data_8YDW
# 
_entry.id   8YDW 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.399 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   8YDW         pdb_00008ydw 10.2210/pdb8ydw/pdb 
WWPDB D_1300045368 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-01-15 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        8YDW 
_pdbx_database_status.recvd_initial_deposition_date   2024-02-21 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBJ 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 3 
_pdbx_contact_author.email              yoshi.cesp@tmd.ac.jp 
_pdbx_contact_author.name_first         Yoshinori 
_pdbx_contact_author.name_last          Fujiyoshi 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-8070-1493 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Nakamura, S.'  1 0000-0003-2253-6976 
'Numoto, N.'    2 0000-0001-6113-9792 
'Fujiyoshi, Y.' 3 0000-0002-8070-1493 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     'Development of a short-peptide inhibiting any SARS-CoV-2 variants based on structural biology' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Nakamura, S.'  1  0000-0003-2253-6976 
primary 'Tanimura, Y.'  2  ?                   
primary 'Nomura, R.'    3  ?                   
primary 'Suzuki, H.'    4  ?                   
primary 'Nishikawa, K.' 5  ?                   
primary 'Kamegawa, A.'  6  ?                   
primary 'Numoto, N.'    7  ?                   
primary 'Tanaka, A.'    8  ?                   
primary 'Kawabata, S.'  9  ?                   
primary 'Sakaguchi, S.' 10 ?                   
primary 'Emi, A.'       11 ?                   
primary 'Suzuki, Y.'    12 ?                   
primary 'Fujiyoshi, Y.' 13 ?                   
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     syn 'SARS-CoV-2 inhibiting peptide CeSPIACE' 4721.475  1  ? ? ? ? 
2 polymer     man 'Spike protein S1'                       26204.250 1  ? ? ? ? 
3 non-polymer syn GLYCEROL                                 92.094    1  ? ? ? ? 
4 non-polymer syn 'SODIUM ION'                             22.990    1  ? ? ? ? 
5 water       nat water                                    18.015    73 ? ? ? ? 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)' no no DKLWILQKIYEIMVRLDEEGHGEASLMVSDLIYEFMKRD DKLWILQKIYEIMVRLDEEGHGEASLMVSDLIYEFMKRD A ? 
2 'polypeptide(L)' no no 
;TNLCPFHEVFNATTFASVYAWNRKRISNCVADYSVIYNFAPFSAFKCYGVSPTKLNDLCFTNVYADSFVIRGNEVSQIAP
GQTGNIADYNYKLPDDFTGCVIAWNSNKLDSKPSGNYNYLYRLFRKSKLKPFERDISTEIYQAGNKPCNGVAGPNCYSPL
RSYGFRPTYGVGHQPYRVVVLSFELLHAPATVCGSNSENLYFQGSHHHHHHHHHHGLNDIFEAQKIEWHE
;
;TNLCPFHEVFNATTFASVYAWNRKRISNCVADYSVIYNFAPFSAFKCYGVSPTKLNDLCFTNVYADSFVIRGNEVSQIAP
GQTGNIADYNYKLPDDFTGCVIAWNSNKLDSKPSGNYNYLYRLFRKSKLKPFERDISTEIYQAGNKPCNGVAGPNCYSPL
RSYGFRPTYGVGHQPYRVVVLSFELLHAPATVCGSNSENLYFQGSHHHHHHHHHHGLNDIFEAQKIEWHE
;
B ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 GLYCEROL     GOL 
4 'SODIUM ION' NA  
5 water        HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   ASP n 
1 2   LYS n 
1 3   LEU n 
1 4   TRP n 
1 5   ILE n 
1 6   LEU n 
1 7   GLN n 
1 8   LYS n 
1 9   ILE n 
1 10  TYR n 
1 11  GLU n 
1 12  ILE n 
1 13  MET n 
1 14  VAL n 
1 15  ARG n 
1 16  LEU n 
1 17  ASP n 
1 18  GLU n 
1 19  GLU n 
1 20  GLY n 
1 21  HIS n 
1 22  GLY n 
1 23  GLU n 
1 24  ALA n 
1 25  SER n 
1 26  LEU n 
1 27  MET n 
1 28  VAL n 
1 29  SER n 
1 30  ASP n 
1 31  LEU n 
1 32  ILE n 
1 33  TYR n 
1 34  GLU n 
1 35  PHE n 
1 36  MET n 
1 37  LYS n 
1 38  ARG n 
1 39  ASP n 
2 1   THR n 
2 2   ASN n 
2 3   LEU n 
2 4   CYS n 
2 5   PRO n 
2 6   PHE n 
2 7   HIS n 
2 8   GLU n 
2 9   VAL n 
2 10  PHE n 
2 11  ASN n 
2 12  ALA n 
2 13  THR n 
2 14  THR n 
2 15  PHE n 
2 16  ALA n 
2 17  SER n 
2 18  VAL n 
2 19  TYR n 
2 20  ALA n 
2 21  TRP n 
2 22  ASN n 
2 23  ARG n 
2 24  LYS n 
2 25  ARG n 
2 26  ILE n 
2 27  SER n 
2 28  ASN n 
2 29  CYS n 
2 30  VAL n 
2 31  ALA n 
2 32  ASP n 
2 33  TYR n 
2 34  SER n 
2 35  VAL n 
2 36  ILE n 
2 37  TYR n 
2 38  ASN n 
2 39  PHE n 
2 40  ALA n 
2 41  PRO n 
2 42  PHE n 
2 43  SER n 
2 44  ALA n 
2 45  PHE n 
2 46  LYS n 
2 47  CYS n 
2 48  TYR n 
2 49  GLY n 
2 50  VAL n 
2 51  SER n 
2 52  PRO n 
2 53  THR n 
2 54  LYS n 
2 55  LEU n 
2 56  ASN n 
2 57  ASP n 
2 58  LEU n 
2 59  CYS n 
2 60  PHE n 
2 61  THR n 
2 62  ASN n 
2 63  VAL n 
2 64  TYR n 
2 65  ALA n 
2 66  ASP n 
2 67  SER n 
2 68  PHE n 
2 69  VAL n 
2 70  ILE n 
2 71  ARG n 
2 72  GLY n 
2 73  ASN n 
2 74  GLU n 
2 75  VAL n 
2 76  SER n 
2 77  GLN n 
2 78  ILE n 
2 79  ALA n 
2 80  PRO n 
2 81  GLY n 
2 82  GLN n 
2 83  THR n 
2 84  GLY n 
2 85  ASN n 
2 86  ILE n 
2 87  ALA n 
2 88  ASP n 
2 89  TYR n 
2 90  ASN n 
2 91  TYR n 
2 92  LYS n 
2 93  LEU n 
2 94  PRO n 
2 95  ASP n 
2 96  ASP n 
2 97  PHE n 
2 98  THR n 
2 99  GLY n 
2 100 CYS n 
2 101 VAL n 
2 102 ILE n 
2 103 ALA n 
2 104 TRP n 
2 105 ASN n 
2 106 SER n 
2 107 ASN n 
2 108 LYS n 
2 109 LEU n 
2 110 ASP n 
2 111 SER n 
2 112 LYS n 
2 113 PRO n 
2 114 SER n 
2 115 GLY n 
2 116 ASN n 
2 117 TYR n 
2 118 ASN n 
2 119 TYR n 
2 120 LEU n 
2 121 TYR n 
2 122 ARG n 
2 123 LEU n 
2 124 PHE n 
2 125 ARG n 
2 126 LYS n 
2 127 SER n 
2 128 LYS n 
2 129 LEU n 
2 130 LYS n 
2 131 PRO n 
2 132 PHE n 
2 133 GLU n 
2 134 ARG n 
2 135 ASP n 
2 136 ILE n 
2 137 SER n 
2 138 THR n 
2 139 GLU n 
2 140 ILE n 
2 141 TYR n 
2 142 GLN n 
2 143 ALA n 
2 144 GLY n 
2 145 ASN n 
2 146 LYS n 
2 147 PRO n 
2 148 CYS n 
2 149 ASN n 
2 150 GLY n 
2 151 VAL n 
2 152 ALA n 
2 153 GLY n 
2 154 PRO n 
2 155 ASN n 
2 156 CYS n 
2 157 TYR n 
2 158 SER n 
2 159 PRO n 
2 160 LEU n 
2 161 ARG n 
2 162 SER n 
2 163 TYR n 
2 164 GLY n 
2 165 PHE n 
2 166 ARG n 
2 167 PRO n 
2 168 THR n 
2 169 TYR n 
2 170 GLY n 
2 171 VAL n 
2 172 GLY n 
2 173 HIS n 
2 174 GLN n 
2 175 PRO n 
2 176 TYR n 
2 177 ARG n 
2 178 VAL n 
2 179 VAL n 
2 180 VAL n 
2 181 LEU n 
2 182 SER n 
2 183 PHE n 
2 184 GLU n 
2 185 LEU n 
2 186 LEU n 
2 187 HIS n 
2 188 ALA n 
2 189 PRO n 
2 190 ALA n 
2 191 THR n 
2 192 VAL n 
2 193 CYS n 
2 194 GLY n 
2 195 SER n 
2 196 ASN n 
2 197 SER n 
2 198 GLU n 
2 199 ASN n 
2 200 LEU n 
2 201 TYR n 
2 202 PHE n 
2 203 GLN n 
2 204 GLY n 
2 205 SER n 
2 206 HIS n 
2 207 HIS n 
2 208 HIS n 
2 209 HIS n 
2 210 HIS n 
2 211 HIS n 
2 212 HIS n 
2 213 HIS n 
2 214 HIS n 
2 215 HIS n 
2 216 GLY n 
2 217 LEU n 
2 218 ASN n 
2 219 ASP n 
2 220 ILE n 
2 221 PHE n 
2 222 GLU n 
2 223 ALA n 
2 224 GLN n 
2 225 LYS n 
2 226 ILE n 
2 227 GLU n 
2 228 TRP n 
2 229 HIS n 
2 230 GLU n 
# 
_entity_src_gen.entity_id                          2 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   230 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'S, 2' 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Severe acute respiratory syndrome coronavirus 2' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     2697049 
_entity_src_gen.pdbx_gene_src_variant              ? 
_entity_src_gen.pdbx_gene_src_cell_line            ? 
_entity_src_gen.pdbx_gene_src_atcc                 ? 
_entity_src_gen.pdbx_gene_src_organ                ? 
_entity_src_gen.pdbx_gene_src_organelle            ? 
_entity_src_gen.pdbx_gene_src_cell                 ? 
_entity_src_gen.pdbx_gene_src_cellular_location    ? 
_entity_src_gen.host_org_common_name               ? 
_entity_src_gen.pdbx_host_org_scientific_name      'Homo sapiens' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     9606 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            Expi293F 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
_pdbx_entity_src_syn.entity_id              1 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       1 
_pdbx_entity_src_syn.pdbx_end_seq_num       39 
_pdbx_entity_src_syn.organism_scientific    'synthetic construct' 
_pdbx_entity_src_syn.organism_common_name   ? 
