HETATM 10574 O O . HOH I 6 . . 46.647 18.564 -14.214 0.47 21.6 ? O HOH A 245 1 
HETATM 10575 O O . HOH I 6 . . 46.861 14.022 10.905 0.84 38.73 ? O HOH A 246 1 
HETATM 10576 O O . HOH I 6 . . 48.854 5.013 -13.161 0.99 10.7 ? O HOH A 247 1 
HETATM 10577 O O . HOH I 6 . . 28.508 4.255 -10.091 1 12.25 ? O HOH A 248 1 
HETATM 10578 O O . HOH I 6 . . 45.308 30.226 4.009 1 13.93 ? O HOH A 249 1 
HETATM 10579 O O . HOH I 6 . . 16.858 20.546 8.831 0.76 36.54 ? O HOH A 250 1 
HETATM 10580 O O . HOH I 6 . . 21.686 37.175 -4.354 0.31 15.48 ? O HOH A 251 1 
HETATM 10581 O O . HOH I 6 . . 29.191 4.533 5.752 1 11.93 ? O HOH A 252 1 
HETATM 10582 O O . HOH I 6 . . 30.651 21.019 14.664 0.96 11.22 ? O HOH A 253 1 
HETATM 10583 O O . HOH I 6 . . 36.267 6.295 1.839 0.82 9.04 ? O HOH A 254 1 
HETATM 10584 O O . HOH I 6 . . 36.783 5.315 -9.254 1 15.95 ? O HOH A 255 1 
HETATM 10585 O O . HOH I 6 . . 50.848 13.854 -12.046 0.72 10.83 ? O HOH A 256 1 
HETATM 10586 O O . HOH I 6 . . 20.858 27.345 -2.274 0.8 12.12 ? O HOH A 257 1 
HETATM 10587 O O A HOH I 6 . . 34.524 26.219 -12.941 0.46 14.98 ? O HOH A 258 1 
HETATM 10588 O O B HOH I 6 . . 34.7 27.349 -13.707 0.54 19.35 ? O HOH A 258 1 
HETATM 10589 O O . HOH I 6 . . 32.271 -0.587 -17.716 0.53 29.4 ? O HOH A 259 1 
HETATM 10590 O O . HOH I 6 . . 21.461 34.255 -1.768 1 37.68 ? O HOH A 260 1 
HETATM 10591 O O . HOH I 6 . . 17.815 17.568 9.691 0.61 30.47 ? O HOH A 261 1 
HETATM 10592 O O . HOH I 6 . . 47.203 20.616 14.368 1 37.59 ? O HOH A 262 1 
HETATM 10593 O O . HOH I 6 . . 50.281 14.906 -14.626 0.8 11.84 ? O HOH A 263 1 
HETATM 10594 O O . HOH I 6 . . 19.926 9.18 6.057 0.87 41.43 ? O HOH A 264 1 
HETATM 10595 O O . HOH I 6 . . 23.98 20.521 13.228 0.79 10.83 ? O HOH A 265 1 
HETATM 10596 O O . HOH I 6 . . 39.572 9.251 5.095 0.6 9.42 ? O HOH A 266 1 
HETATM 10597 O O . HOH I 6 . . 41.946 15.84 6.398 0.92 14.64 ? O HOH A 267 1 
HETATM 10598 O O . HOH I 6 . . 17.085 15.574 -2.983 0.99 14.46 ? O HOH A 268 1 
HETATM 10599 O O . HOH I 6 . . 26.632 38.857 -0.351 0.62 36.45 ? O HOH A 269 1 
HETATM 10600 O O . HOH I 6 . . 23.569 33.702 -11.982 0.91 15.69 ? O HOH A 270 1 
HETATM 10601 O O . HOH I 6 . . 46.58 23.32 -9.143 0.97 16.99 ? O HOH A 271 1 
HETATM 10602 O O . HOH I 6 . . 20.427 12.216 -10.004 1 20.07 ? O HOH A 272 1 
HETATM 10603 O O . HOH I 6 . . 22.224 30.68 0.966 0.76 13 ? O HOH A 273 1 
HETATM 10604 O O . HOH I 6 . . 30.137 -0.664 3.292 0.62 12.52 ? O HOH A 274 1 
HETATM 10605 O O . HOH I 6 . . 34.398 1.645 -8.933 0.75 11.6 ? O HOH A 275 1 
HETATM 10606 O O . HOH I 6 . . 48.92 26.073 10.418 0.58 32.94 ? O HOH A 276 1 
HETATM 10607 O O . HOH I 6 . . 19.618 12.223 2.72 0.66 11.23 ? O HOH A 277 1 
HETATM 10608 O O . HOH I 6 . . 26.451 15.775 18.146 0.59 11.26 ? O HOH A 278 1 
HETATM 10609 O O . HOH I 6 . . 18.562 28.657 10.417 0.63 9.01 ? O HOH A 279 1 
HETATM 10610 O O . HOH I 6 . . 23.57 8.148 6.862 1 17.02 ? O HOH A 280 1 
HETATM 10611 O O . HOH I 6 . . 31.47 3.364 6.708 0.96 17.49 ? O HOH A 281 1 
HETATM 10612 O O . HOH I 6 . . 27.122 14.707 -20.475 0.75 15.61 ? O HOH A 282 1 
HETATM 10613 O O . HOH I 6 . . 32.018 4.837 9.036 0.62 16.36 ? O HOH A 283 1 
HETATM 10614 O O . HOH I 6 . . 47.93 23.874 15.333 0.76 37.5 ? O HOH A 284 1 
HETATM 10615 O O . HOH I 6 . . 27.49 37.827 -5.427 0.86 14.26 ? O HOH A 285 1 
HETATM 10616 O O . HOH I 6 . . 21.124 10.021 3.671 0.66 13.82 ? O HOH A 286 1 
HETATM 10617 O O . HOH I 6 . . 49.352 9.703 1.724 0.5 11.07 ? O HOH A 287 1 
HETATM 10618 O O . HOH I 6 . . 49.607 28.614 4.946 0.24 14.92 ? O HOH A 288 1 
HETATM 10619 O O . HOH I 6 . . 27.512 28.625 -16.249 0.49 8.05 ? O HOH A 289 1 
HETATM 10620 O O . HOH I 6 . . 21.989 26.96 0.681 0.45 10.54 ? O HOH A 290 1 
HETATM 10621 O O . HOH I 6 . . 27.099 3.374 4.889 0.28 9.74 ? O HOH A 291 1 
HETATM 10622 O O . HOH I 6 . . 19.288 27.005 0.52 0.77 25.41 ? O HOH A 292 1 
HETATM 10623 O O A HOH I 6 . . 17.977 26.296 -2.238 0.52 13.99 ? O HOH A 293 1 
HETATM 10624 O O B HOH I 6 . . 17.195 26.346 -3.309 0.48 18.4 ? O HOH A 293 1 
HETATM 10625 O O . HOH I 6 . . 29.616 -0.642 -5.995 0.29 12.37 ? O HOH A 294 1 
HETATM 10626 O O . HOH I 6 . . 39.605 -1.421 -10.954 0.48 19.85 ? O HOH A 295 1 
HETATM 10627 O O . HOH I 6 . . 38.89 23.779 -17.94 0.53 30.73 ? O HOH A 296 1 
HETATM 10628 O O . HOH I 6 . . 25.81 6.533 7.349 0.59 11.5 ? O HOH A 297 1 
HETATM 10629 O O . HOH I 6 . . 25.987 29.732 11.677 1 22.91 ? O HOH A 298 1 
HETATM 10630 O O . HOH I 6 . . 21.312 20.03 13.706 0.86 19.12 ? O HOH A 299 1 
HETATM 10631 O O . HOH I 6 . . 16.188 21.64 -8.153 0.8 14.09 ? O HOH A 300 1 
HETATM 10632 O O . HOH I 6 . . 36.824 22.978 17.42 0.63 15.6 ? O HOH A 302 1 
HETATM 10633 O O . HOH I 6 . . 24.922 13.283 -13.013 0.97 21.47 ? O HOH A 303 1 
HETATM 10634 O O . HOH I 6 . . 25.306 6.461 -0.259 1 28.03 ? O HOH A 304 1 
HETATM 10635 O O . HOH I 6 . . 33.042 8.419 11.068 0.59 16.61 ? O HOH A 311 1 
HETATM 10636 O O . HOH I 6 . . 23.24 39.052 -11.089 0.75 20.61 ? O HOH A 312 1 
HETATM 10637 O O . HOH I 6 . . 43.029 13.113 5.752 0.49 10.43 ? O HOH A 313 1 
HETATM 10638 O O . HOH I 6 . . 34.357 33.045 -21.687 0.94 9.31 ? O HOH A 314 1 
HETATM 10639 O O . HOH I 6 . . 34.339 33.846 -16.699 0.91 18.6 ? O HOH A 315 1 
HETATM 10640 O O . HOH I 6 . . 34.238 23.456 18.56 0.69 20.99 ? O HOH A 316 1 
HETATM 10641 O O . HOH I 6 . . 31.738 22.276 17.153 0.81 18.01 ? O HOH A 317 1 
HETATM 10642 O O . HOH I 6 . . 44.456 21.582 -15.429 0.53 15.5 ? O HOH A 318 1 
HETATM 10643 O O . HOH I 6 . . 19.314 8.72 -1.275 0.68 23.8 ? O HOH A 319 1 
HETATM 10644 O O . HOH I 6 . . 49.628 28.648 -9.247 0.18 30.64 ? O HOH A 320 1 
HETATM 10645 O O . HOH I 6 . . 44.022 31.005 -12.296 0.5 26.92 ? O HOH A 321 1 
HETATM 10646 O O . HOH I 6 . . 45.541 32.951 -13.126 0.68 36.45 ? O HOH A 322 1 
HETATM 10647 O O . HOH I 6 . . 20.101 16.388 9.292 0.81 21.41 ? O HOH A 323 1 
HETATM 10648 O O . HOH I 6 . . 17.933 27.74 8.831 1 23.53 ? O HOH A 324 1 
HETATM 10649 O O . HOH I 6 . . 24.22 19.596 19.267 0.48 14.46 ? O HOH A 325 1 
HETATM 10650 O O . HOH I 6 . . 29.503 23.69 15.144 0.9 19.98 ? O HOH A 326 1 
HETATM 10651 O O . HOH I 6 . . 46.987 0.157 -11.566 0.66 20.45 ? O HOH A 327 1 
HETATM 10652 O O . HOH I 6 . . 32.641 2.065 -11.49 0.58 30.02 ? O HOH A 328 1 
HETATM 10653 O O . HOH I 6 . . 30.385 2.57 -11.441 0.37 21.56 ? O HOH A 329 1 
HETATM 10654 O O . HOH I 6 . . 25.41 15.791 -22.274 0.73 24.4 ? O HOH A 330 1 
HETATM 10655 O O . HOH I 6 . . 22.883 26.818 -15.999 0.42 10.98 ? O HOH A 331 1 
HETATM 10656 O O . HOH I 6 . . 30.82 38.373 -13.428 0.98 14.49 ? O HOH A 332 1 
HETATM 10657 O O . HOH I 6 . . 24.349 23.306 13.385 0.72 16.84 ? O HOH A 333 1 
HETATM 10658 O O . HOH I 6 . . 32.469 20.537 19.282 0.67 19.44 ? O HOH A 334 1 
HETATM 10659 O O . HOH I 6 . . 20.633 21.243 15.256 0.44 25.78 ? O HOH A 335 1 
HETATM 10660 O O . HOH I 6 . . 22.267 11.752 -12.237 0.61 21.15 ? O HOH A 336 1 
HETATM 10661 O O . HOH I 6 . . 21.957 20.572 16.559 0.4 22.45 ? O HOH A 337 1 
HETATM 10662 O O . HOH I 6 . . 15.376 18.058 16.482 0.68 40.23 ? O HOH A 338 1 
HETATM 10663 O O . HOH I 6 . . 29.587 37.164 2.123 0.55 29.45 ? O HOH A 339 1 
HETATM 10664 O O . HOH I 6 . . 32.425 38.368 4.598 0.66 32.31 ? O HOH A 340 1 
HETATM 10665 O O . HOH I 6 . . 28.776 36.478 6.259 0.8 33.06 ? O HOH A 341 1 
HETATM 10666 O O . HOH I 6 . . 26.369 36.207 7.603 0.6 33.38 ? O HOH A 342 1 
HETATM 10667 O O . HOH I 6 . . 25.109 13.147 13.334 0.62 15.05 ? O HOH A 343 1 
HETATM 10668 O O . HOH I 6 . . 37.411 21.497 -16.615 0.29 12.31 ? O HOH A 344 1 
HETATM 10669 O O . HOH I 6 . . 24.887 9.836 -11.192 0.55 28.29 ? O HOH A 345 1 
HETATM 10670 O O . HOH I 6 . . 20.253 29.362 -0.447 0.44 19.1 ? O HOH A 346 1 
HETATM 10671 O O . HOH I 6 . . 40.404 34.558 -13.991 0.63 16.82 ? O HOH A 347 1 
HETATM 10672 O O . HOH I 6 . . 17.367 29.801 -10.222 0.59 17.56 ? O HOH A 348 1 
HETATM 10673 O O . HOH I 6 . . 47.307 10.548 3.316 0.82 30.59 ? O HOH A 349 1 
HETATM 10674 O O . HOH I 6 . . 36.521 31.798 -16.334 0.72 18.66 ? O HOH A 350 1 
HETATM 10675 O O . HOH I 6 . . 35.151 6.513 10.487 0.53 18.78 ? O HOH A 351 1 
HETATM 10676 O O . HOH I 6 . . 24.339 35.046 1.32 0.77 22.91 ? O HOH A 352 1 
HETATM 10677 O O . HOH I 6 . . 32.361 9.604 17.402 0.63 18.62 ? O HOH A 353 1 
HETATM 10678 O O . HOH I 6 . . 25.709 40.974 -7.099 1 29.22 ? O HOH A 354 1 
HETATM 10679 O O . HOH I 6 . . 17.128 21.424 4.573 0.57 17.96 ? O HOH A 355 1 
HETATM 10680 O O . HOH I 6 . . 30.548 0.742 -8.514 0.59 18.27 ? O HOH A 356 1 
HETATM 10681 O O . HOH I 6 . . 30.904 4.768 -10.305 0.49 22.53 ? O HOH A 357 1 
HETATM 10682 O O A HOH I 6 . . 39.419 0.373 -0.344 0.47 11.85 ? O HOH A 358 1 
HETATM 10683 O O B HOH I 6 . . 39.993 1.138 1.095 0.53 20.93 ? O HOH A 358 1 
HETATM 10684 O O . HOH I 6 . . 47.172 20.615 -13.124 0.38 15.81 ? O HOH A 359 1 
HETATM 10685 O O . HOH I 6 . . 16.521 27.268 -8.267 0.77 15.2 ? O HOH A 360 1 
HETATM 10686 O O . HOH I 6 . . 50.392 24.296 0.539 0.6 17.22 ? O HOH A 361 1 
HETATM 10687 O O . HOH I 6 . . 19.18 29.628 12.119 0.62 19.8 ? O HOH A 362 1 
HETATM 10688 O O . HOH I 6 . . 46.277 13.169 3.683 0.29 10.41 ? O HOH A 363 1 
HETATM 10689 O O . HOH I 6 . . 17.056 27.169 4.392 1 33.42 ? O HOH A 364 1 
HETATM 10690 O O . HOH I 6 . . 14.741 24.983 -3.503 1 35.4 ? O HOH A 365 1 
HETATM 10691 O O . HOH I 6 . . 43.242 -4.309 -5.194 1 28.55 ? O HOH A 366 1 
HETATM 10692 O O . HOH I 6 . . 41.617 -3.346 -3.726 1 32.37 ? O HOH A 367 1 
HETATM 10693 O O . HOH I 6 . . 17.567 33.952 -8.939 1 35.65 ? O HOH A 368 1 
HETATM 10694 O O . HOH I 6 . . 24.512 36.855 -1.119 1 34.2 ? O HOH A 369 1 
HETATM 10695 O O . HOH I 6 . . 28.311 8.064 13.055 0.63 21.64 ? O HOH A 370 1 
HETATM 10696 O O . HOH I 6 . . 42.481 25.133 -13.506 0.28 15.67 ? O HOH A 371 1 
HETATM 10697 O O . HOH I 6 . . 45.769 3.012 -3.549 0.93 31.79 ? O HOH A 372 1 
HETATM 10698 O O . HOH I 6 . . 39.98 3.641 -0.165 1 37.23 ? O HOH A 373 1 
HETATM 10699 O O . HOH I 6 . . 20.647 21.031 -17.896 1 32.39 ? O HOH A 374 1 
HETATM 10700 O O . HOH I 6 . . 47.845 13.736 7.281 1 40.07 ? O HOH A 375 1 
HETATM 10701 O O . HOH I 6 . . 43.148 9.49 9.248 1 35.87 ? O HOH A 376 1 
HETATM 10702 O O . HOH I 6 . . 34.749 -1.264 -8.636 0.69 18.43 ? O HOH A 377 1 
HETATM 10703 O O . HOH I 6 . . 41.033 10.157 12.92 1 37.4 ? O HOH A 378 1 
HETATM 10704 O O . HOH I 6 . . 51.771 28.723 -0.411 1 26.41 ? O HOH A 379 1 
HETATM 10705 O O A HOH I 6 . . 49.628 28.644 -1.959 0.31 14.63 ? O HOH A 380 1 
HETATM 10706 O O B HOH I 6 . . 48.894 28.515 -0.535 0.69 30.71 ? O HOH A 380 1 
HETATM 10707 O O . HOH I 6 . . 26.265 5.514 -3.718 1 26.99 ? O HOH A 381 1 
HETATM 10708 O O . HOH I 6 . . 42.534 6.215 4.827 1 34.53 ? O HOH A 382 1 
HETATM 10709 O O . HOH I 6 . . 21.555 9.878 8.107 0.44 16.74 ? O HOH A 383 1 
HETATM 10710 O O . HOH I 6 . . 43.151 5.342 -9.632 0.37 21.51 ? O HOH A 384 1 
HETATM 10711 O O . HOH I 6 . . 41.994 22.806 -16.614 1 37.07 ? O HOH A 385 1 
HETATM 10712 O O A HOH I 6 . . 41.476 9.588 -2.104 0.27 12.36 ? O HOH A 386 1 
HETATM 10713 O O B HOH I 6 . . 40.071 10.464 -3.217 0.73 9.75 ? O HOH A 386 1 
HETATM 10714 O O . HOH I 6 . . 21.335 11.975 6.514 0.74 22.04 ? O HOH A 387 1 
HETATM 10715 O O . HOH I 6 . . 46.924 -0.075 -8.105 0.25 15.96 ? O HOH A 388 1 
HETATM 10716 O O . HOH I 6 . . 12.985 18.35 1.304 1 36.56 ? O HOH A 389 1 
HETATM 10717 O O . HOH I 6 . . 26.191 5.38 -11.415 1 39.59 ? O HOH A 390 1 
HETATM 10718 O O . HOH I 6 . . 46.93 30.908 2.158 1 31.43 ? O HOH A 391 1 
HETATM 10719 O O A HOH I 6 . . 48.095 25.371 7.76 0.71 18.36 ? O HOH A 392 1 
HETATM 10720 O O B HOH I 6 . . 48.363 26.99 6.697 0.29 19.15 ? O HOH A 392 1 
HETATM 10721 O O . HOH I 6 . . 19.569 24.41 11.539 0.4 17.81 ? O HOH A 393 1 
HETATM 10722 O O . HOH I 6 . . 13.407 21.501 -1.964 0.72 21.31 ? O HOH A 394 1 
HETATM 10723 O O . HOH I 6 . . 43.44 -1.756 -4.224 1 37.27 ? O HOH A 395 1 
HETATM 10724 O O . HOH I 6 . . 21.192 28.652 -16.426 0.5 14.5 ? O HOH A 396 1 
HETATM 10725 O O . HOH I 6 . . 14.588 24.306 -5.409 0.61 16.32 ? O HOH A 397 1 
HETATM 10726 O O . HOH I 6 . . 50.638 22.789 -9.514 1 23.09 ? O HOH A 398 1 
HETATM 10727 O O . HOH I 6 . . 27.909 10.803 -14.986 1 19.26 ? O HOH A 399 1 
HETATM 10728 O O . HOH I 6 . . 28.728 8.705 -13.344 1 30.23 ? O HOH A 400 1 
HETATM 10729 O O . HOH I 6 . . 26.019 9.728 -13.336 1 38.51 ? O HOH A 401 1 
HETATM 10730 O O . HOH I 6 . . 52.022 25.089 -7.662 1 25.38 ? O HOH A 402 1 
HETATM 10731 O O . HOH I 6 . . 50.419 25.263 -9.495 1 29.5 ? O HOH A 403 1 
HETATM 10732 O O . HOH I 6 . . 32.638 24.232 17.547 1 17.72 ? O HOH A 404 1 
HETATM 10733 O O . HOH I 6 . . 19.885 30.212 -12.925 1 35.03 ? O HOH A 405 1 
HETATM 10734 O O . HOH I 6 . . 48.986 29.37 2.246 0.64 26.87 ? O HOH A 406 1 
HETATM 10735 O O . HOH I 6 . . 46.378 28.347 10.204 1 37.16 ? O HOH A 407 1 
HETATM 10736 O O A HOH I 6 . . 42.28 6.595 -2.012 0.71 11.14 ? O HOH A 408 1 
HETATM 10737 O O B HOH I 6 . . 43.754 6.357 -2.016 0.29 12.66 ? O HOH A 408 1 
HETATM 10738 O O . HOH I 6 . . 48.369 8.032 -5.035 1 35.51 ? O HOH A 409 1 
HETATM 10739 O O . HOH I 6 . . 45.937 7.82 -6.045 1 33.82 ? O HOH A 410 1 
HETATM 10740 O O . HOH I 6 . . 49.835 8.806 -10.825 1 35.54 ? O HOH A 411 1 
HETATM 10741 O O . HOH I 6 . . 23.664 32.951 -0.231 0.94 14.43 ? O HOH A 412 1 
HETATM 10742 O O . HOH I 6 . . 31.246 28.718 -18.364 0.59 26.93 ? O HOH A 413 1 
HETATM 10743 O O A HOH I 6 . . 33.616 28.172 -17.283 0.58 19.84 ? O HOH A 414 1 
HETATM 10744 O O B HOH I 6 . . 32.376 28.663 -16.421 0.42 28.06 ? O HOH A 414 1 
HETATM 10745 O O . HOH I 6 . . 30.327 25.19 -13.862 0.54 11.82 ? O HOH A 415 1 
HETATM 10746 O O . HOH I 6 . . 33.065 25.147 -13.629 0.63 17.78 ? O HOH A 416 1 
HETATM 10747 O O . HOH I 6 . . 32.101 30.337 -17.682 0.59 29.2 ? O HOH A 417 1 
HETATM 10748 O O . HOH I 6 . . 37.465 0.326 2.519 1 17.88 ? O HOH A 418 1 
HETATM 10749 O O . HOH I 6 . . 37.328 -1.136 -3.205 1 26.43 ? O HOH A 419 1 
HETATM 10750 O O . HOH I 6 . . 35.18 21.363 20.847 1 34.76 ? O HOH A 420 1 
HETATM 10751 O O . HOH I 6 . . 43.491 8.624 -6.289 0.43 28.42 ? O HOH A 421 1 
HETATM 10752 O O . HOH I 6 . . 41.974 11.23 -4.666 0.48 28.07 ? O HOH A 422 1 
HETATM 10753 O O . HOH I 6 . . 19.972 27.185 10.795 0.38 12.14 ? O HOH A 423 1 
HETATM 10754 O O . HOH I 6 . . 18.335 14.072 5.266 0.7 26.46 ? O HOH A 424 1 
HETATM 10755 O O . HOH I 6 . . 15.546 26.369 -5.915 0.57 22.9 ? O HOH A 425 1 
HETATM 10756 O O . HOH I 6 . . 32.748 9.092 13.767 0.58 23.64 ? O HOH A 426 1 
HETATM 10757 O O . HOH I 6 . . 31.235 25.2 16.431 0.65 24.06 ? O HOH A 427 1 
HETATM 10758 O O . HOH I 6 . . 22.326 35.03 -4.796 0.56 20.99 ? O HOH A 428 1 
HETATM 10759 O O . HOH I 6 . . 46.731 27.508 7.936 0.76 28.29 ? O HOH A 429 1 
HETATM 10760 O O . HOH I 6 . . 25.133 35.264 -3.801 0.91 17.1 ? O HOH A 430 1 
HETATM 10761 O O . HOH I 6 . . 28.522 10.213 15.088 0.91 19.1 ? O HOH A 431 1 
HETATM 10762 O O . HOH I 6 . . 35.412 -0.246 -12.141 0.37 25.02 ? O HOH A 432 1 
HETATM 10763 O O . HOH I 6 . . 20.742 14.542 3.767 0.72 10.88 ? O HOH A 433 1 
HETATM 10764 O O . HOH I 6 . . 30.624 40.264 -4.012 0.46 18.11 ? O HOH A 434 1 
HETATM 10765 O O . HOH I 6 . . 24.714 28.101 -16.899 0.64 14.39 ? O HOH A 435 1 
HETATM 10766 O O . HOH I 6 . . 19.963 29.472 9.282 0.67 21.5 ? O HOH A 436 1 
HETATM 10767 O O . HOH I 6 . . 13.579 22.53 -4.856 0.23 15.71 ? O HOH A 437 1 
HETATM 10768 O O . HOH I 6 . . 31.876 -1.047 -8.813 0.3 18.57 ? O HOH A 438 1 
HETATM 10769 O O . HOH I 6 . . 33.559 26.001 17.853 0.6 21.01 ? O HOH A 439 1 
HETATM 10770 O O . HOH I 6 . . 20.093 37.226 -8.307 0.43 25 ? O HOH A 440 1 
HETATM 10771 O O . HOH I 6 . . 35.694 2.264 -11.889 0.67 16 ? O HOH A 441 1 
HETATM 10772 O O . HOH I 6 . . 18.58 28.257 -13.8 0.55 25.76 ? O HOH A 442 1 
HETATM 10773 O O . HOH I 6 . . 18.315 20.771 -14.886 0.43 22.62 ? O HOH A 443 1 
HETATM 10774 O O . HOH I 6 . . 36.978 2.548 -8.975 0.68 17.69 ? O HOH A 444 1 
HETATM 10775 O O . HOH I 6 . . 51.605 14.96 10.109 0.52 20.06 ? O HOH A 445 1 
HETATM 10776 O O . HOH I 6 . . 16.649 28.762 2.466 0.77 21.15 ? O HOH A 446 1 
HETATM 10777 O O . HOH I 6 . . 46.404 14.802 5.556 0.43 19.16 ? O HOH A 447 1 
HETATM 10778 O O . HOH I 6 . . 48.448 22.788 -11.118 0.53 23.29 ? O HOH A 448 1 
HETATM 10779 O O . HOH I 6 . . 29.013 6.328 -16.537 0.53 22.06 ? O HOH A 449 1 
HETATM 10780 O O . HOH I 6 . . 20.222 13.462 8.529 0.67 27.89 ? O HOH A 450 1 
HETATM 10781 O O . HOH I 6 . . 23.481 6.097 2.363 0.75 32.43 ? O HOH A 451 1 
HETATM 10782 O O . HOH I 6 . . 18.35 22.07 6.793 0.62 27.49 ? O HOH A 452 1 
HETATM 10783 O O . HOH I 6 . . 32.076 35.368 6.999 0.63 27.74 ? O HOH A 453 1 
HETATM 10784 O O . HOH I 6 . . 34.734 13.028 3.743 1 5.62 ? O HOH A 454 1 
HETATM 10785 O O . HOH I 6 . . 41.77 10.33 0.264 0.98 10.32 ? O HOH A 455 1 
HETATM 10786 O O . HOH I 6 . . 26.661 33.906 -5.984 0.9 8.62 ? O HOH A 456 1 
HETATM 10787 O O . HOH I 6 . . 39.768 9.351 2.219 1 10.54 ? O HOH A 457 1 
HETATM 10788 O O . HOH I 6 . . 39.775 11.992 3.439 1 12.65 ? O HOH A 458 1 
HETATM 10789 O O . HOH I 6 . . 24.389 36.847 -12.55 0.86 9.36 ? O HOH A 459 1 
HETATM 10790 O O . HOH I 6 . . 48.688 21.29 -7.949 1 12.94 ? O HOH A 460 1 
HETATM 10791 O O . HOH I 6 . . 13.025 18.75 -0.99 0.84 31.79 ? O HOH A 461 1 
HETATM 10792 O O . HOH I 6 . . 18.164 24.532 9.306 0.96 29.02 ? O HOH A 462 1 
HETATM 10793 O O . HOH I 6 . . 12.663 25.166 -5.747 0.4 21.77 ? O HOH A 463 1 
HETATM 10794 O O . HOH I 6 . . 42.156 31.009 -13.865 0.64 23.88 ? O HOH A 464 1 
HETATM 10795 O O . HOH I 6 . . 38.102 16.93 1.388 1 5.52 ? O HOH A 465 1 
HETATM 10796 O O . HOH I 6 . . 50.301 5.699 -4.916 0.35 13.23 ? O HOH A 466 1 
HETATM 10797 O O . HOH I 6 . . 25.92 35.657 3.042 0.89 26.22 ? O HOH A 467 1 
HETATM 10798 O O . HOH I 6 . . 20.142 22.837 -15.952 0.44 18.68 ? O HOH A 468 1 
HETATM 10799 O O . HOH I 6 . . 25.749 22.07 20.137 0.7 33.22 ? O HOH A 469 1 
HETATM 10800 O O . HOH I 6 . . 41.822 9.747 5.773 0.4 21.51 ? O HOH A 470 1 
HETATM 10801 O O . HOH I 6 . . 30.498 7.106 11.386 0.44 20.98 ? O HOH A 471 1 
HETATM 10802 O O . HOH I 6 . . 28.451 2.749 3.347 0.43 14.8 ? O HOH A 472 1 
HETATM 10803 O O . HOH I 6 . . 25.475 18.012 21.279 0.43 18.87 ? O HOH A 473 1 
HETATM 10804 O O . HOH I 6 . . 14.52 20.659 -5.723 0.36 18.61 ? O HOH A 474 1 