_pdbx_entity_src_syn.ncbi_taxonomy_id       32630 
_pdbx_entity_src_syn.details                ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ?                               'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ?                               'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ?                               'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ?                               'C4 H7 N O4'     133.103 
CYS 'L-peptide linking' y CYSTEINE        ?                               'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE       ?                               'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ?                               'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE         ?                               'C2 H5 N O2'     75.067  
GOL non-polymer         . GLYCEROL        'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3'       92.094  
HIS 'L-peptide linking' y HISTIDINE       ?                               'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER           ?                               'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE      ?                               'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE         ?                               'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE          ?                               'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE      ?                               'C5 H11 N O2 S'  149.211 
NA  non-polymer         . 'SODIUM ION'    ?                               'Na 1'           22.990  
PHE 'L-peptide linking' y PHENYLALANINE   ?                               'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ?                               'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ?                               'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE       ?                               'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN      ?                               'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE        ?                               'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE          ?                               'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   ASP 1   1   1   ASP ASP A . n 
A 1 2   LYS 2   2   2   LYS LYS A . n 
A 1 3   LEU 3   3   3   LEU LEU A . n 
A 1 4   TRP 4   4   4   TRP TRP A . n 
A 1 5   ILE 5   5   5   ILE ILE A . n 
A 1 6   LEU 6   6   6   LEU LEU A . n 
A 1 7   GLN 7   7   7   GLN GLN A . n 
A 1 8   LYS 8   8   8   LYS LYS A . n 
A 1 9   ILE 9   9   9   ILE ILE A . n 
A 1 10  TYR 10  10  10  TYR TYR A . n 
A 1 11  GLU 11  11  11  GLU GLU A . n 
A 1 12  ILE 12  12  12  ILE ILE A . n 
A 1 13  MET 13  13  13  MET MET A . n 
A 1 14  VAL 14  14  14  VAL VAL A . n 
A 1 15  ARG 15  15  15  ARG ARG A . n 
A 1 16  LEU 16  16  16  LEU LEU A . n 
A 1 17  ASP 17  17  17  ASP ASP A . n 
A 1 18  GLU 18  18  18  GLU GLU A . n 
A 1 19  GLU 19  19  19  GLU GLU A . n 
A 1 20  GLY 20  20  20  GLY GLY A . n 
A 1 21  HIS 21  21  21  HIS HIS A . n 
A 1 22  GLY 22  22  22  GLY GLY A . n 
A 1 23  GLU 23  23  23  GLU GLU A . n 
A 1 24  ALA 24  24  24  ALA ALA A . n 
A 1 25  SER 25  25  25  SER SER A . n 
A 1 26  LEU 26  26  26  LEU LEU A . n 
A 1 27  MET 27  27  27  MET MET A . n 
A 1 28  VAL 28  28  28  VAL VAL A . n 
A 1 29  SER 29  29  29  SER SER A . n 
A 1 30  ASP 30  30  30  ASP ASP A . n 
A 1 31  LEU 31  31  31  LEU LEU A . n 
A 1 32  ILE 32  32  32  ILE ILE A . n 
A 1 33  TYR 33  33  33  TYR TYR A . n 
A 1 34  GLU 34  34  34  GLU GLU A . n 
A 1 35  PHE 35  35  35  PHE PHE A . n 
A 1 36  MET 36  36  36  MET MET A . n 
A 1 37  LYS 37  37  37  LYS LYS A . n 
A 1 38  ARG 38  38  38  ARG ARG A . n 
A 1 39  ASP 39  39  39  ASP ASP A . n 
B 2 1   THR 1   333 ?   ?   ?   B . n 
B 2 2   ASN 2   334 334 ASN ASN B . n 
B 2 3   LEU 3   335 335 LEU LEU B . n 
B 2 4   CYS 4   336 336 CYS CYS B . n 
B 2 5   PRO 5   337 337 PRO PRO B . n 
B 2 6   PHE 6   338 338 PHE PHE B . n 
B 2 7   HIS 7   339 339 HIS HIS B . n 
B 2 8   GLU 8   340 340 GLU GLU B . n 
B 2 9   VAL 9   341 341 VAL VAL B . n 
B 2 10  PHE 10  342 342 PHE PHE B . n 
B 2 11  ASN 11  343 343 ASN ASN B . n 
B 2 12  ALA 12  344 344 ALA ALA B . n 
B 2 13  THR 13  345 345 THR THR B . n 
B 2 14  THR 14  346 346 THR THR B . n 
B 2 15  PHE 15  347 347 PHE PHE B . n 
B 2 16  ALA 16  348 348 ALA ALA B . n 
B 2 17  SER 17  349 349 SER SER B . n 
B 2 18  VAL 18  350 350 VAL VAL B . n 
B 2 19  TYR 19  351 351 TYR TYR B . n 
B 2 20  ALA 20  352 352 ALA ALA B . n 
B 2 21  TRP 21  353 353 TRP TRP B . n 
B 2 22  ASN 22  354 354 ASN ASN B . n 
B 2 23  ARG 23  355 355 ARG ARG B . n 
B 2 24  LYS 24  356 356 LYS LYS B . n 
B 2 25  ARG 25  357 357 ARG ARG B . n 
B 2 26  ILE 26  358 358 ILE ILE B . n 
B 2 27  SER 27  359 359 SER SER B . n 
B 2 28  ASN 28  360 360 ASN ASN B . n 
B 2 29  CYS 29  361 361 CYS CYS B . n 
B 2 30  VAL 30  362 362 VAL VAL B . n 
B 2 31  ALA 31  363 363 ALA ALA B . n 
B 2 32  ASP 32  364 364 ASP ASP B . n 
B 2 33  TYR 33  365 365 TYR TYR B . n 
B 2 34  SER 34  366 366 SER SER B . n 
B 2 35  VAL 35  367 367 VAL VAL B . n 
B 2 36  ILE 36  368 368 ILE ILE B . n 
B 2 37  TYR 37  369 369 TYR TYR B . n 
B 2 38  ASN 38  370 370 ASN ASN B . n 
B 2 39  PHE 39  371 371 PHE PHE B . n 
B 2 40  ALA 40  372 372 ALA ALA B . n 
B 2 41  PRO 41  373 373 PRO PRO B . n 
B 2 42  PHE 42  374 374 PHE PHE B . n 
B 2 43  SER 43  375 375 SER SER B . n 
B 2 44  ALA 44  376 376 ALA ALA B . n 
B 2 45  PHE 45  377 377 PHE PHE B . n 
B 2 46  LYS 46  378 378 LYS LYS B . n 
B 2 47  CYS 47  379 379 CYS CYS B . n 
B 2 48  TYR 48  380 380 TYR TYR B . n 
B 2 49  GLY 49  381 381 GLY GLY B . n 
B 2 50  VAL 50  382 382 VAL VAL B . n 
B 2 51  SER 51  383 383 SER SER B . n 
B 2 52  PRO 52  384 384 PRO PRO B . n 
B 2 53  THR 53  385 385 THR THR B . n 
B 2 54  LYS 54  386 386 LYS LYS B . n 
B 2 55  LEU 55  387 387 LEU LEU B . n 
B 2 56  ASN 56  388 388 ASN ASN B . n 
B 2 57  ASP 57  389 389 ASP ASP B . n 
B 2 58  LEU 58  390 390 LEU LEU B . n 
B 2 59  CYS 59  391 391 CYS CYS B . n 
B 2 60  PHE 60  392 392 PHE PHE B . n 
B 2 61  THR 61  393 393 THR THR B . n 
B 2 62  ASN 62  394 394 ASN ASN B . n 
B 2 63  VAL 63  395 395 VAL VAL B . n 
B 2 64  TYR 64  396 396 TYR TYR B . n 
B 2 65  ALA 65  397 397 ALA ALA B . n 
B 2 66  ASP 66  398 398 ASP ASP B . n 
B 2 67  SER 67  399 399 SER SER B . n 
B 2 68  PHE 68  400 400 PHE PHE B . n 
B 2 69  VAL 69  401 401 VAL VAL B . n 
B 2 70  ILE 70  402 402 ILE ILE B . n 
B 2 71  ARG 71  403 403 ARG ARG B . n 
B 2 72  GLY 72  404 404 GLY GLY B . n 
B 2 73  ASN 73  405 405 ASN ASN B . n 
B 2 74  GLU 74  406 406 GLU GLU B . n 
B 2 75  VAL 75  407 407 VAL VAL B . n 
B 2 76  SER 76  408 408 SER SER B . n 
B 2 77  GLN 77  409 409 GLN GLN B . n 
B 2 78  ILE 78  410 410 ILE ILE B . n 
B 2 79  ALA 79  411 411 ALA ALA B . n 
B 2 80  PRO 80  412 412 PRO PRO B . n 
B 2 81  GLY 81  413 413 GLY GLY B . n 
B 2 82  GLN 82  414 414 GLN GLN B . n 
B 2 83  THR 83  415 415 THR THR B . n 
B 2 84  GLY 84  416 416 GLY GLY B . n 
B 2 85  ASN 85  417 417 ASN ASN B . n 
B 2 86  ILE 86  418 418 ILE ILE B . n 
B 2 87  ALA 87  419 419 ALA ALA B . n 
B 2 88  ASP 88  420 420 ASP ASP B . n 
B 2 89  TYR 89  421 421 TYR TYR B . n 
B 2 90  ASN 90  422 422 ASN ASN B . n 
B 2 91  TYR 91  423 423 TYR TYR B . n 
B 2 92  LYS 92  424 424 LYS LYS B . n 
B 2 93  LEU 93  425 425 LEU LEU B . n 
B 2 94  PRO 94  426 426 PRO PRO B . n 
B 2 95  ASP 95  427 427 ASP ASP B . n 
B 2 96  ASP 96  428 428 ASP ASP B . n 
B 2 97  PHE 97  429 429 PHE PHE B . n 
B 2 98  THR 98  430 430 THR THR B . n 
B 2 99  GLY 99  431 431 GLY GLY B . n 
B 2 100 CYS 100 432 432 CYS CYS B . n 
B 2 101 VAL 101 433 433 VAL VAL B . n 
B 2 102 ILE 102 434 434 ILE ILE B . n 
B 2 103 ALA 103 435 435 ALA ALA B . n 
B 2 104 TRP 104 436 436 TRP TRP B . n 
B 2 105 ASN 105 437 437 ASN ASN B . n 
B 2 106 SER 106 438 438 SER SER B . n 
B 2 107 ASN 107 439 439 ASN ASN B . n 
B 2 108 LYS 108 440 440 LYS LYS B . n 
B 2 109 LEU 109 441 441 LEU LEU B . n 
B 2 110 ASP 110 442 442 ASP ASP B . n 
B 2 111 SER 111 443 443 SER SER B . n 
B 2 112 LYS 112 444 444 LYS LYS B . n 
B 2 113 PRO 113 445 445 PRO PRO B . n 
B 2 114 SER 114 446 446 SER SER B . n 
B 2 115 GLY 115 447 447 GLY GLY B . n 
B 2 116 ASN 116 448 448 ASN ASN B . n 
B 2 117 TYR 117 449 449 TYR TYR B . n 
B 2 118 ASN 118 450 450 ASN ASN B . n 
B 2 119 TYR 119 451 451 TYR TYR B . n 
B 2 120 LEU 120 452 452 LEU LEU B . n 
B 2 121 TYR 121 453 453 TYR TYR B . n 
B 2 122 ARG 122 454 454 ARG ARG B . n 
B 2 123 LEU 123 455 455 LEU LEU B . n 
B 2 124 PHE 124 456 456 PHE PHE B . n 
B 2 125 ARG 125 457 457 ARG ARG B . n 
B 2 126 LYS 126 458 458 LYS LYS B . n 
B 2 127 SER 127 459 459 SER SER B . n 
B 2 128 LYS 128 460 460 LYS LYS B . n 
B 2 129 LEU 129 461 461 LEU LEU B . n 
B 2 130 LYS 130 462 462 LYS LYS B . n 
B 2 131 PRO 131 463 463 PRO PRO B . n 
B 2 132 PHE 132 464 464 PHE PHE B . n 
B 2 133 GLU 133 465 465 GLU GLU B . n 
B 2 134 ARG 134 466 466 ARG ARG B . n 
B 2 135 ASP 135 467 467 ASP ASP B . n 
B 2 136 ILE 136 468 468 ILE ILE B . n 
B 2 137 SER 137 469 469 SER SER B . n 
B 2 138 THR 138 470 470 THR THR B . n 
B 2 139 GLU 139 471 471 GLU GLU B . n 
B 2 140 ILE 140 472 472 ILE ILE B . n 
B 2 141 TYR 141 473 473 TYR TYR B . n 
B 2 142 GLN 142 474 474 GLN GLN B . n 
B 2 143 ALA 143 475 475 ALA ALA B . n 
B 2 144 GLY 144 476 476 GLY GLY B . n 
B 2 145 ASN 145 477 477 ASN ASN B . n 
B 2 146 LYS 146 478 478 LYS LYS B . n 
B 2 147 PRO 147 479 479 PRO PRO B . n 
B 2 148 CYS 148 480 480 CYS CYS B . n 
B 2 149 ASN 149 481 481 ASN ASN B . n 
B 2 150 GLY 150 482 482 GLY GLY B . n 
B 2 151 VAL 151 483 483 VAL VAL B . n 
B 2 152 ALA 152 484 484 ALA ALA B . n 
B 2 153 GLY 153 485 485 GLY GLY B . n 
B 2 154 PRO 154 486 486 PRO PRO B . n 
B 2 155 ASN 155 487 487 ASN ASN B . n 
B 2 156 CYS 156 488 488 CYS CYS B . n 
B 2 157 TYR 157 489 489 TYR TYR B . n 
B 2 158 SER 158 490 490 SER SER B . n 
B 2 159 PRO 159 491 491 PRO PRO B . n 
B 2 160 LEU 160 492 492 LEU LEU B . n 
B 2 161 ARG 161 493 493 ARG ARG B . n 
B 2 162 SER 162 494 494 SER SER B . n 
B 2 163 TYR 163 495 495 TYR TYR B . n 
B 2 164 GLY 164 496 496 GLY GLY B . n 
B 2 165 PHE 165 497 497 PHE PHE B . n 
B 2 166 ARG 166 498 498 ARG ARG B . n 
B 2 167 PRO 167 499 499 PRO PRO B . n 
B 2 168 THR 168 500 500 THR THR B . n 
B 2 169 TYR 169 501 501 TYR TYR B . n 
B 2 170 GLY 170 502 502 GLY GLY B . n 
B 2 171 VAL 171 503 503 VAL VAL B . n 
B 2 172 GLY 172 504 504 GLY GLY B . n 
B 2 173 HIS 173 505 505 HIS HIS B . n 
B 2 174 GLN 174 506 506 GLN GLN B . n 
B 2 175 PRO 175 507 507 PRO PRO B . n 
B 2 176 TYR 176 508 508 TYR TYR B . n 
B 2 177 ARG 177 509 509 ARG ARG B . n 
B 2 178 VAL 178 510 510 VAL VAL B . n 
B 2 179 VAL 179 511 511 VAL VAL B . n 
B 2 180 VAL 180 512 512 VAL VAL B . n 
B 2 181 LEU 181 513 513 LEU LEU B . n 
B 2 182 SER 182 514 514 SER SER B . n 
B 2 183 PHE 183 515 515 PHE PHE B . n 
B 2 184 GLU 184 516 516 GLU GLU B . n 
B 2 185 LEU 185 517 517 LEU LEU B . n 
B 2 186 LEU 186 518 518 LEU LEU B . n 
B 2 187 HIS 187 519 519 HIS HIS B . n 
B 2 188 ALA 188 520 520 ALA ALA B . n 
B 2 189 PRO 189 521 521 PRO PRO B . n 
B 2 190 ALA 190 522 522 ALA ALA B . n 
B 2 191 THR 191 523 523 THR THR B . n 
B 2 192 VAL 192 524 524 VAL VAL B . n 
B 2 193 CYS 193 525 525 CYS CYS B . n 
B 2 194 GLY 194 526 526 GLY GLY B . n 
B 2 195 SER 195 527 527 SER SER B . n 
B 2 196 ASN 196 528 528 ASN ASN B . n 
B 2 197 SER 197 529 529 SER SER B . n 
B 2 198 GLU 198 530 530 GLU GLU B . n 
B 2 199 ASN 199 531 ?   ?   ?   B . n 
B 2 200 LEU 200 532 ?   ?   ?   B . n 
B 2 201 TYR 201 533 ?   ?   ?   B . n 
B 2 202 PHE 202 534 ?   ?   ?   B . n 
B 2 203 GLN 203 535 ?   ?   ?   B . n 
B 2 204 GLY 204 536 ?   ?   ?   B . n 
B 2 205 SER 205 537 ?   ?   ?   B . n 
B 2 206 HIS 206 538 ?   ?   ?   B . n 
B 2 207 HIS 207 539 ?   ?   ?   B . n 
B 2 208 HIS 208 540 ?   ?   ?   B . n 
B 2 209 HIS 209 541 ?   ?   ?   B . n 
B 2 210 HIS 210 542 ?   ?   ?   B . n 
B 2 211 HIS 211 543 ?   ?   ?   B . n 
B 2 212 HIS 212 544 ?   ?   ?   B . n 
B 2 213 HIS 213 545 ?   ?   ?   B . n 
B 2 214 HIS 214 546 ?   ?   ?   B . n 
B 2 215 HIS 215 547 ?   ?   ?   B . n 
B 2 216 GLY 216 548 ?   ?   ?   B . n 
B 2 217 LEU 217 549 ?   ?   ?   B . n 
B 2 218 ASN 218 550 ?   ?   ?   B . n 
B 2 219 ASP 219 551 ?   ?   ?   B . n 
B 2 220 ILE 220 552 ?   ?   ?   B . n 
B 2 221 PHE 221 553 ?   ?   ?   B . n 
B 2 222 GLU 222 554 ?   ?   ?   B . n 
B 2 223 ALA 223 555 ?   ?   ?   B . n 
B 2 224 GLN 224 556 ?   ?   ?   B . n 
B 2 225 LYS 225 557 ?   ?   ?   B . n 
B 2 226 ILE 226 558 ?   ?   ?   B . n 
B 2 227 GLU 227 559 ?   ?   ?   B . n 
B 2 228 TRP 228 560 ?   ?   ?   B . n 
B 2 229 HIS 229 561 ?   ?   ?   B . n 
B 2 230 GLU 230 562 ?   ?   ?   B . n 
# 
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 
C 3 GOL 1  601 102 GOL GOL B . 
D 4 NA  1  602 1   NA  NA  B . 
E 5 HOH 1  101 15  HOH HOH A . 
E 5 HOH 2  102 100 HOH HOH A . 
E 5 HOH 3  103 62  HOH HOH A . 
E 5 HOH 4  104 5   HOH HOH A . 
E 5 HOH 5  105 43  HOH HOH A . 
E 5 HOH 6  106 27  HOH HOH A . 
E 5 HOH 7  107 199 HOH HOH A . 
E 5 HOH 8  108 35  HOH HOH A . 
E 5 HOH 9  109 39  HOH HOH A . 
E 5 HOH 10 110 41  HOH HOH A . 
E 5 HOH 11 111 200 HOH HOH A . 
F 5 HOH 1  701 31  HOH HOH B . 
F 5 HOH 2  702 170 HOH HOH B . 
F 5 HOH 3  703 12  HOH HOH B . 
F 5 HOH 4  704 104 HOH HOH B . 
F 5 HOH 5  705 36  HOH HOH B . 
F 5 HOH 6  706 29  HOH HOH B . 
F 5 HOH 7  707 92  HOH HOH B . 
F 5 HOH 8  708 11  HOH HOH B . 
F 5 HOH 9  709 3   HOH HOH B . 
F 5 HOH 10 710 83  HOH HOH B . 
F 5 HOH 11 711 16  HOH HOH B . 
F 5 HOH 12 712 26  HOH HOH B . 
F 5 HOH 13 713 9   HOH HOH B . 
F 5 HOH 14 714 21  HOH HOH B . 
F 5 HOH 15 715 8   HOH HOH B . 
F 5 HOH 16 716 32  HOH HOH B . 
F 5 HOH 17 717 105 HOH HOH B . 
F 5 HOH 18 718 13  HOH HOH B . 
F 5 HOH 19 719 23  HOH HOH B . 
F 5 HOH 20 720 17  HOH HOH B . 
F 5 HOH 21 721 6   HOH HOH B . 
F 5 HOH 22 722 10  HOH HOH B . 
F 5 HOH 23 723 202 HOH HOH B . 
F 5 HOH 24 724 24  HOH HOH B . 
F 5 HOH 25 725 2   HOH HOH B . 
F 5 HOH 26 726 77  HOH HOH B . 
F 5 HOH 27 727 88  HOH HOH B . 
F 5 HOH 28 728 4   HOH HOH B . 
F 5 HOH 29 729 166 HOH HOH B . 
F 5 HOH 30 730 7   HOH HOH B . 
F 5 HOH 31 731 20  HOH HOH B . 
F 5 HOH 32 732 73  HOH HOH B . 
F 5 HOH 33 733 22  HOH HOH B . 
F 5 HOH 34 734 130 HOH HOH B . 
F 5 HOH 35 735 19  HOH HOH B . 
F 5 HOH 36 736 81  HOH HOH B . 
F 5 HOH 37 737 95  HOH HOH B . 
F 5 HOH 38 738 80  HOH HOH B . 
F 5 HOH 39 739 55  HOH HOH B . 
F 5 HOH 40 740 190 HOH HOH B . 
F 5 HOH 41 741 67  HOH HOH B . 
F 5 HOH 42 742 94  HOH HOH B . 
F 5 HOH 43 743 33  HOH HOH B . 
F 5 HOH 44 744 54  HOH HOH B . 
F 5 HOH 45 745 169 HOH HOH B . 
F 5 HOH 46 746 99  HOH HOH B . 
F 5 HOH 47 747 203 HOH HOH B . 
F 5 HOH 48 748 70  HOH HOH B . 
F 5 HOH 49 749 56  HOH HOH B . 
F 5 HOH 50 750 52  HOH HOH B . 
F 5 HOH 51 751 51  HOH HOH B . 
F 5 HOH 52 752 204 HOH HOH B . 
F 5 HOH 53 753 48  HOH HOH B . 
F 5 HOH 54 754 173 HOH HOH B . 
F 5 HOH 55 755 188 HOH HOH B . 
F 5 HOH 56 756 101 HOH HOH B . 
F 5 HOH 57 757 103 HOH HOH B . 
F 5 HOH 58 758 205 HOH HOH B . 
F 5 HOH 59 759 86  HOH HOH B . 
F 5 HOH 60 760 68  HOH HOH B . 
F 5 HOH 61 761 82  HOH HOH B . 
F 5 HOH 62 762 129 HOH HOH B . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0411 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .        2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? .        4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  120.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     8YDW 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     74.760 
_cell.length_a_esd                 ? 
_cell.length_b                     74.760 
_cell.length_b_esd                 ? 
_cell.length_c                     100.070 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        6 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         8YDW 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                152 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 31 2 1' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   8YDW 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.61 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          52.88 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.1 M CHES (pH 9.5), 20% PEG 8000' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS 6M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-07-14 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'SPRING-8 BEAMLINE BL45XU' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   BL45XU 
_diffrn_source.pdbx_synchrotron_site       SPring-8 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       8YDW 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.72 
_reflns.d_resolution_low                               50 
_reflns.details                                        ? 
_reflns.limit_h_max                                    ? 
_reflns.limit_h_min                                    ? 
_reflns.limit_k_max                                    ? 
_reflns.limit_k_min                                    ? 
_reflns.limit_l_max                                    ? 
_reflns.limit_l_min                                    ? 
_reflns.number_all                                     ? 
_reflns.number_obs                                     34940 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           99.9 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                13.0 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          16.09 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                ? 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.999 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.72 
_reflns_shell.d_res_low                                     1.82 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             5379 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               ? 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.702 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            2.838 
_refine.aniso_B[1][2]                            1.419 
_refine.aniso_B[1][3]                            0.000 
_refine.aniso_B[2][2]                            2.838 
_refine.aniso_B[2][3]                            -0.000 
_refine.aniso_B[3][3]                            -9.206 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               65.885 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.960 
_refine.correlation_coeff_Fo_to_Fc_free          0.943 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 8YDW 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            2.000 
_refine.ls_d_res_low                             39.622 
_refine.ls_extinction_coef                       ? 
_refine.ls_extinction_coef_esd                   ? 
_refine.ls_extinction_expression                 ? 
_refine.ls_extinction_method                     ? 
_refine.ls_goodness_of_fit_all                   ? 
_refine.ls_goodness_of_fit_all_esd               ? 
_refine.ls_goodness_of_fit_obs                   ? 
_refine.ls_goodness_of_fit_obs_esd               ? 
_refine.ls_hydrogen_treatment                    ? 
_refine.ls_matrix_type                           ? 
_refine.ls_number_constraints                    ? 
_refine.ls_number_parameters                     ? 
_refine.ls_number_reflns_all                     ? 
_refine.ls_number_reflns_obs                     22387 
_refine.ls_number_reflns_R_free                  1111 
_refine.ls_number_reflns_R_work                  21276 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.893 
_refine.ls_percent_reflns_R_free                 4.963 
_refine.ls_R_factor_all                          0.225 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.2538 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2230 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'MASK BULK SOLVENT' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.174 
_refine.pdbx_overall_ESU_R_Free                  0.157 
_refine.pdbx_solvent_vdw_probe_radii             1.200 
_refine.pdbx_solvent_ion_probe_radii             0.800 
_refine.pdbx_solvent_shrinkage_radii             0.800 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            ? 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        1889 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         7 
_refine_hist.number_atoms_solvent             73 
_refine_hist.number_atoms_total               1969 
_refine_hist.d_res_high                       2.000 
_refine_hist.d_res_low                        39.622 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.007  0.012  1950 ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.002  0.016  1772 ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.346  1.648  2648 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 0.769  1.569  4078 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 7.284  5.000  234  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 6.672  5.000  11   ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 15.127 10.000 305  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 14.776 10.000 95   ? r_dihedral_angle_6_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.064  0.200  277  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.007  0.020  2294 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.009  0.020  486  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.231  0.200  392  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.216  0.200  1740 ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.193  0.200  974  ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.086  0.200  1035 ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.149  0.200  84   ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.041  0.200  1    ? r_metal_ion_refined            ? ? 
'X-RAY DIFFRACTION' ? 0.061  0.200  6    ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.165  0.200  52   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.123  0.200  3    ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 5.734  6.622  942  ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 5.732  6.622  942  ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 7.813  11.864 1174 ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 7.809  11.866 1175 ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 6.099  7.019  1008 ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 6.082  7.015  1007 ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 8.609  12.709 1474 ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 8.606  12.710 1475 ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 10.858 63.679 2222 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 10.848 63.698 2217 ? r_lrange_other                 ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 2.000 2.052  1623 . 80 1543 100.0000 . 0.402 . . 0.407 . . . . . 0.369 . 20 . 0.822 0.801 0.308 
'X-RAY DIFFRACTION' 2.052 2.108  1573 . 77 1492 99.7457  . 0.385 . . 0.389 . . . . . 0.355 . 20 . 0.844 0.825 0.319 
'X-RAY DIFFRACTION' 2.108 2.169  1558 . 80 1477 99.9358  . 0.348 . . 0.346 . . . . . 0.305 . 20 . 0.885 0.865 0.385 
'X-RAY DIFFRACTION' 2.169 2.235  1492 . 72 1419 99.9330  . 0.333 . . 0.330 . . . . . 0.299 . 20 . 0.913 0.915 0.375 
'X-RAY DIFFRACTION' 2.235 2.308  1464 . 72 1392 100.0000 . 0.274 . . 0.274 . . . . . 0.246 . 20 . 0.940 0.922 0.269 
'X-RAY DIFFRACTION' 2.308 2.389  1407 . 70 1336 99.9289  . 0.256 . . 0.254 . . . . . 0.229 . 20 . 0.950 0.929 0.298 
'X-RAY DIFFRACTION' 2.389 2.479  1374 . 70 1303 99.9272  . 0.255 . . 0.253 . . . . . 0.229 . 20 . 0.955 0.944 0.291 
'X-RAY DIFFRACTION' 2.479 2.580  1305 . 62 1239 99.6935  . 0.236 . . 0.235 . . . . . 0.213 . 20 . 0.962 0.947 0.267 
'X-RAY DIFFRACTION' 2.580 2.694  1260 . 63 1196 99.9206  . 0.223 . . 0.221 . . . . . 0.207 . 20 . 0.964 0.959 0.258 
'X-RAY DIFFRACTION' 2.694 2.825  1212 . 62 1150 100.0000 . 0.235 . . 0.231 . . . . . 0.220 . 20 . 0.963 0.932 0.333 
'X-RAY DIFFRACTION' 2.825 2.977  1160 . 60 1100 100.0000 . 0.248 . . 0.246 . . . . . 0.233 . 20 . 0.960 0.955 0.284 
'X-RAY DIFFRACTION' 2.977 3.156  1096 . 56 1040 100.0000 . 0.249 . . 0.246 . . . . . 0.244 . 20 . 0.958 0.945 0.289 
'X-RAY DIFFRACTION' 3.156 3.373  1019 . 50 969  100.0000 . 0.250 . . 0.246 . . . . . 0.236 . 20 . 0.963 0.926 0.322 
'X-RAY DIFFRACTION' 3.373 3.641  975  . 49 926  100.0000 . 0.230 . . 0.230 . . . . . 0.233 . 20 . 0.969 0.957 0.232 
'X-RAY DIFFRACTION' 3.641 3.985  892  . 42 846  99.5516  . 0.214 . . 0.209 . . . . . 0.222 . 20 . 0.974 0.935 0.330 
'X-RAY DIFFRACTION' 3.985 4.450  817  . 41 775  99.8776  . 0.182 . . 0.181 . . . . . 0.206 . 20 . 0.979 0.972 0.196 
'X-RAY DIFFRACTION' 4.450 5.127  730  . 33 696  99.8630  . 0.176 . . 0.175 . . . . . 0.204 . 20 . 0.983 0.972 0.197 
'X-RAY DIFFRACTION' 5.127 6.253  630  . 32 598  100.0000 . 0.196 . . 0.197 . . . . . 0.239 . 20 . 0.980 0.980 0.182 
'X-RAY DIFFRACTION' 6.253 8.735  492  . 24 468  100.0000 . 0.186 . . 0.184 . . . . . 0.224 . 20 . 0.979 0.976 0.221 
'X-RAY DIFFRACTION' 8.735 39.622 321  . 16 303  99.3769  . 0.177 . . 0.176 . . . . . 0.225 . 20 . 0.977 0.975 0.191 
# 
_struct.entry_id                     8YDW 
_struct.title                        
'Crystal structure of the receptor binding domain of SARS-CoV-2 Omicron XBB.1.5 variant spike protein in complex with CeSPIACE' 
_struct.pdbx_model_details           ? 