HETATM 10805 O O . HOH I 6 . . 16.146 25.763 -11.671 0.54 23.92 ? O HOH A 475 1 
HETATM 10806 O O . HOH I 6 . . 14.617 18.815 -6.399 0.55 30.96 ? O HOH A 476 1 
HETATM 10807 O O . HOH I 6 . . 25.654 2.94 -3.441 0.39 26.87 ? O HOH A 477 1 
HETATM 10808 O O . HOH I 6 . . 26.821 12.319 15.28 0.54 17.49 ? O HOH A 478 1 
HETATM 10809 O O . HOH I 6 . . 40.346 9.061 10.327 0.53 26.31 ? O HOH A 479 1 
HETATM 10810 O O . HOH I 6 . . 41.473 7.533 6.061 0.67 30.22 ? O HOH A 480 1 
HETATM 10811 O O . HOH I-2 6 . . 80.628 26.484 9.023 0.25 13.9 ? O HOH A-2 179 1 
HETATM 10812 O O . HOH I-2 6 . . 62.265 15.212 19.293 0.62 26.57 ? O HOH A-2 180 1 
HETATM 10813 O O . HOH I-2 6 . . 71.94 15.937 20.739 0.6 26.35 ? O HOH A-2 181 1 
HETATM 10814 O O . HOH I-2 6 . . 55.679 5.638 5.611 0.48 23.99 ? O HOH A-2 182 1 
HETATM 10815 O O . HOH I-2 6 . . 70.893 17.712 22.09 0.75 33.89 ? O HOH A-2 183 1 
HETATM 10816 O O . HOH I-2 6 . . 67.087 25.026 4.031 1 5.77 ? O HOH A-2 184 1 
HETATM 10817 O O . HOH I-2 6 . . 66.387 27.075 2.22 1 5.76 ? O HOH A-2 185 1 
HETATM 10818 O O . HOH I-2 6 . . 71.31 7.777 -13.326 0.71 13.09 ? O HOH A-2 186 1 
HETATM 10819 O O . HOH I-2 6 . . 62.577 5.207 11.709 0.5 24.79 ? O HOH A-2 187 1 
HETATM 10820 O O . HOH I-2 6 . . 51.936 18.755 -14.616 0.59 31.06 ? O HOH A-2 188 1 
HETATM 10821 O O . HOH I-2 6 . . 73.885 27.468 12.754 1 20.27 ? O HOH A-2 189 1 
HETATM 10822 O O . HOH I-2 6 . . 77.02 4.725 -0.451 0.49 21.06 ? O HOH A-2 190 1 
HETATM 10823 O O . HOH I-2 6 . . 71.171 20.85 2.761 1 5.98 ? O HOH A-2 191 1 
HETATM 10824 O O . HOH I-2 6 . . 73.428 29.899 11.802 0.44 25.29 ? O HOH A-2 192 1 
HETATM 10825 O O . HOH I-2 6 . . 64.146 27.046 -0.654 0.88 6.01 ? O HOH A-2 193 1 
HETATM 10826 O O . HOH I-2 6 . . 62.805 -0.521 2.167 0.26 16.69 ? O HOH A-2 194 1 
HETATM 10827 O O . HOH I-2 6 . . 82.193 13.631 1.872 1 41.67 ? O HOH A-2 195 1 
HETATM 10828 O O . HOH I-2 6 . . 60.606 37.786 8.025 0.68 33.26 ? O HOH A-2 196 1 
HETATM 10829 O O . HOH I-2 6 . . 51.556 30.399 5.977 0.67 12.25 ? O HOH A-2 197 1 
HETATM 10830 O O . HOH I-2 6 . . 54.313 13.576 -9.111 1 6.89 ? O HOH A-2 198 1 
HETATM 10831 O O . HOH I-2 6 . . 69.607 -0.4 -9.095 0.72 42.23 ? O HOH A-2 199 1 
HETATM 10832 O O . HOH I-2 6 . . 54.449 14.931 12.072 1 28.75 ? O HOH A-2 200 1 
HETATM 10833 O O . HOH I-2 6 . . 74.044 21.442 15.102 0.9 19.82 ? O HOH A-2 201 1 
HETATM 10834 O O . HOH I-2 6 . . 55.722 26.545 -11.1 0.42 20.13 ? O HOH A-2 202 1 
HETATM 10835 O O . HOH I-2 6 . . 80.748 32.867 -9.625 0.94 31.19 ? O HOH A-2 203 1 
HETATM 10836 O O . HOH I-2 6 . . 66.88 1.286 11.651 0.18 10.24 ? O HOH A-2 204 1 
HETATM 10837 O O . HOH I-2 6 . . 55.939 16.495 -15.653 0.66 31.37 ? O HOH A-2 205 1 
HETATM 10838 O O . HOH I-2 6 . . 67.243 33.41 6.397 0.53 28.14 ? O HOH A-2 206 1 
HETATM 10839 O O . HOH I-2 6 . . 66.843 16.443 21.391 0.71 30.43 ? O HOH A-2 207 1 
HETATM 10840 O O . HOH I-2 6 . . 72.209 30.828 8.235 0.67 32.61 ? O HOH A-2 208 1 
HETATM 10841 O O . HOH I-2 6 . . 60.224 37.547 -9.784 0.9 6.78 ? O HOH A-2 209 1 
HETATM 10842 O O . HOH I-2 6 . . 63.798 28.769 14.649 1 32.24 ? O HOH A-2 210 1 
HETATM 10843 O O . HOH I-2 6 . . 71.793 25.926 -2.353 1 7.1 ? O HOH A-2 211 1 
HETATM 10844 O O . HOH I-2 6 . . 66.534 29.384 14.159 0.71 27.9 ? O HOH A-2 212 1 
HETATM 10845 O O . HOH I-2 6 . . 73.025 27.619 1.31 1 6.84 ? O HOH A-2 213 1 
HETATM 10846 O O . HOH I-2 6 . . 63.226 1.789 -16.679 0.73 29.41 ? O HOH A-2 214 1 
HETATM 10847 O O . HOH I-2 6 . . 54.819 10.536 10.936 0.69 35.79 ? O HOH A-2 215 1 
HETATM 10848 O O . HOH I-2 6 . . 64.85 26.602 4.379 0.91 6.19 ? O HOH A-2 216 1 
HETATM 10849 O O . HOH I-2 6 . . 80.464 15.62 9.777 0.72 33.33 ? O HOH A-2 217 1 
HETATM 10850 O O . HOH I-2 6 . . 71.425 28.545 -0.934 0.96 7.56 ? O HOH A-2 218 1 
HETATM 10851 O O . HOH I-2 6 . . 81.31 26.77 -2.368 1 8.78 ? O HOH A-2 219 1 
HETATM 10852 O O . HOH I-2 6 . . 63.946 10.919 13.477 0.92 14.41 ? O HOH A-2 220 1 
HETATM 10853 O O . HOH I-2 6 . . 63.009 19.939 -14.617 1 8.09 ? O HOH A-2 221 1 
HETATM 10854 O O . HOH I-2 6 . . 57.662 1.056 -13.595 0.82 21 ? O HOH A-2 222 1 
HETATM 10855 O O . HOH I-2 6 . . 69.976 1.627 -1.453 0.77 22.15 ? O HOH A-2 223 1 
HETATM 10856 O O . HOH I-2 6 . . 70.04 0.046 -0.023 0.13 8.18 ? O HOH A-2 224 1 
HETATM 10857 O O . HOH I-2 6 . . 81.171 12.069 -6.672 0.87 30.47 ? O HOH A-2 225 1 
HETATM 10858 O O . HOH I-2 6 . . 60.543 4.01 11.635 0.59 24.12 ? O HOH A-2 226 1 
HETATM 10859 O O . HOH I-2 6 . . 53.967 11.02 -1.782 0.91 6.92 ? O HOH A-2 227 1 
HETATM 10860 O O . HOH I-2 6 . . 79.827 10.502 -5.58 0.51 20.67 ? O HOH A-2 228 1 
HETATM 10861 O O . HOH I-2 6 . . 70.726 33.938 -8.65 1 8.93 ? O HOH A-2 229 1 
HETATM 10862 O O . HOH I-2 6 . . 62.42 39.461 0.392 1 7.53 ? O HOH A-2 230 1 
HETATM 10863 O O . HOH I-2 6 . . 60.347 3.322 -14.172 1 9.3 ? O HOH A-2 231 1 
HETATM 10864 O O . HOH I-2 6 . . 69.005 31.305 3.134 1 9.26 ? O HOH A-2 232 1 
HETATM 10865 O O . HOH I-2 6 . . 79.768 26.699 -9.803 1 12.66 ? O HOH A-2 233 1 
HETATM 10866 O O . HOH I-2 6 . . 73.138 34.031 -11.68 0.9 6.97 ? O HOH A-2 234 1 
HETATM 10867 O O . HOH I-2 6 . . 63.609 4.193 -14.036 0.7 16.56 ? O HOH A-2 235 1 
HETATM 10868 O O . HOH I-2 6 . . 69.906 33.826 1.97 0.42 14.12 ? O HOH A-2 236 1 
HETATM 10869 O O . HOH I-2 6 . . 64.309 31.908 8.427 1 30.87 ? O HOH A-2 237 1 
HETATM 10870 O O . HOH I-2 6 . . 67.649 0.004 0.032 0.24 15.64 ? O HOH A-2 238 1 
HETATM 10871 O O . HOH I-2 6 . . 72.03 2.889 -2.415 0.8 11.06 ? O HOH A-2 239 1 
HETATM 10872 O O . HOH I-2 6 . . 60.956 1.752 2.701 0.59 24.24 ? O HOH A-2 240 1 
HETATM 10873 O O . HOH I-2 6 . . 79.853 22.456 9.586 0.7 27.71 ? O HOH A-2 241 1 
HETATM 10874 O O . HOH I-2 6 . . 58.921 18.682 -9.554 0.7 5.9 ? O HOH A-2 242 1 
HETATM 10875 O O A HOH I-2 6 . . 49.632 28.629 11.205 0.49 37.53 ? O HOH A-2 243 1 
HETATM 10876 O O B HOH I-2 6 . . 49.631 28.701 9.063 0.51 34.9 ? O HOH A-2 243 1 
HETATM 10877 O O . HOH I-2 6 . . 62.456 8.176 13.393 0.58 23.66 ? O HOH A-2 244 1 
HETATM 10878 O O . HOH I-2 6 . . 59.853 31.115 -14.214 0.47 21.6 ? O HOH A-2 245 1 
HETATM 10879 O O . HOH I-2 6 . . 63.679 33.572 10.905 0.84 38.73 ? O HOH A-2 246 1 
HETATM 10880 O O . HOH I-2 6 . . 70.485 39.802 -13.161 0.99 10.7 ? O HOH A-2 247 1 
HETATM 10881 O O . HOH I-2 6 . . 81.314 22.561 -10.091 1 12.25 ? O HOH A-2 248 1 
HETATM 10882 O O . HOH I-2 6 . . 50.423 24.125 4.009 1 13.93 ? O HOH A-2 249 1 
HETATM 10883 O O . HOH I-2 6 . . 73.031 4.326 8.831 0.76 36.54 ? O HOH A-2 250 1 
HETATM 10884 O O . HOH I-2 6 . . 56.216 0.193 -4.354 0.31 15.48 ? O HOH A-2 251 1 
HETATM 10885 O O . HOH I-2 6 . . 80.732 23.014 5.752 1 11.93 ? O HOH A-2 252 1 
HETATM 10886 O O . HOH I-2 6 . . 65.725 16.035 14.664 0.96 11.22 ? O HOH A-2 253 1 
HETATM 10887 O O . HOH I-2 6 . . 75.668 28.261 1.839 0.82 9.04 ? O HOH A-2 254 1 
HETATM 10888 O O . HOH I-2 6 . . 76.259 29.198 -9.254 1 15.95 ? O HOH A-2 255 1 
HETATM 10889 O O . HOH I-2 6 . . 61.831 37.109 -12.046 0.72 10.83 ? O HOH A-2 256 1 
HETATM 10890 O O . HOH I-2 6 . . 65.143 4.391 -2.274 0.8 12.12 ? O HOH A-2 257 1 
HETATM 10891 O O A HOH I-2 6 . . 59.285 16.789 -12.941 0.46 14.98 ? O HOH A-2 258 1 
HETATM 10892 O O B HOH I-2 6 . . 58.218 16.377 -13.707 0.54 19.35 ? O HOH A-2 258 1 
HETATM 10893 O O . HOH I-2 6 . . 83.626 28.241 -17.716 0.53 29.4 ? O HOH A-2 259 1 
HETATM 10894 O O . HOH I-2 6 . . 58.857 1.458 -1.768 1 37.68 ? O HOH A-2 260 1 
HETATM 10895 O O . HOH I-2 6 . . 75.131 6.644 9.691 0.61 30.47 ? O HOH A-2 261 1 
HETATM 10896 O O . HOH I-2 6 . . 57.798 30.571 14.368 1 37.59 ? O HOH A-2 262 1 
HETATM 10897 O O . HOH I-2 6 . . 61.204 36.092 -14.626 0.8 11.84 ? O HOH A-2 263 1 
HETATM 10898 O O . HOH I-2 6 . . 81.34 12.666 6.057 0.87 41.43 ? O HOH A-2 264 1 
HETATM 10899 O O . HOH I-2 6 . . 69.491 10.507 13.228 0.79 10.83 ? O HOH A-2 265 1 
HETATM 10900 O O . HOH I-2 6 . . 71.455 29.645 5.095 0.6 9.42 ? O HOH A-2 266 1 
HETATM 10901 O O . HOH I-2 6 . . 64.562 28.406 6.398 0.92 14.64 ? O HOH A-2 267 1 
HETATM 10902 O O . HOH I-2 6 . . 77.223 7.009 -2.983 0.99 14.46 ? O HOH A-2 268 1 
HETATM 10903 O O . HOH I-2 6 . . 52.286 3.635 -0.351 0.62 36.45 ? O HOH A-2 269 1 
HETATM 10904 O O . HOH I-2 6 . . 58.282 3.56 -11.982 0.91 15.69 ? O HOH A-2 270 1 
HETATM 10905 O O . HOH I-2 6 . . 55.767 28.679 -9.143 0.97 16.99 ? O HOH A-2 271 1 
HETATM 10906 O O . HOH I-2 6 . . 78.46 11.582 -10.004 1 20.07 ? O HOH A-2 272 1 
HETATM 10907 O O . HOH I-2 6 . . 61.571 3.907 0.966 0.76 13 ? O HOH A-2 273 1 
HETATM 10908 O O . HOH I-2 6 . . 84.76 26.431 3.292 0.62 12.52 ? O HOH A-2 274 1 
HETATM 10909 O O . HOH I-2 6 . . 80.629 28.967 -8.933 0.75 11.6 ? O HOH A-2 275 1 
HETATM 10910 O O . HOH I-2 6 . . 52.213 29.329 10.418 0.58 32.94 ? O HOH A-2 276 1 
HETATM 10911 O O . HOH I-2 6 . . 78.859 10.878 2.72 0.66 11.23 ? O HOH A-2 277 1 
HETATM 10912 O O . HOH I-2 6 . . 72.366 15.02 18.146 0.59 11.26 ? O HOH A-2 278 1 
HETATM 10913 O O . HOH I-2 6 . . 65.154 1.747 10.417 0.63 9.01 ? O HOH A-2 279 1 
HETATM 10914 O O . HOH I-2 6 . . 80.412 16.338 6.862 1 17.02 ? O HOH A-2 280 1 
HETATM 10915 O O . HOH I-2 6 . . 80.605 25.572 6.708 0.96 17.49 ? O HOH A-2 281 1 
HETATM 10916 O O . HOH I-2 6 . . 72.955 16.135 -20.475 0.75 15.61 ? O HOH A-2 282 1 
HETATM 10917 O O . HOH I-2 6 . . 79.055 25.31 9.036 0.62 16.36 ? O HOH A-2 283 1 
HETATM 10918 O O . HOH I-2 6 . . 54.613 29.572 15.333 0.76 37.5 ? O HOH A-2 284 1 
HETATM 10919 O O . HOH I-2 6 . . 52.749 4.894 -5.427 0.86 14.26 ? O HOH A-2 285 1 
HETATM 10920 O O . HOH I-2 6 . . 80.013 13.283 3.671 0.66 13.82 ? O HOH A-2 286 1 
HETATM 10921 O O . HOH I-2 6 . . 66.174 37.889 1.724 0.5 11.07 ? O HOH A-2 287 1 
HETATM 10922 O O . HOH I-2 6 . . 49.669 28.654 4.946 0.24 14.92 ? O HOH A-2 288 1 
HETATM 10923 O O . HOH I-2 6 . . 60.707 9.514 -16.249 0.49 8.05 ? O HOH A-2 289 1 
HETATM 10924 O O . HOH I-2 6 . . 64.91 5.563 0.681 0.45 10.54 ? O HOH A-2 290 1 
HETATM 10925 O O . HOH I-2 6 . . 82.782 21.781 4.889 0.28 9.74 ? O HOH A-2 291 1 
HETATM 10926 O O . HOH I-2 6 . . 66.222 3.201 0.52 0.77 25.41 ? O HOH A-2 292 1 
HETATM 10927 O O A HOH I-2 6 . . 67.491 2.421 -2.238 0.52 13.99 ? O HOH A-2 293 1 
HETATM 10928 O O B HOH I-2 6 . . 67.839 1.718 -3.309 0.48 18.4 ? O HOH A-2 293 1 
HETATM 10929 O O . HOH I-2 6 . . 85.001 25.969 -5.995 0.29 12.37 ? O HOH A-2 294 1 
HETATM 10930 O O . HOH I-2 6 . . 80.681 35.009 -10.954 0.48 19.85 ? O HOH A-2 295 1 
HETATM 10931 O O . HOH I-2 6 . . 59.215 21.79 -17.94 0.53 30.73 ? O HOH A-2 296 1 
HETATM 10932 O O . HOH I-2 6 . . 80.69 19.086 7.349 0.59 11.5 ? O HOH A-2 297 1 
HETATM 10933 O O . HOH I-2 6 . . 60.511 7.639 11.677 1 22.91 ? O HOH A-2 298 1 
HETATM 10934 O O . HOH I-2 6 . . 71.251 8.442 13.706 0.86 19.12 ? O HOH A-2 299 1 
HETATM 10935 O O . HOH I-2 6 . . 72.418 3.199 -8.153 0.8 14.09 ? O HOH A-2 300 1 
HETATM 10936 O O . HOH I-2 6 . . 60.941 20.402 17.42 0.63 15.6 ? O HOH A-2 302 1 
HETATM 10937 O O . HOH I-2 6 . . 75.289 14.942 -13.013 0.97 21.47 ? O HOH A-2 303 1 
HETATM 10938 O O . HOH I-2 6 . . 81.005 18.685 -0.259 1 28.03 ? O HOH A-2 304 1 
HETATM 10939 O O . HOH I-2 6 . . 75.441 24.406 11.068 0.59 16.61 ? O HOH A-2 311 1 
HETATM 10940 O O . HOH I-2 6 . . 53.813 0.6 -11.089 0.75 20.61 ? O HOH A-2 312 1 
HETATM 10941 O O . HOH I-2 6 . . 66.382 30.708 5.752 0.49 10.43 ? O HOH A-2 313 1 
HETATM 10942 O O . HOH I-2 6 . . 53.457 13.232 -21.687 0.94 9.31 ? O HOH A-2 314 1 
HETATM 10943 O O . HOH I-2 6 . . 52.772 12.815 -16.699 0.91 18.6 ? O HOH A-2 315 1 
HETATM 10944 O O . HOH I-2 6 . . 61.821 17.923 18.56 0.69 20.99 ? O HOH A-2 316 1 
HETATM 10945 O O . HOH I-2 6 . . 64.092 16.348 17.153 0.81 18.01 ? O HOH A-2 317 1 
HETATM 10946 O O . HOH I-2 6 . . 58.334 27.709 -15.429 0.53 15.5 ? O HOH A-2 318 1 
HETATM 10947 O O . HOH I-2 6 . . 82.044 12.366 -1.275 0.68 23.8 ? O HOH A-2 319 1 
HETATM 10948 O O . HOH I-2 6 . . 49.629 28.655 -9.247 0.18 30.64 ? O HOH A-2 320 1 
HETATM 10949 O O . HOH I-2 6 . . 50.391 22.622 -12.296 0.5 26.92 ? O HOH A-2 321 1 
HETATM 10950 O O . HOH I-2 6 . . 47.946 22.964 -13.126 0.68 36.45 ? O HOH A-2 322 1 
HETATM 10951 O O . HOH I-2 6 . . 75.01 9.214 9.292 0.81 21.41 ? O HOH A-2 323 1 
HETATM 10952 O O . HOH I-2 6 . . 66.263 1.66 8.831 1 23.53 ? O HOH A-2 324 1 
HETATM 10953 O O . HOH I-2 6 . . 70.172 11.177 19.267 0.48 14.46 ? O HOH A-2 325 1 
HETATM 10954 O O . HOH I-2 6 . . 63.985 13.705 15.144 0.9 19.98 ? O HOH A-2 326 1 
HETATM 10955 O O . HOH I-2 6 . . 75.624 40.613 -11.566 0.66 20.45 ? O HOH A-2 327 1 
HETATM 10956 O O . HOH I-2 6 . . 81.144 27.235 -11.49 0.58 30.02 ? O HOH A-2 328 1 
HETATM 10957 O O . HOH I-2 6 . . 81.835 25.029 -11.441 0.37 21.56 ? O HOH A-2 329 1 
HETATM 10958 O O . HOH I-2 6 . . 72.873 14.11 -22.274 0.73 24.4 ? O HOH A-2 330 1 
HETATM 10959 O O . HOH I-2 6 . . 64.586 6.408 -15.999 0.42 10.98 ? O HOH A-2 331 1 
HETATM 10960 O O . HOH I-2 6 . . 50.611 7.504 -13.428 0.98 14.49 ? O HOH A-2 332 1 
HETATM 10961 O O . HOH I-2 6 . . 66.895 9.434 13.385 0.72 16.84 ? O HOH A-2 333 1 
HETATM 10962 O O . HOH I-2 6 . . 65.233 17.85 19.282 0.67 19.44 ? O HOH A-2 334 1 
HETATM 10963 O O . HOH I-2 6 . . 70.54 7.247 15.256 0.44 25.78 ? O HOH A-2 335 1 
HETATM 10964 O O . HOH I-2 6 . . 77.942 13.408 -12.237 0.61 21.15 ? O HOH A-2 336 1 
HETATM 10965 O O . HOH I-2 6 . . 70.459 8.729 16.559 0.4 22.45 ? O HOH A-2 337 1 
HETATM 10966 O O . HOH I-2 6 . . 75.926 4.287 16.482 0.68 40.23 ? O HOH A-2 338 1 
HETATM 10967 O O . HOH I-2 6 . . 52.275 7.041 2.123 0.55 29.45 ? O HOH A-2 339 1 
HETATM 10968 O O . HOH I-2 6 . . 49.813 8.897 4.598 0.66 32.31 ? O HOH A-2 340 1 
HETATM 10969 O O . HOH I-2 6 . . 53.274 6.682 6.259 0.8 33.06 ? O HOH A-2 341 1 
HETATM 10970 O O . HOH I-2 6 . . 54.712 4.733 7.603 0.6 33.38 ? O HOH A-2 342 1 
HETATM 10971 O O . HOH I-2 6 . . 75.313 15.172 13.334 0.62 15.05 ? O HOH A-2 343 1 
HETATM 10972 O O . HOH I-2 6 . . 61.931 21.65 -16.615 0.29 12.31 ? O HOH A-2 344 1 
HETATM 10973 O O . HOH I-2 6 . . 78.291 16.635 -11.192 0.55 28.29 ? O HOH A-2 345 1 
HETATM 10974 O O . HOH I-2 6 . . 63.698 2.859 -0.447 0.44 19.1 ? O HOH A-2 346 1 
HETATM 10975 O O . HOH I-2 6 . . 49.123 17.712 -13.991 0.63 16.82 ? O HOH A-2 347 1 
HETATM 10976 O O . HOH I-2 6 . . 64.761 0.14 -10.222 0.59 17.56 ? O HOH A-2 348 1 
HETATM 10977 O O . HOH I-2 6 . . 66.465 35.695 3.316 0.82 30.59 ? O HOH A-2 349 1 
HETATM 10978 O O . HOH I-2 6 . . 53.455 15.729 -16.334 0.72 18.66 ? O HOH A-2 350 1 
HETATM 10979 O O . HOH I-2 6 . . 76.037 27.185 10.487 0.53 18.78 ? O HOH A-2 351 1 
HETATM 10980 O O . HOH I-2 6 . . 56.733 3.555 1.32 0.77 22.91 ? O HOH A-2 352 1 
HETATM 10981 O O . HOH I-2 6 . . 74.755 23.223 17.402 0.63 18.62 ? O HOH A-2 353 1 
HETATM 10982 O O . HOH I-2 6 . . 50.914 1.778 -7.099 1 29.22 ? O HOH A-2 354 1 
HETATM 10983 O O . HOH I-2 6 . . 72.135 4.121 4.573 0.57 17.96 ? O HOH A-2 355 1 
HETATM 10984 O O . HOH I-2 6 . . 83.336 26.084 -8.514 0.59 18.27 ? O HOH A-2 356 1 
HETATM 10985 O O . HOH I-2 6 . . 79.672 24.38 -10.305 0.49 22.53 ? O HOH A-2 357 1 
HETATM 10986 O O A HOH I-2 6 . . 79.22 33.951 -0.344 0.47 11.85 ? O HOH A-2 358 1 
HETATM 10987 O O B HOH I-2 6 . . 78.271 34.066 1.095 0.53 20.93 ? O HOH A-2 358 1 
HETATM 10988 O O . HOH I-2 6 . . 57.814 30.545 -13.124 0.38 15.81 ? O HOH A-2 359 1 
HETATM 10989 O O . HOH I-2 6 . . 67.378 0.674 -8.267 0.77 15.2 ? O HOH A-2 360 1 
HETATM 10990 O O . HOH I-2 6 . . 53.016 31.493 0.539 0.6 17.22 ? O HOH A-2 361 1 
HETATM 10991 O O . HOH I-2 6 . . 64.004 1.796 12.119 0.62 19.8 ? O HOH A-2 362 1 
HETATM 10992 O O . HOH I-2 6 . . 64.71 33.493 3.683 0.29 10.41 ? O HOH A-2 363 1 
HETATM 10993 O O . HOH I-2 6 . . 67.196 1.186 4.392 1 33.42 ? O HOH A-2 364 1 
HETATM 10994 O O . HOH I-2 6 . . 70.247 0.275 -3.503 1 35.4 ? O HOH A-2 365 1 
HETATM 10995 O O . HOH I-2 6 . . 81.364 39.603 -5.194 1 28.55 ? O HOH A-2 366 1 
HETATM 10996 O O . HOH I-2 6 . . 81.342 37.714 -3.726 1 32.37 ? O HOH A-2 367 1 
HETATM 10997 O O . HOH I-2 6 . . 61.066 -1.763 -8.939 1 35.65 ? O HOH A-2 368 1 
HETATM 10998 O O . HOH I-2 6 . . 55.08 2.801 -1.119 1 34.2 ? O HOH A-2 369 1 
HETATM 10999 O O . HOH I-2 6 . . 78.114 20.486 13.055 0.63 21.64 ? O HOH A-2 370 1 
HETATM 11000 O O . HOH I-2 6 . . 56.247 24.223 -13.506 0.28 15.67 ? O HOH A-2 371 1 
HETATM 11001 O O . HOH I-2 6 . . 73.76 38.131 -3.549 0.93 31.79 ? O HOH A-2 372 1 
HETATM 11002 O O . HOH I-2 6 . . 76.11 32.803 -0.165 1 37.23 ? O HOH A-2 373 1 
HETATM 11003 O O . HOH I-2 6 . . 70.716 7.365 -17.896 1 32.39 ? O HOH A-2 374 1 
HETATM 11004 O O . HOH I-2 6 . . 63.435 34.567 7.281 1 40.07 ? O HOH A-2 375 1 
HETATM 11005 O O . HOH I-2 6 . . 69.46 32.622 9.248 1 35.87 ? O HOH A-2 376 1 
HETATM 11006 O O . HOH I-2 6 . . 82.973 30.726 -8.636 0.69 18.43 ? O HOH A-2 377 1 
HETATM 11007 O O . HOH I-2 6 . . 69.94 30.457 12.92 1 37.4 ? O HOH A-2 378 1 
HETATM 11008 O O . HOH I-2 6 . . 48.493 30.474 -0.411 1 26.41 ? O HOH A-2 379 1 
HETATM 11009 O O A HOH I-2 6 . . 49.633 28.657 -1.959 0.31 14.63 ? O HOH A-2 380 1 
HETATM 11010 O O B HOH I-2 6 . . 50.111 28.086 -0.535 0.69 30.71 ? O HOH A-2 380 1 
HETATM 11011 O O . HOH I-2 6 . . 81.345 19.989 -3.718 1 26.99 ? O HOH A-2 381 1 
HETATM 11012 O O . HOH I-2 6 . . 72.604 33.728 4.827 1 34.53 ? O HOH A-2 382 1 
HETATM 11013 O O . HOH I-2 6 . . 79.921 13.728 8.107 0.44 16.74 ? O HOH A-2 383 1 
HETATM 11014 O O . HOH I-2 6 . . 73.051 34.699 -9.632 0.37 21.51 ? O HOH A-2 384 1 
HETATM 11015 O O . HOH I-2 6 . . 58.505 24.965 -16.614 1 37.07 ? O HOH A-2 385 1 
HETATM 11016 O O A HOH I-2 6 . . 70.212 31.125 -2.104 0.27 12.36 ? O HOH A-2 386 1 
HETATM 11017 O O B HOH I-2 6 . . 70.155 29.471 -3.217 0.73 9.75 ? O HOH A-2 386 1 
HETATM 11018 O O . HOH I-2 6 . . 78.215 12.489 6.514 0.74 22.04 ? O HOH A-2 387 1 
HETATM 11019 O O . HOH I-2 6 . . 75.856 40.675 -8.105 0.25 15.96 ? O HOH A-2 388 1 
HETATM 11020 O O . HOH I-2 6 . . 76.869 2.07 1.304 1 36.56 ? O HOH A-2 389 1 
HETATM 11021 O O . HOH I-2 6 . . 81.498 19.992 -11.415 1 39.59 ? O HOH A-2 390 1 
HETATM 11022 O O . HOH I-2 6 . . 49.021 25.189 2.158 1 31.43 ? O HOH A-2 391 1 
HETATM 11023 O O A HOH I-2 6 . . 53.234 28.966 7.76 0.71 18.36 ? O HOH A-2 392 1 
HETATM 11024 O O B HOH I-2 6 . . 51.697 28.389 6.697 0.29 19.15 ? O HOH A-2 392 1 
HETATM 11025 O O . HOH I-2 6 . . 68.329 4.742 11.539 0.4 17.81 ? O HOH A-2 393 1 
HETATM 11026 O O . HOH I-2 6 . . 73.929 0.86 -1.964 0.72 21.31 ? O HOH A-2 394 1 
HETATM 11027 O O . HOH I-2 6 . . 79.054 38.498 -4.224 1 37.27 ? O HOH A-2 395 1 
HETATM 11028 O O . HOH I-2 6 . . 63.844 4.027 -16.426 0.5 14.5 ? O HOH A-2 396 1 
HETATM 11029 O O . HOH I-2 6 . . 70.909 0.481 -5.409 0.61 16.32 ? O HOH A-2 397 1 
HETATM 11030 O O . HOH I-2 6 . . 54.198 32.459 -9.514 1 23.09 ? O HOH A-2 398 1 
HETATM 11031 O O . HOH I-2 6 . . 75.943 18.768 -14.986 1 19.26 ? O HOH A-2 399 1 
HETATM 11032 O O . HOH I-2 6 . . 77.35 20.527 -13.344 1 30.23 ? O HOH A-2 400 1 
HETATM 11033 O O . HOH I-2 6 . . 77.819 17.669 -13.336 1 38.51 ? O HOH A-2 401 1 
HETATM 11034 O O . HOH I-2 6 . . 51.514 32.508 -7.662 1 25.38 ? O HOH A-2 402 1 
HETATM 11035 O O . HOH I-2 6 . . 52.165 31.033 -9.495 1 29.5 ? O HOH A-2 403 1 
HETATM 11036 O O . HOH I-2 6 . . 61.948 16.149 17.547 1 17.72 ? O HOH A-2 404 1 
HETATM 11037 O O . HOH I-2 6 . . 63.146 2.115 -12.925 1 35.03 ? O HOH A-2 405 1 
HETATM 11038 O O . HOH I-2 6 . . 49.325 27.738 2.246 0.64 26.87 ? O HOH A-2 406 1 
HETATM 11039 O O . HOH I-2 6 . . 51.515 25.991 10.204 1 37.16 ? O HOH A-2 407 1 
HETATM 11040 O O A HOH I-2 6 . . 72.402 33.318 -2.012 0.71 11.14 ? O HOH A-2 408 1 
HETATM 11041 O O B HOH I-2 6 . . 71.871 34.714 -2.016 0.29 12.66 ? O HOH A-2 408 1 
HETATM 11042 O O . HOH I-2 6 . . 68.113 37.873 -5.035 1 35.51 ? O HOH A-2 409 1 
HETATM 11043 O O . HOH I-2 6 . . 69.512 35.873 -6.045 1 33.82 ? O HOH A-2 410 1 
HETATM 11044 O O . HOH I-2 6 . . 66.709 38.755 -10.825 1 35.54 ? O HOH A-2 411 1 
HETATM 11045 O O . HOH I-2 6 . . 58.885 4.018 -0.231 0.94 14.43 ? O HOH A-2 412 1 
HETATM 11046 O O . HOH I-2 6 . . 58.759 12.701 -18.364 0.59 26.93 ? O HOH A-2 413 1 
HETATM 11047 O O A HOH I-2 6 . . 58.047 15.026 -17.283 0.58 19.84 ? O HOH A-2 414 1 
HETATM 11048 O O B HOH I-2 6 . . 58.242 13.707 -16.421 0.42 28.06 ? O HOH A-2 414 1 
HETATM 11049 O O . HOH I-2 6 . . 62.274 13.669 -13.862 0.54 11.82 ? O HOH A-2 415 1 
HETATM 11050 O O . HOH I-2 6 . . 60.943 16.062 -13.629 0.63 17.78 ? O HOH A-2 416 1 
HETATM 11051 O O . HOH I-2 6 . . 56.93 12.632 -17.682 0.59 29.2 ? O HOH A-2 417 1 
HETATM 11052 O O . HOH I-2 6 . . 80.238 32.283 2.519 1 17.88 ? O HOH A-2 418 1 
HETATM 11053 O O . HOH I-2 6 . . 81.573 32.895 -3.205 1 26.43 ? O HOH A-2 419 1 
HETATM 11054 O O . HOH I-2 6 . . 63.162 19.785 20.847 1 34.76 ? O HOH A-2 420 1 
HETATM 11055 O O . HOH I-2 6 . . 70.039 33.352 -6.289 0.43 28.42 ? O HOH A-2 421 1 
HETATM 11056 O O . HOH I-2 6 . . 68.541 30.736 -4.666 0.48 28.07 ? O HOH A-2 422 1 
HETATM 11057 O O . HOH I-2 6 . . 65.724 3.704 10.795 0.38 12.14 ? O HOH A-2 423 1 
HETATM 11058 O O . HOH I-2 6 . . 77.899 8.843 5.266 0.7 26.46 ? O HOH A-2 424 1 
HETATM 11059 O O . HOH I-2 6 . . 68.644 0.279 -5.915 0.57 22.9 ? O HOH A-2 425 1 
HETATM 11060 O O . HOH I-2 6 . . 75.005 23.815 13.767 0.58 23.64 ? O HOH A-2 426 1 
HETATM 11061 O O . HOH I-2 6 . . 61.812 14.45 16.431 0.65 24.06 ? O HOH A-2 427 1 
HETATM 11062 O O . HOH I-2 6 . . 57.753 1.82 -4.796 0.56 20.99 ? O HOH A-2 428 1 
HETATM 11063 O O . HOH I-2 6 . . 52.065 26.716 7.936 0.76 28.29 ? O HOH A-2 429 1 
HETATM 11064 O O . HOH I-2 6 . . 56.147 4.134 -3.801 0.91 17.1 ? O HOH A-2 430 1 
HETATM 11065 O O . HOH I-2 6 . . 76.147 19.594 15.088 0.91 19.1 ? O HOH A-2 431 1 
HETATM 11066 O O . HOH I-2 6 . . 81.76 30.791 -12.141 0.37 25.02 ? O HOH A-2 432 1 
HETATM 11067 O O . HOH I-2 6 . . 76.288 10.692 3.767 0.72 10.88 ? O HOH A-2 433 1 
HETATM 11068 O O . HOH I-2 6 . . 49.071 6.389 -4.012 0.46 18.11 ? O HOH A-2 434 1 
HETATM 11069 O O . HOH I-2 6 . . 62.56 7.352 -16.899 0.64 14.39 ? O HOH A-2 435 1 
HETATM 11070 O O . HOH I-2 6 . . 63.748 2.552 9.282 0.67 21.5 ? O HOH A-2 436 1 
HETATM 11071 O O . HOH I-2 6 . . 72.952 0.495 -4.856 0.23 15.71 ? O HOH A-2 437 1 
HETATM 11072 O O . HOH I-2 6 . . 84.222 28.129 -8.813 0.3 18.57 ? O HOH A-2 438 1 
HETATM 11073 O O . HOH I-2 6 . . 59.956 16.062 17.853 0.6 21.01 ? O HOH A-2 439 1 
HETATM 11074 O O . HOH I-2 6 . . 56.968 -1.212 -8.307 0.43 25 ? O HOH A-2 440 1 
HETATM 11075 O O . HOH I-2 6 . . 79.445 29.78 -11.889 0.67 16 ? O HOH A-2 441 1 
HETATM 11076 O O . HOH I-2 6 . . 65.492 1.962 -13.8 0.55 25.76 ? O HOH A-2 442 1 
HETATM 11077 O O . HOH I-2 6 . . 72.107 5.476 -14.886 0.43 22.62 ? O HOH A-2 443 1 
HETATM 11078 O O . HOH I-2 6 . . 78.557 30.75 -8.975 0.68 17.69 ? O HOH A-2 444 1 
HETATM 11079 O O . HOH I-2 6 . . 60.495 37.211 10.109 0.52 20.06 ? O HOH A-2 445 1 
HETATM 11080 O O . HOH I-2 6 . . 66.02 0.037 2.466 0.77 21.15 ? O HOH A-2 446 1 
HETATM 11081 O O . HOH I-2 6 . . 63.232 32.786 5.556 0.43 19.16 ? O HOH A-2 447 1 
HETATM 11082 O O . HOH I-2 6 . . 55.294 30.563 -11.118 0.53 23.29 ? O HOH A-2 448 1 
HETATM 11083 O O . HOH I-2 6 . . 79.266 21.962 -16.537 0.53 22.06 ? O HOH A-2 449 1 
HETATM 11084 O O . HOH I-2 6 . . 77.484 10.782 8.529 0.67 27.89 ? O HOH A-2 450 1 
HETATM 11085 O O . HOH I-2 6 . . 82.232 17.287 2.363 0.75 32.43 ? O HOH A-2 451 1 
HETATM 11086 O O . HOH I-2 6 . . 70.965 4.857 6.793 0.62 27.49 ? O HOH A-2 452 1 
HETATM 11087 O O . HOH I-2 6 . . 52.585 10.095 6.999 0.63 27.74 ? O HOH A-2 453 1 
HETATM 11088 O O . HOH I-2 6 . . 70.603 23.567 3.743 1 5.62 ? O HOH A-2 454 1 
HETATM 11089 O O . HOH I-2 6 . . 69.422 31.009 0.264 0.98 10.32 ? O HOH A-2 455 1 
HETATM 11090 O O . HOH I-2 6 . . 56.559 6.136 -5.984 0.9 8.62 ? O HOH A-2 456 1 
HETATM 11091 O O . HOH I-2 6 . . 71.271 29.765 2.219 1 10.54 ? O HOH A-2 457 1 
HETATM 11092 O O . HOH I-2 6 . . 68.98 28.45 3.439 1 12.65 ? O HOH A-2 458 1 
HETATM 11093 O O . HOH I-2 6 . . 55.148 2.698 -12.55 0.86 9.36 ? O HOH A-2 459 1 
HETATM 11094 O O . HOH I-2 6 . . 56.471 31.52 -7.949 1 12.94 ? O HOH A-2 460 1 
HETATM 11095 O O . HOH I-2 6 . . 76.503 1.905 -0.99 0.84 31.79 ? O HOH A-2 461 1 
HETATM 11096 O O . HOH I-2 6 . . 68.926 3.464 9.306 0.96 29.02 ? O HOH A-2 462 1 
HETATM 11097 O O . HOH I-2 6 . . 71.127 -1.617 -5.747 0.4 21.77 ? O HOH A-2 463 1 
HETATM 11098 O O . HOH I-2 6 . . 51.32 21.004 -13.865 0.64 23.88 ? O HOH A-2 464 1 
HETATM 11099 O O . HOH I-2 6 . . 65.54 24.532 1.388 1 5.52 ? O HOH A-2 465 1 
HETATM 11100 O O . HOH I-2 6 . . 69.167 40.712 -4.916 0.35 13.23 ? O HOH A-2 466 1 
HETATM 11101 O O . HOH I-2 6 . . 55.413 4.619 3.042 0.89 26.22 ? O HOH A-2 467 1 
HETATM 11102 O O . HOH I-2 6 . . 69.405 6.025 -15.952 0.44 18.68 ? O HOH A-2 468 1 
HETATM 11103 O O . HOH I-2 6 . . 67.265 11.264 20.137 0.7 33.22 ? O HOH A-2 469 1 
HETATM 11104 O O . HOH I-2 6 . . 69.901 31.345 5.773 0.4 21.51 ? O HOH A-2 470 1 
HETATM 11105 O O . HOH I-2 6 . . 77.85 22.859 11.386 0.44 20.98 ? O HOH A-2 471 1 
HETATM 11106 O O . HOH I-2 6 . . 82.647 23.265 3.347 0.43 14.8 ? O HOH A-2 472 1 
HETATM 11107 O O . HOH I-2 6 . . 70.917 13.056 21.279 0.43 18.87 ? O HOH A-2 473 1 
HETATM 11108 O O . HOH I-2 6 . . 74.102 2.245 -5.723 0.36 18.61 ? O HOH A-2 474 1 
HETATM 11109 O O . HOH I-2 6 . . 68.869 1.101 -11.671 0.54 23.92 ? O HOH A-2 475 1 
HETATM 11110 O O . HOH I-2 6 . . 75.65 3.251 -6.399 0.55 30.96 ? O HOH A-2 476 1 
HETATM 11111 O O . HOH I-2 6 . . 83.88 20.747 -3.441 0.39 26.87 ? O HOH A-2 477 1 
HETATM 11112 O O . HOH I-2 6 . . 75.174 17.068 15.28 0.54 17.49 ? O HOH A-2 478 1 
HETATM 11113 O O . HOH I-2 6 . . 71.233 30.41 10.327 0.53 26.31 ? O HOH A-2 479 1 
HETATM 11114 O O . HOH I-2 6 . . 71.993 32.15 6.061 0.67 30.22 ? O HOH A-2 480 1 
HETATM 11115 O O . HOH I-3 6 . . 36.004 56.584 9.023 0.25 13.9 ? O HOH A-3 179 1 
HETATM 11116 O O . HOH I-3 6 . . 54.947 46.317 19.293 0.62 26.57 ? O HOH A-3 180 1 
HETATM 11117 O O . HOH I-3 6 . . 49.481 54.334 20.739 0.6 26.35 ? O HOH A-3 181 1 
HETATM 11118 O O . HOH I-3 6 . . 66.531 45.401 5.611 0.48 23.99 ? O HOH A-3 182 1 
HETATM 11119 O O . HOH I-3 6 . . 48.467 52.539 22.09 0.75 33.89 ? O HOH A-3 183 1 
HETATM 11120 O O . HOH I-3 6 . . 44.037 45.586 4.031 1 5.77 ? O HOH A-3 184 1 
HETATM 11121 O O . HOH I-3 6 . . 42.611 43.955 2.22 1 5.76 ? O HOH A-3 185 1 
HETATM 11122 O O . HOH I-3 6 . . 56.863 57.867 -13.326 0.71 13.09 ? O HOH A-3 186 1 
HETATM 11123 O O . HOH I-3 6 . . 63.455 51.59 11.709 0.5 24.79 ? O HOH A-3 187 1 
HETATM 11124 O O . HOH I-3 6 . . 57.042 35.6 -14.616 0.59 31.06 ? O HOH A-3 188 1 
HETATM 11125 O O . HOH I-3 6 . . 38.522 50.252 12.754 1 20.27 ? O HOH A-3 189 1 
HETATM 11126 O O . HOH I-3 6 . . 56.651 64.338 -0.451 0.49 21.06 ? O HOH A-3 190 1 
HETATM 11127 O O . HOH I-3 6 . . 45.611 51.21 2.761 1 5.98 ? O HOH A-3 191 1 
HETATM 11128 O O . HOH I-3 6 . . 36.646 48.641 11.802 0.44 25.29 ? O HOH A-3 192 1 
HETATM 11129 O O . HOH I-3 6 . . 43.757 42.029 -0.654 0.88 6.01 ? O HOH A-3 193 1 
HETATM 11130 O O . HOH I-3 6 . . 68.301 54.651 2.167 0.26 16.69 ? O HOH A-3 194 1 
HETATM 11131 O O . HOH I-3 6 . . 46.352 64.365 1.872 1 41.67 ? O HOH A-3 195 1 
HETATM 11132 O O . HOH I-3 6 . . 36.226 33.594 8.025 0.68 33.26 ? O HOH A-3 196 1 
HETATM 11133 O O . HOH I-3 6 . . 47.148 29.449 5.977 0.67 12.25 ? O HOH A-3 197 1 
HETATM 11134 O O . HOH I-3 6 . . 60.339 40.249 -9.111 1 6.89 ? O HOH A-3 198 1 
HETATM 11135 O O . HOH I-3 6 . . 64.796 60.482 -9.095 0.72 42.23 ? O HOH A-3 199 1 
HETATM 11136 O O . HOH I-3 6 . . 59.098 39.688 12.072 1 28.75 ? O HOH A-3 200 1 
HETATM 11137 O O . HOH I-3 6 . . 43.661 53.403 15.102 0.9 19.82 ? O HOH A-3 201 1 
HETATM 11138 O O . HOH I-3 6 . . 48.404 34.984 -11.1 0.42 20.13 ? O HOH A-3 202 1 
HETATM 11139 O O . HOH I-3 6 . . 30.415 53.497 -9.625 0.94 31.19 ? O HOH A-3 203 1 
HETATM 11140 O O . HOH I-3 6 . . 64.7 57.277 11.651 0.18 10.24 ? O HOH A-3 204 1 
HETATM 11141 O O . HOH I-3 6 . . 56.999 40.197 -15.653 0.66 31.37 ? O HOH A-3 205 1 
HETATM 11142 O O . HOH I-3 6 . . 36.697 41.529 6.397 0.53 28.14 ? O HOH A-3 206 1 
HETATM 11143 O O . HOH I-3 6 . . 51.591 49.666 21.391 0.71 30.43 ? O HOH A-3 207 1 
HETATM 11144 O O . HOH I-3 6 . . 36.451 47.121 8.235 0.67 32.61 ? O HOH A-3 208 1 
HETATM 11145 O O . HOH I-3 6 . . 36.625 33.382 -9.784 0.9 6.78 ? O HOH A-3 209 1 
HETATM 11146 O O . HOH I-3 6 . . 42.439 40.867 14.649 1 32.24 ? O HOH A-3 210 1 
HETATM 11147 O O . HOH I-3 6 . . 40.904 49.212 -2.353 1 7.1 ? O HOH A-3 211 1 
HETATM 11148 O O . HOH I-3 6 . . 40.538 42.928 14.159 0.71 27.9 ? O HOH A-3 212 1 
HETATM 11149 O O . HOH I-3 6 . . 38.822 49.432 1.31 1 6.84 ? O HOH A-3 213 1 
HETATM 11150 O O . HOH I-3 6 . . 66.091 53.861 -16.679 0.73 29.41 ? O HOH A-3 214 1 
HETATM 11151 O O . HOH I-3 6 . . 62.719 42.206 10.936 0.69 35.79 ? O HOH A-3 215 1 
HETATM 11152 O O . HOH I-3 6 . . 43.79 42.86 4.379 0.91 6.19 ? O HOH A-3 216 1 
HETATM 11153 O O . HOH I-3 6 . . 45.494 61.874 9.777 0.72 33.33 ? O HOH A-3 217 1 
HETATM 11154 O O . HOH I-3 6 . . 38.819 47.583 -0.934 0.96 7.56 ? O HOH A-3 218 1 
HETATM 11155 O O . HOH I-3 6 . . 35.414 57.032 -2.368 1 8.78 ? O HOH A-3 219 1 
HETATM 11156 O O . HOH I-3 6 . . 57.823 49.919 13.477 0.92 14.41 ? O HOH A-3 220 1 
HETATM 11157 O O . HOH I-3 6 . . 50.481 44.597 -14.617 1 8.09 ? O HOH A-3 221 1 
HETATM 11158 O O . HOH I-3 6 . . 69.508 49.409 -13.595 0.82 21 ? O HOH A-3 222 1 
HETATM 11159 O O . HOH I-3 6 . . 62.856 59.787 -1.453 0.77 22.15 ? O HOH A-3 223 1 
HETATM 11160 O O . HOH I-3 6 . . 64.193 60.634 -0.023 0.13 8.18 ? O HOH A-3 224 1 
HETATM 11161 O O . HOH I-3 6 . . 48.215 64.262 -6.672 0.87 30.47 ? O HOH A-3 225 1 
HETATM 11162 O O . HOH I-3 6 . . 65.509 50.426 11.635 0.59 24.12 ? O HOH A-3 226 1 
HETATM 11163 O O . HOH I-3 6 . . 62.726 41.226 -1.782 0.91 6.92 ? O HOH A-3 227 1 
HETATM 11164 O O . HOH I-3 6 . . 50.244 63.881 -5.58 0.51 20.67 ? O HOH A-3 228 1 
HETATM 11165 O O . HOH I-3 6 . . 34.499 44.281 -8.65 1 8.93 ? O HOH A-3 229 1 
HETATM 11166 O O . HOH I-3 6 . . 33.869 34.326 0.392 1 7.53 ? O HOH A-3 230 1 
HETATM 11167 O O . HOH I-3 6 . . 66.202 50.601 -14.172 1 9.3 ? O HOH A-3 231 1 
HETATM 11168 O O . HOH I-3 6 . . 37.64 44.108 3.134 1 9.26 ? O HOH A-3 232 1 
HETATM 11169 O O . HOH I-3 6 . . 36.247 55.732 -9.803 1 12.66 ? O HOH A-3 233 1 
HETATM 11170 O O . HOH I-3 6 . . 33.213 46.324 -11.68 0.9 6.97 ? O HOH A-3 234 1 
HETATM 11171 O O . HOH I-3 6 . . 63.817 52.991 -14.036 0.7 16.56 ? O HOH A-3 235 1 
HETATM 11172 O O . HOH I-3 6 . . 35.005 43.627 1.97 0.42 14.12 ? O HOH A-3 236 1 
HETATM 11173 O O . HOH I-3 6 . . 39.466 39.739 8.427 1 30.87 ? O HOH A-3 237 1 
HETATM 11174 O O . HOH I-3 6 . . 65.425 58.583 0.032 0.24 15.64 ? O HOH A-3 238 1 
HETATM 11175 O O . HOH I-3 6 . . 60.736 60.936 -2.415 0.8 11.06 ? O HOH A-3 239 1 
HETATM 11176 O O . HOH I-3 6 . . 67.257 51.913 2.701 0.59 24.24 ? O HOH A-3 240 1 
HETATM 11177 O O . HOH I-3 6 . . 39.879 57.927 9.586 0.7 27.71 ? O HOH A-3 241 1 
HETATM 11178 O O . HOH I-3 6 . . 53.614 41.686 -9.554 0.7 5.9 ? O HOH A-3 242 1 
HETATM 11179 O O A HOH I-3 6 . . 49.644 28.668 11.205 0.49 37.53 ? O HOH A-3 243 1 
HETATM 11180 O O B HOH I-3 6 . . 49.581 28.631 9.063 0.51 34.9 ? O HOH A-3 243 1 
HETATM 11181 O O . HOH I-3 6 . . 60.944 50.001 13.393 0.58 23.66 ? O HOH A-3 244 1 
HETATM 11182 O O . HOH I-3 6 . . 42.38 36.276 -14.214 0.47 21.6 ? O HOH A-3 245 1 
HETATM 11183 O O . HOH I-3 6 . . 38.339 38.362 10.905 0.84 38.73 ? O HOH A-3 246 1 
HETATM 11184 O O . HOH I-3 6 . . 29.541 41.14 -13.161 0.99 10.7 ? O HOH A-3 247 1 
HETATM 11185 O O . HOH I-3 6 . . 39.057 59.139 -10.091 1 12.25 ? O HOH A-3 248 1 
HETATM 11186 O O . HOH I-3 6 . . 53.149 31.605 4.009 1 13.93 ? O HOH A-3 249 1 
HETATM 11187 O O . HOH I-3 6 . . 58.991 61.083 8.831 0.76 36.54 ? O HOH A-3 250 1 
HETATM 11188 O O . HOH I-3 6 . . 70.978 48.587 -4.354 0.31 15.48 ? O HOH A-3 251 1 
HETATM 11189 O O . HOH I-3 6 . . 38.957 58.409 5.752 1 11.93 ? O HOH A-3 252 1 
HETATM 11190 O O . HOH I-3 6 . . 52.504 48.902 14.664 0.96 11.22 ? O HOH A-3 253 1 
HETATM 11191 O O . HOH I-3 6 . . 36.945 51.4 1.839 0.82 9.04 ? O HOH A-3 254 1 
HETATM 11192 O O . HOH I-3 6 . . 35.838 51.443 -9.254 1 15.95 ? O HOH A-3 255 1 
HETATM 11193 O O . HOH I-3 6 . . 36.2 34.993 -12.046 0.72 10.83 ? O HOH A-3 256 1 
HETATM 11194 O O . HOH I-3 6 . . 62.879 54.22 -2.274 0.8 12.12 ? O HOH A-3 257 1 
HETATM 11195 O O A HOH I-3 6 . . 55.071 42.947 -12.941 0.46 14.98 ? O HOH A-3 258 1 
HETATM 11196 O O B HOH I-3 6 . . 55.961 42.23 -13.707 0.54 19.35 ? O HOH A-3 258 1 
HETATM 11197 O O . HOH I-3 6 . . 32.983 58.302 -17.716 0.53 29.4 ? O HOH A-3 259 1 
HETATM 11198 O O . HOH I-3 6 . . 68.562 50.242 -1.768 1 37.68 ? O HOH A-3 260 1 
HETATM 11199 O O . HOH I-3 6 . . 55.933 61.743 9.691 0.61 30.47 ? O HOH A-3 261 1 
HETATM 11200 O O . HOH I-3 6 . . 43.879 34.769 14.368 1 37.59 ? O HOH A-3 262 1 
HETATM 11201 O O . HOH I-3 6 . . 37.395 34.958 -14.626 0.8 11.84 ? O HOH A-3 263 1 
HETATM 11202 O O . HOH I-3 6 . . 47.614 64.109 6.057 0.87 41.43 ? O HOH A-3 264 1 
HETATM 11203 O O . HOH I-3 6 . . 55.408 54.928 13.228 0.79 10.83 ? O HOH A-3 265 1 
HETATM 11204 O O . HOH I-3 6 . . 37.852 47.06 5.095 0.6 9.42 ? O HOH A-3 266 1 
HETATM 11205 O O . HOH I-3 6 . . 42.371 41.709 6.398 0.92 14.64 ? O HOH A-3 267 1 
HETATM 11206 O O . HOH I-3 6 . . 54.571 63.373 -2.983 0.99 14.46 ? O HOH A-3 268 1 
HETATM 11207 O O . HOH I-3 6 . . 69.962 43.463 -0.351 0.62 36.45 ? O HOH A-3 269 1 
HETATM 11208 O O . HOH I-3 6 . . 67.029 48.693 -11.982 0.91 15.69 ? O HOH A-3 270 1 
HETATM 11209 O O . HOH I-3 6 . . 46.532 33.956 -9.143 0.97 16.99 ? O HOH A-3 271 1 
HETATM 11210 O O . HOH I-3 6 . . 49.992 62.157 -10.004 1 20.07 ? O HOH A-3 272 1 
HETATM 11211 O O . HOH I-3 6 . . 65.084 51.369 0.966 0.76 13 ? O HOH A-3 273 1 
HETATM 11212 O O . HOH I-3 6 . . 33.983 60.188 3.292 0.62 12.52 ? O HOH A-3 274 1 
HETATM 11213 O O . HOH I-3 6 . . 33.852 55.344 -8.933 0.75 11.6 ? O HOH A-3 275 1 
HETATM 11214 O O . HOH I-3 6 . . 47.746 30.553 10.418 0.58 32.94 ? O HOH A-3 276 1 
HETATM 11215 O O . HOH I-3 6 . . 50.403 62.854 2.72 0.66 11.23 ? O HOH A-3 277 1 
HETATM 11216 O O . HOH I-3 6 . . 50.063 55.161 18.146 0.59 11.26 ? O HOH A-3 278 1 
HETATM 11217 O O . HOH I-3 6 . . 65.163 55.552 10.417 0.63 9.01 ? O HOH A-3 279 1 
HETATM 11218 O O . HOH I-3 6 . . 44.898 61.469 6.862 1 17.02 ? O HOH A-3 280 1 
HETATM 11219 O O . HOH I-3 6 . . 36.805 57.02 6.708 0.96 17.49 ? O HOH A-3 281 1 
HETATM 11220 O O . HOH I-3 6 . . 48.802 55.114 -20.475 0.75 15.61 ? O HOH A-3 282 1 
HETATM 11221 O O . HOH I-3 6 . . 37.806 55.809 9.036 0.62 16.36 ? O HOH A-3 283 1 
HETATM 11222 O O . HOH I-3 6 . . 46.337 32.51 15.333 0.76 37.5 ? O HOH A-3 284 1 
HETATM 11223 O O . HOH I-3 6 . . 68.641 43.235 -5.427 0.86 14.26 ? O HOH A-3 285 1 
HETATM 11224 O O . HOH I-3 6 . . 47.743 62.651 3.671 0.66 13.82 ? O HOH A-3 286 1 
HETATM 11225 O O . HOH I-3 6 . . 33.354 38.364 1.724 0.5 11.07 ? O HOH A-3 287 1 
HETATM 11226 O O . HOH I-3 6 . . 49.603 28.688 4.946 0.24 14.92 ? O HOH A-3 288 1 
HETATM 11227 O O . HOH I-3 6 . . 60.66 47.817 -16.249 0.49 8.05 ? O HOH A-3 289 1 
HETATM 11228 O O . HOH I-3 6 . . 61.98 53.433 0.681 0.45 10.54 ? O HOH A-3 290 1 
HETATM 11229 O O . HOH I-3 6 . . 38.999 60.8 4.889 0.28 9.74 ? O HOH A-3 291 1 
HETATM 11230 O O . HOH I-3 6 . . 63.37 55.749 0.52 0.77 25.41 ? O HOH A-3 292 1 
HETATM 11231 O O A HOH I-3 6 . . 63.411 57.239 -2.238 0.52 13.99 ? O HOH A-3 293 1 
HETATM 11232 O O B HOH I-3 6 . . 63.845 57.891 -3.309 0.48 18.4 ? O HOH A-3 293 1 
HETATM 11233 O O . HOH I-3 6 . . 34.263 60.628 -5.995 0.29 12.37 ? O HOH A-3 294 1 
HETATM 11234 O O . HOH I-3 6 . . 28.593 52.367 -10.954 0.48 19.85 ? O HOH A-3 295 1 
HETATM 11235 O O . HOH I-3 6 . . 50.775 40.386 -17.94 0.53 30.73 ? O HOH A-3 296 1 
HETATM 11236 O O . HOH I-3 6 . . 42.379 60.337 7.349 0.59 11.5 ? O HOH A-3 297 1 
HETATM 11237 O O . HOH I-3 6 . . 62.382 48.584 11.677 1 22.91 ? O HOH A-3 298 1 
HETATM 11238 O O . HOH I-3 6 . . 56.317 57.484 13.706 0.86 19.12 ? O HOH A-3 299 1 
HETATM 11239 O O . HOH I-3 6 . . 60.273 61.116 -8.153 0.8 14.09 ? O HOH A-3 300 1 
HETATM 11240 O O . HOH I-3 6 . . 51.114 42.576 17.42 0.63 15.6 ? O HOH A-3 302 1 
HETATM 11241 O O . HOH I-3 6 . . 48.669 57.731 -13.013 0.97 21.47 ? O HOH A-3 303 1 
HETATM 11242 O O . HOH I-3 6 . . 42.569 60.809 -0.259 1 28.03 ? O HOH A-3 304 1 
HETATM 11243 O O . HOH I-3 6 . . 40.397 53.131 11.068 0.59 16.61 ? O HOH A-3 311 1 
HETATM 11244 O O . HOH I-3 6 . . 71.827 46.303 -11.089 0.75 20.61 ? O HOH A-3 312 1 
HETATM 11245 O O . HOH I-3 6 . . 39.468 42.135 5.752 0.49 10.43 ? O HOH A-3 313 1 