_struct.pdbx_formula_weight          ? 
_struct.pdbx_formula_weight_method   ? 
_struct.pdbx_model_type_details      ? 
_struct.pdbx_CASP_flag               N 
# 
_struct_keywords.entry_id        8YDW 
_struct_keywords.text            'RBD, VIRAL PROTEIN-INHIBITOR COMPLEX' 
_struct_keywords.pdbx_keywords   'VIRAL PROTEIN/INHIBITOR' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 4 ? 
E N N 5 ? 
F N N 5 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 PDB 8YDW        8YDW   ? 1 ? 1   
2 UNP SPIKE_SARS2 P0DTC2 ? 2 
;TNLCPFGEVFNATRFASVYAWNRKRISNCVADYSVLYNSASFSTFKCYGVSPTKLNDLCFTNVYADSFVIRGDEVRQIAP
GQTGKIADYNYKLPDDFTGCVIAWNSNNLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGSTPCNGVEGFNCYFPL
QSYGFQPTNGVGYQPYRVVVLSFELLHAPATVCG
;
333 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 8YDW A 1 ? 39  ? 8YDW   1   ? 39  ? 1   39  
2 2 8YDW B 1 ? 194 ? P0DTC2 333 ? 526 ? 333 526 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
2 8YDW HIS B 7   ? UNP P0DTC2 GLY 339 variant          339 1  
2 8YDW THR B 14  ? UNP P0DTC2 ARG 346 variant          346 2  
2 8YDW ILE B 36  ? UNP P0DTC2 LEU 368 variant          368 3  
2 8YDW PHE B 39  ? UNP P0DTC2 SER 371 variant          371 4  
2 8YDW PRO B 41  ? UNP P0DTC2 SER 373 variant          373 5  
2 8YDW ALA B 44  ? UNP P0DTC2 THR 376 variant          376 6  
2 8YDW ASN B 73  ? UNP P0DTC2 ASP 405 variant          405 7  
2 8YDW SER B 76  ? UNP P0DTC2 ARG 408 variant          408 8  
2 8YDW ASN B 85  ? UNP P0DTC2 LYS 417 variant          417 9  
2 8YDW LYS B 108 ? UNP P0DTC2 ASN 440 variant          440 10 
2 8YDW PRO B 113 ? UNP P0DTC2 VAL 445 variant          445 11 
2 8YDW SER B 114 ? UNP P0DTC2 GLY 446 variant          446 12 
2 8YDW LYS B 128 ? UNP P0DTC2 ASN 460 variant          460 13 
2 8YDW ASN B 145 ? UNP P0DTC2 SER 477 variant          477 14 
2 8YDW LYS B 146 ? UNP P0DTC2 THR 478 variant          478 15 
2 8YDW ALA B 152 ? UNP P0DTC2 GLU 484 variant          484 16 
2 8YDW PRO B 154 ? UNP P0DTC2 PHE 486 variant          486 17 
2 8YDW SER B 158 ? UNP P0DTC2 PHE 490 variant          490 18 
2 8YDW ARG B 161 ? UNP P0DTC2 GLN 493 variant          493 19 
2 8YDW ARG B 166 ? UNP P0DTC2 GLN 498 variant          498 20 
2 8YDW TYR B 169 ? UNP P0DTC2 ASN 501 variant          501 21 
2 8YDW HIS B 173 ? UNP P0DTC2 TYR 505 variant          505 22 
2 8YDW SER B 195 ? UNP P0DTC2 ?   ?   'expression tag' 527 23 
2 8YDW ASN B 196 ? UNP P0DTC2 ?   ?   'expression tag' 528 24 
2 8YDW SER B 197 ? UNP P0DTC2 ?   ?   'expression tag' 529 25 
2 8YDW GLU B 198 ? UNP P0DTC2 ?   ?   'expression tag' 530 26 
2 8YDW ASN B 199 ? UNP P0DTC2 ?   ?   'expression tag' 531 27 
2 8YDW LEU B 200 ? UNP P0DTC2 ?   ?   'expression tag' 532 28 
2 8YDW TYR B 201 ? UNP P0DTC2 ?   ?   'expression tag' 533 29 
2 8YDW PHE B 202 ? UNP P0DTC2 ?   ?   'expression tag' 534 30 
2 8YDW GLN B 203 ? UNP P0DTC2 ?   ?   'expression tag' 535 31 
2 8YDW GLY B 204 ? UNP P0DTC2 ?   ?   'expression tag' 536 32 
2 8YDW SER B 205 ? UNP P0DTC2 ?   ?   'expression tag' 537 33 
2 8YDW HIS B 206 ? UNP P0DTC2 ?   ?   'expression tag' 538 34 
2 8YDW HIS B 207 ? UNP P0DTC2 ?   ?   'expression tag' 539 35 
2 8YDW HIS B 208 ? UNP P0DTC2 ?   ?   'expression tag' 540 36 
2 8YDW HIS B 209 ? UNP P0DTC2 ?   ?   'expression tag' 541 37 
2 8YDW HIS B 210 ? UNP P0DTC2 ?   ?   'expression tag' 542 38 
2 8YDW HIS B 211 ? UNP P0DTC2 ?   ?   'expression tag' 543 39 
2 8YDW HIS B 212 ? UNP P0DTC2 ?   ?   'expression tag' 544 40 
2 8YDW HIS B 213 ? UNP P0DTC2 ?   ?   'expression tag' 545 41 
2 8YDW HIS B 214 ? UNP P0DTC2 ?   ?   'expression tag' 546 42 
2 8YDW HIS B 215 ? UNP P0DTC2 ?   ?   'expression tag' 547 43 
2 8YDW GLY B 216 ? UNP P0DTC2 ?   ?   'expression tag' 548 44 
2 8YDW LEU B 217 ? UNP P0DTC2 ?   ?   'expression tag' 549 45 
2 8YDW ASN B 218 ? UNP P0DTC2 ?   ?   'expression tag' 550 46 
2 8YDW ASP B 219 ? UNP P0DTC2 ?   ?   'expression tag' 551 47 
2 8YDW ILE B 220 ? UNP P0DTC2 ?   ?   'expression tag' 552 48 
2 8YDW PHE B 221 ? UNP P0DTC2 ?   ?   'expression tag' 553 49 
2 8YDW GLU B 222 ? UNP P0DTC2 ?   ?   'expression tag' 554 50 
2 8YDW ALA B 223 ? UNP P0DTC2 ?   ?   'expression tag' 555 51 
2 8YDW GLN B 224 ? UNP P0DTC2 ?   ?   'expression tag' 556 52 
2 8YDW LYS B 225 ? UNP P0DTC2 ?   ?   'expression tag' 557 53 
2 8YDW ILE B 226 ? UNP P0DTC2 ?   ?   'expression tag' 558 54 
2 8YDW GLU B 227 ? UNP P0DTC2 ?   ?   'expression tag' 559 55 
2 8YDW TRP B 228 ? UNP P0DTC2 ?   ?   'expression tag' 560 56 
2 8YDW HIS B 229 ? UNP P0DTC2 ?   ?   'expression tag' 561 57 
2 8YDW GLU B 230 ? UNP P0DTC2 ?   ?   'expression tag' 562 58 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 2320  ? 
1 MORE         -14   ? 
1 'SSA (A^2)'  11830 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
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 AA1 ASP A 1   ? GLU A 19  ? ASP A 1   GLU A 19  1 ? 19 
HELX_P HELX_P2 AA2 HIS A 21  ? ARG A 38  ? HIS A 21  ARG A 38  1 ? 18 
HELX_P HELX_P3 AA3 PHE B 6   ? ASN B 11  ? PHE B 338 ASN B 343 1 ? 6  
HELX_P HELX_P4 AA4 SER B 51  ? ASN B 56  ? SER B 383 ASN B 388 1 ? 6  
HELX_P HELX_P5 AA5 ASN B 73  ? ILE B 78  ? ASN B 405 ILE B 410 5 ? 6  
HELX_P HELX_P6 AA6 GLY B 84  ? ASN B 90  ? GLY B 416 ASN B 422 1 ? 7  
HELX_P HELX_P7 AA7 SER B 106 ? SER B 111 ? SER B 438 SER B 443 1 ? 6  
HELX_P HELX_P8 AA8 GLY B 170 ? HIS B 173 ? GLY B 502 HIS B 505 5 ? 4  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_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_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1 disulf ? ? B CYS 4   SG ? ? ? 1_555 B CYS 29  SG ? ? B CYS 336 B CYS 361 1_555 ? ? ? ? ? ? ? 2.033 ? ? 
disulf2 disulf ? ? B CYS 47  SG ? ? ? 1_555 B CYS 100 SG ? ? B CYS 379 B CYS 432 1_555 ? ? ? ? ? ? ? 2.141 ? ? 
disulf3 disulf ? ? B CYS 59  SG ? ? ? 1_555 B CYS 193 SG ? ? B CYS 391 B CYS 525 1_555 ? ? ? ? ? ? ? 2.060 ? ? 
disulf4 disulf ? ? B CYS 148 SG ? ? ? 1_555 B CYS 156 SG ? ? B CYS 480 B CYS 488 1_555 ? ? ? ? ? ? ? 2.082 ? ? 
metalc1 metalc ? ? B ASN 73  O  ? ? ? 1_555 D NA  .   NA ? ? B ASN 405 B NA  602 1_555 ? ? ? ? ? ? ? 2.369 ? ? 
metalc2 metalc ? ? B SER 76  OG ? ? ? 1_555 D NA  .   NA ? ? B SER 408 B NA  602 1_555 ? ? ? ? ? ? ? 2.518 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
metalc ? ? 
# 
_pdbx_struct_conn_angle.id                    1 
_pdbx_struct_conn_angle.ptnr1_label_atom_id   O 
_pdbx_struct_conn_angle.ptnr1_label_alt_id    ? 
_pdbx_struct_conn_angle.ptnr1_label_asym_id   B 
_pdbx_struct_conn_angle.ptnr1_label_comp_id   ASN 
_pdbx_struct_conn_angle.ptnr1_label_seq_id    73 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id    ? 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id    B 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id    ASN 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id     405 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code    ? 
_pdbx_struct_conn_angle.ptnr1_symmetry        1_555 
_pdbx_struct_conn_angle.ptnr2_label_atom_id   NA 
_pdbx_struct_conn_angle.ptnr2_label_alt_id    ? 
_pdbx_struct_conn_angle.ptnr2_label_asym_id   D 
_pdbx_struct_conn_angle.ptnr2_label_comp_id   NA 
_pdbx_struct_conn_angle.ptnr2_label_seq_id    . 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id    ? 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id    B 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id    NA 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id     602 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code    ? 
_pdbx_struct_conn_angle.ptnr2_symmetry        1_555 
_pdbx_struct_conn_angle.ptnr3_label_atom_id   OG 
_pdbx_struct_conn_angle.ptnr3_label_alt_id    ? 
_pdbx_struct_conn_angle.ptnr3_label_asym_id   B 
_pdbx_struct_conn_angle.ptnr3_label_comp_id   SER 
_pdbx_struct_conn_angle.ptnr3_label_seq_id    76 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id    ? 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id    B 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id    SER 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id     408 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code    ? 
_pdbx_struct_conn_angle.ptnr3_symmetry        1_555 
_pdbx_struct_conn_angle.value                 97.8 
_pdbx_struct_conn_angle.value_esd             ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 CYS B 4   ? CYS B 29  ? CYS B 336 ? 1_555 CYS B 361 ? 1_555 SG SG . . . None 'Disulfide bridge' 
2 CYS B 47  ? CYS B 100 ? CYS B 379 ? 1_555 CYS B 432 ? 1_555 SG SG . . . None 'Disulfide bridge' 
3 CYS B 59  ? CYS B 193 ? CYS B 391 ? 1_555 CYS B 525 ? 1_555 SG SG . . . None 'Disulfide bridge' 
4 CYS B 148 ? CYS B 156 ? CYS B 480 ? 1_555 CYS B 488 ? 1_555 SG SG . . . None 'Disulfide bridge' 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 3 ? 