HETATM 11246 O O . HOH I-3 6 . . 61.066 39.679 -21.687 0.94 9.31 ? O HOH A-3 314 1 
HETATM 11247 O O . HOH I-3 6 . . 61.768 39.294 -16.699 0.91 18.6 ? O HOH A-3 315 1 
HETATM 11248 O O . HOH I-3 6 . . 52.821 44.577 18.56 0.69 20.99 ? O HOH A-3 316 1 
HETATM 11249 O O . HOH I-3 6 . . 53.049 47.332 17.153 0.81 18.01 ? O HOH A-3 317 1 
HETATM 11250 O O . HOH I-3 6 . . 46.089 36.665 -15.429 0.53 15.5 ? O HOH A-3 318 1 
HETATM 11251 O O . HOH I-3 6 . . 47.521 64.869 -1.275 0.68 23.8 ? O HOH A-3 319 1 
HETATM 11252 O O . HOH I-3 6 . . 49.622 28.653 -9.247 0.18 30.64 ? O HOH A-3 320 1 
HETATM 11253 O O . HOH I-3 6 . . 54.467 32.329 -12.296 0.5 26.92 ? O HOH A-3 321 1 
HETATM 11254 O O . HOH I-3 6 . . 55.392 30.04 -13.126 0.68 36.45 ? O HOH A-3 322 1 
HETATM 11255 O O . HOH I-3 6 . . 53.768 60.354 9.292 0.81 21.41 ? O HOH A-3 323 1 
HETATM 11256 O O . HOH I-3 6 . . 64.684 56.555 8.831 1 23.53 ? O HOH A-3 324 1 
HETATM 11257 O O . HOH I-3 6 . . 54.487 55.182 19.267 0.48 14.46 ? O HOH A-3 325 1 
HETATM 11258 O O . HOH I-3 6 . . 55.391 48.56 15.144 0.9 19.98 ? O HOH A-3 326 1 
HETATM 11259 O O . HOH I-3 6 . . 26.269 45.185 -11.566 0.66 20.45 ? O HOH A-3 327 1 
HETATM 11260 O O . HOH I-3 6 . . 35.094 56.655 -11.49 0.58 30.02 ? O HOH A-3 328 1 
HETATM 11261 O O . HOH I-3 6 . . 36.66 58.356 -11.441 0.37 21.56 ? O HOH A-3 329 1 
HETATM 11262 O O . HOH I-3 6 . . 50.597 56.054 -22.274 0.73 24.4 ? O HOH A-3 330 1 
HETATM 11263 O O . HOH I-3 6 . . 61.41 52.729 -15.999 0.42 10.98 ? O HOH A-3 331 1 
HETATM 11264 O O . HOH I-3 6 . . 67.448 40.078 -13.428 0.98 14.49 ? O HOH A-3 332 1 
HETATM 11265 O O . HOH I-3 6 . . 57.636 53.216 13.385 0.72 16.84 ? O HOH A-3 333 1 
HETATM 11266 O O . HOH I-3 6 . . 51.178 47.568 19.282 0.67 19.44 ? O HOH A-3 334 1 
HETATM 11267 O O . HOH I-3 6 . . 57.707 57.465 15.256 0.44 25.78 ? O HOH A-3 335 1 
HETATM 11268 O O . HOH I-3 6 . . 48.671 60.796 -12.237 0.61 21.15 ? O HOH A-3 336 1 
HETATM 11269 O O . HOH I-3 6 . . 56.464 56.654 16.559 0.4 22.45 ? O HOH A-3 337 1 
HETATM 11270 O O . HOH I-3 6 . . 57.577 63.611 16.482 0.68 40.23 ? O HOH A-3 338 1 
HETATM 11271 O O . HOH I-3 6 . . 67.018 41.751 2.123 0.55 29.45 ? O HOH A-3 339 1 
HETATM 11272 O O . HOH I-3 6 . . 66.642 38.691 4.598 0.66 32.31 ? O HOH A-3 340 1 
HETATM 11273 O O . HOH I-3 6 . . 66.829 42.796 6.259 0.8 33.06 ? O HOH A-3 341 1 
HETATM 11274 O O . HOH I-3 6 . . 67.798 45.016 7.603 0.6 33.38 ? O HOH A-3 342 1 
HETATM 11275 O O . HOH I-3 6 . . 48.458 57.637 13.334 0.62 15.05 ? O HOH A-3 343 1 
HETATM 11276 O O . HOH I-3 6 . . 49.538 42.808 -16.615 0.29 12.31 ? O HOH A-3 344 1 
HETATM 11277 O O . HOH I-3 6 . . 45.701 59.485 -11.192 0.55 28.29 ? O HOH A-3 345 1 
HETATM 11278 O O . HOH I-3 6 . . 64.928 53.735 -0.447 0.44 19.1 ? O HOH A-3 346 1 
HETATM 11279 O O . HOH I-3 6 . . 59.353 33.686 -13.991 0.63 16.82 ? O HOH A-3 347 1 
HETATM 11280 O O . HOH I-3 6 . . 66.751 56.015 -10.222 0.59 17.56 ? O HOH A-3 348 1 
HETATM 11281 O O . HOH I-3 6 . . 35.108 39.713 3.316 0.82 30.59 ? O HOH A-3 349 1 
HETATM 11282 O O . HOH I-3 6 . . 58.904 38.429 -16.334 0.72 18.66 ? O HOH A-3 350 1 
HETATM 11283 O O . HOH I-3 6 . . 37.691 52.257 10.487 0.53 18.78 ? O HOH A-3 351 1 
HETATM 11284 O O . HOH I-3 6 . . 67.808 47.354 1.32 0.77 22.91 ? O HOH A-3 352 1 
HETATM 11285 O O . HOH I-3 6 . . 41.763 53.128 17.402 0.63 18.62 ? O HOH A-3 353 1 
HETATM 11286 O O . HOH I-3 6 . . 72.257 43.204 -7.099 1 29.22 ? O HOH A-3 354 1 
HETATM 11287 O O . HOH I-3 6 . . 59.616 60.41 4.573 0.57 17.96 ? O HOH A-3 355 1 
HETATM 11288 O O . HOH I-3 6 . . 34.995 59.129 -8.514 0.59 18.27 ? O HOH A-3 356 1 
HETATM 11289 O O . HOH I-3 6 . . 38.304 56.808 -10.305 0.49 22.53 ? O HOH A-3 357 1 
HETATM 11290 O O A HOH I-3 6 . . 30.24 51.631 -0.344 0.47 11.85 ? O HOH A-3 358 1 
HETATM 11291 O O B HOH I-3 6 . . 30.616 50.752 1.095 0.53 20.93 ? O HOH A-3 358 1 
HETATM 11292 O O . HOH I-3 6 . . 43.894 34.796 -13.124 0.38 15.81 ? O HOH A-3 359 1 
HETATM 11293 O O . HOH I-3 6 . . 64.981 58.014 -8.267 0.77 15.2 ? O HOH A-3 360 1 
HETATM 11294 O O . HOH I-3 6 . . 45.471 30.167 0.539 0.6 17.22 ? O HOH A-3 361 1 
HETATM 11295 O O . HOH I-3 6 . . 65.695 54.531 12.119 0.62 19.8 ? O HOH A-3 362 1 
HETATM 11296 O O . HOH I-3 6 . . 37.893 39.294 3.683 0.29 10.41 ? O HOH A-3 363 1 
HETATM 11297 O O . HOH I-3 6 . . 64.628 57.6 4.392 1 33.42 ? O HOH A-3 364 1 
HETATM 11298 O O . HOH I-3 6 . . 63.892 60.698 -3.503 1 35.4 ? O HOH A-3 365 1 
HETATM 11299 O O . HOH I-3 6 . . 24.274 50.661 -5.194 1 28.55 ? O HOH A-3 366 1 
HETATM 11300 O O . HOH I-3 6 . . 25.92 51.587 -3.726 1 32.37 ? O HOH A-3 367 1 
HETATM 11301 O O . HOH I-3 6 . . 70.246 53.766 -8.939 1 35.65 ? O HOH A-3 368 1 
HETATM 11302 O O . HOH I-3 6 . . 69.288 46.3 -1.119 1 34.2 ? O HOH A-3 369 1 
HETATM 11303 O O . HOH I-3 6 . . 42.455 57.406 13.055 0.63 21.64 ? O HOH A-3 370 1 
HETATM 11304 O O . HOH I-3 6 . . 50.152 36.599 -13.506 0.28 15.67 ? O HOH A-3 371 1 
HETATM 11305 O O . HOH I-3 6 . . 29.35 44.813 -3.549 0.93 31.79 ? O HOH A-3 372 1 
HETATM 11306 O O . HOH I-3 6 . . 32.79 49.511 -0.165 1 37.23 ? O HOH A-3 373 1 
HETATM 11307 O O . HOH I-3 6 . . 57.516 57.559 -17.896 1 32.39 ? O HOH A-3 374 1 
HETATM 11308 O O . HOH I-3 6 . . 37.6 37.653 7.281 1 40.07 ? O HOH A-3 375 1 
HETATM 11309 O O . HOH I-3 6 . . 36.271 43.843 9.248 1 35.87 ? O HOH A-3 376 1 
HETATM 11310 O O . HOH I-3 6 . . 31.157 56.494 -8.636 0.69 18.43 ? O HOH A-3 377 1 
HETATM 11311 O O . HOH I-3 6 . . 37.906 45.341 12.92 1 37.4 ? O HOH A-3 378 1 
HETATM 11312 O O . HOH I-3 6 . . 48.616 26.759 -0.411 1 26.41 ? O HOH A-3 379 1 
HETATM 11313 O O A HOH I-3 6 . . 49.619 28.655 -1.959 0.31 14.63 ? O HOH A-3 380 1 
HETATM 11314 O O B HOH I-3 6 . . 49.874 29.355 -0.535 0.69 30.71 ? O HOH A-3 380 1 
HETATM 11315 O O . HOH I-3 6 . . 41.269 60.452 -3.718 1 26.99 ? O HOH A-3 381 1 
HETATM 11316 O O . HOH I-3 6 . . 33.742 46.013 4.827 1 34.53 ? O HOH A-3 382 1 
HETATM 11317 O O . HOH I-3 6 . . 47.404 62.349 8.107 0.44 16.74 ? O HOH A-3 383 1 
HETATM 11318 O O . HOH I-3 6 . . 32.677 45.915 -9.632 0.37 21.51 ? O HOH A-3 384 1 
HETATM 11319 O O . HOH I-3 6 . . 48.38 38.185 -16.614 1 37.07 ? O HOH A-3 385 1 
HETATM 11320 O O A HOH I-3 6 . . 37.192 45.242 -2.104 0.27 12.36 ? O HOH A-3 386 1 
HETATM 11321 O O B HOH I-3 6 . . 38.653 46.021 -3.217 0.73 9.75 ? O HOH A-3 386 1 
HETATM 11322 O O . HOH I-3 6 . . 49.33 61.491 6.514 0.74 22.04 ? O HOH A-3 387 1 
HETATM 11323 O O . HOH I-3 6 . . 26.1 45.356 -8.105 0.25 15.96 ? O HOH A-3 388 1 
HETATM 11324 O O . HOH I-3 6 . . 59.026 65.535 1.304 1 36.56 ? O HOH A-3 389 1 
HETATM 11325 O O . HOH I-3 6 . . 41.19 60.584 -11.415 1 39.59 ? O HOH A-3 390 1 
HETATM 11326 O O . HOH I-3 6 . . 52.929 29.859 2.158 1 31.43 ? O HOH A-3 391 1 
HETATM 11327 O O A HOH I-3 6 . . 47.551 31.619 7.76 0.71 18.36 ? O HOH A-3 392 1 
HETATM 11328 O O B HOH I-3 6 . . 48.819 30.577 6.697 0.29 19.15 ? O HOH A-3 392 1 
HETATM 11329 O O . HOH I-3 6 . . 60.982 56.803 11.539 0.4 17.81 ? O HOH A-3 393 1 
HETATM 11330 O O . HOH I-3 6 . . 61.543 63.594 -1.964 0.72 21.31 ? O HOH A-3 394 1 
HETATM 11331 O O . HOH I-3 6 . . 26.386 49.213 -4.224 1 37.27 ? O HOH A-3 395 1 
HETATM 11332 O O . HOH I-3 6 . . 63.844 53.277 -16.426 0.5 14.5 ? O HOH A-3 396 1 
HETATM 11333 O O . HOH I-3 6 . . 63.382 61.169 -5.409 0.61 16.32 ? O HOH A-3 397 1 
HETATM 11334 O O . HOH I-3 6 . . 44.043 30.707 -9.514 1 23.09 ? O HOH A-3 398 1 
HETATM 11335 O O . HOH I-3 6 . . 45.028 56.384 -14.986 1 19.26 ? O HOH A-3 399 1 
HETATM 11336 O O . HOH I-3 6 . . 42.801 56.724 -13.344 1 30.23 ? O HOH A-3 400 1 
HETATM 11337 O O . HOH I-3 6 . . 45.042 58.559 -13.336 1 38.51 ? O HOH A-3 401 1 
HETATM 11338 O O . HOH I-3 6 . . 45.343 28.359 -7.662 1 25.38 ? O HOH A-3 402 1 
HETATM 11339 O O . HOH I-3 6 . . 46.295 29.66 -9.495 1 29.5 ? O HOH A-3 403 1 
HETATM 11340 O O . HOH I-3 6 . . 54.293 45.574 17.547 1 17.72 ? O HOH A-3 404 1 
HETATM 11341 O O . HOH I-3 6 . . 65.848 53.629 -12.925 1 35.03 ? O HOH A-3 405 1 
HETATM 11342 O O . HOH I-3 6 . . 50.569 28.847 2.246 0.64 26.87 ? O HOH A-3 406 1 
HETATM 11343 O O . HOH I-3 6 . . 50.987 31.618 10.204 1 37.16 ? O HOH A-3 407 1 
HETATM 11344 O O A HOH I-3 6 . . 34.198 46.043 -2.012 0.71 11.14 ? O HOH A-3 408 1 
HETATM 11345 O O B HOH I-3 6 . . 33.255 44.885 -2.016 0.29 12.66 ? O HOH A-3 408 1 
HETATM 11346 O O . HOH I-3 6 . . 32.398 40.051 -5.035 1 35.51 ? O HOH A-3 409 1 
HETATM 11347 O O . HOH I-3 6 . . 33.43 42.263 -6.045 1 33.82 ? O HOH A-3 410 1 
HETATM 11348 O O . HOH I-3 6 . . 32.335 38.394 -10.825 1 35.54 ? O HOH A-3 411 1 
HETATM 11349 O O . HOH I-3 6 . . 66.331 48.986 -0.231 0.94 14.43 ? O HOH A-3 412 1 
HETATM 11350 O O . HOH I-3 6 . . 58.874 44.537 -18.364 0.59 26.93 ? O HOH A-3 413 1 
HETATM 11351 O O A HOH I-3 6 . . 57.216 42.757 -17.283 0.58 19.84 ? O HOH A-3 414 1 
HETATM 11352 O O B HOH I-3 6 . . 58.261 43.586 -16.421 0.42 28.06 ? O HOH A-3 414 1 
HETATM 11353 O O . HOH I-3 6 . . 56.278 47.097 -13.862 0.54 11.82 ? O HOH A-3 415 1 
HETATM 11354 O O . HOH I-3 6 . . 54.872 44.747 -13.629 0.63 17.78 ? O HOH A-3 416 1 
HETATM 11355 O O . HOH I-3 6 . . 59.849 42.987 -17.682 0.59 29.2 ? O HOH A-3 417 1 
HETATM 11356 O O . HOH I-3 6 . . 31.176 53.347 2.519 1 17.88 ? O HOH A-3 418 1 
HETATM 11357 O O . HOH I-3 6 . . 29.979 54.197 -3.205 1 26.43 ? O HOH A-3 419 1 
HETATM 11358 O O . HOH I-3 6 . . 50.537 44.807 20.847 1 34.76 ? O HOH A-3 420 1 
HETATM 11359 O O . HOH I-3 6 . . 35.35 43.979 -6.289 0.43 28.42 ? O HOH A-3 421 1 
HETATM 11360 O O . HOH I-3 6 . . 38.365 43.99 -4.666 0.48 28.07 ? O HOH A-3 422 1 
HETATM 11361 O O . HOH I-3 6 . . 63.183 55.067 10.795 0.38 12.14 ? O HOH A-3 423 1 
HETATM 11362 O O . HOH I-3 6 . . 52.646 63.041 5.266 0.7 26.46 ? O HOH A-3 424 1 
HETATM 11363 O O . HOH I-3 6 . . 64.69 59.308 -5.915 0.57 22.9 ? O HOH A-3 425 1 
HETATM 11364 O O . HOH I-3 6 . . 41.126 53.049 13.767 0.58 23.64 ? O HOH A-3 426 1 
HETATM 11365 O O . HOH I-3 6 . . 55.833 46.305 16.431 0.65 24.06 ? O HOH A-3 427 1 
HETATM 11366 O O . HOH I-3 6 . . 68.8 49.106 -4.796 0.56 20.99 ? O HOH A-3 428 1 
HETATM 11367 O O . HOH I-3 6 . . 50.084 31.731 7.936 0.76 28.29 ? O HOH A-3 429 1 
HETATM 11368 O O . HOH I-3 6 . . 67.6 46.558 -3.801 0.91 17.1 ? O HOH A-3 430 1 
HETATM 11369 O O . HOH I-3 6 . . 44.21 56.148 15.088 0.91 19.1 ? O HOH A-3 431 1 
HETATM 11370 O O . HOH I-3 6 . . 31.707 55.411 -12.141 0.37 25.02 ? O HOH A-3 432 1 
HETATM 11371 O O . HOH I-3 6 . . 51.849 60.722 3.767 0.72 10.88 ? O HOH A-3 433 1 
HETATM 11372 O O . HOH I-3 6 . . 69.184 39.302 -4.012 0.46 18.11 ? O HOH A-3 434 1 
HETATM 11373 O O . HOH I-3 6 . . 61.606 50.502 -16.899 0.64 14.39 ? O HOH A-3 435 1 
HETATM 11374 O O . HOH I-3 6 . . 65.169 53.931 9.282 0.67 21.5 ? O HOH A-3 436 1 
HETATM 11375 O O . HOH I-3 6 . . 62.349 62.931 -4.856 0.23 15.71 ? O HOH A-3 437 1 
HETATM 11376 O O . HOH I-3 6 . . 32.782 58.874 -8.813 0.3 18.57 ? O HOH A-3 438 1 
HETATM 11377 O O . HOH I-3 6 . . 55.365 43.892 17.853 0.6 21.01 ? O HOH A-3 439 1 
HETATM 11378 O O . HOH I-3 6 . . 71.819 49.942 -8.307 0.43 25 ? O HOH A-3 440 1 
HETATM 11379 O O . HOH I-3 6 . . 33.74 53.912 -11.889 0.67 16 ? O HOH A-3 441 1 
HETATM 11380 O O . HOH I-3 6 . . 64.808 55.736 -13.8 0.55 25.76 ? O HOH A-3 442 1 
HETATM 11381 O O . HOH I-3 6 . . 58.457 59.709 -14.886 0.43 22.62 ? O HOH A-3 443 1 
HETATM 11382 O O . HOH I-3 6 . . 33.344 52.658 -8.975 0.68 17.69 ? O HOH A-3 444 1 
HETATM 11383 O O . HOH I-3 6 . . 36.78 33.784 10.109 0.52 20.06 ? O HOH A-3 445 1 
HETATM 11384 O O . HOH I-3 6 . . 66.211 57.156 2.466 0.77 21.15 ? O HOH A-3 446 1 
HETATM 11385 O O . HOH I-3 6 . . 39.243 38.368 5.556 0.43 19.16 ? O HOH A-3 447 1 
HETATM 11386 O O . HOH I-3 6 . . 45.137 32.604 -11.118 0.53 23.29 ? O HOH A-3 448 1 
HETATM 11387 O O . HOH I-3 6 . . 40.6 57.666 -16.537 0.53 22.06 ? O HOH A-3 449 1 
HETATM 11388 O O . HOH I-3 6 . . 51.174 61.712 8.529 0.67 27.89 ? O HOH A-3 450 1 
HETATM 11389 O O . HOH I-3 6 . . 43.166 62.572 2.363 0.75 32.43 ? O HOH A-3 451 1 
HETATM 11390 O O . HOH I-3 6 . . 59.565 59.029 6.793 0.62 27.49 ? O HOH A-3 452 1 
HETATM 11391 O O . HOH I-3 6 . . 64.218 40.493 6.999 0.63 27.74 ? O HOH A-3 453 1 
HETATM 11392 O O . HOH I-3 6 . . 43.542 49.361 3.743 1 5.62 ? O HOH A-3 454 1 
HETATM 11393 O O . HOH I-3 6 . . 37.688 44.617 0.264 0.98 10.32 ? O HOH A-3 455 1 
HETATM 11394 O O . HOH I-3 6 . . 65.659 45.914 -5.984 0.9 8.62 ? O HOH A-3 456 1 
HETATM 11395 O O . HOH I-3 6 . . 37.841 46.84 2.219 1 10.54 ? O HOH A-3 457 1 
HETATM 11396 O O . HOH I-3 6 . . 40.124 45.513 3.439 1 12.65 ? O HOH A-3 458 1 
HETATM 11397 O O . HOH I-3 6 . . 69.342 46.411 -12.55 0.86 9.36 ? O HOH A-3 459 1 
HETATM 11398 O O . HOH I-3 6 . . 43.72 33.146 -7.949 1 12.94 ? O HOH A-3 460 1 
HETATM 11399 O O . HOH I-3 6 . . 59.352 65.301 -0.99 0.84 31.79 ? O HOH A-3 461 1 
HETATM 11400 O O . HOH I-3 6 . . 61.79 57.959 9.306 0.96 29.02 ? O HOH A-3 462 1 
HETATM 11401 O O . HOH I-3 6 . . 65.089 62.406 -5.747 0.4 21.77 ? O HOH A-3 463 1 
HETATM 11402 O O . HOH I-3 6 . . 55.403 33.943 -13.865 0.64 23.88 ? O HOH A-3 464 1 
HETATM 11403 O O . HOH I-3 6 . . 45.237 44.493 1.388 1 5.52 ? O HOH A-3 465 1 
HETATM 11404 O O . HOH I-3 6 . . 29.411 39.544 -4.916 0.35 13.23 ? O HOH A-3 466 1 
HETATM 11405 O O . HOH I-3 6 . . 67.546 45.68 3.042 0.89 26.22 ? O HOH A-3 467 1 
HETATM 11406 O O . HOH I-3 6 . . 59.333 57.094 -15.952 0.44 18.68 ? O HOH A-3 468 1 
HETATM 11407 O O . HOH I-3 6 . . 55.865 52.621 20.137 0.7 33.22 ? O HOH A-3 469 1 
HETATM 11408 O O . HOH I-3 6 . . 37.157 44.863 5.773 0.4 21.51 ? O HOH A-3 470 1 
HETATM 11409 O O . HOH I-3 6 . . 40.531 55.991 11.386 0.44 20.98 ? O HOH A-3 471 1 
HETATM 11410 O O . HOH I-3 6 . . 37.782 59.942 3.347 0.43 14.8 ? O HOH A-3 472 1 
HETATM 11411 O O . HOH I-3 6 . . 52.488 54.888 21.279 0.43 18.87 ? O HOH A-3 473 1 
HETATM 11412 O O . HOH I-3 6 . . 60.258 63.051 -5.723 0.36 18.61 ? O HOH A-3 474 1 
HETATM 11413 O O . HOH I-3 6 . . 63.865 59.091 -11.671 0.54 23.92 ? O HOH A-3 475 1 
HETATM 11414 O O . HOH I-3 6 . . 58.612 63.889 -6.399 0.55 30.96 ? O HOH A-3 476 1 
HETATM 11415 O O . HOH I-3 6 . . 39.346 62.269 -3.441 0.39 26.87 ? O HOH A-3 477 1 
HETATM 11416 O O . HOH I-3 6 . . 46.885 56.568 15.28 0.54 17.49 ? O HOH A-3 478 1 
HETATM 11417 O O . HOH I-3 6 . . 37.301 46.484 10.327 0.53 26.31 ? O HOH A-3 479 1 
HETATM 11418 O O . HOH I-3 6 . . 35.414 46.272 6.061 0.67 30.22 ? O HOH A-3 480 1 
HETATM 11419 O O . HOH I-4 6 . . 36.004 0.72 -41.875 0.25 13.9 ? O HOH A-4 179 1 
HETATM 11420 O O . HOH I-4 6 . . 54.947 10.987 -52.145 0.62 26.57 ? O HOH A-4 180 1 
HETATM 11421 O O . HOH I-4 6 . . 49.481 2.97 -53.591 0.6 26.35 ? O HOH A-4 181 1 
HETATM 11422 O O . HOH I-4 6 . . 66.531 11.903 -38.463 0.48 23.99 ? O HOH A-4 182 1 
HETATM 11423 O O . HOH I-4 6 . . 48.467 4.764 -54.942 0.75 33.89 ? O HOH A-4 183 1 
HETATM 11424 O O . HOH I-4 6 . . 44.037 11.718 -36.883 1 5.77 ? O HOH A-4 184 1 
HETATM 11425 O O . HOH I-4 6 . . 42.611 13.349 -35.072 1 5.76 ? O HOH A-4 185 1 
HETATM 11426 O O . HOH I-4 6 . . 56.863 -0.564 -19.526 0.71 13.09 ? O HOH A-4 186 1 
HETATM 11427 O O . HOH I-4 6 . . 63.455 5.714 -44.561 0.5 24.79 ? O HOH A-4 187 1 
HETATM 11428 O O . HOH I-4 6 . . 57.042 21.703 -18.236 0.59 31.06 ? O HOH A-4 188 1 
HETATM 11429 O O . HOH I-4 6 . . 38.522 7.051 -45.606 1 20.27 ? O HOH A-4 189 1 
HETATM 11430 O O . HOH I-4 6 . . 56.651 -7.034 -32.401 0.49 21.06 ? O HOH A-4 190 1 
HETATM 11431 O O . HOH I-4 6 . . 45.611 6.093 -35.613 1 5.98 ? O HOH A-4 191 1 
HETATM 11432 O O . HOH I-4 6 . . 36.646 8.663 -44.654 0.44 25.29 ? O HOH A-4 192 1 
HETATM 11433 O O . HOH I-4 6 . . 43.757 15.274 -32.198 0.88 6.01 ? O HOH A-4 193 1 
HETATM 11434 O O . HOH I-4 6 . . 68.301 2.652 -35.019 0.26 16.69 ? O HOH A-4 194 1 
HETATM 11435 O O . HOH I-4 6 . . 46.352 -7.062 -34.724 1 41.67 ? O HOH A-4 195 1 
HETATM 11436 O O . HOH I-4 6 . . 36.226 23.71 -40.877 0.68 33.26 ? O HOH A-4 196 1 
HETATM 11437 O O . HOH I-4 6 . . 47.148 27.854 -38.829 0.67 12.25 ? O HOH A-4 197 1 
HETATM 11438 O O . HOH I-4 6 . . 60.339 17.055 -23.741 1 6.89 ? O HOH A-4 198 1 
HETATM 11439 O O . HOH I-4 6 . . 64.796 -3.178 -23.757 0.72 42.23 ? O HOH A-4 199 1 
HETATM 11440 O O . HOH I-4 6 . . 59.098 17.615 -44.924 1 28.75 ? O HOH A-4 200 1 
HETATM 11441 O O . HOH I-4 6 . . 43.661 3.901 -47.954 0.9 19.82 ? O HOH A-4 201 1 
HETATM 11442 O O . HOH I-4 6 . . 48.404 22.32 -21.752 0.42 20.13 ? O HOH A-4 202 1 
HETATM 11443 O O . HOH I-4 6 . . 30.415 3.807 -23.227 0.94 31.19 ? O HOH A-4 203 1 
HETATM 11444 O O . HOH I-4 6 . . 64.7 0.027 -44.503 0.18 10.24 ? O HOH A-4 204 1 
HETATM 11445 O O . HOH I-4 6 . . 56.999 17.107 -17.199 0.66 31.37 ? O HOH A-4 205 1 
HETATM 11446 O O . HOH I-4 6 . . 36.697 15.774 -39.249 0.53 28.14 ? O HOH A-4 206 1 
HETATM 11447 O O . HOH I-4 6 . . 51.591 7.637 -54.243 0.71 30.43 ? O HOH A-4 207 1 
HETATM 11448 O O . HOH I-4 6 . . 36.451 10.183 -41.087 0.67 32.61 ? O HOH A-4 208 1 
HETATM 11449 O O . HOH I-4 6 . . 36.625 23.922 -23.068 0.9 6.78 ? O HOH A-4 209 1 
HETATM 11450 O O . HOH I-4 6 . . 42.439 16.437 -47.501 1 32.24 ? O HOH A-4 210 1 
HETATM 11451 O O . HOH I-4 6 . . 40.904 8.092 -30.499 1 7.1 ? O HOH A-4 211 1 
HETATM 11452 O O . HOH I-4 6 . . 40.538 14.376 -47.011 0.71 27.9 ? O HOH A-4 212 1 
HETATM 11453 O O . HOH I-4 6 . . 38.822 7.872 -34.162 1 6.84 ? O HOH A-4 213 1 
HETATM 11454 O O . HOH I-4 6 . . 66.091 3.443 -16.173 0.73 29.41 ? O HOH A-4 214 1 
HETATM 11455 O O . HOH I-4 6 . . 62.719 15.098 -43.788 0.69 35.79 ? O HOH A-4 215 1 
HETATM 11456 O O . HOH I-4 6 . . 43.79 14.443 -37.231 0.91 6.19 ? O HOH A-4 216 1 
HETATM 11457 O O . HOH I-4 6 . . 45.494 -4.57 -42.629 0.72 33.33 ? O HOH A-4 217 1 
HETATM 11458 O O . HOH I-4 6 . . 38.819 9.721 -31.918 0.96 7.56 ? O HOH A-4 218 1 
HETATM 11459 O O . HOH I-4 6 . . 35.414 0.272 -30.484 1 8.78 ? O HOH A-4 219 1 
HETATM 11460 O O . HOH I-4 6 . . 57.823 7.385 -46.329 0.92 14.41 ? O HOH A-4 220 1 
HETATM 11461 O O . HOH I-4 6 . . 50.481 12.706 -18.235 1 8.09 ? O HOH A-4 221 1 
HETATM 11462 O O . HOH I-4 6 . . 69.508 7.895 -19.257 0.82 21 ? O HOH A-4 222 1 
HETATM 11463 O O . HOH I-4 6 . . 62.856 -2.483 -31.399 0.77 22.15 ? O HOH A-4 223 1 
HETATM 11464 O O . HOH I-4 6 . . 64.193 -3.33 -32.829 0.13 8.18 ? O HOH A-4 224 1 
HETATM 11465 O O . HOH I-4 6 . . 48.215 -6.958 -26.18 0.87 30.47 ? O HOH A-4 225 1 
HETATM 11466 O O . HOH I-4 6 . . 65.509 6.877 -44.487 0.59 24.12 ? O HOH A-4 226 1 
HETATM 11467 O O . HOH I-4 6 . . 62.726 16.077 -31.07 0.91 6.92 ? O HOH A-4 227 1 
HETATM 11468 O O . HOH I-4 6 . . 50.244 -6.578 -27.272 0.51 20.67 ? O HOH A-4 228 1 
HETATM 11469 O O . HOH I-4 6 . . 34.499 13.022 -24.202 1 8.93 ? O HOH A-4 229 1 
HETATM 11470 O O . HOH I-4 6 . . 33.869 22.977 -33.244 1 7.53 ? O HOH A-4 230 1 
HETATM 11471 O O . HOH I-4 6 . . 66.202 6.702 -18.68 1 9.3 ? O HOH A-4 231 1 
HETATM 11472 O O . HOH I-4 6 . . 37.64 13.196 -35.986 1 9.26 ? O HOH A-4 232 1 
HETATM 11473 O O . HOH I-4 6 . . 36.247 1.572 -23.049 1 12.66 ? O HOH A-4 233 1 
HETATM 11474 O O . HOH I-4 6 . . 33.213 10.98 -21.172 0.9 6.97 ? O HOH A-4 234 1 
HETATM 11475 O O . HOH I-4 6 . . 63.817 4.313 -18.816 0.7 16.56 ? O HOH A-4 235 1 
HETATM 11476 O O . HOH I-4 6 . . 35.005 13.677 -34.822 0.42 14.12 ? O HOH A-4 236 1 
HETATM 11477 O O . HOH I-4 6 . . 39.466 17.565 -41.279 1 30.87 ? O HOH A-4 237 1 
HETATM 11478 O O . HOH I-4 6 . . 65.425 -1.279 -32.884 0.24 15.64 ? O HOH A-4 238 1 
HETATM 11479 O O . HOH I-4 6 . . 60.736 -3.632 -30.437 0.8 11.06 ? O HOH A-4 239 1 
HETATM 11480 O O . HOH I-4 6 . . 67.257 5.39 -35.553 0.59 24.24 ? O HOH A-4 240 1 
HETATM 11481 O O . HOH I-4 6 . . 39.879 -0.623 -42.438 0.7 27.71 ? O HOH A-4 241 1 
HETATM 11482 O O . HOH I-4 6 . . 53.614 15.618 -23.298 0.7 5.9 ? O HOH A-4 242 1 
HETATM 11483 O O A HOH I-4 6 . . 49.644 28.636 -44.057 0.49 37.53 ? O HOH A-4 243 1 
HETATM 11484 O O B HOH I-4 6 . . 49.581 28.673 -41.915 0.51 34.9 ? O HOH A-4 243 1 
HETATM 11485 O O . HOH I-4 6 . . 60.944 7.303 -46.245 0.58 23.66 ? O HOH A-4 244 1 
HETATM 11486 O O . HOH I-4 6 . . 42.38 21.028 -18.638 0.47 21.6 ? O HOH A-4 245 1 
HETATM 11487 O O . HOH I-4 6 . . 38.339 18.942 -43.757 0.84 38.73 ? O HOH A-4 246 1 
HETATM 11488 O O . HOH I-4 6 . . 29.541 16.163 -19.691 0.99 10.7 ? O HOH A-4 247 1 
HETATM 11489 O O . HOH I-4 6 . . 39.057 -1.836 -22.761 1 12.25 ? O HOH A-4 248 1 
HETATM 11490 O O . HOH I-4 6 . . 53.149 25.699 -36.861 1 13.93 ? O HOH A-4 249 1 
HETATM 11491 O O . HOH I-4 6 . . 58.991 -3.779 -41.683 0.76 36.54 ? O HOH A-4 250 1 
HETATM 11492 O O . HOH I-4 6 . . 70.978 8.716 -28.498 0.31 15.48 ? O HOH A-4 251 1 
HETATM 11493 O O . HOH I-4 6 . . 38.957 -1.105 -38.604 1 11.93 ? O HOH A-4 252 1 
HETATM 11494 O O . HOH I-4 6 . . 52.504 8.402 -47.516 0.96 11.22 ? O HOH A-4 253 1 
HETATM 11495 O O . HOH I-4 6 . . 36.945 5.904 -34.691 0.82 9.04 ? O HOH A-4 254 1 
HETATM 11496 O O . HOH I-4 6 . . 35.838 5.861 -23.598 1 15.95 ? O HOH A-4 255 1 
HETATM 11497 O O . HOH I-4 6 . . 36.2 22.311 -20.806 0.72 10.83 ? O HOH A-4 256 1 
HETATM 11498 O O . HOH I-4 6 . . 62.879 3.084 -30.578 0.8 12.12 ? O HOH A-4 257 1 
HETATM 11499 O O A HOH I-4 6 . . 55.071 14.356 -19.911 0.46 14.98 ? O HOH A-4 258 1 
HETATM 11500 O O B HOH I-4 6 . . 55.961 15.074 -19.145 0.54 19.35 ? O HOH A-4 258 1 
HETATM 11501 O O . HOH I-4 6 . . 32.983 -0.998 -15.136 0.53 29.4 ? O HOH A-4 259 1 
HETATM 11502 O O . HOH I-4 6 . . 68.562 7.061 -31.084 1 37.68 ? O HOH A-4 260 1 
HETATM 11503 O O . HOH I-4 6 . . 55.933 -4.44 -42.543 0.61 30.47 ? O HOH A-4 261 1 
HETATM 11504 O O . HOH I-4 6 . . 43.879 22.535 -47.22 1 37.59 ? O HOH A-4 262 1 
HETATM 11505 O O . HOH I-4 6 . . 37.395 22.346 -18.226 0.8 11.84 ? O HOH A-4 263 1 
HETATM 11506 O O . HOH I-4 6 . . 47.614 -6.805 -38.909 0.87 41.43 ? O HOH A-4 264 1 
HETATM 11507 O O . HOH I-4 6 . . 55.408 2.376 -46.08 0.79 10.83 ? O HOH A-4 265 1 
HETATM 11508 O O . HOH I-4 6 . . 37.852 10.244 -37.947 0.6 9.42 ? O HOH A-4 266 1 
HETATM 11509 O O . HOH I-4 6 . . 42.371 15.594 -39.25 0.92 14.64 ? O HOH A-4 267 1 
HETATM 11510 O O . HOH I-4 6 . . 54.571 -6.069 -29.869 0.99 14.46 ? O HOH A-4 268 1 
HETATM 11511 O O . HOH I-4 6 . . 69.962 13.841 -32.501 0.62 36.45 ? O HOH A-4 269 1 
HETATM 11512 O O . HOH I-4 6 . . 67.029 8.61 -20.87 0.91 15.69 ? O HOH A-4 270 1 
HETATM 11513 O O . HOH I-4 6 . . 46.532 23.348 -23.709 0.97 16.99 ? O HOH A-4 271 1 
HETATM 11514 O O . HOH I-4 6 . . 49.992 -4.854 -22.848 1 20.07 ? O HOH A-4 272 1 
HETATM 11515 O O . HOH I-4 6 . . 65.084 5.935 -33.818 0.76 13 ? O HOH A-4 273 1 
HETATM 11516 O O . HOH I-4 6 . . 33.983 -2.884 -36.144 0.62 12.52 ? O HOH A-4 274 1 
HETATM 11517 O O . HOH I-4 6 . . 33.852 1.96 -23.919 0.75 11.6 ? O HOH A-4 275 1 
HETATM 11518 O O . HOH I-4 6 . . 47.746 26.751 -43.27 0.58 32.94 ? O HOH A-4 276 1 
HETATM 11519 O O . HOH I-4 6 . . 50.403 -5.551 -35.572 0.66 11.23 ? O HOH A-4 277 1 
HETATM 11520 O O . HOH I-4 6 . . 50.063 2.143 -50.998 0.59 11.26 ? O HOH A-4 278 1 
HETATM 11521 O O . HOH I-4 6 . . 65.163 1.752 -43.269 0.63 9.01 ? O HOH A-4 279 1 
HETATM 11522 O O . HOH I-4 6 . . 44.898 -4.166 -39.714 1 17.02 ? O HOH A-4 280 1 
HETATM 11523 O O . HOH I-4 6 . . 36.805 0.284 -39.56 0.96 17.49 ? O HOH A-4 281 1 
HETATM 11524 O O . HOH I-4 6 . . 48.802 2.19 -12.377 0.75 15.61 ? O HOH A-4 282 1 
HETATM 11525 O O . HOH I-4 6 . . 37.806 1.495 -41.888 0.62 16.36 ? O HOH A-4 283 1 
HETATM 11526 O O . HOH I-4 6 . . 46.337 24.794 -48.185 0.76 37.5 ? O HOH A-4 284 1 
HETATM 11527 O O . HOH I-4 6 . . 68.641 14.069 -27.425 0.86 14.26 ? O HOH A-4 285 1 
HETATM 11528 O O . HOH I-4 6 . . 47.743 -5.347 -36.523 0.66 13.82 ? O HOH A-4 286 1 
HETATM 11529 O O . HOH I-4 6 . . 33.354 18.94 -34.576 0.5 11.07 ? O HOH A-4 287 1 
HETATM 11530 O O . HOH I-4 6 . . 49.603 28.616 -37.798 0.24 14.92 ? O HOH A-4 288 1 
HETATM 11531 O O . HOH I-4 6 . . 60.66 9.487 -16.603 0.49 8.05 ? O HOH A-4 289 1 
HETATM 11532 O O . HOH I-4 6 . . 61.98 3.871 -33.533 0.45 10.54 ? O HOH A-4 290 1 
HETATM 11533 O O . HOH I-4 6 . . 38.999 -3.496 -37.741 0.28 9.74 ? O HOH A-4 291 1 
HETATM 11534 O O . HOH I-4 6 . . 63.37 1.555 -33.372 0.77 25.41 ? O HOH A-4 292 1 
HETATM 11535 O O A HOH I-4 6 . . 63.411 0.065 -30.614 0.52 13.99 ? O HOH A-4 293 1 
HETATM 11536 O O B HOH I-4 6 . . 63.845 -0.588 -29.543 0.48 18.4 ? O HOH A-4 293 1 
HETATM 11537 O O . HOH I-4 6 . . 34.263 -3.325 -26.857 0.29 12.37 ? O HOH A-4 294 1 
HETATM 11538 O O . HOH I-4 6 . . 28.593 4.937 -21.898 0.48 19.85 ? O HOH A-4 295 1 
HETATM 11539 O O . HOH I-4 6 . . 50.775 16.917 -14.912 0.53 30.73 ? O HOH A-4 296 1 
HETATM 11540 O O . HOH I-4 6 . . 42.379 -3.033 -40.201 0.59 11.5 ? O HOH A-4 297 1 
HETATM 11541 O O . HOH I-4 6 . . 62.382 8.72 -44.529 1 22.91 ? O HOH A-4 298 1 
HETATM 11542 O O . HOH I-4 6 . . 56.317 -0.18 -46.558 0.86 19.12 ? O HOH A-4 299 1 
HETATM 11543 O O . HOH I-4 6 . . 60.273 -3.813 -24.699 0.8 14.09 ? O HOH A-4 300 1 
HETATM 11544 O O . HOH I-4 6 . . 51.114 14.728 -50.272 0.63 15.6 ? O HOH A-4 302 1 
HETATM 11545 O O . HOH I-4 6 . . 48.669 -0.427 -19.839 0.97 21.47 ? O HOH A-4 303 1 
HETATM 11546 O O . HOH I-4 6 . . 42.569 -3.506 -32.593 1 28.03 ? O HOH A-4 304 1 
HETATM 11547 O O . HOH I-4 6 . . 40.397 4.173 -43.92 0.59 16.61 ? O HOH A-4 311 1 
HETATM 11548 O O . HOH I-4 6 . . 71.827 11.001 -21.763 0.75 20.61 ? O HOH A-4 312 1 
HETATM 11549 O O . HOH I-4 6 . . 39.468 15.169 -38.604 0.49 10.43 ? O HOH A-4 313 1 
HETATM 11550 O O . HOH I-4 6 . . 61.066 17.625 -11.165 0.94 9.31 ? O HOH A-4 314 1 
HETATM 11551 O O . HOH I-4 6 . . 61.768 18.01 -16.153 0.91 18.6 ? O HOH A-4 315 1 
HETATM 11552 O O . HOH I-4 6 . . 52.821 12.727 -51.412 0.69 20.99 ? O HOH A-4 316 1 
HETATM 11553 O O . HOH I-4 6 . . 53.049 9.972 -50.005 0.81 18.01 ? O HOH A-4 317 1 
HETATM 11554 O O . HOH I-4 6 . . 46.089 20.639 -17.423 0.53 15.5 ? O HOH A-4 318 1 
HETATM 11555 O O . HOH I-4 6 . . 47.521 -7.565 -31.577 0.68 23.8 ? O HOH A-4 319 1 
HETATM 11556 O O . HOH I-4 6 . . 49.622 28.651 -23.605 0.18 30.64 ? O HOH A-4 320 1 
HETATM 11557 O O . HOH I-4 6 . . 54.467 24.975 -20.556 0.5 26.92 ? O HOH A-4 321 1 
HETATM 11558 O O . HOH I-4 6 . . 55.392 27.263 -19.726 0.68 36.45 ? O HOH A-4 322 1 
HETATM 11559 O O . HOH I-4 6 . . 53.768 -3.05 -42.144 0.81 21.41 ? O HOH A-4 323 1 
HETATM 11560 O O . HOH I-4 6 . . 64.684 0.749 -41.683 1 23.53 ? O HOH A-4 324 1 
HETATM 11561 O O . HOH I-4 6 . . 54.487 2.121 -52.119 0.48 14.46 ? O HOH A-4 325 1 
HETATM 11562 O O . HOH I-4 6 . . 55.391 8.743 -47.996 0.9 19.98 ? O HOH A-4 326 1 
HETATM 11563 O O . HOH I-4 6 . . 26.269 12.119 -21.286 0.66 20.45 ? O HOH A-4 327 1 
HETATM 11564 O O . HOH I-4 6 . . 35.094 0.649 -21.362 0.58 30.02 ? O HOH A-4 328 1 
HETATM 11565 O O . HOH I-4 6 . . 36.66 -1.053 -21.411 0.37 21.56 ? O HOH A-4 329 1 
HETATM 11566 O O . HOH I-4 6 . . 50.597 1.249 -10.578 0.73 24.4 ? O HOH A-4 330 1 
HETATM 11567 O O . HOH I-4 6 . . 61.41 4.574 -16.853 0.42 10.98 ? O HOH A-4 331 1 
HETATM 11568 O O . HOH I-4 6 . . 67.448 17.226 -19.424 0.98 14.49 ? O HOH A-4 332 1 
HETATM 11569 O O . HOH I-4 6 . . 57.636 4.088 -46.237 0.72 16.84 ? O HOH A-4 333 1 
HETATM 11570 O O . HOH I-4 6 . . 51.178 9.736 -52.134 0.67 19.44 ? O HOH A-4 334 1 
HETATM 11571 O O . HOH I-4 6 . . 57.707 -0.162 -48.108 0.44 25.78 ? O HOH A-4 335 1 
HETATM 11572 O O . HOH I-4 6 . . 48.671 -3.492 -20.615 0.61 21.15 ? O HOH A-4 336 1 
HETATM 11573 O O . HOH I-4 6 . . 56.464 0.649 -49.411 0.4 22.45 ? O HOH A-4 337 1 
HETATM 11574 O O . HOH I-4 6 . . 57.577 -6.307 -49.334 0.68 40.23 ? O HOH A-4 338 1 
HETATM 11575 O O . HOH I-4 6 . . 67.018 15.553 -34.975 0.55 29.45 ? O HOH A-4 339 1 
HETATM 11576 O O . HOH I-4 6 . . 66.642 18.613 -37.45 0.66 32.31 ? O HOH A-4 340 1 
HETATM 11577 O O . HOH I-4 6 . . 66.829 14.508 -39.111 0.8 33.06 ? O HOH A-4 341 1 
HETATM 11578 O O . HOH I-4 6 . . 67.798 12.288 -40.455 0.6 33.38 ? O HOH A-4 342 1 
HETATM 11579 O O . HOH I-4 6 . . 48.458 -0.333 -46.186 0.62 15.05 ? O HOH A-4 343 1 
HETATM 11580 O O . HOH I-4 6 . . 49.538 14.496 -16.237 0.29 12.31 ? O HOH A-4 344 1 
HETATM 11581 O O . HOH I-4 6 . . 45.701 -2.181 -21.66 0.55 28.29 ? O HOH A-4 345 1 
HETATM 11582 O O . HOH I-4 6 . . 64.928 3.569 -32.405 0.44 19.1 ? O HOH A-4 346 1 
HETATM 11583 O O . HOH I-4 6 . . 59.353 23.618 -18.861 0.63 16.82 ? O HOH A-4 347 1 
HETATM 11584 O O . HOH I-4 6 . . 66.751 1.289 -22.63 0.59 17.56 ? O HOH A-4 348 1 
HETATM 11585 O O . HOH I-4 6 . . 35.108 17.591 -36.168 0.82 30.59 ? O HOH A-4 349 1 
HETATM 11586 O O . HOH I-4 6 . . 58.904 18.875 -16.518 0.72 18.66 ? O HOH A-4 350 1 
HETATM 11587 O O . HOH I-4 6 . . 37.691 5.046 -43.339 0.53 18.78 ? O HOH A-4 351 1 
HETATM 11588 O O . HOH I-4 6 . . 67.808 9.949 -34.172 0.77 22.91 ? O HOH A-4 352 1 
HETATM 11589 O O . HOH I-4 6 . . 41.763 4.176 -50.254 0.63 18.62 ? O HOH A-4 353 1 
HETATM 11590 O O . HOH I-4 6 . . 72.257 14.1 -25.753 1 29.22 ? O HOH A-4 354 1 
HETATM 11591 O O . HOH I-4 6 . . 59.616 -3.107 -37.425 0.57 17.96 ? O HOH A-4 355 1 
HETATM 11592 O O . HOH I-4 6 . . 34.995 -1.826 -24.338 0.59 18.27 ? O HOH A-4 356 1 
HETATM 11593 O O . HOH I-4 6 . . 38.304 0.496 -22.547 0.49 22.53 ? O HOH A-4 357 1 
HETATM 11594 O O A HOH I-4 6 . . 30.24 5.672 -32.508 0.47 11.85 ? O HOH A-4 358 1 
HETATM 11595 O O B HOH I-4 6 . . 30.616 6.552 -33.947 0.53 20.93 ? O HOH A-4 358 1 
HETATM 11596 O O . HOH I-4 6 . . 43.894 22.508 -19.728 0.38 15.81 ? O HOH A-4 359 1 
HETATM 11597 O O . HOH I-4 6 . . 64.981 -0.71 -24.585 0.77 15.2 ? O HOH A-4 360 1 
HETATM 11598 O O . HOH I-4 6 . . 45.471 27.137 -33.391 0.6 17.22 ? O HOH A-4 361 1 
HETATM 11599 O O . HOH I-4 6 . . 65.695 2.772 -44.971 0.62 19.8 ? O HOH A-4 362 1 
HETATM 11600 O O . HOH I-4 6 . . 37.893 18.01 -36.535 0.29 10.41 ? O HOH A-4 363 1 
HETATM 11601 O O . HOH I-4 6 . . 64.628 -0.296 -37.244 1 33.42 ? O HOH A-4 364 1 
HETATM 11602 O O . HOH I-4 6 . . 63.892 -3.394 -29.349 1 35.4 ? O HOH A-4 365 1 
HETATM 11603 O O . HOH I-4 6 . . 24.274 6.642 -27.658 1 28.55 ? O HOH A-4 366 1 
HETATM 11604 O O . HOH I-4 6 . . 25.92 5.717 -29.126 1 32.37 ? O HOH A-4 367 1 
HETATM 11605 O O . HOH I-4 6 . . 70.246 3.538 -23.913 1 35.65 ? O HOH A-4 368 1 
HETATM 11606 O O . HOH I-4 6 . . 69.288 11.004 -31.733 1 34.2 ? O HOH A-4 369 1 
HETATM 11607 O O . HOH I-4 6 . . 42.455 -0.102 -45.907 0.63 21.64 ? O HOH A-4 370 1 
HETATM 11608 O O . HOH I-4 6 . . 50.152 20.704 -19.346 0.28 15.67 ? O HOH A-4 371 1 
HETATM 11609 O O . HOH I-4 6 . . 29.35 12.491 -29.303 0.93 31.79 ? O HOH A-4 372 1 
HETATM 11610 O O . HOH I-4 6 . . 32.79 7.792 -32.687 1 37.23 ? O HOH A-4 373 1 
HETATM 11611 O O . HOH I-4 6 . . 57.516 -0.256 -14.956 1 32.39 ? O HOH A-4 374 1 
HETATM 11612 O O . HOH I-4 6 . . 37.6 19.651 -40.133 1 40.07 ? O HOH A-4 375 1 
HETATM 11613 O O . HOH I-4 6 . . 36.271 13.46 -42.1 1 35.87 ? O HOH A-4 376 1 
HETATM 11614 O O . HOH I-4 6 . . 31.157 0.81 -24.216 0.69 18.43 ? O HOH A-4 377 1 
HETATM 11615 O O . HOH I-4 6 . . 37.906 11.962 -45.772 1 37.4 ? O HOH A-4 378 1 
HETATM 11616 O O . HOH I-4 6 . . 48.616 30.545 -32.441 1 26.41 ? O HOH A-4 379 1 
HETATM 11617 O O A HOH I-4 6 . . 49.619 28.649 -30.893 0.31 14.63 ? O HOH A-4 380 1 
HETATM 11618 O O B HOH I-4 6 . . 49.874 27.949 -32.317 0.69 30.71 ? O HOH A-4 380 1 
HETATM 11619 O O . HOH I-4 6 . . 41.269 -3.149 -29.134 1 26.99 ? O HOH A-4 381 1 
HETATM 11620 O O . HOH I-4 6 . . 33.742 11.291 -37.679 1 34.53 ? O HOH A-4 382 1 
HETATM 11621 O O . HOH I-4 6 . . 47.404 -5.046 -40.959 0.44 16.74 ? O HOH A-4 383 1 
HETATM 11622 O O . HOH I-4 6 . . 32.677 11.389 -23.22 0.37 21.51 ? O HOH A-4 384 1 
HETATM 11623 O O . HOH I-4 6 . . 48.38 19.119 -16.238 1 37.07 ? O HOH A-4 385 1 
HETATM 11624 O O A HOH I-4 6 . . 37.192 12.061 -30.748 0.27 12.36 ? O HOH A-4 386 1 
HETATM 11625 O O B HOH I-4 6 . . 38.653 11.283 -29.635 0.73 9.75 ? O HOH A-4 386 1 
HETATM 11626 O O . HOH I-4 6 . . 49.33 -4.188 -39.366 0.74 22.04 ? O HOH A-4 387 1 
HETATM 11627 O O . HOH I-4 6 . . 26.1 11.948 -24.747 0.25 15.96 ? O HOH A-4 388 1 
HETATM 11628 O O . HOH I-4 6 . . 59.026 -8.232 -34.156 1 36.56 ? O HOH A-4 389 1 
HETATM 11629 O O . HOH I-4 6 . . 41.19 -3.28 -21.437 1 39.59 ? O HOH A-4 390 1 
HETATM 11630 O O . HOH I-4 6 . . 52.929 27.445 -35.01 1 31.43 ? O HOH A-4 391 1 
HETATM 11631 O O A HOH I-4 6 . . 47.551 25.685 -40.612 0.71 18.36 ? O HOH A-4 392 1 
HETATM 11632 O O B HOH I-4 6 . . 48.819 26.727 -39.549 0.29 19.15 ? O HOH A-4 392 1 
HETATM 11633 O O . HOH I-4 6 . . 60.982 0.5 -44.391 0.4 17.81 ? O HOH A-4 393 1 
HETATM 11634 O O . HOH I-4 6 . . 61.543 -6.291 -30.888 0.72 21.31 ? O HOH A-4 394 1 
HETATM 11635 O O . HOH I-4 6 . . 26.386 8.09 -28.628 1 37.27 ? O HOH A-4 395 1 
HETATM 11636 O O . HOH I-4 6 . . 63.844 4.027 -16.426 0.5 14.5 ? O HOH A-4 396 1 
HETATM 11637 O O . HOH I-4 6 . . 63.382 -3.865 -27.443 0.61 16.32 ? O HOH A-4 397 1 
HETATM 11638 O O . HOH I-4 6 . . 44.043 26.596 -23.338 1 23.09 ? O HOH A-4 398 1 
HETATM 11639 O O . HOH I-4 6 . . 45.028 0.92 -17.866 1 19.26 ? O HOH A-4 399 1 
HETATM 11640 O O . HOH I-4 6 . . 42.801 0.58 -19.508 1 30.23 ? O HOH A-4 400 1 
HETATM 11641 O O . HOH I-4 6 . . 45.042 -1.255 -19.516 1 38.51 ? O HOH A-4 401 1 
HETATM 11642 O O . HOH I-4 6 . . 45.343 28.945 -25.19 1 25.38 ? O HOH A-4 402 1 
HETATM 11643 O O . HOH I-4 6 . . 46.295 27.644 -23.357 1 29.5 ? O HOH A-4 403 1 
HETATM 11644 O O . HOH I-4 6 . . 54.293 11.729 -50.399 1 17.72 ? O HOH A-4 404 1 
HETATM 11645 O O . HOH I-4 6 . . 65.848 3.675 -19.927 1 35.03 ? O HOH A-4 405 1 
HETATM 11646 O O . HOH I-4 6 . . 50.569 28.456 -35.098 0.64 26.87 ? O HOH A-4 406 1 
HETATM 11647 O O . HOH I-4 6 . . 50.987 25.686 -43.056 1 37.16 ? O HOH A-4 407 1 
HETATM 11648 O O A HOH I-4 6 . . 34.198 11.261 -30.84 0.71 11.14 ? O HOH A-4 408 1 
HETATM 11649 O O B HOH I-4 6 . . 33.255 12.419 -30.836 0.29 12.66 ? O HOH A-4 408 1 
HETATM 11650 O O . HOH I-4 6 . . 32.398 17.253 -27.817 1 35.51 ? O HOH A-4 409 1 
HETATM 11651 O O . HOH I-4 6 . . 33.43 15.041 -26.807 1 33.82 ? O HOH A-4 410 1 
HETATM 11652 O O . HOH I-4 6 . . 32.335 18.91 -22.027 1 35.54 ? O HOH A-4 411 1 
HETATM 11653 O O . HOH I-4 6 . . 66.331 8.317 -32.621 0.94 14.43 ? O HOH A-4 412 1 
HETATM 11654 O O . HOH I-4 6 . . 58.874 12.767 -14.488 0.59 26.93 ? O HOH A-4 413 1 
HETATM 11655 O O A HOH I-4 6 . . 57.216 14.546 -15.569 0.58 19.84 ? O HOH A-4 414 1 
HETATM 11656 O O B HOH I-4 6 . . 58.261 13.718 -16.431 0.42 28.06 ? O HOH A-4 414 1 
HETATM 11657 O O . HOH I-4 6 . . 56.278 10.207 -18.99 0.54 11.82 ? O HOH A-4 415 1 
HETATM 11658 O O . HOH I-4 6 . . 54.872 12.557 -19.223 0.63 17.78 ? O HOH A-4 416 1 
HETATM 11659 O O . HOH I-4 6 . . 59.849 14.317 -15.17 0.59 29.2 ? O HOH A-4 417 1 
HETATM 11660 O O . HOH I-4 6 . . 31.176 3.957 -35.371 1 17.88 ? O HOH A-4 418 1 
HETATM 11661 O O . HOH I-4 6 . . 29.979 3.107 -29.647 1 26.43 ? O HOH A-4 419 1 
HETATM 11662 O O . HOH I-4 6 . . 50.537 12.496 -53.699 1 34.76 ? O HOH A-4 420 1 
HETATM 11663 O O . HOH I-4 6 . . 35.35 13.324 -26.563 0.43 28.42 ? O HOH A-4 421 1 
HETATM 11664 O O . HOH I-4 6 . . 38.365 13.314 -28.186 0.48 28.07 ? O HOH A-4 422 1 
HETATM 11665 O O . HOH I-4 6 . . 63.183 2.237 -43.647 0.38 12.14 ? O HOH A-4 423 1 
HETATM 11666 O O . HOH I-4 6 . . 52.646 -5.737 -38.118 0.7 26.46 ? O HOH A-4 424 1 
HETATM 11667 O O . HOH I-4 6 . . 64.69 -2.004 -26.937 0.57 22.9 ? O HOH A-4 425 1 
HETATM 11668 O O . HOH I-4 6 . . 41.126 4.255 -46.619 0.58 23.64 ? O HOH A-4 426 1 
HETATM 11669 O O . HOH I-4 6 . . 55.833 10.998 -49.283 0.65 24.06 ? O HOH A-4 427 1 
HETATM 11670 O O . HOH I-4 6 . . 68.8 8.198 -28.056 0.56 20.99 ? O HOH A-4 428 1 
HETATM 11671 O O . HOH I-4 6 . . 50.084 25.572 -40.788 0.76 28.29 ? O HOH A-4 429 1 
HETATM 11672 O O . HOH I-4 6 . . 67.6 10.746 -29.051 0.91 17.1 ? O HOH A-4 430 1 
HETATM 11673 O O . HOH I-4 6 . . 44.21 1.155 -47.94 0.91 19.1 ? O HOH A-4 431 1 
HETATM 11674 O O . HOH I-4 6 . . 31.707 1.893 -20.711 0.37 25.02 ? O HOH A-4 432 1 
HETATM 11675 O O . HOH I-4 6 . . 51.849 -3.418 -36.619 0.72 10.88 ? O HOH A-4 433 1 
HETATM 11676 O O . HOH I-4 6 . . 69.184 18.001 -28.84 0.46 18.11 ? O HOH A-4 434 1 
HETATM 11677 O O . HOH I-4 6 . . 61.606 6.802 -15.953 0.64 14.39 ? O HOH A-4 435 1 
HETATM 11678 O O . HOH I-4 6 . . 65.169 3.373 -42.134 0.67 21.5 ? O HOH A-4 436 1 
HETATM 11679 O O . HOH I-4 6 . . 62.349 -5.627 -27.996 0.23 15.71 ? O HOH A-4 437 1 
HETATM 11680 O O . HOH I-4 6 . . 32.782 -1.57 -24.039 0.3 18.57 ? O HOH A-4 438 1 
HETATM 11681 O O . HOH I-4 6 . . 55.365 13.412 -50.705 0.6 21.01 ? O HOH A-4 439 1 
HETATM 11682 O O . HOH I-4 6 . . 71.819 7.362 -24.545 0.43 25 ? O HOH A-4 440 1 