AA3 ? 2 ? 
AA4 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? parallel      
AA2 2 3 ? anti-parallel 
AA3 1 2 ? anti-parallel 
AA4 1 2 ? anti-parallel 
# 
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.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 
AA1 1 ASN B 22  ? ILE B 26  ? ASN B 354 ILE B 358 
AA1 2 ASN B 62  ? ARG B 71  ? ASN B 394 ARG B 403 
AA1 3 PRO B 175 ? GLU B 184 ? PRO B 507 GLU B 516 
AA1 4 CYS B 100 ? ASN B 105 ? CYS B 432 ASN B 437 
AA1 5 ALA B 44  ? CYS B 47  ? ALA B 376 CYS B 379 
AA2 1 CYS B 29  ? ALA B 31  ? CYS B 361 ALA B 363 
AA2 2 VAL B 192 ? GLY B 194 ? VAL B 524 GLY B 526 
AA2 3 CYS B 59  ? PHE B 60  ? CYS B 391 PHE B 392 
AA3 1 LEU B 120 ? ARG B 122 ? LEU B 452 ARG B 454 
AA3 2 LEU B 160 ? SER B 162 ? LEU B 492 SER B 494 
AA4 1 TYR B 141 ? GLN B 142 ? TYR B 473 GLN B 474 
AA4 2 CYS B 156 ? TYR B 157 ? CYS B 488 TYR B 489 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 N ILE B 26  ? N ILE B 358 O VAL B 63  ? O VAL B 395 
AA1 2 3 N ASN B 62  ? N ASN B 394 O GLU B 184 ? O GLU B 516 
AA1 3 4 O VAL B 179 ? O VAL B 511 N ILE B 102 ? N ILE B 434 
AA1 4 5 O VAL B 101 ? O VAL B 433 N LYS B 46  ? N LYS B 378 
AA2 1 2 N ALA B 31  ? N ALA B 363 O CYS B 193 ? O CYS B 525 
AA2 2 3 O VAL B 192 ? O VAL B 524 N PHE B 60  ? N PHE B 392 
AA3 1 2 N TYR B 121 ? N TYR B 453 O ARG B 161 ? O ARG B 493 
AA4 1 2 N TYR B 141 ? N TYR B 473 O TYR B 157 ? O TYR B 489 
# 
_pdbx_entry_details.entry_id                   8YDW 
_pdbx_entry_details.has_ligand_of_interest     N 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   Y 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1 1 HIS A 21  ? ? -114.90 50.21  
2 1 ALA B 352 ? ? -109.42 53.45  
3 1 TYR B 365 ? ? -91.55  43.36  
4 1 PHE B 377 ? ? -161.87 69.83  
5 1 ASN B 422 ? ? -129.62 -52.43 
6 1 ASP B 428 ? ? -96.82  35.89  
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 B THR 333 ? B THR 1   
2  1 Y 1 B ASN 531 ? B ASN 199 
3  1 Y 1 B LEU 532 ? B LEU 200 
4  1 Y 1 B TYR 533 ? B TYR 201 
5  1 Y 1 B PHE 534 ? B PHE 202 
6  1 Y 1 B GLN 535 ? B GLN 203 
7  1 Y 1 B GLY 536 ? B GLY 204 
8  1 Y 1 B SER 537 ? B SER 205 
9  1 Y 1 B HIS 538 ? B HIS 206 
10 1 Y 1 B HIS 539 ? B HIS 207 
11 1 Y 1 B HIS 540 ? B HIS 208 
12 1 Y 1 B HIS 541 ? B HIS 209 
13 1 Y 1 B HIS 542 ? B HIS 210 
14 1 Y 1 B HIS 543 ? B HIS 211 
15 1 Y 1 B HIS 544 ? B HIS 212 
16 1 Y 1 B HIS 545 ? B HIS 213 
17 1 Y 1 B HIS 546 ? B HIS 214 
18 1 Y 1 B HIS 547 ? B HIS 215 
19 1 Y 1 B GLY 548 ? B GLY 216 
20 1 Y 1 B LEU 549 ? B LEU 217 
21 1 Y 1 B ASN 550 ? B ASN 218 
22 1 Y 1 B ASP 551 ? B ASP 219 
23 1 Y 1 B ILE 552 ? B ILE 220 
24 1 Y 1 B PHE 553 ? B PHE 221 
25 1 Y 1 B GLU 554 ? B GLU 222 
26 1 Y 1 B ALA 555 ? B ALA 223 
27 1 Y 1 B GLN 556 ? B GLN 224 
28 1 Y 1 B LYS 557 ? B LYS 225 
29 1 Y 1 B ILE 558 ? B ILE 226 
30 1 Y 1 B GLU 559 ? B GLU 227 
31 1 Y 1 B TRP 560 ? B TRP 228 
32 1 Y 1 B HIS 561 ? B HIS 229 
33 1 Y 1 B GLU 562 ? B GLU 230 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N  N N 1   
ALA CA   C  N S 2   
ALA C    C  N N 3   
ALA O    O  N N 4   
ALA CB   C  N N 5   
ALA OXT  O  N N 6   
ALA H    H  N N 7   
ALA H2   H  N N 8   
ALA HA   H  N N 9   
ALA HB1  H  N N 10  
ALA HB2  H  N N 11  
ALA HB3  H  N N 12  
ALA HXT  H  N N 13  
ARG N    N  N N 14  
ARG CA   C  N S 15  
ARG C    C  N N 16  
ARG O    O  N N 17  
ARG CB   C  N N 18  
ARG CG   C  N N 19  
ARG CD   C  N N 20  
ARG NE   N  N N 21  
ARG CZ   C  N N 22  
ARG NH1  N  N N 23  
ARG NH2  N  N N 24  
ARG OXT  O  N N 25  
ARG H    H  N N 26  
ARG H2   H  N N 27  
ARG HA   H  N N 28  
ARG HB2  H  N N 29  
ARG HB3  H  N N 30  
ARG HG2  H  N N 31  
ARG HG3  H  N N 32  
ARG HD2  H  N N 33  
ARG HD3  H  N N 34  
ARG HE   H  N N 35  
ARG HH11 H  N N 36  
ARG HH12 H  N N 37  
ARG HH21 H  N N 38  
ARG HH22 H  N N 39  
ARG HXT  H  N N 40  
ASN N    N  N N 41  
ASN CA   C  N S 42  
ASN C    C  N N 43  
ASN O    O  N N 44  
ASN CB   C  N N 45  
ASN CG   C  N N 46  
ASN OD1  O  N N 47  
ASN ND2  N  N N 48  
ASN OXT  O  N N 49  
ASN H    H  N N 50  
ASN H2   H  N N 51  
ASN HA   H  N N 52  
ASN HB2  H  N N 53  
ASN HB3  H  N N 54  
ASN HD21 H  N N 55  
ASN HD22 H  N N 56  
ASN HXT  H  N N 57  
ASP N    N  N N 58  
ASP CA   C  N S 59  
ASP C    C  N N 60  
ASP O    O  N N 61  
ASP CB   C  N N 62  
ASP CG   C  N N 63  
ASP OD1  O  N N 64  
ASP OD2  O  N N 65  
ASP OXT  O  N N 66  
ASP H    H  N N 67  
ASP H2   H  N N 68  
ASP HA   H  N N 69  
ASP HB2  H  N N 70  
ASP HB3  H  N N 71  
ASP HD2  H  N N 72  
ASP HXT  H  N N 73  
CYS N    N  N N 74  
CYS CA   C  N R 75  
CYS C    C  N N 76  
CYS O    O  N N 77  
CYS CB   C  N N 78  
CYS SG   S  N N 79  
CYS OXT  O  N N 80  
CYS H    H  N N 81  
CYS H2   H  N N 82  
CYS HA   H  N N 83  
CYS HB2  H  N N 84  
CYS HB3  H  N N 85  
CYS HG   H  N N 86  
CYS HXT  H  N N 87  
GLN N    N  N N 88  
GLN CA   C  N S 89  
GLN C    C  N N 90  
GLN O    O  N N 91  
GLN CB   C  N N 92  
GLN CG   C  N N 93  
GLN CD   C  N N 94  
GLN OE1  O  N N 95  
GLN NE2  N  N N 96  
GLN OXT  O  N N 97  
GLN H    H  N N 98  
GLN H2   H  N N 99  
GLN HA   H  N N 100 
GLN HB2  H  N N 101 
GLN HB3  H  N N 102 
GLN HG2  H  N N 103 
GLN HG3  H  N N 104 
GLN HE21 H  N N 105 
GLN HE22 H  N N 106 
GLN HXT  H  N N 107 
GLU N    N  N N 108 
GLU CA   C  N S 109 
GLU C    C  N N 110 
GLU O    O  N N 111 
GLU CB   C  N N 112 
GLU CG   C  N N 113 
GLU CD   C  N N 114 
GLU OE1  O  N N 115 
GLU OE2  O  N N 116 
GLU OXT  O  N N 117 
GLU H    H  N N 118 
GLU H2   H  N N 119 
GLU HA   H  N N 120 
GLU HB2  H  N N 121 
GLU HB3  H  N N 122 
GLU HG2  H  N N 123 
GLU HG3  H  N N 124 
GLU HE2  H  N N 125 
GLU HXT  H  N N 126 
GLY N    N  N N 127 
GLY CA   C  N N 128 
GLY C    C  N N 129 
GLY O    O  N N 130 
GLY OXT  O  N N 131 
GLY H    H  N N 132 
GLY H2   H  N N 133 
GLY HA2  H  N N 134 
GLY HA3  H  N N 135 
GLY HXT  H  N N 136 
GOL C1   C  N N 137 
GOL O1   O  N N 138 
GOL C2   C  N N 139 
GOL O2   O  N N 140 
GOL C3   C  N N 141 
GOL O3   O  N N 142 
GOL H11  H  N N 143 
GOL H12  H  N N 144 
GOL HO1  H  N N 145 
GOL H2   H  N N 146 
GOL HO2  H  N N 147 
GOL H31  H  N N 148 
GOL H32  H  N N 149 
GOL HO3  H  N N 150 
HIS N    N  N N 151 
HIS CA   C  N S 152 
HIS C    C  N N 153 
HIS O    O  N N 154 
HIS CB   C  N N 155 
HIS CG   C  Y N 156 
HIS ND1  N  Y N 157 
HIS CD2  C  Y N 158 
HIS CE1  C  Y N 159 
HIS NE2  N  Y N 160 
HIS OXT  O  N N 161 
HIS H    H  N N 162 
HIS H2   H  N N 163 
HIS HA   H  N N 164 
HIS HB2  H  N N 165 
HIS HB3  H  N N 166 
HIS HD1  H  N N 167 
HIS HD2  H  N N 168 
HIS HE1  H  N N 169 
HIS HE2  H  N N 170 
HIS HXT  H  N N 171 
HOH O    O  N N 172 
HOH H1   H  N N 173 
HOH H2   H  N N 174 
ILE N    N  N N 175 
ILE CA   C  N S 176 
ILE C    C  N N 177 
ILE O    O  N N 178 
ILE CB   C  N S 179 
ILE CG1  C  N N 180 
ILE CG2  C  N N 181 
ILE CD1  C  N N 182 
ILE OXT  O  N N 183 
ILE H    H  N N 184 
ILE H2   H  N N 185 
ILE HA   H  N N 186 
ILE HB   H  N N 187 
ILE HG12 H  N N 188 
ILE HG13 H  N N 189 
ILE HG21 H  N N 190 
ILE HG22 H  N N 191 
ILE HG23 H  N N 192 
ILE HD11 H  N N 193 
ILE HD12 H  N N 194 
ILE HD13 H  N N 195 
ILE HXT  H  N N 196 
LEU N    N  N N 197 
LEU CA   C  N S 198 
LEU C    C  N N 199 
LEU O    O  N N 200 
LEU CB   C  N N 201 
LEU CG   C  N N 202 
LEU CD1  C  N N 203 
LEU CD2  C  N N 204 
LEU OXT  O  N N 205 
LEU H    H  N N 206 
LEU H2   H  N N 207 
LEU HA   H  N N 208 
LEU HB2  H  N N 209 
LEU HB3  H  N N 210 
LEU HG   H  N N 211 
LEU HD11 H  N N 212 
LEU HD12 H  N N 213 
LEU HD13 H  N N 214 
LEU HD21 H  N N 215 
LEU HD22 H  N N 216 
LEU HD23 H  N N 217 
LEU HXT  H  N N 218 
LYS N    N  N N 219 
LYS CA   C  N S 220 
LYS C    C  N N 221 
LYS O    O  N N 222 
LYS CB   C  N N 223 
LYS CG   C  N N 224 
LYS CD   C  N N 225 
LYS CE   C  N N 226 
LYS NZ   N  N N 227 
LYS OXT  O  N N 228 
LYS H    H  N N 229 
LYS H2   H  N N 230 
LYS HA   H  N N 231 
LYS HB2  H  N N 232 
LYS HB3  H  N N 233 
LYS HG2  H  N N 234 
LYS HG3  H  N N 235 
LYS HD2  H  N N 236 
LYS HD3  H  N N 237 
LYS HE2  H  N N 238 
LYS HE3  H  N N 239 
LYS HZ1  H  N N 240 
LYS HZ2  H  N N 241 
LYS HZ3  H  N N 242 
LYS HXT  H  N N 243 
MET N    N  N N 244 
MET CA   C  N S 245 
MET C    C  N N 246 
MET O    O  N N 247 
MET CB   C  N N 248 
MET CG   C  N N 249 
MET SD   S  N N 250 
MET CE   C  N N 251 
MET OXT  O  N N 252 
MET H    H  N N 253 
MET H2   H  N N 254 
MET HA   H  N N 255 
MET HB2  H  N N 256 
MET HB3  H  N N 257 
MET HG2  H  N N 258 
MET HG3  H  N N 259 
MET HE1  H  N N 260 
MET HE2  H  N N 261 
MET HE3  H  N N 262 
MET HXT  H  N N 263 
NA  NA   NA N N 264 
PHE N    N  N N 265 
PHE CA   C  N S 266 
PHE C    C  N N 267 
PHE O    O  N N 268 
PHE CB   C  N N 269 
PHE CG   C  Y N 270 
PHE CD1  C  Y N 271 
PHE CD2  C  Y N 272 
PHE CE1  C  Y N 273 
PHE CE2  C  Y N 274 
PHE CZ   C  Y N 275 
PHE OXT  O  N N 276 
PHE H    H  N N 277 
PHE H2   H  N N 278 
PHE HA   H  N N 279 
PHE HB2  H  N N 280 
PHE HB3  H  N N 281 
PHE HD1  H  N N 282 
PHE HD2  H  N N 283 
PHE HE1  H  N N 284 
PHE HE2  H  N N 285 
PHE HZ   H  N N 286 
PHE HXT  H  N N 287 
PRO N    N  N N 288 
PRO CA   C  N S 289 
PRO C    C  N N 290 
PRO O    O  N N 291 
PRO CB   C  N N 292 
PRO CG   C  N N 293 
PRO CD   C  N N 294 
PRO OXT  O  N N 295 
PRO H    H  N N 296 
PRO HA   H  N N 297 
PRO HB2  H  N N 298 
PRO HB3  H  N N 299 
PRO HG2  H  N N 300 
PRO HG3  H  N N 301 
PRO HD2  H  N N 302 
PRO HD3  H  N N 303 
PRO HXT  H  N N 304 
SER N    N  N N 305 
SER CA   C  N S 306 
SER C    C  N N 307 
SER O    O  N N 308 
SER CB   C  N N 309 
SER OG   O  N N 310 
SER OXT  O  N N 311 