HETATM 11683 O O . HOH I-4 6 . . 33.74 3.392 -20.963 0.67 16 ? O HOH A-4 441 1 
HETATM 11684 O O . HOH I-4 6 . . 64.808 1.567 -19.052 0.55 25.76 ? O HOH A-4 442 1 
HETATM 11685 O O . HOH I-4 6 . . 58.457 -2.405 -17.966 0.43 22.62 ? O HOH A-4 443 1 
HETATM 11686 O O . HOH I-4 6 . . 33.344 4.646 -23.877 0.68 17.69 ? O HOH A-4 444 1 
HETATM 11687 O O . HOH I-4 6 . . 36.78 23.519 -42.961 0.52 20.06 ? O HOH A-4 445 1 
HETATM 11688 O O . HOH I-4 6 . . 66.211 0.148 -35.318 0.77 21.15 ? O HOH A-4 446 1 
HETATM 11689 O O . HOH I-4 6 . . 39.243 18.936 -38.408 0.43 19.16 ? O HOH A-4 447 1 
HETATM 11690 O O . HOH I-4 6 . . 45.137 24.699 -21.734 0.53 23.29 ? O HOH A-4 448 1 
HETATM 11691 O O . HOH I-4 6 . . 40.6 -0.362 -16.315 0.53 22.06 ? O HOH A-4 449 1 
HETATM 11692 O O . HOH I-4 6 . . 51.174 -4.408 -41.381 0.67 27.89 ? O HOH A-4 450 1 
HETATM 11693 O O . HOH I-4 6 . . 43.166 -5.268 -35.215 0.75 32.43 ? O HOH A-4 451 1 
HETATM 11694 O O . HOH I-4 6 . . 59.565 -1.725 -39.645 0.62 27.49 ? O HOH A-4 452 1 
HETATM 11695 O O . HOH I-4 6 . . 64.218 16.811 -39.851 0.63 27.74 ? O HOH A-4 453 1 
HETATM 11696 O O . HOH I-4 6 . . 43.542 7.943 -36.595 1 5.62 ? O HOH A-4 454 1 
HETATM 11697 O O . HOH I-4 6 . . 37.688 12.687 -33.116 0.98 10.32 ? O HOH A-4 455 1 
HETATM 11698 O O . HOH I-4 6 . . 65.659 11.39 -26.868 0.9 8.62 ? O HOH A-4 456 1 
HETATM 11699 O O . HOH I-4 6 . . 37.841 10.464 -35.071 1 10.54 ? O HOH A-4 457 1 
HETATM 11700 O O . HOH I-4 6 . . 40.124 11.79 -36.291 1 12.65 ? O HOH A-4 458 1 
HETATM 11701 O O . HOH I-4 6 . . 69.342 10.893 -20.302 0.86 9.36 ? O HOH A-4 459 1 
HETATM 11702 O O . HOH I-4 6 . . 43.72 24.158 -24.903 1 12.94 ? O HOH A-4 460 1 
HETATM 11703 O O . HOH I-4 6 . . 59.352 -7.997 -31.862 0.84 31.79 ? O HOH A-4 461 1 
HETATM 11704 O O . HOH I-4 6 . . 61.79 -0.655 -42.158 0.96 29.02 ? O HOH A-4 462 1 
HETATM 11705 O O . HOH I-4 6 . . 65.089 -5.102 -27.105 0.4 21.77 ? O HOH A-4 463 1 
HETATM 11706 O O . HOH I-4 6 . . 55.403 23.361 -18.987 0.64 23.88 ? O HOH A-4 464 1 
HETATM 11707 O O . HOH I-4 6 . . 45.237 12.81 -34.24 1 5.52 ? O HOH A-4 465 1 
HETATM 11708 O O . HOH I-4 6 . . 29.411 17.76 -27.936 0.35 13.23 ? O HOH A-4 466 1 
HETATM 11709 O O . HOH I-4 6 . . 67.546 11.624 -35.894 0.89 26.22 ? O HOH A-4 467 1 
HETATM 11710 O O . HOH I-4 6 . . 59.333 0.21 -16.9 0.44 18.68 ? O HOH A-4 468 1 
HETATM 11711 O O . HOH I-4 6 . . 55.865 4.682 -52.989 0.7 33.22 ? O HOH A-4 469 1 
HETATM 11712 O O . HOH I-4 6 . . 37.157 12.441 -38.625 0.4 21.51 ? O HOH A-4 470 1 
HETATM 11713 O O . HOH I-4 6 . . 40.531 1.313 -44.238 0.44 20.98 ? O HOH A-4 471 1 
HETATM 11714 O O . HOH I-4 6 . . 37.782 -2.638 -36.199 0.43 14.8 ? O HOH A-4 472 1 
HETATM 11715 O O . HOH I-4 6 . . 52.488 2.416 -54.131 0.43 18.87 ? O HOH A-4 473 1 
HETATM 11716 O O . HOH I-4 6 . . 60.258 -5.748 -27.129 0.36 18.61 ? O HOH A-4 474 1 
HETATM 11717 O O . HOH I-4 6 . . 63.865 -1.788 -21.181 0.54 23.92 ? O HOH A-4 475 1 
HETATM 11718 O O . HOH I-4 6 . . 58.612 -6.586 -26.453 0.55 30.96 ? O HOH A-4 476 1 
HETATM 11719 O O . HOH I-4 6 . . 39.346 -4.965 -29.411 0.39 26.87 ? O HOH A-4 477 1 
HETATM 11720 O O . HOH I-4 6 . . 46.885 0.735 -48.132 0.54 17.49 ? O HOH A-4 478 1 
HETATM 11721 O O . HOH I-4 6 . . 37.301 10.819 -43.179 0.53 26.31 ? O HOH A-4 479 1 
HETATM 11722 O O . HOH I-4 6 . . 35.414 11.031 -38.913 0.67 30.22 ? O HOH A-4 480 1 
HETATM 11723 O O . HOH I-5 6 . . 32.248 54.416 -41.875 0.25 13.9 ? O HOH A-5 179 1 
HETATM 11724 O O . HOH I-5 6 . . 31.668 32.877 -52.145 0.62 26.57 ? O HOH A-5 180 1 
HETATM 11725 O O . HOH I-5 6 . . 27.458 41.619 -53.591 0.6 26.35 ? O HOH A-5 181 1 
HETATM 11726 O O . HOH I-5 6 . . 26.669 22.387 -38.463 0.48 23.99 ? O HOH A-5 182 1 
HETATM 11727 O O . HOH I-5 6 . . 29.519 41.6 -54.942 0.75 33.89 ? O HOH A-5 183 1 
HETATM 11728 O O . HOH I-5 6 . . 37.756 41.96 -36.883 1 5.77 ? O HOH A-5 184 1 
HETATM 11729 O O . HOH I-5 6 . . 39.881 42.379 -35.072 1 5.76 ? O HOH A-5 185 1 
HETATM 11730 O O . HOH I-5 6 . . 20.707 36.993 -19.526 0.71 13.09 ? O HOH A-5 186 1 
HETATM 11731 O O . HOH I-5 6 . . 22.847 28.145 -44.561 0.5 24.79 ? O HOH A-5 187 1 
HETATM 11732 O O . HOH I-5 6 . . 39.901 25.704 -18.236 0.59 31.06 ? O HOH A-5 188 1 
HETATM 11733 O O . HOH I-5 6 . . 36.472 49.069 -45.606 1 20.27 ? O HOH A-5 189 1 
HETATM 11734 O O . HOH I-5 6 . . 15.209 40.412 -32.401 0.49 21.06 ? O HOH A-5 190 1 
HETATM 11735 O O . HOH I-5 6 . . 32.098 43.409 -35.613 1 5.98 ? O HOH A-5 191 1 
HETATM 11736 O O . HOH I-5 6 . . 38.806 49.888 -44.654 0.44 25.29 ? O HOH A-5 192 1 
HETATM 11737 O O . HOH I-5 6 . . 40.976 40.424 -32.198 0.88 6.01 ? O HOH A-5 193 1 
HETATM 11738 O O . HOH I-5 6 . . 17.773 25.479 -35.019 0.26 16.69 ? O HOH A-5 194 1 
HETATM 11739 O O . HOH I-5 6 . . 20.335 49.345 -34.724 1 41.67 ? O HOH A-5 195 1 
HETATM 11740 O O . HOH I-5 6 . . 52.047 42.728 -40.877 0.68 33.26 ? O HOH A-5 196 1 
HETATM 11741 O O . HOH I-5 6 . . 50.175 31.197 -38.829 0.67 12.25 ? O HOH A-5 197 1 
HETATM 11742 O O . HOH I-5 6 . . 34.227 25.173 -23.741 1 6.89 ? O HOH A-5 198 1 
HETATM 11743 O O . HOH I-5 6 . . 14.476 31.43 -23.757 0.72 42.23 ? O HOH A-5 199 1 
HETATM 11744 O O . HOH I-5 6 . . 35.333 25.968 -44.924 1 28.75 ? O HOH A-5 200 1 
HETATM 11745 O O . HOH I-5 6 . . 31.174 46.194 -47.954 0.9 19.82 ? O HOH A-5 201 1 
HETATM 11746 O O . HOH I-5 6 . . 44.754 32.877 -21.752 0.42 20.13 ? O HOH A-5 202 1 
HETATM 11747 O O . HOH I-5 6 . . 37.716 57.712 -23.227 0.94 31.19 ? O HOH A-5 203 1 
HETATM 11748 O O . HOH I-5 6 . . 17.3 29.911 -44.503 0.18 10.24 ? O HOH A-5 204 1 
HETATM 11749 O O . HOH I-5 6 . . 35.942 28.04 -17.199 0.66 31.37 ? O HOH A-5 205 1 
HETATM 11750 O O . HOH I-5 6 . . 44.939 46.288 -39.249 0.53 28.14 ? O HOH A-5 206 1 
HETATM 11751 O O . HOH I-5 6 . . 30.445 37.458 -54.243 0.71 30.43 ? O HOH A-5 207 1 
HETATM 11752 O O . HOH I-5 6 . . 40.22 49.297 -41.087 0.67 32.61 ? O HOH A-5 208 1 
HETATM 11753 O O . HOH I-5 6 . . 52.031 42.277 -23.068 0.9 6.78 ? O HOH A-5 209 1 
HETATM 11754 O O . HOH I-5 6 . . 42.642 40.984 -47.501 1 32.24 ? O HOH A-5 210 1 
HETATM 11755 O O . HOH I-5 6 . . 36.182 46.486 -30.499 1 7.1 ? O HOH A-5 211 1 
HETATM 11756 O O . HOH I-5 6 . . 41.807 43.661 -47.011 0.71 27.9 ? O HOH A-5 212 1 
HETATM 11757 O O . HOH I-5 6 . . 37.033 48.399 -34.162 1 6.84 ? O HOH A-5 213 1 
HETATM 11758 O O . HOH I-5 6 . . 19.563 26.998 -16.173 0.73 29.41 ? O HOH A-5 214 1 
HETATM 11759 O O . HOH I-5 6 . . 31.342 24.091 -43.788 0.69 35.79 ? O HOH A-5 215 1 
HETATM 11760 O O . HOH I-5 6 . . 40.24 40.811 -37.231 0.91 6.19 ? O HOH A-5 216 1 
HETATM 11761 O O . HOH I-5 6 . . 22.922 48.842 -42.629 0.72 33.33 ? O HOH A-5 217 1 
HETATM 11762 O O . HOH I-5 6 . . 38.635 47.477 -31.918 0.96 7.56 ? O HOH A-5 218 1 
HETATM 11763 O O . HOH I-5 6 . . 32.155 55.15 -30.484 1 8.78 ? O HOH A-5 219 1 
HETATM 11764 O O . HOH I-5 6 . . 27.11 32.187 -46.329 0.92 14.41 ? O HOH A-5 220 1 
HETATM 11765 O O . HOH I-5 6 . . 35.39 35.885 -18.235 1 8.09 ? O HOH A-5 221 1 
HETATM 11766 O O . HOH I-5 6 . . 21.71 21.813 -19.257 0.82 21 ? O HOH A-5 222 1 
HETATM 11767 O O . HOH I-5 6 . . 16.048 32.763 -31.399 0.77 22.15 ? O HOH A-5 223 1 
HETATM 11768 O O . HOH I-5 6 . . 14.646 32.028 -32.829 0.13 8.18 ? O HOH A-5 224 1 
HETATM 11769 O O . HOH I-5 6 . . 19.493 47.679 -26.18 0.87 30.47 ? O HOH A-5 225 1 
HETATM 11770 O O . HOH I-5 6 . . 22.828 25.785 -44.487 0.59 24.12 ? O HOH A-5 226 1 
HETATM 11771 O O . HOH I-5 6 . . 32.187 23.595 -31.07 0.91 6.92 ? O HOH A-5 227 1 
HETATM 11772 O O . HOH I-5 6 . . 18.808 45.732 -27.272 0.51 20.67 ? O HOH A-5 228 1 
HETATM 11773 O O . HOH I-5 6 . . 43.655 49.568 -24.202 1 8.93 ? O HOH A-5 229 1 
HETATM 11774 O O . HOH I-5 6 . . 52.591 45.136 -33.244 1 7.53 ? O HOH A-5 230 1 
HETATM 11775 O O . HOH I-5 6 . . 22.33 25.272 -18.68 1 9.3 ? O HOH A-5 231 1 
HETATM 11776 O O . HOH I-5 6 . . 42.235 46.761 -35.986 1 9.26 ? O HOH A-5 232 1 
HETATM 11777 O O . HOH I-5 6 . . 32.864 53.779 -23.049 1 12.66 ? O HOH A-5 233 1 
HETATM 11778 O O . HOH I-5 6 . . 42.529 51.703 -21.172 0.9 6.97 ? O HOH A-5 234 1 
HETATM 11779 O O . HOH I-5 6 . . 21.453 28.532 -18.816 0.7 16.56 ? O HOH A-5 235 1 
HETATM 11780 O O . HOH I-5 6 . . 43.968 48.802 -34.822 0.42 14.12 ? O HOH A-5 236 1 
HETATM 11781 O O . HOH I-5 6 . . 45.105 42.995 -41.279 1 30.87 ? O HOH A-5 237 1 
HETATM 11782 O O . HOH I-5 6 . . 15.806 29.936 -32.884 0.24 15.64 ? O HOH A-5 238 1 
HETATM 11783 O O . HOH I-5 6 . . 16.113 35.173 -30.437 0.8 11.06 ? O HOH A-5 239 1 
HETATM 11784 O O . HOH I-5 6 . . 20.666 25.014 -35.553 0.59 24.24 ? O HOH A-5 240 1 
HETATM 11785 O O . HOH I-5 6 . . 29.147 51.731 -42.438 0.7 27.71 ? O HOH A-5 241 1 
HETATM 11786 O O . HOH I-5 6 . . 36.345 31.716 -23.298 0.7 5.9 ? O HOH A-5 242 1 
HETATM 11787 O O A HOH I-5 6 . . 49.604 28.645 -44.057 0.49 37.53 ? O HOH A-5 243 1 
HETATM 11788 O O B HOH I-5 6 . . 49.667 28.681 -41.915 0.51 34.9 ? O HOH A-5 243 1 
HETATM 11789 O O . HOH I-5 6 . . 25.479 29.525 -46.245 0.58 23.66 ? O HOH A-5 244 1 
HETATM 11790 O O . HOH I-5 6 . . 46.647 38.74 -18.638 0.47 21.6 ? O HOH A-5 245 1 
HETATM 11791 O O . HOH I-5 6 . . 46.861 43.282 -43.757 0.84 38.73 ? O HOH A-5 246 1 
HETATM 11792 O O . HOH I-5 6 . . 48.854 52.291 -19.691 0.99 10.7 ? O HOH A-5 247 1 
HETATM 11793 O O . HOH I-5 6 . . 28.508 53.049 -22.761 1 12.25 ? O HOH A-5 248 1 
HETATM 11794 O O . HOH I-5 6 . . 45.308 27.078 -36.861 1 13.93 ? O HOH A-5 249 1 
HETATM 11795 O O . HOH I-5 6 . . 16.858 36.758 -41.683 0.76 36.54 ? O HOH A-5 250 1 
HETATM 11796 O O . HOH I-5 6 . . 21.686 20.129 -28.498 0.31 15.48 ? O HOH A-5 251 1 
HETATM 11797 O O . HOH I-5 6 . . 29.191 52.771 -38.604 1 11.93 ? O HOH A-5 252 1 
HETATM 11798 O O . HOH I-5 6 . . 30.651 36.285 -47.516 0.96 11.22 ? O HOH A-5 253 1 
HETATM 11799 O O . HOH I-5 6 . . 36.267 51.009 -34.691 0.82 9.04 ? O HOH A-5 254 1 
HETATM 11800 O O . HOH I-5 6 . . 36.783 51.989 -23.598 1 15.95 ? O HOH A-5 255 1 
HETATM 11801 O O . HOH I-5 6 . . 50.848 43.45 -20.806 0.72 10.83 ? O HOH A-5 256 1 
HETATM 11802 O O . HOH I-5 6 . . 20.858 29.959 -30.578 0.8 12.12 ? O HOH A-5 257 1 
HETATM 11803 O O A HOH I-5 6 . . 34.524 31.085 -19.911 0.46 14.98 ? O HOH A-5 258 1 
HETATM 11804 O O B HOH I-5 6 . . 34.7 29.955 -19.145 0.54 19.35 ? O HOH A-5 258 1 
HETATM 11805 O O . HOH I-5 6 . . 32.271 57.891 -15.136 0.53 29.4 ? O HOH A-5 259 1 
HETATM 11806 O O . HOH I-5 6 . . 21.461 23.049 -31.084 1 37.68 ? O HOH A-5 260 1 
HETATM 11807 O O . HOH I-5 6 . . 17.815 39.736 -42.543 0.61 30.47 ? O HOH A-5 261 1 
HETATM 11808 O O . HOH I-5 6 . . 47.203 36.688 -47.22 1 37.59 ? O HOH A-5 262 1 
HETATM 11809 O O . HOH I-5 6 . . 50.281 42.398 -18.226 0.8 11.84 ? O HOH A-5 263 1 
HETATM 11810 O O . HOH I-5 6 . . 19.926 48.124 -38.909 0.87 41.43 ? O HOH A-5 264 1 
HETATM 11811 O O . HOH I-5 6 . . 23.98 36.783 -46.08 0.79 10.83 ? O HOH A-5 265 1 
HETATM 11812 O O . HOH I-5 6 . . 39.572 48.053 -37.947 0.6 9.42 ? O HOH A-5 266 1 
HETATM 11813 O O . HOH I-5 6 . . 41.946 41.464 -39.25 0.92 14.64 ? O HOH A-5 267 1 
HETATM 11814 O O . HOH I-5 6 . . 17.085 41.73 -29.869 0.99 14.46 ? O HOH A-5 268 1 
HETATM 11815 O O . HOH I-5 6 . . 26.632 18.447 -32.501 0.62 36.45 ? O HOH A-5 269 1 
HETATM 11816 O O . HOH I-5 6 . . 23.569 23.602 -20.87 0.91 15.69 ? O HOH A-5 270 1 
HETATM 11817 O O . HOH I-5 6 . . 46.58 33.984 -23.709 0.97 16.99 ? O HOH A-5 271 1 
HETATM 11818 O O . HOH I-5 6 . . 20.427 45.088 -22.848 1 20.07 ? O HOH A-5 272 1 
HETATM 11819 O O . HOH I-5 6 . . 22.224 26.624 -33.818 0.76 13 ? O HOH A-5 273 1 
HETATM 11820 O O . HOH I-5 6 . . 30.137 57.968 -36.144 0.62 12.52 ? O HOH A-5 274 1 
HETATM 11821 O O . HOH I-5 6 . . 34.398 55.659 -23.919 0.75 11.6 ? O HOH A-5 275 1 
HETATM 11822 O O . HOH I-5 6 . . 48.92 31.231 -43.27 0.58 32.94 ? O HOH A-5 276 1 
HETATM 11823 O O . HOH I-5 6 . . 19.618 45.081 -35.572 0.66 11.23 ? O HOH A-5 277 1 
HETATM 11824 O O . HOH I-5 6 . . 26.451 41.529 -50.998 0.59 11.26 ? O HOH A-5 278 1 
HETATM 11825 O O . HOH I-5 6 . . 18.562 28.647 -43.269 0.63 9.01 ? O HOH A-5 279 1 
HETATM 11826 O O . HOH I-5 6 . . 23.57 49.156 -39.714 1 17.02 ? O HOH A-5 280 1 
HETATM 11827 O O . HOH I-5 6 . . 31.47 53.94 -39.56 0.96 17.49 ? O HOH A-5 281 1 
HETATM 11828 O O . HOH I-5 6 . . 27.122 42.597 -12.377 0.75 15.61 ? O HOH A-5 282 1 
HETATM 11829 O O . HOH I-5 6 . . 32.018 52.467 -41.888 0.62 16.36 ? O HOH A-5 283 1 
HETATM 11830 O O . HOH I-5 6 . . 47.93 33.43 -48.185 0.76 37.5 ? O HOH A-5 284 1 
HETATM 11831 O O . HOH I-5 6 . . 27.49 19.477 -27.425 0.86 14.26 ? O HOH A-5 285 1 
HETATM 11832 O O . HOH I-5 6 . . 21.124 47.283 -36.523 0.66 13.82 ? O HOH A-5 286 1 
HETATM 11833 O O . HOH I-5 6 . . 49.352 47.601 -34.576 0.5 11.07 ? O HOH A-5 287 1 
HETATM 11834 O O . HOH I-5 6 . . 49.607 28.69 -37.798 0.24 14.92 ? O HOH A-5 288 1 
HETATM 11835 O O . HOH I-5 6 . . 27.512 28.679 -16.603 0.49 8.05 ? O HOH A-5 289 1 
HETATM 11836 O O . HOH I-5 6 . . 21.989 30.344 -33.533 0.45 10.54 ? O HOH A-5 290 1 
HETATM 11837 O O . HOH I-5 6 . . 27.099 53.93 -37.741 0.28 9.74 ? O HOH A-5 291 1 
HETATM 11838 O O . HOH I-5 6 . . 19.288 30.299 -33.372 0.77 25.41 ? O HOH A-5 292 1 
HETATM 11839 O O A HOH I-5 6 . . 17.977 31.008 -30.614 0.52 13.99 ? O HOH A-5 293 1 
HETATM 11840 O O B HOH I-5 6 . . 17.195 30.958 -29.543 0.48 18.4 ? O HOH A-5 293 1 
HETATM 11841 O O . HOH I-5 6 . . 29.616 57.946 -26.857 0.29 12.37 ? O HOH A-5 294 1 
HETATM 11842 O O . HOH I-5 6 . . 39.605 58.725 -21.898 0.48 19.85 ? O HOH A-5 295 1 
HETATM 11843 O O . HOH I-5 6 . . 38.89 33.525 -14.912 0.53 30.73 ? O HOH A-5 296 1 
HETATM 11844 O O . HOH I-5 6 . . 25.81 50.771 -40.201 0.59 11.5 ? O HOH A-5 297 1 
HETATM 11845 O O . HOH I-5 6 . . 25.987 27.572 -44.529 1 22.91 ? O HOH A-5 298 1 
HETATM 11846 O O . HOH I-5 6 . . 21.312 37.274 -46.558 0.86 19.12 ? O HOH A-5 299 1 
HETATM 11847 O O . HOH I-5 6 . . 16.188 35.664 -24.699 0.8 14.09 ? O HOH A-5 300 1 
HETATM 11848 O O . HOH I-5 6 . . 36.824 34.326 -50.272 0.63 15.6 ? O HOH A-5 302 1 
HETATM 11849 O O . HOH I-5 6 . . 24.922 44.021 -19.839 0.97 21.47 ? O HOH A-5 303 1 
HETATM 11850 O O . HOH I-5 6 . . 25.306 50.843 -32.593 1 28.03 ? O HOH A-5 304 1 
HETATM 11851 O O . HOH I-5 6 . . 33.042 48.885 -43.92 0.59 16.61 ? O HOH A-5 311 1 
HETATM 11852 O O . HOH I-5 6 . . 23.24 18.252 -21.763 0.75 20.61 ? O HOH A-5 312 1 
HETATM 11853 O O . HOH I-5 6 . . 43.029 44.191 -38.604 0.49 10.43 ? O HOH A-5 313 1 
HETATM 11854 O O . HOH I-5 6 . . 34.357 24.259 -11.165 0.94 9.31 ? O HOH A-5 314 1 
HETATM 11855 O O . HOH I-5 6 . . 34.339 23.458 -16.153 0.91 18.6 ? O HOH A-5 315 1 
HETATM 11856 O O . HOH I-5 6 . . 34.238 33.848 -51.412 0.69 20.99 ? O HOH A-5 316 1 
HETATM 11857 O O . HOH I-5 6 . . 31.738 35.028 -50.005 0.81 18.01 ? O HOH A-5 317 1 
HETATM 11858 O O . HOH I-5 6 . . 44.456 35.722 -17.423 0.53 15.5 ? O HOH A-5 318 1 
HETATM 11859 O O . HOH I-5 6 . . 19.314 48.584 -31.577 0.68 23.8 ? O HOH A-5 319 1 
HETATM 11860 O O . HOH I-5 6 . . 49.628 28.656 -23.605 0.18 30.64 ? O HOH A-5 320 1 
HETATM 11861 O O . HOH I-5 6 . . 44.022 26.299 -20.556 0.5 26.92 ? O HOH A-5 321 1 
HETATM 11862 O O . HOH I-5 6 . . 45.541 24.353 -19.726 0.68 36.45 ? O HOH A-5 322 1 
HETATM 11863 O O . HOH I-5 6 . . 20.101 40.916 -42.144 0.81 21.41 ? O HOH A-5 323 1 
HETATM 11864 O O . HOH I-5 6 . . 17.933 29.564 -41.683 1 23.53 ? O HOH A-5 324 1 
HETATM 11865 O O . HOH I-5 6 . . 24.22 37.708 -52.119 0.48 14.46 ? O HOH A-5 325 1 
HETATM 11866 O O . HOH I-5 6 . . 29.503 33.614 -47.996 0.9 19.98 ? O HOH A-5 326 1 
HETATM 11867 O O . HOH I-5 6 . . 46.987 57.147 -21.286 0.66 20.45 ? O HOH A-5 327 1 
HETATM 11868 O O . HOH I-5 6 . . 32.641 55.239 -21.362 0.58 30.02 ? O HOH A-5 328 1 
HETATM 11869 O O . HOH I-5 6 . . 30.385 54.734 -21.411 0.37 21.56 ? O HOH A-5 329 1 
HETATM 11870 O O . HOH I-5 6 . . 25.41 41.513 -10.578 0.73 24.4 ? O HOH A-5 330 1 
HETATM 11871 O O . HOH I-5 6 . . 22.883 30.486 -16.853 0.42 10.98 ? O HOH A-5 331 1 
HETATM 11872 O O . HOH I-5 6 . . 30.82 18.931 -19.424 0.98 14.49 ? O HOH A-5 332 1 
HETATM 11873 O O . HOH I-5 6 . . 24.349 33.998 -46.237 0.72 16.84 ? O HOH A-5 333 1 
HETATM 11874 O O . HOH I-5 6 . . 32.469 36.767 -52.134 0.67 19.44 ? O HOH A-5 334 1 
HETATM 11875 O O . HOH I-5 6 . . 20.633 36.061 -48.108 0.44 25.78 ? O HOH A-5 335 1 
HETATM 11876 O O . HOH I-5 6 . . 22.267 45.552 -20.615 0.61 21.15 ? O HOH A-5 336 1 
HETATM 11877 O O . HOH I-5 6 . . 21.957 36.732 -49.411 0.4 22.45 ? O HOH A-5 337 1 
HETATM 11878 O O . HOH I-5 6 . . 15.376 39.246 -49.334 0.68 40.23 ? O HOH A-5 338 1 
HETATM 11879 O O . HOH I-5 6 . . 29.587 20.14 -34.975 0.55 29.45 ? O HOH A-5 339 1 
HETATM 11880 O O . HOH I-5 6 . . 32.425 18.936 -37.45 0.66 32.31 ? O HOH A-5 340 1 
HETATM 11881 O O . HOH I-5 6 . . 28.776 20.826 -39.111 0.8 33.06 ? O HOH A-5 341 1 
HETATM 11882 O O . HOH I-5 6 . . 26.369 21.097 -40.455 0.6 33.38 ? O HOH A-5 342 1 
HETATM 11883 O O . HOH I-5 6 . . 25.109 44.157 -46.186 0.62 15.05 ? O HOH A-5 343 1 
HETATM 11884 O O . HOH I-5 6 . . 37.411 35.807 -16.237 0.29 12.31 ? O HOH A-5 344 1 
HETATM 11885 O O . HOH I-5 6 . . 24.887 47.468 -21.66 0.55 28.29 ? O HOH A-5 345 1 
HETATM 11886 O O . HOH I-5 6 . . 20.253 27.942 -32.405 0.44 19.1 ? O HOH A-5 346 1 
HETATM 11887 O O . HOH I-5 6 . . 40.404 22.746 -18.861 0.63 16.82 ? O HOH A-5 347 1 
HETATM 11888 O O . HOH I-5 6 . . 17.367 27.503 -22.63 0.59 17.56 ? O HOH A-5 348 1 
HETATM 11889 O O . HOH I-5 6 . . 47.307 46.756 -36.168 0.82 30.59 ? O HOH A-5 349 1 
HETATM 11890 O O . HOH I-5 6 . . 36.521 25.506 -16.518 0.72 18.66 ? O HOH A-5 350 1 
HETATM 11891 O O . HOH I-5 6 . . 35.151 50.791 -43.339 0.53 18.78 ? O HOH A-5 351 1 
HETATM 11892 O O . HOH I-5 6 . . 24.339 22.258 -34.172 0.77 22.91 ? O HOH A-5 352 1 
HETATM 11893 O O . HOH I-5 6 . . 32.361 47.7 -50.254 0.63 18.62 ? O HOH A-5 353 1 
HETATM 11894 O O . HOH I-5 6 . . 25.709 16.33 -25.753 1 29.22 ? O HOH A-5 354 1 
HETATM 11895 O O . HOH I-5 6 . . 17.128 35.88 -37.425 0.57 17.96 ? O HOH A-5 355 1 
HETATM 11896 O O . HOH I-5 6 . . 30.548 56.562 -24.338 0.59 18.27 ? O HOH A-5 356 1 
HETATM 11897 O O . HOH I-5 6 . . 30.904 52.536 -22.547 0.49 22.53 ? O HOH A-5 357 1 
HETATM 11898 O O A HOH I-5 6 . . 39.419 56.931 -32.508 0.47 11.85 ? O HOH A-5 358 1 
HETATM 11899 O O B HOH I-5 6 . . 39.993 56.166 -33.947 0.53 20.93 ? O HOH A-5 358 1 
HETATM 11900 O O . HOH I-5 6 . . 47.172 36.689 -19.728 0.38 15.81 ? O HOH A-5 359 1 
HETATM 11901 O O . HOH I-5 6 . . 16.521 30.036 -24.585 0.77 15.2 ? O HOH A-5 360 1 
HETATM 11902 O O . HOH I-5 6 . . 50.392 33.008 -33.391 0.6 17.22 ? O HOH A-5 361 1 
HETATM 11903 O O . HOH I-5 6 . . 19.18 27.676 -44.971 0.62 19.8 ? O HOH A-5 362 1 
HETATM 11904 O O . HOH I-5 6 . . 46.277 44.135 -36.535 0.29 10.41 ? O HOH A-5 363 1 
HETATM 11905 O O . HOH I-5 6 . . 17.056 30.135 -37.244 1 33.42 ? O HOH A-5 364 1 
HETATM 11906 O O . HOH I-5 6 . . 14.741 32.321 -29.349 1 35.4 ? O HOH A-5 365 1 
HETATM 11907 O O . HOH I-5 6 . . 43.242 61.613 -27.658 1 28.55 ? O HOH A-5 366 1 
HETATM 11908 O O . HOH I-5 6 . . 41.617 60.65 -29.126 1 32.37 ? O HOH A-5 367 1 
HETATM 11909 O O . HOH I-5 6 . . 17.567 23.352 -23.913 1 35.65 ? O HOH A-5 368 1 
HETATM 11910 O O . HOH I-5 6 . . 24.512 20.449 -31.733 1 34.2 ? O HOH A-5 369 1 
HETATM 11911 O O . HOH I-5 6 . . 28.311 49.24 -45.907 0.63 21.64 ? O HOH A-5 370 1 
HETATM 11912 O O . HOH I-5 6 . . 42.481 32.171 -19.346 0.28 15.67 ? O HOH A-5 371 1 
HETATM 11913 O O . HOH I-5 6 . . 45.769 54.292 -29.303 0.93 31.79 ? O HOH A-5 372 1 
HETATM 11914 O O . HOH I-5 6 . . 39.98 53.663 -32.687 1 37.23 ? O HOH A-5 373 1 
HETATM 11915 O O . HOH I-5 6 . . 20.647 36.273 -14.956 1 32.39 ? O HOH A-5 374 1 
HETATM 11916 O O . HOH I-5 6 . . 47.845 43.568 -40.133 1 40.07 ? O HOH A-5 375 1 
HETATM 11917 O O . HOH I-5 6 . . 43.148 47.814 -42.1 1 35.87 ? O HOH A-5 376 1 
HETATM 11918 O O . HOH I-5 6 . . 34.749 58.568 -24.216 0.69 18.43 ? O HOH A-5 377 1 
HETATM 11919 O O . HOH I-5 6 . . 41.033 47.147 -45.772 1 37.4 ? O HOH A-5 378 1 
HETATM 11920 O O . HOH I-5 6 . . 51.771 28.581 -32.441 1 26.41 ? O HOH A-5 379 1 
HETATM 11921 O O A HOH I-5 6 . . 49.628 28.66 -30.893 0.31 14.63 ? O HOH A-5 380 1 
HETATM 11922 O O B HOH I-5 6 . . 48.894 28.789 -32.317 0.69 30.71 ? O HOH A-5 380 1 
HETATM 11923 O O . HOH I-5 6 . . 26.265 51.79 -29.134 1 26.99 ? O HOH A-5 381 1 
HETATM 11924 O O . HOH I-5 6 . . 42.534 51.089 -37.679 1 34.53 ? O HOH A-5 382 1 
HETATM 11925 O O . HOH I-5 6 . . 21.555 47.426 -40.959 0.44 16.74 ? O HOH A-5 383 1 
HETATM 11926 O O . HOH I-5 6 . . 43.151 51.962 -23.22 0.37 21.51 ? O HOH A-5 384 1 
HETATM 11927 O O . HOH I-5 6 . . 41.994 34.498 -16.238 1 37.07 ? O HOH A-5 385 1 
HETATM 11928 O O A HOH I-5 6 . . 41.476 47.716 -30.748 0.27 12.36 ? O HOH A-5 386 1 
HETATM 11929 O O B HOH I-5 6 . . 40.071 46.84 -29.635 0.73 9.75 ? O HOH A-5 386 1 
HETATM 11930 O O . HOH I-5 6 . . 21.335 45.329 -39.366 0.74 22.04 ? O HOH A-5 387 1 
HETATM 11931 O O . HOH I-5 6 . . 46.924 57.379 -24.747 0.25 15.96 ? O HOH A-5 388 1 
HETATM 11932 O O . HOH I-5 6 . . 12.985 38.954 -34.156 1 36.56 ? O HOH A-5 389 1 
HETATM 11933 O O . HOH I-5 6 . . 26.191 51.924 -21.437 1 39.59 ? O HOH A-5 390 1 
HETATM 11934 O O . HOH I-5 6 . . 46.93 26.396 -35.01 1 31.43 ? O HOH A-5 391 1 
HETATM 11935 O O A HOH I-5 6 . . 48.095 31.933 -40.612 0.71 18.36 ? O HOH A-5 392 1 
HETATM 11936 O O B HOH I-5 6 . . 48.363 30.314 -39.549 0.29 19.15 ? O HOH A-5 392 1 
HETATM 11937 O O . HOH I-5 6 . . 19.569 32.894 -44.391 0.4 17.81 ? O HOH A-5 393 1 
HETATM 11938 O O . HOH I-5 6 . . 13.407 35.803 -30.888 0.72 21.31 ? O HOH A-5 394 1 
HETATM 11939 O O . HOH I-5 6 . . 43.44 59.06 -28.628 1 37.27 ? O HOH A-5 395 1 
HETATM 11940 O O . HOH I-5 6 . . 21.192 28.652 -16.426 0.5 14.5 ? O HOH A-5 396 1 
HETATM 11941 O O . HOH I-5 6 . . 14.588 32.998 -27.443 0.61 16.32 ? O HOH A-5 397 1 
HETATM 11942 O O . HOH I-5 6 . . 50.638 34.515 -23.338 1 23.09 ? O HOH A-5 398 1 
HETATM 11943 O O . HOH I-5 6 . . 27.909 46.501 -17.866 1 19.26 ? O HOH A-5 399 1 
HETATM 11944 O O . HOH I-5 6 . . 28.728 48.599 -19.508 1 30.23 ? O HOH A-5 400 1 
HETATM 11945 O O . HOH I-5 6 . . 26.019 47.576 -19.516 1 38.51 ? O HOH A-5 401 1 
HETATM 11946 O O . HOH I-5 6 . . 52.022 32.215 -25.19 1 25.38 ? O HOH A-5 402 1 
HETATM 11947 O O . HOH I-5 6 . . 50.419 32.041 -23.357 1 29.5 ? O HOH A-5 403 1 
HETATM 11948 O O . HOH I-5 6 . . 32.638 33.072 -50.399 1 17.72 ? O HOH A-5 404 1 
HETATM 11949 O O . HOH I-5 6 . . 19.885 27.092 -19.927 1 35.03 ? O HOH A-5 405 1 
HETATM 11950 O O . HOH I-5 6 . . 48.986 27.934 -35.098 0.64 26.87 ? O HOH A-5 406 1 
HETATM 11951 O O . HOH I-5 6 . . 46.378 28.957 -43.056 1 37.16 ? O HOH A-5 407 1 
HETATM 11952 O O A HOH I-5 6 . . 42.28 50.709 -30.84 0.71 11.14 ? O HOH A-5 408 1 
HETATM 11953 O O B HOH I-5 6 . . 43.754 50.947 -30.836 0.29 12.66 ? O HOH A-5 408 1 
HETATM 11954 O O . HOH I-5 6 . . 48.369 49.272 -27.817 1 35.51 ? O HOH A-5 409 1 
HETATM 11955 O O . HOH I-5 6 . . 45.937 49.484 -26.807 1 33.82 ? O HOH A-5 410 1 
HETATM 11956 O O . HOH I-5 6 . . 49.835 48.498 -22.027 1 35.54 ? O HOH A-5 411 1 
HETATM 11957 O O . HOH I-5 6 . . 23.664 24.353 -32.621 0.94 14.43 ? O HOH A-5 412 1 
HETATM 11958 O O . HOH I-5 6 . . 31.246 28.586 -14.488 0.59 26.93 ? O HOH A-5 413 1 
HETATM 11959 O O A HOH I-5 6 . . 33.616 29.132 -15.569 0.58 19.84 ? O HOH A-5 414 1 
HETATM 11960 O O B HOH I-5 6 . . 32.376 28.641 -16.431 0.42 28.06 ? O HOH A-5 414 1 
HETATM 11961 O O . HOH I-5 6 . . 30.327 32.114 -18.99 0.54 11.82 ? O HOH A-5 415 1 
HETATM 11962 O O . HOH I-5 6 . . 33.065 32.157 -19.223 0.63 17.78 ? O HOH A-5 416 1 
HETATM 11963 O O . HOH I-5 6 . . 32.101 26.967 -15.17 0.59 29.2 ? O HOH A-5 417 1 
HETATM 11964 O O . HOH I-5 6 . . 37.465 56.978 -35.371 1 17.88 ? O HOH A-5 418 1 
HETATM 11965 O O . HOH I-5 6 . . 37.328 58.44 -29.647 1 26.43 ? O HOH A-5 419 1 
HETATM 11966 O O . HOH I-5 6 . . 35.18 35.941 -53.699 1 34.76 ? O HOH A-5 420 1 
HETATM 11967 O O . HOH I-5 6 . . 43.491 48.68 -26.563 0.43 28.42 ? O HOH A-5 421 1 
HETATM 11968 O O . HOH I-5 6 . . 41.974 46.074 -28.186 0.48 28.07 ? O HOH A-5 422 1 
HETATM 11969 O O . HOH I-5 6 . . 19.972 30.119 -43.647 0.38 12.14 ? O HOH A-5 423 1 
HETATM 11970 O O . HOH I-5 6 . . 18.335 43.232 -38.118 0.7 26.46 ? O HOH A-5 424 1 
HETATM 11971 O O . HOH I-5 6 . . 15.546 30.935 -26.937 0.57 22.9 ? O HOH A-5 425 1 
HETATM 11972 O O . HOH I-5 6 . . 32.748 48.212 -46.619 0.58 23.64 ? O HOH A-5 426 1 
HETATM 11973 O O . HOH I-5 6 . . 31.235 32.104 -49.283 0.65 24.06 ? O HOH A-5 427 1 
HETATM 11974 O O . HOH I-5 6 . . 22.326 22.274 -28.056 0.56 20.99 ? O HOH A-5 428 1 
HETATM 11975 O O . HOH I-5 6 . . 46.731 29.796 -40.788 0.76 28.29 ? O HOH A-5 429 1 
HETATM 11976 O O . HOH I-5 6 . . 25.133 22.04 -29.051 0.91 17.1 ? O HOH A-5 430 1 
HETATM 11977 O O . HOH I-5 6 . . 28.522 47.091 -47.94 0.91 19.1 ? O HOH A-5 431 1 
HETATM 11978 O O . HOH I-5 6 . . 35.412 57.55 -20.711 0.37 25.02 ? O HOH A-5 432 1 
HETATM 11979 O O . HOH I-5 6 . . 20.742 42.762 -36.619 0.72 10.88 ? O HOH A-5 433 1 
HETATM 11980 O O . HOH I-5 6 . . 30.624 17.04 -28.84 0.46 18.11 ? O HOH A-5 434 1 
HETATM 11981 O O . HOH I-5 6 . . 24.714 29.203 -15.953 0.64 14.39 ? O HOH A-5 435 1 
HETATM 11982 O O . HOH I-5 6 . . 19.963 27.832 -42.134 0.67 21.5 ? O HOH A-5 436 1 
HETATM 11983 O O . HOH I-5 6 . . 13.579 34.774 -27.996 0.23 15.71 ? O HOH A-5 437 1 
HETATM 11984 O O . HOH I-5 6 . . 31.876 58.351 -24.039 0.3 18.57 ? O HOH A-5 438 1 
HETATM 11985 O O . HOH I-5 6 . . 33.559 31.303 -50.705 0.6 21.01 ? O HOH A-5 439 1 
HETATM 11986 O O . HOH I-5 6 . . 20.093 20.078 -24.545 0.43 25 ? O HOH A-5 440 1 
HETATM 11987 O O . HOH I-5 6 . . 35.694 55.04 -20.963 0.67 16 ? O HOH A-5 441 1 
HETATM 11988 O O . HOH I-5 6 . . 18.58 29.047 -19.052 0.55 25.76 ? O HOH A-5 442 1 
HETATM 11989 O O . HOH I-5 6 . . 18.315 36.533 -17.966 0.43 22.62 ? O HOH A-5 443 1 
HETATM 11990 O O . HOH I-5 6 . . 36.978 54.756 -23.877 0.68 17.69 ? O HOH A-5 444 1 
HETATM 11991 O O . HOH I-5 6 . . 51.605 42.344 -42.961 0.52 20.06 ? O HOH A-5 445 1 
HETATM 11992 O O . HOH I-5 6 . . 16.649 28.542 -35.318 0.77 21.15 ? O HOH A-5 446 1 
HETATM 11993 O O . HOH I-5 6 . . 46.404 42.502 -38.408 0.43 19.16 ? O HOH A-5 447 1 
HETATM 11994 O O . HOH I-5 6 . . 48.448 34.516 -21.734 0.53 23.29 ? O HOH A-5 448 1 
HETATM 11995 O O . HOH I-5 6 . . 29.013 50.976 -16.315 0.53 22.06 ? O HOH A-5 449 1 
HETATM 11996 O O . HOH I-5 6 . . 20.222 43.842 -41.381 0.67 27.89 ? O HOH A-5 450 1 
HETATM 11997 O O . HOH I-5 6 . . 23.481 51.207 -35.215 0.75 32.43 ? O HOH A-5 451 1 
HETATM 11998 O O . HOH I-5 6 . . 18.35 35.234 -39.645 0.62 27.49 ? O HOH A-5 452 1 
HETATM 11999 O O . HOH I-5 6 . . 32.076 21.936 -39.851 0.63 27.74 ? O HOH A-5 453 1 
HETATM 12000 O O . HOH I-5 6 . . 34.734 44.276 -36.595 1 5.62 ? O HOH A-5 454 1 
HETATM 12001 O O . HOH I-5 6 . . 41.77 46.974 -33.116 0.98 10.32 ? O HOH A-5 455 1 
HETATM 12002 O O . HOH I-5 6 . . 26.661 23.398 -26.868 0.9 8.62 ? O HOH A-5 456 1 
HETATM 12003 O O . HOH I-5 6 . . 39.768 47.953 -35.071 1 10.54 ? O HOH A-5 457 1 
HETATM 12004 O O . HOH I-5 6 . . 39.775 45.312 -36.291 1 12.65 ? O HOH A-5 458 1 
HETATM 12005 O O . HOH I-5 6 . . 24.389 20.457 -20.302 0.86 9.36 ? O HOH A-5 459 1 
HETATM 12006 O O . HOH I-5 6 . . 48.688 36.014 -24.903 1 12.94 ? O HOH A-5 460 1 
HETATM 12007 O O . HOH I-5 6 . . 13.025 38.554 -31.862 0.84 31.79 ? O HOH A-5 461 1 
HETATM 12008 O O . HOH I-5 6 . . 18.164 32.772 -42.158 0.96 29.02 ? O HOH A-5 462 1 
HETATM 12009 O O . HOH I-5 6 . . 12.663 32.138 -27.105 0.4 21.77 ? O HOH A-5 463 1 
HETATM 12010 O O . HOH I-5 6 . . 42.156 26.295 -18.987 0.64 23.88 ? O HOH A-5 464 1 
HETATM 12011 O O . HOH I-5 6 . . 38.102 40.374 -34.24 1 5.52 ? O HOH A-5 465 1 
HETATM 12012 O O . HOH I-5 6 . . 50.301 51.605 -27.936 0.35 13.23 ? O HOH A-5 466 1 
HETATM 12013 O O . HOH I-5 6 . . 25.92 21.647 -35.894 0.89 26.22 ? O HOH A-5 467 1 
HETATM 12014 O O . HOH I-5 6 . . 20.142 34.467 -16.9 0.44 18.68 ? O HOH A-5 468 1 
HETATM 12015 O O . HOH I-5 6 . . 25.749 35.234 -52.989 0.7 33.22 ? O HOH A-5 469 1 
HETATM 12016 O O . HOH I-5 6 . . 41.822 47.557 -38.625 0.4 21.51 ? O HOH A-5 470 1 
HETATM 12017 O O . HOH I-5 6 . . 30.498 50.198 -44.238 0.44 20.98 ? O HOH A-5 471 1 
HETATM 12018 O O . HOH I-5 6 . . 28.451 54.555 -36.199 0.43 14.8 ? O HOH A-5 472 1 
HETATM 12019 O O . HOH I-5 6 . . 25.475 39.292 -54.131 0.43 18.87 ? O HOH A-5 473 1 
HETATM 12020 O O . HOH I-5 6 . . 14.52 36.645 -27.129 0.36 18.61 ? O HOH A-5 474 1 
HETATM 12021 O O . HOH I-5 6 . . 16.146 31.541 -21.181 0.54 23.92 ? O HOH A-5 475 1 
HETATM 12022 O O . HOH I-5 6 . . 14.617 38.489 -26.453 0.55 30.96 ? O HOH A-5 476 1 
HETATM 12023 O O . HOH I-5 6 . . 25.654 54.364 -29.411 0.39 26.87 ? O HOH A-5 477 1 
HETATM 12024 O O . HOH I-5 6 . . 26.821 44.985 -48.132 0.54 17.49 ? O HOH A-5 478 1 
HETATM 12025 O O . HOH I-5 6 . . 40.346 48.243 -43.179 0.53 26.31 ? O HOH A-5 479 1 
HETATM 12026 O O . HOH I-5 6 . . 41.473 49.771 -38.913 0.67 30.22 ? O HOH A-5 480 1 
HETATM 12027 O O . HOH I-6 6 . . 80.628 30.82 -41.875 0.25 13.9 ? O HOH A-6 179 1 
HETATM 12028 O O . HOH I-6 6 . . 62.265 42.092 -52.145 0.62 26.57 ? O HOH A-6 180 1 
HETATM 12029 O O . HOH I-6 6 . . 71.94 41.367 -53.591 0.6 26.35 ? O HOH A-6 181 1 
HETATM 12030 O O . HOH I-6 6 . . 55.679 51.666 -38.463 0.48 23.99 ? O HOH A-6 182 1 
HETATM 12031 O O . HOH I-6 6 . . 70.893 39.592 -54.942 0.75 33.89 ? O HOH A-6 183 1 
HETATM 12032 O O . HOH I-6 6 . . 67.087 32.278 -36.883 1 5.77 ? O HOH A-6 184 1 
HETATM 12033 O O . HOH I-6 6 . . 66.387 30.228 -35.072 1 5.76 ? O HOH A-6 185 1 
HETATM 12034 O O . HOH I-6 6 . . 71.31 49.526 -19.526 0.71 13.09 ? O HOH A-6 186 1 
HETATM 12035 O O . HOH I-6 6 . . 62.577 52.097 -44.561 0.5 24.79 ? O HOH A-6 187 1 
HETATM 12036 O O . HOH I-6 6 . . 51.936 38.548 -18.236 0.59 31.06 ? O HOH A-6 188 1 
HETATM 12037 O O . HOH I-6 6 . . 73.885 29.836 -45.606 1 20.27 ? O HOH A-6 189 1 
HETATM 12038 O O . HOH I-6 6 . . 77.02 52.578 -32.401 0.49 21.06 ? O HOH A-6 190 1 
HETATM 12039 O O . HOH I-6 6 . . 71.171 36.454 -35.613 1 5.98 ? O HOH A-6 191 1 
HETATM 12040 O O . HOH I-6 6 . . 73.428 27.405 -44.654 0.44 25.29 ? O HOH A-6 192 1 
HETATM 12041 O O . HOH I-6 6 . . 64.146 30.257 -32.198 0.88 6.01 ? O HOH A-6 193 1 
HETATM 12042 O O . HOH I-6 6 . . 62.805 57.824 -35.019 0.26 16.69 ? O HOH A-6 194 1 
HETATM 12043 O O . HOH I-6 6 . . 82.193 43.673 -34.724 1 41.67 ? O HOH A-6 195 1 
HETATM 12044 O O . HOH I-6 6 . . 60.606 19.518 -40.877 0.68 33.26 ? O HOH A-6 196 1 
HETATM 12045 O O . HOH I-6 6 . . 51.556 26.904 -38.829 0.67 12.25 ? O HOH A-6 197 1 
HETATM 12046 O O . HOH I-6 6 . . 54.313 43.728 -23.741 1 6.89 ? O HOH A-6 198 1 
HETATM 12047 O O . HOH I-6 6 . . 69.607 57.704 -23.757 0.72 42.23 ? O HOH A-6 199 1 
HETATM 12048 O O . HOH I-6 6 . . 54.449 42.372 -44.924 1 28.75 ? O HOH A-6 200 1 
HETATM 12049 O O . HOH I-6 6 . . 74.044 35.861 -47.954 0.9 19.82 ? O HOH A-6 201 1 
HETATM 12050 O O . HOH I-6 6 . . 55.722 30.759 -21.752 0.42 20.13 ? O HOH A-6 202 1 
HETATM 12051 O O . HOH I-6 6 . . 80.748 24.437 -23.227 0.94 31.19 ? O HOH A-6 203 1 
HETATM 12052 O O . HOH I-6 6 . . 66.88 56.018 -44.503 0.18 10.24 ? O HOH A-6 204 1 
HETATM 12053 O O . HOH I-6 6 . . 55.939 40.809 -17.199 0.66 31.37 ? O HOH A-6 205 1 
HETATM 12054 O O . HOH I-6 6 . . 67.243 23.893 -39.249 0.53 28.14 ? O HOH A-6 206 1 
HETATM 12055 O O . HOH I-6 6 . . 66.843 40.861 -54.243 0.71 30.43 ? O HOH A-6 207 1 
HETATM 12056 O O . HOH I-6 6 . . 72.209 26.476 -41.087 0.67 32.61 ? O HOH A-6 208 1 
HETATM 12057 O O . HOH I-6 6 . . 60.224 19.757 -23.068 0.9 6.78 ? O HOH A-6 209 1 
HETATM 12058 O O . HOH I-6 6 . . 63.798 28.535 -47.501 1 32.24 ? O HOH A-6 210 1 
HETATM 12059 O O . HOH I-6 6 . . 71.793 31.378 -30.499 1 7.1 ? O HOH A-6 211 1 
HETATM 12060 O O . HOH I-6 6 . . 66.534 27.919 -47.011 0.71 27.9 ? O HOH A-6 212 1 
HETATM 12061 O O . HOH I-6 6 . . 73.025 29.685 -34.162 1 6.84 ? O HOH A-6 213 1 
HETATM 12062 O O . HOH I-6 6 . . 63.226 55.515 -16.173 0.73 29.41 ? O HOH A-6 214 1 
HETATM 12063 O O . HOH I-6 6 . . 54.819 46.767 -43.788 0.69 35.79 ? O HOH A-6 215 1 
HETATM 12064 O O . HOH I-6 6 . . 64.85 30.701 -37.231 0.91 6.19 ? O HOH A-6 216 1 
HETATM 12065 O O . HOH I-6 6 . . 80.464 41.684 -42.629 0.72 33.33 ? O HOH A-6 217 1 
HETATM 12066 O O . HOH I-6 6 . . 71.425 28.758 -31.918 0.96 7.56 ? O HOH A-6 218 1 
HETATM 12067 O O . HOH I-6 6 . . 81.31 30.534 -30.484 1 8.78 ? O HOH A-6 219 1 
HETATM 12068 O O . HOH I-6 6 . . 63.946 46.384 -46.329 0.92 14.41 ? O HOH A-6 220 1 
HETATM 12069 O O . HOH I-6 6 . . 63.009 37.365 -18.235 1 8.09 ? O HOH A-6 221 1 
HETATM 12070 O O . HOH I-6 6 . . 57.662 56.248 -19.257 0.82 21 ? O HOH A-6 222 1 
HETATM 12071 O O . HOH I-6 6 . . 69.976 55.676 -31.399 0.77 22.15 ? O HOH A-6 223 1 
HETATM 12072 O O . HOH I-6 6 . . 70.04 57.258 -32.829 0.13 8.18 ? O HOH A-6 224 1 
HETATM 12073 O O . HOH I-6 6 . . 81.171 45.235 -26.18 0.87 30.47 ? O HOH A-6 225 1 
HETATM 12074 O O . HOH I-6 6 . . 60.543 53.294 -44.487 0.59 24.12 ? O HOH A-6 226 1 
HETATM 12075 O O . HOH I-6 6 . . 53.967 46.283 -31.07 0.91 6.92 ? O HOH A-6 227 1 
HETATM 12076 O O . HOH I-6 6 . . 79.827 46.802 -27.272 0.51 20.67 ? O HOH A-6 228 1 
HETATM 12077 O O . HOH I-6 6 . . 70.726 23.365 -24.202 1 8.93 ? O HOH A-6 229 1 
HETATM 12078 O O . HOH I-6 6 . . 62.42 17.843 -33.244 1 7.53 ? O HOH A-6 230 1 
HETATM 12079 O O . HOH I-6 6 . . 60.347 53.981 -18.68 1 9.3 ? O HOH A-6 231 1 
HETATM 12080 O O . HOH I-6 6 . . 69.005 25.999 -35.986 1 9.26 ? O HOH A-6 232 1 
HETATM 12081 O O . HOH I-6 6 . . 79.768 30.605 -23.049 1 12.66 ? O HOH A-6 233 1 
HETATM 12082 O O . HOH I-6 6 . . 73.138 23.273 -21.172 0.9 6.97 ? O HOH A-6 234 1 
HETATM 12083 O O . HOH I-6 6 . . 63.609 53.111 -18.816 0.7 16.56 ? O HOH A-6 235 1 
HETATM 12084 O O . HOH I-6 6 . . 69.906 23.477 -34.822 0.42 14.12 ? O HOH A-6 236 1 
HETATM 12085 O O . HOH I-6 6 . . 64.309 25.396 -41.279 1 30.87 ? O HOH A-6 237 1 
HETATM 12086 O O . HOH I-6 6 . . 67.649 57.299 -32.884 0.24 15.64 ? O HOH A-6 238 1 
HETATM 12087 O O . HOH I-6 6 . . 72.03 54.415 -30.437 0.8 11.06 ? O HOH A-6 239 1 
HETATM 12088 O O . HOH I-6 6 . . 60.956 55.551 -35.553 0.59 24.24 ? O HOH A-6 240 1 
HETATM 12089 O O . HOH I-6 6 . . 79.853 34.848 -42.438 0.7 27.71 ? O HOH A-6 241 1 
HETATM 12090 O O . HOH I-6 6 . . 58.921 38.622 -23.298 0.7 5.9 ? O HOH A-6 242 1 
HETATM 12091 O O A HOH I-6 6 . . 49.632 28.675 -44.057 0.49 37.53 ? O HOH A-6 243 1 
HETATM 12092 O O B HOH I-6 6 . . 49.631 28.602 -41.915 0.51 34.9 ? O HOH A-6 243 1 
HETATM 12093 O O . HOH I-6 6 . . 62.456 49.128 -46.245 0.58 23.66 ? O HOH A-6 244 1 
HETATM 12094 O O . HOH I-6 6 . . 59.853 26.188 -18.638 0.47 21.6 ? O HOH A-6 245 1 
HETATM 12095 O O . HOH I-6 6 . . 63.679 23.732 -43.757 0.84 38.73 ? O HOH A-6 246 1 
HETATM 12096 O O . HOH I-6 6 . . 70.485 17.501 -19.691 0.99 10.7 ? O HOH A-6 247 1 
HETATM 12097 O O . HOH I-6 6 . . 81.314 34.743 -22.761 1 12.25 ? O HOH A-6 248 1 
HETATM 12098 O O . HOH I-6 6 . . 50.423 33.179 -36.861 1 13.93 ? O HOH A-6 249 1 
HETATM 12099 O O . HOH I-6 6 . . 73.031 52.977 -41.683 0.76 36.54 ? O HOH A-6 250 1 
HETATM 12100 O O . HOH I-6 6 . . 56.216 57.111 -28.498 0.31 15.48 ? O HOH A-6 251 1 
HETATM 12101 O O . HOH I-6 6 . . 80.732 34.29 -38.604 1 11.93 ? O HOH A-6 252 1 
HETATM 12102 O O . HOH I-6 6 . . 65.725 41.269 -47.516 0.96 11.22 ? O HOH A-6 253 1 
HETATM 12103 O O . HOH I-6 6 . . 75.668 29.043 -34.691 0.82 9.04 ? O HOH A-6 254 1 
HETATM 12104 O O . HOH I-6 6 . . 76.259 28.106 -23.598 1 15.95 ? O HOH A-6 255 1 
HETATM 12105 O O . HOH I-6 6 . . 61.831 20.195 -20.806 0.72 10.83 ? O HOH A-6 256 1 
HETATM 12106 O O . HOH I-6 6 . . 65.143 52.913 -30.578 0.8 12.12 ? O HOH A-6 257 1 
HETATM 12107 O O A HOH I-6 6 . . 59.285 40.515 -19.911 0.46 14.98 ? O HOH A-6 258 1 
HETATM 12108 O O B HOH I-6 6 . . 58.218 40.927 -19.145 0.54 19.35 ? O HOH A-6 258 1 
HETATM 12109 O O . HOH I-6 6 . . 83.626 29.063 -15.136 0.53 29.4 ? O HOH A-6 259 1 
HETATM 12110 O O . HOH I-6 6 . . 58.857 55.845 -31.084 1 37.68 ? O HOH A-6 260 1 
HETATM 12111 O O . HOH I-6 6 . . 75.131 50.66 -42.543 0.61 30.47 ? O HOH A-6 261 1 
HETATM 12112 O O . HOH I-6 6 . . 57.798 26.733 -47.22 1 37.59 ? O HOH A-6 262 1 
HETATM 12113 O O . HOH I-6 6 . . 61.204 21.212 -18.226 0.8 11.84 ? O HOH A-6 263 1 
HETATM 12114 O O . HOH I-6 6 . . 81.34 44.637 -38.909 0.87 41.43 ? O HOH A-6 264 1 
HETATM 12115 O O . HOH I-6 6 . . 69.491 46.797 -46.08 0.79 10.83 ? O HOH A-6 265 1 
HETATM 12116 O O . HOH I-6 6 . . 71.455 27.659 -37.947 0.6 9.42 ? O HOH A-6 266 1 