SER H    H  N N 312 
SER H2   H  N N 313 
SER HA   H  N N 314 
SER HB2  H  N N 315 
SER HB3  H  N N 316 
SER HG   H  N N 317 
SER HXT  H  N N 318 
THR N    N  N N 319 
THR CA   C  N S 320 
THR C    C  N N 321 
THR O    O  N N 322 
THR CB   C  N R 323 
THR OG1  O  N N 324 
THR CG2  C  N N 325 
THR OXT  O  N N 326 
THR H    H  N N 327 
THR H2   H  N N 328 
THR HA   H  N N 329 
THR HB   H  N N 330 
THR HG1  H  N N 331 
THR HG21 H  N N 332 
THR HG22 H  N N 333 
THR HG23 H  N N 334 
THR HXT  H  N N 335 
TRP N    N  N N 336 
TRP CA   C  N S 337 
TRP C    C  N N 338 
TRP O    O  N N 339 
TRP CB   C  N N 340 
TRP CG   C  Y N 341 
TRP CD1  C  Y N 342 
TRP CD2  C  Y N 343 
TRP NE1  N  Y N 344 
TRP CE2  C  Y N 345 
TRP CE3  C  Y N 346 
TRP CZ2  C  Y N 347 
TRP CZ3  C  Y N 348 
TRP CH2  C  Y N 349 
TRP OXT  O  N N 350 
TRP H    H  N N 351 
TRP H2   H  N N 352 
TRP HA   H  N N 353 
TRP HB2  H  N N 354 
TRP HB3  H  N N 355 
TRP HD1  H  N N 356 
TRP HE1  H  N N 357 
TRP HE3  H  N N 358 
TRP HZ2  H  N N 359 
TRP HZ3  H  N N 360 
TRP HH2  H  N N 361 
TRP HXT  H  N N 362 
TYR N    N  N N 363 
TYR CA   C  N S 364 
TYR C    C  N N 365 
TYR O    O  N N 366 
TYR CB   C  N N 367 
TYR CG   C  Y N 368 
TYR CD1  C  Y N 369 
TYR CD2  C  Y N 370 
TYR CE1  C  Y N 371 
TYR CE2  C  Y N 372 
TYR CZ   C  Y N 373 
TYR OH   O  N N 374 
TYR OXT  O  N N 375 
TYR H    H  N N 376 
TYR H2   H  N N 377 
TYR HA   H  N N 378 
TYR HB2  H  N N 379 
TYR HB3  H  N N 380 
TYR HD1  H  N N 381 
TYR HD2  H  N N 382 
TYR HE1  H  N N 383 
TYR HE2  H  N N 384 
TYR HH   H  N N 385 
TYR HXT  H  N N 386 
VAL N    N  N N 387 
VAL CA   C  N S 388 
VAL C    C  N N 389 
VAL O    O  N N 390 
VAL CB   C  N N 391 
VAL CG1  C  N N 392 
VAL CG2  C  N N 393 
VAL OXT  O  N N 394 
VAL H    H  N N 395 
VAL H2   H  N N 396 
VAL HA   H  N N 397 
VAL HB   H  N N 398 
VAL HG11 H  N N 399 
VAL HG12 H  N N 400 
VAL HG13 H  N N 401 
VAL HG21 H  N N 402 
VAL HG22 H  N N 403 
VAL HG23 H  N N 404 
VAL HXT  H  N N 405 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
GOL C1  O1   sing N N 129 
GOL C1  C2   sing N N 130 
GOL C1  H11  sing N N 131 
GOL C1  H12  sing N N 132 
GOL O1  HO1  sing N N 133 
GOL C2  O2   sing N N 134 
GOL C2  C3   sing N N 135 
GOL C2  H2   sing N N 136 
GOL O2  HO2  sing N N 137 
GOL C3  O3   sing N N 138 
GOL C3  H31  sing N N 139 
GOL C3  H32  sing N N 140 
GOL O3  HO3  sing N N 141 
HIS N   CA   sing N N 142 
HIS N   H    sing N N 143 
HIS N   H2   sing N N 144 
HIS CA  C    sing N N 145 
HIS CA  CB   sing N N 146 
HIS CA  HA   sing N N 147 
HIS C   O    doub N N 148 
HIS C   OXT  sing N N 149 
HIS CB  CG   sing N N 150 
HIS CB  HB2  sing N N 151 
HIS CB  HB3  sing N N 152 
HIS CG  ND1  sing Y N 153 
HIS CG  CD2  doub Y N 154 
HIS ND1 CE1  doub Y N 155 
HIS ND1 HD1  sing N N 156 
HIS CD2 NE2  sing Y N 157 
HIS CD2 HD2  sing N N 158 
HIS CE1 NE2  sing Y N 159 
HIS CE1 HE1  sing N N 160 
HIS NE2 HE2  sing N N 161 
HIS OXT HXT  sing N N 162 
HOH O   H1   sing N N 163 
HOH O   H2   sing N N 164 
ILE N   CA   sing N N 165 
ILE N   H    sing N N 166 
ILE N   H2   sing N N 167 
ILE CA  C    sing N N 168 
ILE CA  CB   sing N N 169 
ILE CA  HA   sing N N 170 
ILE C   O    doub N N 171 
ILE C   OXT  sing N N 172 
ILE CB  CG1  sing N N 173 
ILE CB  CG2  sing N N 174 
ILE CB  HB   sing N N 175 
ILE CG1 CD1  sing N N 176 
ILE CG1 HG12 sing N N 177 
ILE CG1 HG13 sing N N 178 
ILE CG2 HG21 sing N N 179 
ILE CG2 HG22 sing N N 180 
ILE CG2 HG23 sing N N 181 
ILE CD1 HD11 sing N N 182 
ILE CD1 HD12 sing N N 183 
ILE CD1 HD13 sing N N 184 
ILE OXT HXT  sing N N 185 
LEU N   CA   sing N N 186 
LEU N   H    sing N N 187 
LEU N   H2   sing N N 188 
LEU CA  C    sing N N 189 
LEU CA  CB   sing N N 190 
LEU CA  HA   sing N N 191 
LEU C   O    doub N N 192 
LEU C   OXT  sing N N 193 
LEU CB  CG   sing N N 194 
LEU CB  HB2  sing N N 195 
LEU CB  HB3  sing N N 196 
LEU CG  CD1  sing N N 197 
LEU CG  CD2  sing N N 198 
LEU CG  HG   sing N N 199 
LEU CD1 HD11 sing N N 200 
LEU CD1 HD12 sing N N 201 
LEU CD1 HD13 sing N N 202 
LEU CD2 HD21 sing N N 203 
LEU CD2 HD22 sing N N 204 
LEU CD2 HD23 sing N N 205 
LEU OXT HXT  sing N N 206 
LYS N   CA   sing N N 207 
LYS N   H    sing N N 208 
LYS N   H2   sing N N 209 
LYS CA  C    sing N N 210 
LYS CA  CB   sing N N 211 
LYS CA  HA   sing N N 212 
LYS C   O    doub N N 213 
LYS C   OXT  sing N N 214 
LYS CB  CG   sing N N 215 
LYS CB  HB2  sing N N 216 
LYS CB  HB3  sing N N 217 
LYS CG  CD   sing N N 218 
LYS CG  HG2  sing N N 219 
LYS CG  HG3  sing N N 220 
LYS CD  CE   sing N N 221 
LYS CD  HD2  sing N N 222 
LYS CD  HD3  sing N N 223 
LYS CE  NZ   sing N N 224 
LYS CE  HE2  sing N N 225 
LYS CE  HE3  sing N N 226 
LYS NZ  HZ1  sing N N 227 
LYS NZ  HZ2  sing N N 228 
LYS NZ  HZ3  sing N N 229 
LYS OXT HXT  sing N N 230 
MET N   CA   sing N N 231 
MET N   H    sing N N 232 
MET N   H2   sing N N 233 
MET CA  C    sing N N 234 
MET CA  CB   sing N N 235 
MET CA  HA   sing N N 236 
MET C   O    doub N N 237 
MET C   OXT  sing N N 238 
MET CB  CG   sing N N 239 
MET CB  HB2  sing N N 240 
MET CB  HB3  sing N N 241 
MET CG  SD   sing N N 242 
MET CG  HG2  sing N N 243 
MET CG  HG3  sing N N 244 
MET SD  CE   sing N N 245 
MET CE  HE1  sing N N 246 
MET CE  HE2  sing N N 247 
MET CE  HE3  sing N N 248 
MET OXT HXT  sing N N 249 
PHE N   CA   sing N N 250 
PHE N   H    sing N N 251 
PHE N   H2   sing N N 252 
PHE CA  C    sing N N 253 
PHE CA  CB   sing N N 254 
PHE CA  HA   sing N N 255 
PHE C   O    doub N N 256 
PHE C   OXT  sing N N 257 
PHE CB  CG   sing N N 258 
PHE CB  HB2  sing N N 259 
PHE CB  HB3  sing N N 260 
PHE CG  CD1  doub Y N 261 
PHE CG  CD2  sing Y N 262 
PHE CD1 CE1  sing Y N 263 
PHE CD1 HD1  sing N N 264 
PHE CD2 CE2  doub Y N 265 
PHE CD2 HD2  sing N N 266 
PHE CE1 CZ   doub Y N 267 
PHE CE1 HE1  sing N N 268 
PHE CE2 CZ   sing Y N 269 
PHE CE2 HE2  sing N N 270 
PHE CZ  HZ   sing N N 271 
PHE OXT HXT  sing N N 272 
PRO N   CA   sing N N 273 
PRO N   CD   sing N N 274 
PRO N   H    sing N N 275 
PRO CA  C    sing N N 276 
PRO CA  CB   sing N N 277 
PRO CA  HA   sing N N 278 
PRO C   O    doub N N 279 
PRO C   OXT  sing N N 280 
PRO CB  CG   sing N N 281 
PRO CB  HB2  sing N N 282 
PRO CB  HB3  sing N N 283 
PRO CG  CD   sing N N 284 
PRO CG  HG2  sing N N 285 
PRO CG  HG3  sing N N 286 
PRO CD  HD2  sing N N 287 
PRO CD  HD3  sing N N 288 
PRO OXT HXT  sing N N 289 
SER N   CA   sing N N 290 
SER N   H    sing N N 291 
SER N   H2   sing N N 292 
SER CA  C    sing N N 293 
SER CA  CB   sing N N 294 
SER CA  HA   sing N N 295 
SER C   O    doub N N 296 
SER C   OXT  sing N N 297 
SER CB  OG   sing N N 298 
SER CB  HB2  sing N N 299 
SER CB  HB3  sing N N 300 
SER OG  HG   sing N N 301 
SER OXT HXT  sing N N 302 
THR N   CA   sing N N 303 
THR N   H    sing N N 304 
THR N   H2   sing N N 305 
THR CA  C    sing N N 306 
THR CA  CB   sing N N 307 
THR CA  HA   sing N N 308 
THR C   O    doub N N 309 
THR C   OXT  sing N N 310 
THR CB  OG1  sing N N 311 
THR CB  CG2  sing N N 312 
THR CB  HB   sing N N 313 
THR OG1 HG1  sing N N 314 
THR CG2 HG21 sing N N 315 
THR CG2 HG22 sing N N 316 
THR CG2 HG23 sing N N 317 
THR OXT HXT  sing N N 318 
TRP N   CA   sing N N 319 
TRP N   H    sing N N 320 
TRP N   H2   sing N N 321 
TRP CA  C    sing N N 322 
TRP CA  CB   sing N N 323 
TRP CA  HA   sing N N 324 
TRP C   O    doub N N 325 
TRP C   OXT  sing N N 326 
TRP CB  CG   sing N N 327 
TRP CB  HB2  sing N N 328 
TRP CB  HB3  sing N N 329 
TRP CG  CD1  doub Y N 330 
TRP CG  CD2  sing Y N 331 
TRP CD1 NE1  sing Y N 332 
TRP CD1 HD1  sing N N 333 
TRP CD2 CE2  doub Y N 334 
TRP CD2 CE3  sing Y N 335 
TRP NE1 CE2  sing Y N 336 
TRP NE1 HE1  sing N N 337 
TRP CE2 CZ2  sing Y N 338 
TRP CE3 CZ3  doub Y N 339 
TRP CE3 HE3  sing N N 340 
TRP CZ2 CH2  doub Y N 341 
TRP CZ2 HZ2  sing N N 342 
TRP CZ3 CH2  sing Y N 343 
TRP CZ3 HZ3  sing N N 344 
TRP CH2 HH2  sing N N 345 
TRP OXT HXT  sing N N 346 
TYR N   CA   sing N N 347 
TYR N   H    sing N N 348 
TYR N   H2   sing N N 349 
TYR CA  C    sing N N 350 
TYR CA  CB   sing N N 351 
TYR CA  HA   sing N N 352 
TYR C   O    doub N N 353 
TYR C   OXT  sing N N 354 
TYR CB  CG   sing N N 355 
TYR CB  HB2  sing N N 356 
TYR CB  HB3  sing N N 357 
TYR CG  CD1  doub Y N 358 
TYR CG  CD2  sing Y N 359 
TYR CD1 CE1  sing Y N 360 
TYR CD1 HD1  sing N N 361 
TYR CD2 CE2  doub Y N 362 
TYR CD2 HD2  sing N N 363 
TYR CE1 CZ   doub Y N 364 
TYR CE1 HE1  sing N N 365 
TYR CE2 CZ   sing Y N 366 
TYR CE2 HE2  sing N N 367 
TYR CZ  OH   sing N N 368 
TYR OH  HH   sing N N 369 
TYR OXT HXT  sing N N 370 
VAL N   CA   sing N N 371 
VAL N   H    sing N N 372 
VAL N   H2   sing N N 373 
VAL CA  C    sing N N 374 
VAL CA  CB   sing N N 375 
VAL CA  HA   sing N N 376 
VAL C   O    doub N N 377 
VAL C   OXT  sing N N 378 
VAL CB  CG1  sing N N 379 
VAL CB  CG2  sing N N 380 
VAL CB  HB   sing N N 381 
VAL CG1 HG11 sing N N 382 
VAL CG1 HG12 sing N N 383 
VAL CG1 HG13 sing N N 384 
VAL CG2 HG21 sing N N 385 
VAL CG2 HG22 sing N N 386 
VAL CG2 HG23 sing N N 387 
VAL OXT HXT  sing N N 388 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Japan Agency for Medical Research and Development (AMED)' Japan 'JP21fk0108462, JP21fk0108585, JP21ae0121028, JP18ae0101046' 1 
'Japan Society for the Promotion of Science (JSPS)'        Japan 20H00451                                                     2 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   7jzu 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    8YDW 
_atom_sites.Cartn_transf_matrix[1][1]   ? 
_atom_sites.Cartn_transf_matrix[1][2]   ? 
_atom_sites.Cartn_transf_matrix[1][3]   ? 
_atom_sites.Cartn_transf_matrix[2][1]   ? 
_atom_sites.Cartn_transf_matrix[2][2]   ? 
_atom_sites.Cartn_transf_matrix[2][3]   ? 
_atom_sites.Cartn_transf_matrix[3][1]   ? 
_atom_sites.Cartn_transf_matrix[3][2]   ? 
_atom_sites.Cartn_transf_matrix[3][3]   ? 
_atom_sites.Cartn_transf_vector[1]      ? 
_atom_sites.Cartn_transf_vector[2]      ? 
_atom_sites.Cartn_transf_vector[3]      ? 
_atom_sites.Cartn_transform_axes        ? 
_atom_sites.fract_transf_matrix[1][1]   0.013376 
_atom_sites.fract_transf_matrix[1][2]   0.007723 
_atom_sites.fract_transf_matrix[1][3]   0.000000 
_atom_sites.fract_transf_matrix[2][1]   0.000000 
_atom_sites.fract_transf_matrix[2][2]   0.015445 
_atom_sites.fract_transf_matrix[2][3]   0.000000 
_atom_sites.fract_transf_matrix[3][1]   0.000000 
_atom_sites.fract_transf_matrix[3][2]   0.000000 
_atom_sites.fract_transf_matrix[3][3]   0.009993 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.pdbx_scat_Z 
_atom_type.pdbx_N_electrons 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C  6  6  2.3103  20.8439 1.0201 10.2075 1.5888 0.5687  0.8651 51.6512  0.2156   
H  1  1  0.4930  10.5109 0.3229 26.1257 0.1402 3.1424  0.0408 57.7997  0.0030   
N  7  7  12.2220 0.0057  3.1346 9.8933  2.0141 28.9975 1.1672 0.5826   -11.5379 
NA 11 11 4.7659  3.2850  3.1758 8.8422  1.2683 0.3136  1.1136 129.4240 0.7359   
O  8  8  3.0487  13.2771 2.2870 5.7011  1.5464 0.3239  0.8671 32.9089  0.2508   
S  16 16 6.9054  1.4679  5.2035 22.2151 1.4379 0.2536  1.5863 56.1720  1.0555   
# 
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_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
_atom_site.calc_flag 
ATOM   1    N  N   . ASP A 1 1   ? -17.858 3.852  -20.031 1.000 139.530 0 1   ASP A N   1 ? 
ATOM   2    C  CA  . ASP A 1 1   ? -17.556 3.285  -18.688 1.000 132.590 0 1   ASP A CA  1 ? 
ATOM   3    C  C   . ASP A 1 1   ? -18.836 3.337  -17.851 1.000 126.900 0 1   ASP A C   1 ? 
ATOM   4    O  O   . ASP A 1 1   ? -19.929 3.115  -18.370 1.000 122.040 0 1   ASP A O   1 ? 
ATOM   5    C  CB  . ASP A 1 1   ? -16.360 4.006  -18.051 1.000 125.250 0 1   ASP A CB  1 ? 
ATOM   6    C  CG  . ASP A 1 1   ? -16.609 5.469  -17.708 1.000 121.540 0 1   ASP A CG  1 ? 
ATOM   7    O  OD1 . ASP A 1 1   ? -17.689 5.992  -18.061 1.000 110.710 0 1   ASP A OD1 1 ? 
ATOM   8    O  OD2 . ASP A 1 1   ? -15.728 6.075  -17.078 1.000 123.510 0 1   ASP A OD2 1 ? 
ATOM   9    N  N   . LYS A 1 2   ? -18.688 3.661  -16.563 1.000 116.660 0 2   LYS A N   1 ? 
ATOM   10   C  CA  . LYS A 1 2   ? -19.796 3.706  -15.626 1.000 103.540 0 2   LYS A CA  1 ? 
ATOM   11   C  C   . LYS A 1 2   ? -20.885 4.678  -16.088 1.000 87.500  0 2   LYS A C   1 ? 
ATOM   12   O  O   . LYS A 1 2   ? -22.062 4.396  -15.920 1.000 87.170  0 2   LYS A O   1 ? 
ATOM   13   C  CB  . LYS A 1 2   ? -19.264 4.096  -14.241 1.000 109.000 0 2   LYS A CB  1 ? 
ATOM   14   C  CG  . LYS A 1 2   ? -20.244 3.872  -13.099 1.000 113.880 0 2   LYS A CG  1 ? 
ATOM   15   C  CD  . LYS A 1 2   ? -19.716 4.206  -11.724 1.000 112.110 0 2   LYS A CD  1 ? 
ATOM   16   C  CE  . LYS A 1 2   ? -20.794 4.067  -10.670 1.000 110.760 0 2   LYS A CE  1 ? 
ATOM   17   N  NZ  . LYS A 1 2   ? -20.412 4.721  -9.396  1.000 114.750 0 2   LYS A NZ  1 ? 
ATOM   18   N  N   . LEU A 1 3   ? -20.500 5.807  -16.693 1.000 80.860  0 3   LEU A N   1 ? 
ATOM   19   C  CA  . LEU A 1 3   ? -21.346 6.993  -16.748 1.000 79.410  0 3   LEU A CA  1 ? 
ATOM   20   C  C   . LEU A 1 3   ? -22.347 6.960  -17.902 1.000 82.520  0 3   LEU A C   1 ? 
ATOM   21   O  O   . LEU A 1 3   ? -23.422 7.554  -17.790 1.000 74.410  0 3   LEU A O   1 ? 
ATOM   22   C  CB  . LEU A 1 3   ? -20.440 8.220  -16.896 1.000 80.890  0 3   LEU A CB  1 ? 
ATOM   23   C  CG  . LEU A 1 3   ? -19.541 8.521  -15.698 1.000 84.330  0 3   LEU A CG  1 ? 
ATOM   24   C  CD1 . LEU A 1 3   ? -18.277 9.249  -16.137 1.000 83.830  0 3   LEU A CD1 1 ? 
ATOM   25   C  CD2 . LEU A 1 3   ? -20.304 9.327  -14.651 1.000 72.180  0 3   LEU A CD2 1 ? 
ATOM   26   N  N   . TRP A 1 4   ? -21.965 6.357  -19.037 1.000 83.740  0 4   TRP A N   1 ? 
ATOM   27   C  CA  . TRP A 1 4   ? -22.859 6.321  -20.188 1.000 84.800  0 4   TRP A CA  1 ? 
ATOM   28   C  C   . TRP A 1 4   ? -24.132 5.572  -19.801 1.000 74.890  0 4   TRP A C   1 ? 
ATOM   29   O  O   . TRP A 1 4   ? -25.238 6.049  -20.045 1.000 60.320  0 4   TRP A O   1 ? 
ATOM   30   C  CB  . TRP A 1 4   ? -22.211 5.685  -21.426 1.000 78.470  0 4   TRP A CB  1 ? 
ATOM   31   C  CG  . TRP A 1 4   ? -23.130 5.689  -22.607 1.000 80.490  0 4   TRP A CG  1 ? 
ATOM   32   C  CD1 . TRP A 1 4   ? -23.337 6.716  -23.479 1.000 89.990  0 4   TRP A CD1 1 ? 
ATOM   33   C  CD2 . TRP A 1 4   ? -24.033 4.640  -23.009 1.000 81.840  0 4   TRP A CD2 1 ? 
ATOM   34   N  NE1 . TRP A 1 4   ? -24.268 6.366  -24.422 1.000 89.540  0 4   TRP A NE1 1 ? 
ATOM   35   C  CE2 . TRP A 1 4   ? -24.721 5.101  -24.156 1.000 91.090  0 4   TRP A CE2 1 ? 
ATOM   36   C  CE3 . TRP A 1 4   ? -24.317 3.357  -22.527 1.000 82.550  0 4   TRP A CE3 1 ? 
ATOM   37   C  CZ2 . TRP A 1 4   ? -25.681 4.326  -24.817 1.000 89.870  0 4   TRP A CZ2 1 ? 
ATOM   38   C  CZ3 . TRP A 1 4   ? -25.258 2.589  -23.185 1.000 84.800  0 4   TRP A CZ3 1 ? 
ATOM   39   C  CH2 . TRP A 1 4   ? -25.933 3.070  -24.311 1.000 78.130  0 4   TRP A CH2 1 ? 
ATOM   40   N  N   . ILE A 1 5   ? -23.936 4.413  -19.162 1.000 72.660  0 5   ILE A N   1 ? 
ATOM   41   C  CA  . ILE A 1 5   ? -25.030 3.553  -18.759 1.000 75.020  0 5   ILE A CA  1 ? 
ATOM   42   C  C   . ILE A 1 5   ? -25.839 4.221  -17.643 1.000 75.990  0 5   ILE A C   1 ? 
ATOM   43   O  O   . ILE A 1 5   ? -27.061 4.092  -17.605 1.000 63.810  0 5   ILE A O   1 ? 
ATOM   44   C  CB  . ILE A 1 5   ? -24.498 2.151  -18.392 1.000 79.110  0 5   ILE A CB  1 ? 
ATOM   45   C  CG1 . ILE A 1 5   ? -25.638 1.155  -18.157 1.000 90.190  0 5   ILE A CG1 1 ? 
ATOM   46   C  CG2 . ILE A 1 5   ? -23.528 2.188  -17.226 1.000 78.660  0 5   ILE A CG2 1 ? 
ATOM   47   C  CD1 . ILE A 1 5   ? -26.531 0.937  -19.371 1.000 85.440  0 5   ILE A CD1 1 ? 
ATOM   48   N  N   . LEU A 1 6   ? -25.182 4.998  -16.772 1.000 74.580  0 6   LEU A N   1 ? 