HETATM 12117 O O . HOH I-6 6 . . 64.562 28.897 -39.25 0.92 14.64 ? O HOH A-6 267 1 
HETATM 12118 O O . HOH I-6 6 . . 77.223 50.295 -29.869 0.99 14.46 ? O HOH A-6 268 1 
HETATM 12119 O O . HOH I-6 6 . . 52.286 53.668 -32.501 0.62 36.45 ? O HOH A-6 269 1 
HETATM 12120 O O . HOH I-6 6 . . 58.282 53.743 -20.87 0.91 15.69 ? O HOH A-6 270 1 
HETATM 12121 O O . HOH I-6 6 . . 55.767 28.624 -23.709 0.97 16.99 ? O HOH A-6 271 1 
HETATM 12122 O O . HOH I-6 6 . . 78.46 45.721 -22.848 1 20.07 ? O HOH A-6 272 1 
HETATM 12123 O O . HOH I-6 6 . . 61.571 53.397 -33.818 0.76 13 ? O HOH A-6 273 1 
HETATM 12124 O O . HOH I-6 6 . . 84.76 30.872 -36.144 0.62 12.52 ? O HOH A-6 274 1 
HETATM 12125 O O . HOH I-6 6 . . 80.629 28.337 -23.919 0.75 11.6 ? O HOH A-6 275 1 
HETATM 12126 O O . HOH I-6 6 . . 52.213 27.974 -43.27 0.58 32.94 ? O HOH A-6 276 1 
HETATM 12127 O O . HOH I-6 6 . . 78.859 46.426 -35.572 0.66 11.23 ? O HOH A-6 277 1 
HETATM 12128 O O . HOH I-6 6 . . 72.366 42.284 -50.998 0.59 11.26 ? O HOH A-6 278 1 
HETATM 12129 O O . HOH I-6 6 . . 65.154 55.557 -43.269 0.63 9.01 ? O HOH A-6 279 1 
HETATM 12130 O O . HOH I-6 6 . . 80.412 40.966 -39.714 1 17.02 ? O HOH A-6 280 1 
HETATM 12131 O O . HOH I-6 6 . . 80.605 31.732 -39.56 0.96 17.49 ? O HOH A-6 281 1 
HETATM 12132 O O . HOH I-6 6 . . 72.955 41.169 -12.377 0.75 15.61 ? O HOH A-6 282 1 
HETATM 12133 O O . HOH I-6 6 . . 79.055 31.994 -41.888 0.62 16.36 ? O HOH A-6 283 1 
HETATM 12134 O O . HOH I-6 6 . . 54.613 27.732 -48.185 0.76 37.5 ? O HOH A-6 284 1 
HETATM 12135 O O . HOH I-6 6 . . 52.749 52.41 -27.425 0.86 14.26 ? O HOH A-6 285 1 
HETATM 12136 O O . HOH I-6 6 . . 80.013 44.02 -36.523 0.66 13.82 ? O HOH A-6 286 1 
HETATM 12137 O O . HOH I-6 6 . . 66.174 19.415 -34.576 0.5 11.07 ? O HOH A-6 287 1 
HETATM 12138 O O . HOH I-6 6 . . 49.669 28.65 -37.798 0.24 14.92 ? O HOH A-6 288 1 
HETATM 12139 O O . HOH I-6 6 . . 60.707 47.79 -16.603 0.49 8.05 ? O HOH A-6 289 1 
HETATM 12140 O O . HOH I-6 6 . . 64.91 51.741 -33.533 0.45 10.54 ? O HOH A-6 290 1 
HETATM 12141 O O . HOH I-6 6 . . 82.782 35.522 -37.741 0.28 9.74 ? O HOH A-6 291 1 
HETATM 12142 O O . HOH I-6 6 . . 66.222 54.102 -33.372 0.77 25.41 ? O HOH A-6 292 1 
HETATM 12143 O O A HOH I-6 6 . . 67.491 54.883 -30.614 0.52 13.99 ? O HOH A-6 293 1 
HETATM 12144 O O B HOH I-6 6 . . 67.839 55.585 -29.543 0.48 18.4 ? O HOH A-6 293 1 
HETATM 12145 O O . HOH I-6 6 . . 85.001 31.335 -26.857 0.29 12.37 ? O HOH A-6 294 1 
HETATM 12146 O O . HOH I-6 6 . . 80.681 22.294 -21.898 0.48 19.85 ? O HOH A-6 295 1 
HETATM 12147 O O . HOH I-6 6 . . 59.215 35.514 -14.912 0.53 30.73 ? O HOH A-6 296 1 
HETATM 12148 O O . HOH I-6 6 . . 80.69 38.218 -40.201 0.59 11.5 ? O HOH A-6 297 1 
HETATM 12149 O O . HOH I-6 6 . . 60.511 49.664 -44.529 1 22.91 ? O HOH A-6 298 1 
HETATM 12150 O O . HOH I-6 6 . . 71.251 48.862 -46.558 0.86 19.12 ? O HOH A-6 299 1 
HETATM 12151 O O . HOH I-6 6 . . 72.418 54.105 -24.699 0.8 14.09 ? O HOH A-6 300 1 
HETATM 12152 O O . HOH I-6 6 . . 60.941 36.902 -50.272 0.63 15.6 ? O HOH A-6 302 1 
HETATM 12153 O O . HOH I-6 6 . . 75.289 42.362 -19.839 0.97 21.47 ? O HOH A-6 303 1 
HETATM 12154 O O . HOH I-6 6 . . 81.005 38.619 -32.593 1 28.03 ? O HOH A-6 304 1 
HETATM 12155 O O . HOH I-6 6 . . 75.441 32.898 -43.92 0.59 16.61 ? O HOH A-6 311 1 
HETATM 12156 O O . HOH I-6 6 . . 53.813 56.703 -21.763 0.75 20.61 ? O HOH A-6 312 1 
HETATM 12157 O O . HOH I-6 6 . . 66.382 26.596 -38.604 0.49 10.43 ? O HOH A-6 313 1 
HETATM 12158 O O . HOH I-6 6 . . 53.457 44.072 -11.165 0.94 9.31 ? O HOH A-6 314 1 
HETATM 12159 O O . HOH I-6 6 . . 52.772 44.488 -16.153 0.91 18.6 ? O HOH A-6 315 1 
HETATM 12160 O O . HOH I-6 6 . . 61.821 39.381 -51.412 0.69 20.99 ? O HOH A-6 316 1 
HETATM 12161 O O . HOH I-6 6 . . 64.092 40.956 -50.005 0.81 18.01 ? O HOH A-6 317 1 
HETATM 12162 O O . HOH I-6 6 . . 58.334 29.595 -17.423 0.53 15.5 ? O HOH A-6 318 1 
HETATM 12163 O O . HOH I-6 6 . . 82.044 44.937 -31.577 0.68 23.8 ? O HOH A-6 319 1 
HETATM 12164 O O . HOH I-6 6 . . 49.629 28.649 -23.605 0.18 30.64 ? O HOH A-6 320 1 
HETATM 12165 O O . HOH I-6 6 . . 50.391 34.682 -20.556 0.5 26.92 ? O HOH A-6 321 1 
HETATM 12166 O O . HOH I-6 6 . . 47.946 34.34 -19.726 0.68 36.45 ? O HOH A-6 322 1 
HETATM 12167 O O . HOH I-6 6 . . 75.01 48.09 -42.144 0.81 21.41 ? O HOH A-6 323 1 
HETATM 12168 O O . HOH I-6 6 . . 66.263 55.643 -41.683 1 23.53 ? O HOH A-6 324 1 
HETATM 12169 O O . HOH I-6 6 . . 70.172 46.127 -52.119 0.48 14.46 ? O HOH A-6 325 1 
HETATM 12170 O O . HOH I-6 6 . . 63.985 43.598 -47.996 0.9 19.98 ? O HOH A-6 326 1 
HETATM 12171 O O . HOH I-6 6 . . 75.624 16.69 -21.286 0.66 20.45 ? O HOH A-6 327 1 
HETATM 12172 O O . HOH I-6 6 . . 81.144 30.068 -21.362 0.58 30.02 ? O HOH A-6 328 1 
HETATM 12173 O O . HOH I-6 6 . . 81.835 32.275 -21.411 0.37 21.56 ? O HOH A-6 329 1 
HETATM 12174 O O . HOH I-6 6 . . 72.873 43.194 -10.578 0.73 24.4 ? O HOH A-6 330 1 
HETATM 12175 O O . HOH I-6 6 . . 64.586 50.895 -16.853 0.42 10.98 ? O HOH A-6 331 1 
HETATM 12176 O O . HOH I-6 6 . . 50.611 49.799 -19.424 0.98 14.49 ? O HOH A-6 332 1 
HETATM 12177 O O . HOH I-6 6 . . 66.895 47.87 -46.237 0.72 16.84 ? O HOH A-6 333 1 
HETATM 12178 O O . HOH I-6 6 . . 65.233 39.453 -52.134 0.67 19.44 ? O HOH A-6 334 1 
HETATM 12179 O O . HOH I-6 6 . . 70.54 50.057 -48.108 0.44 25.78 ? O HOH A-6 335 1 
HETATM 12180 O O . HOH I-6 6 . . 77.942 43.896 -20.615 0.61 21.15 ? O HOH A-6 336 1 
HETATM 12181 O O . HOH I-6 6 . . 70.459 48.574 -49.411 0.4 22.45 ? O HOH A-6 337 1 
HETATM 12182 O O . HOH I-6 6 . . 75.926 53.017 -49.334 0.68 40.23 ? O HOH A-6 338 1 
HETATM 12183 O O . HOH I-6 6 . . 52.275 50.263 -34.975 0.55 29.45 ? O HOH A-6 339 1 
HETATM 12184 O O . HOH I-6 6 . . 49.813 48.407 -37.45 0.66 32.31 ? O HOH A-6 340 1 
HETATM 12185 O O . HOH I-6 6 . . 53.274 50.622 -39.111 0.8 33.06 ? O HOH A-6 341 1 
HETATM 12186 O O . HOH I-6 6 . . 54.712 52.571 -40.455 0.6 33.38 ? O HOH A-6 342 1 
HETATM 12187 O O . HOH I-6 6 . . 75.313 42.132 -46.186 0.62 15.05 ? O HOH A-6 343 1 
HETATM 12188 O O . HOH I-6 6 . . 61.931 35.653 -16.237 0.29 12.31 ? O HOH A-6 344 1 
HETATM 12189 O O . HOH I-6 6 . . 78.291 40.669 -21.66 0.55 28.29 ? O HOH A-6 345 1 
HETATM 12190 O O . HOH I-6 6 . . 63.698 54.445 -32.405 0.44 19.1 ? O HOH A-6 346 1 
HETATM 12191 O O . HOH I-6 6 . . 49.123 39.592 -18.861 0.63 16.82 ? O HOH A-6 347 1 
HETATM 12192 O O . HOH I-6 6 . . 64.761 57.164 -22.63 0.59 17.56 ? O HOH A-6 348 1 
HETATM 12193 O O . HOH I-6 6 . . 66.465 21.609 -36.168 0.82 30.59 ? O HOH A-6 349 1 
HETATM 12194 O O . HOH I-6 6 . . 53.455 41.575 -16.518 0.72 18.66 ? O HOH A-6 350 1 
HETATM 12195 O O . HOH I-6 6 . . 76.037 30.119 -43.339 0.53 18.78 ? O HOH A-6 351 1 
HETATM 12196 O O . HOH I-6 6 . . 56.733 53.749 -34.172 0.77 22.91 ? O HOH A-6 352 1 
HETATM 12197 O O . HOH I-6 6 . . 74.755 34.08 -50.254 0.63 18.62 ? O HOH A-6 353 1 
HETATM 12198 O O . HOH I-6 6 . . 50.914 55.526 -25.753 1 29.22 ? O HOH A-6 354 1 
HETATM 12199 O O . HOH I-6 6 . . 72.135 53.182 -37.425 0.57 17.96 ? O HOH A-6 355 1 
HETATM 12200 O O . HOH I-6 6 . . 83.336 31.219 -24.338 0.59 18.27 ? O HOH A-6 356 1 
HETATM 12201 O O . HOH I-6 6 . . 79.672 32.924 -22.547 0.49 22.53 ? O HOH A-6 357 1 
HETATM 12202 O O A HOH I-6 6 . . 79.22 23.352 -32.508 0.47 11.85 ? O HOH A-6 358 1 
HETATM 12203 O O B HOH I-6 6 . . 78.271 23.238 -33.947 0.53 20.93 ? O HOH A-6 358 1 
HETATM 12204 O O . HOH I-6 6 . . 57.814 26.759 -19.728 0.38 15.81 ? O HOH A-6 359 1 
HETATM 12205 O O . HOH I-6 6 . . 67.378 56.63 -24.585 0.77 15.2 ? O HOH A-6 360 1 
HETATM 12206 O O . HOH I-6 6 . . 53.016 25.811 -33.391 0.6 17.22 ? O HOH A-6 361 1 
HETATM 12207 O O . HOH I-6 6 . . 64.004 55.507 -44.971 0.62 19.8 ? O HOH A-6 362 1 
HETATM 12208 O O . HOH I-6 6 . . 64.71 23.811 -36.535 0.29 10.41 ? O HOH A-6 363 1 
HETATM 12209 O O . HOH I-6 6 . . 67.196 56.117 -37.244 1 33.42 ? O HOH A-6 364 1 
HETATM 12210 O O . HOH I-6 6 . . 70.247 57.029 -29.349 1 35.4 ? O HOH A-6 365 1 
HETATM 12211 O O . HOH I-6 6 . . 81.364 17.701 -27.658 1 28.55 ? O HOH A-6 366 1 
HETATM 12212 O O . HOH I-6 6 . . 81.342 19.589 -29.126 1 32.37 ? O HOH A-6 367 1 
HETATM 12213 O O . HOH I-6 6 . . 61.066 59.066 -23.913 1 35.65 ? O HOH A-6 368 1 
HETATM 12214 O O . HOH I-6 6 . . 55.08 54.503 -31.733 1 34.2 ? O HOH A-6 369 1 
HETATM 12215 O O . HOH I-6 6 . . 78.114 36.818 -45.907 0.63 21.64 ? O HOH A-6 370 1 
HETATM 12216 O O . HOH I-6 6 . . 56.247 33.081 -19.346 0.28 15.67 ? O HOH A-6 371 1 
HETATM 12217 O O . HOH I-6 6 . . 73.76 19.173 -29.303 0.93 31.79 ? O HOH A-6 372 1 
HETATM 12218 O O . HOH I-6 6 . . 76.11 24.501 -32.687 1 37.23 ? O HOH A-6 373 1 
HETATM 12219 O O . HOH I-6 6 . . 70.716 49.938 -14.956 1 32.39 ? O HOH A-6 374 1 
HETATM 12220 O O . HOH I-6 6 . . 63.435 22.737 -40.133 1 40.07 ? O HOH A-6 375 1 
HETATM 12221 O O . HOH I-6 6 . . 69.46 24.681 -42.1 1 35.87 ? O HOH A-6 376 1 
HETATM 12222 O O . HOH I-6 6 . . 82.973 26.578 -24.216 0.69 18.43 ? O HOH A-6 377 1 
HETATM 12223 O O . HOH I-6 6 . . 69.94 26.847 -45.772 1 37.4 ? O HOH A-6 378 1 
HETATM 12224 O O . HOH I-6 6 . . 48.493 26.83 -32.441 1 26.41 ? O HOH A-6 379 1 
HETATM 12225 O O A HOH I-6 6 . . 49.633 28.647 -30.893 0.31 14.63 ? O HOH A-6 380 1 
HETATM 12226 O O B HOH I-6 6 . . 50.111 29.218 -32.317 0.69 30.71 ? O HOH A-6 380 1 
HETATM 12227 O O . HOH I-6 6 . . 81.345 37.315 -29.134 1 26.99 ? O HOH A-6 381 1 
HETATM 12228 O O . HOH I-6 6 . . 72.604 23.576 -37.679 1 34.53 ? O HOH A-6 382 1 
HETATM 12229 O O . HOH I-6 6 . . 79.921 43.576 -40.959 0.44 16.74 ? O HOH A-6 383 1 
HETATM 12230 O O . HOH I-6 6 . . 73.051 22.605 -23.22 0.37 21.51 ? O HOH A-6 384 1 
HETATM 12231 O O . HOH I-6 6 . . 58.505 32.339 -16.238 1 37.07 ? O HOH A-6 385 1 
HETATM 12232 O O A HOH I-6 6 . . 70.212 26.178 -30.748 0.27 12.36 ? O HOH A-6 386 1 
HETATM 12233 O O B HOH I-6 6 . . 70.155 27.833 -29.635 0.73 9.75 ? O HOH A-6 386 1 
HETATM 12234 O O . HOH I-6 6 . . 78.215 44.815 -39.366 0.74 22.04 ? O HOH A-6 387 1 
HETATM 12235 O O . HOH I-6 6 . . 75.856 16.629 -24.747 0.25 15.96 ? O HOH A-6 388 1 
HETATM 12236 O O . HOH I-6 6 . . 76.869 55.233 -34.156 1 36.56 ? O HOH A-6 389 1 
HETATM 12237 O O . HOH I-6 6 . . 81.498 37.312 -21.437 1 39.59 ? O HOH A-6 390 1 
HETATM 12238 O O . HOH I-6 6 . . 49.021 32.115 -35.01 1 31.43 ? O HOH A-6 391 1 
HETATM 12239 O O A HOH I-6 6 . . 53.234 28.338 -40.612 0.71 18.36 ? O HOH A-6 392 1 
HETATM 12240 O O B HOH I-6 6 . . 51.697 28.915 -39.549 0.29 19.15 ? O HOH A-6 392 1 
HETATM 12241 O O . HOH I-6 6 . . 68.329 52.561 -44.391 0.4 17.81 ? O HOH A-6 393 1 
HETATM 12242 O O . HOH I-6 6 . . 73.929 56.443 -30.888 0.72 21.31 ? O HOH A-6 394 1 
HETATM 12243 O O . HOH I-6 6 . . 79.054 18.806 -28.628 1 37.27 ? O HOH A-6 395 1 
HETATM 12244 O O . HOH I-6 6 . . 63.844 53.277 -16.426 0.5 14.5 ? O HOH A-6 396 1 
HETATM 12245 O O . HOH I-6 6 . . 70.909 56.823 -27.443 0.61 16.32 ? O HOH A-6 397 1 
HETATM 12246 O O . HOH I-6 6 . . 54.198 24.844 -23.338 1 23.09 ? O HOH A-6 398 1 
HETATM 12247 O O . HOH I-6 6 . . 75.943 38.535 -17.866 1 19.26 ? O HOH A-6 399 1 
HETATM 12248 O O . HOH I-6 6 . . 77.35 36.777 -19.508 1 30.23 ? O HOH A-6 400 1 
HETATM 12249 O O . HOH I-6 6 . . 77.819 39.635 -19.516 1 38.51 ? O HOH A-6 401 1 
HETATM 12250 O O . HOH I-6 6 . . 51.514 24.796 -25.19 1 25.38 ? O HOH A-6 402 1 
HETATM 12251 O O . HOH I-6 6 . . 52.165 26.271 -23.357 1 29.5 ? O HOH A-6 403 1 
HETATM 12252 O O . HOH I-6 6 . . 61.948 41.154 -50.399 1 17.72 ? O HOH A-6 404 1 
HETATM 12253 O O . HOH I-6 6 . . 63.146 55.189 -19.927 1 35.03 ? O HOH A-6 405 1 
HETATM 12254 O O . HOH I-6 6 . . 49.325 29.566 -35.098 0.64 26.87 ? O HOH A-6 406 1 
HETATM 12255 O O . HOH I-6 6 . . 51.515 31.313 -43.056 1 37.16 ? O HOH A-6 407 1 
HETATM 12256 O O A HOH I-6 6 . . 72.402 23.986 -30.84 0.71 11.14 ? O HOH A-6 408 1 
HETATM 12257 O O B HOH I-6 6 . . 71.871 22.59 -30.836 0.29 12.66 ? O HOH A-6 408 1 
HETATM 12258 O O . HOH I-6 6 . . 68.113 19.431 -27.817 1 35.51 ? O HOH A-6 409 1 
HETATM 12259 O O . HOH I-6 6 . . 69.512 21.431 -26.807 1 33.82 ? O HOH A-6 410 1 
HETATM 12260 O O . HOH I-6 6 . . 66.709 18.548 -22.027 1 35.54 ? O HOH A-6 411 1 
HETATM 12261 O O . HOH I-6 6 . . 58.885 53.286 -32.621 0.94 14.43 ? O HOH A-6 412 1 
HETATM 12262 O O . HOH I-6 6 . . 58.759 44.603 -14.488 0.59 26.93 ? O HOH A-6 413 1 
HETATM 12263 O O A HOH I-6 6 . . 58.047 42.277 -15.569 0.58 19.84 ? O HOH A-6 414 1 
HETATM 12264 O O B HOH I-6 6 . . 58.242 43.597 -16.431 0.42 28.06 ? O HOH A-6 414 1 
HETATM 12265 O O . HOH I-6 6 . . 62.274 43.635 -18.99 0.54 11.82 ? O HOH A-6 415 1 
HETATM 12266 O O . HOH I-6 6 . . 60.943 41.242 -19.223 0.63 17.78 ? O HOH A-6 416 1 
HETATM 12267 O O . HOH I-6 6 . . 56.93 44.672 -15.17 0.59 29.2 ? O HOH A-6 417 1 
HETATM 12268 O O . HOH I-6 6 . . 80.238 25.021 -35.371 1 17.88 ? O HOH A-6 418 1 
HETATM 12269 O O . HOH I-6 6 . . 81.573 24.409 -29.647 1 26.43 ? O HOH A-6 419 1 
HETATM 12270 O O . HOH I-6 6 . . 63.162 37.518 -53.699 1 34.76 ? O HOH A-6 420 1 
HETATM 12271 O O . HOH I-6 6 . . 70.039 23.951 -26.563 0.43 28.42 ? O HOH A-6 421 1 
HETATM 12272 O O . HOH I-6 6 . . 68.541 26.568 -28.186 0.48 28.07 ? O HOH A-6 422 1 
HETATM 12273 O O . HOH I-6 6 . . 65.724 53.6 -43.647 0.38 12.14 ? O HOH A-6 423 1 
HETATM 12274 O O . HOH I-6 6 . . 77.899 48.461 -38.118 0.7 26.46 ? O HOH A-6 424 1 
HETATM 12275 O O . HOH I-6 6 . . 68.644 57.025 -26.937 0.57 22.9 ? O HOH A-6 425 1 
HETATM 12276 O O . HOH I-6 6 . . 75.005 33.489 -46.619 0.58 23.64 ? O HOH A-6 426 1 
HETATM 12277 O O . HOH I-6 6 . . 61.812 42.853 -49.283 0.65 24.06 ? O HOH A-6 427 1 
HETATM 12278 O O . HOH I-6 6 . . 57.753 55.484 -28.056 0.56 20.99 ? O HOH A-6 428 1 
HETATM 12279 O O . HOH I-6 6 . . 52.065 30.588 -40.788 0.76 28.29 ? O HOH A-6 429 1 
HETATM 12280 O O . HOH I-6 6 . . 56.147 53.17 -29.051 0.91 17.1 ? O HOH A-6 430 1 
HETATM 12281 O O . HOH I-6 6 . . 76.147 37.709 -47.94 0.91 19.1 ? O HOH A-6 431 1 
HETATM 12282 O O . HOH I-6 6 . . 81.76 26.513 -20.711 0.37 25.02 ? O HOH A-6 432 1 
HETATM 12283 O O . HOH I-6 6 . . 76.288 46.612 -36.619 0.72 10.88 ? O HOH A-6 433 1 
HETATM 12284 O O . HOH I-6 6 . . 49.071 50.915 -28.84 0.46 18.11 ? O HOH A-6 434 1 
HETATM 12285 O O . HOH I-6 6 . . 62.56 49.951 -15.953 0.64 14.39 ? O HOH A-6 435 1 
HETATM 12286 O O . HOH I-6 6 . . 63.748 54.751 -42.134 0.67 21.5 ? O HOH A-6 436 1 
HETATM 12287 O O . HOH I-6 6 . . 72.952 56.809 -27.996 0.23 15.71 ? O HOH A-6 437 1 
HETATM 12288 O O . HOH I-6 6 . . 84.222 29.175 -24.039 0.3 18.57 ? O HOH A-6 438 1 
HETATM 12289 O O . HOH I-6 6 . . 59.956 41.241 -50.705 0.6 21.01 ? O HOH A-6 439 1 
HETATM 12290 O O . HOH I-6 6 . . 56.968 58.516 -24.545 0.43 25 ? O HOH A-6 440 1 
HETATM 12291 O O . HOH I-6 6 . . 79.445 27.524 -20.963 0.67 16 ? O HOH A-6 441 1 
HETATM 12292 O O . HOH I-6 6 . . 65.492 55.341 -19.052 0.55 25.76 ? O HOH A-6 442 1 
HETATM 12293 O O . HOH I-6 6 . . 72.107 51.828 -17.966 0.43 22.62 ? O HOH A-6 443 1 
HETATM 12294 O O . HOH I-6 6 . . 78.557 26.554 -23.877 0.68 17.69 ? O HOH A-6 444 1 
HETATM 12295 O O . HOH I-6 6 . . 60.495 20.093 -42.961 0.52 20.06 ? O HOH A-6 445 1 
HETATM 12296 O O . HOH I-6 6 . . 66.02 57.266 -35.318 0.77 21.15 ? O HOH A-6 446 1 
HETATM 12297 O O . HOH I-6 6 . . 63.232 24.518 -38.408 0.43 19.16 ? O HOH A-6 447 1 
HETATM 12298 O O . HOH I-6 6 . . 55.294 26.741 -21.734 0.53 23.29 ? O HOH A-6 448 1 
HETATM 12299 O O . HOH I-6 6 . . 79.266 35.342 -16.315 0.53 22.06 ? O HOH A-6 449 1 
HETATM 12300 O O . HOH I-6 6 . . 77.484 46.522 -41.381 0.67 27.89 ? O HOH A-6 450 1 
HETATM 12301 O O . HOH I-6 6 . . 82.232 40.017 -35.215 0.75 32.43 ? O HOH A-6 451 1 
HETATM 12302 O O . HOH I-6 6 . . 70.965 52.447 -39.645 0.62 27.49 ? O HOH A-6 452 1 
HETATM 12303 O O . HOH I-6 6 . . 52.585 47.209 -39.851 0.63 27.74 ? O HOH A-6 453 1 
HETATM 12304 O O . HOH I-6 6 . . 70.603 33.737 -36.595 1 5.62 ? O HOH A-6 454 1 
HETATM 12305 O O . HOH I-6 6 . . 69.422 26.295 -33.116 0.98 10.32 ? O HOH A-6 455 1 
HETATM 12306 O O . HOH I-6 6 . . 56.559 51.168 -26.868 0.9 8.62 ? O HOH A-6 456 1 
HETATM 12307 O O . HOH I-6 6 . . 71.271 27.539 -35.071 1 10.54 ? O HOH A-6 457 1 
HETATM 12308 O O . HOH I-6 6 . . 68.98 28.854 -36.291 1 12.65 ? O HOH A-6 458 1 
HETATM 12309 O O . HOH I-6 6 . . 55.148 54.606 -20.302 0.86 9.36 ? O HOH A-6 459 1 
HETATM 12310 O O . HOH I-6 6 . . 56.471 25.784 -24.903 1 12.94 ? O HOH A-6 460 1 
HETATM 12311 O O . HOH I-6 6 . . 76.503 55.399 -31.862 0.84 31.79 ? O HOH A-6 461 1 
HETATM 12312 O O . HOH I-6 6 . . 68.926 53.839 -42.158 0.96 29.02 ? O HOH A-6 462 1 
HETATM 12313 O O . HOH I-6 6 . . 71.127 58.92 -27.105 0.4 21.77 ? O HOH A-6 463 1 
HETATM 12314 O O . HOH I-6 6 . . 51.32 36.3 -18.987 0.64 23.88 ? O HOH A-6 464 1 
HETATM 12315 O O . HOH I-6 6 . . 65.54 32.771 -34.24 1 5.52 ? O HOH A-6 465 1 
HETATM 12316 O O . HOH I-6 6 . . 69.167 16.591 -27.936 0.35 13.23 ? O HOH A-6 466 1 
HETATM 12317 O O . HOH I-6 6 . . 55.413 52.685 -35.894 0.89 26.22 ? O HOH A-6 467 1 
HETATM 12318 O O . HOH I-6 6 . . 69.405 51.279 -16.9 0.44 18.68 ? O HOH A-6 468 1 
HETATM 12319 O O . HOH I-6 6 . . 67.265 46.039 -52.989 0.7 33.22 ? O HOH A-6 469 1 
HETATM 12320 O O . HOH I-6 6 . . 69.901 25.958 -38.625 0.4 21.51 ? O HOH A-6 470 1 
HETATM 12321 O O . HOH I-6 6 . . 77.85 34.445 -44.238 0.44 20.98 ? O HOH A-6 471 1 
HETATM 12322 O O . HOH I-6 6 . . 82.647 34.039 -36.199 0.43 14.8 ? O HOH A-6 472 1 
HETATM 12323 O O . HOH I-6 6 . . 70.917 44.248 -54.131 0.43 18.87 ? O HOH A-6 473 1 
HETATM 12324 O O . HOH I-6 6 . . 74.102 55.059 -27.129 0.36 18.61 ? O HOH A-6 474 1 
HETATM 12325 O O . HOH I-6 6 . . 68.869 56.202 -21.181 0.54 23.92 ? O HOH A-6 475 1 
HETATM 12326 O O . HOH I-6 6 . . 75.65 54.053 -26.453 0.55 30.96 ? O HOH A-6 476 1 
HETATM 12327 O O . HOH I-6 6 . . 83.88 36.557 -29.411 0.39 26.87 ? O HOH A-6 477 1 
HETATM 12328 O O . HOH I-6 6 . . 75.174 40.236 -48.132 0.54 17.49 ? O HOH A-6 478 1 
HETATM 12329 O O . HOH I-6 6 . . 71.233 26.894 -43.179 0.53 26.31 ? O HOH A-6 479 1 
HETATM 12330 O O . HOH I-6 6 . . 71.993 25.154 -38.913 0.67 30.22 ? O HOH A-6 480 1 
#
_coordinate_server_stats.molecule_cached    no 
_coordinate_server_stats.io_time_ms         26 
_coordinate_server_stats.parse_time_ms      44 
_coordinate_server_stats.query_time_ms      106 
_coordinate_server_stats.format_time_ms     85 
#