ATOM   49   C  CA  . LEU A 1 6   ? -25.923 5.754  -15.775 1.000 67.490  0 6   LEU A CA  1 ? 
ATOM   50   C  C   . LEU A 1 6   ? -26.867 6.736  -16.454 1.000 55.620  0 6   LEU A C   1 ? 
ATOM   51   O  O   . LEU A 1 6   ? -28.031 6.829  -16.072 1.000 59.160  0 6   LEU A O   1 ? 
ATOM   52   C  CB  . LEU A 1 6   ? -24.978 6.503  -14.830 1.000 76.130  0 6   LEU A CB  1 ? 
ATOM   53   C  CG  . LEU A 1 6   ? -25.696 7.341  -13.770 1.000 74.100  0 6   LEU A CG  1 ? 
ATOM   54   C  CD1 . LEU A 1 6   ? -26.346 6.429  -12.733 1.000 71.030  0 6   LEU A CD1 1 ? 
ATOM   55   C  CD2 . LEU A 1 6   ? -24.756 8.333  -13.097 1.000 71.070  0 6   LEU A CD2 1 ? 
ATOM   56   N  N   . GLN A 1 7   ? -26.369 7.481  -17.447 1.000 57.670  0 7   GLN A N   1 ? 
ATOM   57   C  CA  . GLN A 1 7   ? -27.187 8.454  -18.167 1.000 58.690  0 7   GLN A CA  1 ? 
ATOM   58   C  C   . GLN A 1 7   ? -28.413 7.767  -18.798 1.000 65.130  0 7   GLN A C   1 ? 
ATOM   59   O  O   . GLN A 1 7   ? -29.531 8.289  -18.768 1.000 62.320  0 7   GLN A O   1 ? 
ATOM   60   C  CB  . GLN A 1 7   ? -26.312 9.156  -19.217 1.000 65.540  0 7   GLN A CB  1 ? 
ATOM   61   C  CG  . GLN A 1 7   ? -26.984 10.329 -19.921 1.000 69.970  0 7   GLN A CG  1 ? 
ATOM   62   C  CD  . GLN A 1 7   ? -27.353 11.470 -18.995 1.000 82.020  0 7   GLN A CD  1 ? 
ATOM   63   O  OE1 . GLN A 1 7   ? -26.792 11.646 -17.912 1.000 75.110  0 7   GLN A OE1 1 ? 
ATOM   64   N  NE2 . GLN A 1 7   ? -28.305 12.281 -19.429 1.000 73.040  0 7   GLN A NE2 1 ? 
ATOM   65   N  N   . LYS A 1 8   ? -28.224 6.574  -19.371 1.000 60.590  0 8   LYS A N   1 ? 
ATOM   66   C  CA  . LYS A 1 8   ? -29.308 5.920  -20.107 1.000 69.480  0 8   LYS A CA  1 ? 
ATOM   67   C  C   . LYS A 1 8   ? -30.431 5.477  -19.168 1.000 60.090  0 8   LYS A C   1 ? 
ATOM   68   O  O   . LYS A 1 8   ? -31.610 5.750  -19.410 1.000 63.080  0 8   LYS A O   1 ? 
ATOM   69   C  CB  . LYS A 1 8   ? -28.782 4.715  -20.891 1.000 65.950  0 8   LYS A CB  1 ? 
ATOM   70   C  CG  . LYS A 1 8   ? -27.961 5.035  -22.136 1.000 71.700  0 8   LYS A CG  1 ? 
ATOM   71   C  CD  . LYS A 1 8   ? -28.703 5.801  -23.239 1.000 80.010  0 8   LYS A CD  1 ? 
ATOM   72   C  CE  . LYS A 1 8   ? -28.336 7.272  -23.298 1.000 89.910  0 8   LYS A CE  1 ? 
ATOM   73   N  NZ  . LYS A 1 8   ? -28.587 7.854  -24.638 1.000 85.610  0 8   LYS A NZ  1 ? 
ATOM   74   N  N   . ILE A 1 9   ? -30.026 4.801  -18.094 1.000 59.880  0 9   ILE A N   1 ? 
ATOM   75   C  CA  . ILE A 1 9   ? -30.913 4.425  -17.006 1.000 64.980  0 9   ILE A CA  1 ? 
ATOM   76   C  C   . ILE A 1 9   ? -31.708 5.643  -16.543 1.000 64.550  0 9   ILE A C   1 ? 
ATOM   77   O  O   . ILE A 1 9   ? -32.935 5.604  -16.504 1.000 60.840  0 9   ILE A O   1 ? 
ATOM   78   C  CB  . ILE A 1 9   ? -30.075 3.798  -15.885 1.000 78.560  0 9   ILE A CB  1 ? 
ATOM   79   C  CG1 . ILE A 1 9   ? -29.489 2.462  -16.345 1.000 78.650  0 9   ILE A CG1 1 ? 
ATOM   80   C  CG2 . ILE A 1 9   ? -30.883 3.652  -14.610 1.000 88.990  0 9   ILE A CG2 1 ? 
ATOM   81   C  CD1 . ILE A 1 9   ? -28.495 1.881  -15.387 1.000 78.780  0 9   ILE A CD1 1 ? 
ATOM   82   N  N   . TYR A 1 10  ? -31.019 6.748  -16.237 1.000 64.020  0 10  TYR A N   1 ? 
ATOM   83   C  CA  . TYR A 1 10  ? -31.717 7.936  -15.774 1.000 64.770  0 10  TYR A CA  1 ? 
ATOM   84   C  C   . TYR A 1 10  ? -32.779 8.336  -16.787 1.000 55.200  0 10  TYR A C   1 ? 
ATOM   85   O  O   . TYR A 1 10  ? -33.891 8.685  -16.416 1.000 60.320  0 10  TYR A O   1 ? 
ATOM   86   C  CB  . TYR A 1 10  ? -30.778 9.127  -15.553 1.000 66.080  0 10  TYR A CB  1 ? 
ATOM   87   C  CG  . TYR A 1 10  ? -31.483 10.405 -15.164 1.000 61.920  0 10  TYR A CG  1 ? 
ATOM   88   C  CD1 . TYR A 1 10  ? -31.840 10.646 -13.847 1.000 57.440  0 10  TYR A CD1 1 ? 
ATOM   89   C  CD2 . TYR A 1 10  ? -31.775 11.386 -16.102 1.000 64.370  0 10  TYR A CD2 1 ? 
ATOM   90   C  CE1 . TYR A 1 10  ? -32.493 11.805 -13.469 1.000 56.420  0 10  TYR A CE1 1 ? 
ATOM   91   C  CE2 . TYR A 1 10  ? -32.419 12.558 -15.742 1.000 62.040  0 10  TYR A CE2 1 ? 
ATOM   92   C  CZ  . TYR A 1 10  ? -32.782 12.763 -14.424 1.000 60.620  0 10  TYR A CZ  1 ? 
ATOM   93   O  OH  . TYR A 1 10  ? -33.422 13.909 -14.052 1.000 65.210  0 10  TYR A OH  1 ? 
ATOM   94   N  N   . GLU A 1 11  ? -32.411 8.321  -18.073 1.000 63.790  0 11  GLU A N   1 ? 
ATOM   95   C  CA  . GLU A 1 11  ? -33.301 8.759  -19.136 1.000 56.760  0 11  GLU A CA  1 ? 
ATOM   96   C  C   . GLU A 1 11  ? -34.517 7.843  -19.269 1.000 51.940  0 11  GLU A C   1 ? 
ATOM   97   O  O   . GLU A 1 11  ? -35.611 8.331  -19.500 1.000 57.530  0 11  GLU A O   1 ? 
ATOM   98   C  CB  . GLU A 1 11  ? -32.528 8.843  -20.452 1.000 60.420  0 11  GLU A CB  1 ? 
ATOM   99   C  CG  . GLU A 1 11  ? -31.605 10.042 -20.465 1.000 78.300  0 11  GLU A CG  1 ? 
ATOM   100  C  CD  . GLU A 1 11  ? -30.645 10.102 -21.636 1.000 77.560  0 11  GLU A CD  1 ? 
ATOM   101  O  OE1 . GLU A 1 11  ? -30.575 9.117  -22.384 1.000 73.020  0 11  GLU A OE1 1 ? 
ATOM   102  O  OE2 . GLU A 1 11  ? -29.983 11.134 -21.786 1.000 79.040  0 11  GLU A OE2 1 ? 
ATOM   103  N  N   . ILE A 1 12  ? -34.328 6.526  -19.150 1.000 56.090  0 12  ILE A N   1 ? 
ATOM   104  C  CA  . ILE A 1 12  ? -35.459 5.607  -19.235 1.000 58.600  0 12  ILE A CA  1 ? 
ATOM   105  C  C   . ILE A 1 12  ? -36.354 5.738  -17.995 1.000 55.940  0 12  ILE A C   1 ? 
ATOM   106  O  O   . ILE A 1 12  ? -37.571 5.710  -18.131 1.000 61.230  0 12  ILE A O   1 ? 
ATOM   107  C  CB  . ILE A 1 12  ? -34.992 4.156  -19.491 1.000 64.570  0 12  ILE A CB  1 ? 
ATOM   108  C  CG1 . ILE A 1 12  ? -36.162 3.234  -19.824 1.000 71.860  0 12  ILE A CG1 1 ? 
ATOM   109  C  CG2 . ILE A 1 12  ? -34.187 3.604  -18.328 1.000 69.050  0 12  ILE A CG2 1 ? 
ATOM   110  C  CD1 . ILE A 1 12  ? -35.750 1.872  -20.334 1.000 73.200  0 12  ILE A CD1 1 ? 
ATOM   111  N  N   . MET A 1 13  ? -35.780 5.965  -16.799 1.000 56.630  0 13  MET A N   1 ? 
ATOM   112  C  CA  . MET A 1 13  ? -36.592 6.245  -15.618 1.000 55.570  0 13  MET A CA  1 ? 
ATOM   113  C  C   . MET A 1 13  ? -37.495 7.442  -15.885 1.000 55.460  0 13  MET A C   1 ? 
ATOM   114  O  O   . MET A 1 13  ? -38.684 7.438  -15.542 1.000 62.510  0 13  MET A O   1 ? 
ATOM   115  C  CB  . MET A 1 13  ? -35.742 6.531  -14.368 1.000 59.370  0 13  MET A CB  1 ? 
ATOM   116  C  CG  . MET A 1 13  ? -36.539 7.129  -13.180 1.000 58.170  0 13  MET A CG  1 ? 
ATOM   117  S  SD  . MET A 1 13  ? -35.524 7.639  -11.742 1.000 60.570  0 13  MET A SD  1 ? 
ATOM   118  C  CE  . MET A 1 13  ? -34.520 8.936  -12.478 1.000 63.090  0 13  MET A CE  1 ? 
ATOM   119  N  N   . VAL A 1 14  ? -36.929 8.486  -16.490 1.000 57.340  0 14  VAL A N   1 ? 
ATOM   120  C  CA  . VAL A 1 14  ? -37.695 9.692  -16.770 1.000 60.500  0 14  VAL A CA  1 ? 
ATOM   121  C  C   . VAL A 1 14  ? -38.737 9.383  -17.840 1.000 64.340  0 14  VAL A C   1 ? 
ATOM   122  O  O   . VAL A 1 14  ? -39.877 9.843  -17.767 1.000 61.120  0 14  VAL A O   1 ? 
ATOM   123  C  CB  . VAL A 1 14  ? -36.771 10.833 -17.234 1.000 67.580  0 14  VAL A CB  1 ? 
ATOM   124  C  CG1 . VAL A 1 14  ? -37.563 12.065 -17.638 1.000 63.840  0 14  VAL A CG1 1 ? 
ATOM   125  C  CG2 . VAL A 1 14  ? -35.721 11.185 -16.191 1.000 70.000  0 14  VAL A CG2 1 ? 
ATOM   126  N  N   . ARG A 1 15  ? -38.315 8.620  -18.860 1.000 64.300  0 15  ARG A N   1 ? 
ATOM   127  C  CA  . ARG A 1 15  ? -39.178 8.349  -20.000 1.000 70.550  0 15  ARG A CA  1 ? 
ATOM   128  C  C   . ARG A 1 15  ? -40.315 7.430  -19.557 1.000 60.330  0 15  ARG A C   1 ? 
ATOM   129  O  O   . ARG A 1 15  ? -41.473 7.630  -19.937 1.000 61.550  0 15  ARG A O   1 ? 
ATOM   130  C  CB  . ARG A 1 15  ? -38.355 7.776  -21.162 1.000 65.620  0 15  ARG A CB  1 ? 
ATOM   131  C  CG  . ARG A 1 15  ? -39.085 7.742  -22.501 1.000 75.410  0 15  ARG A CG  1 ? 
ATOM   132  C  CD  . ARG A 1 15  ? -38.153 7.268  -23.608 1.000 81.480  0 15  ARG A CD  1 ? 
ATOM   133  N  NE  . ARG A 1 15  ? -38.853 6.832  -24.815 1.000 105.890 0 15  ARG A NE  1 ? 
ATOM   134  C  CZ  . ARG A 1 15  ? -38.748 5.627  -25.389 1.000 112.690 0 15  ARG A CZ  1 ? 
ATOM   135  N  NH1 . ARG A 1 15  ? -37.965 4.689  -24.881 1.000 119.610 0 15  ARG A NH1 1 ? 
ATOM   136  N  NH2 . ARG A 1 15  ? -39.442 5.358  -26.483 1.000 103.830 0 15  ARG A NH2 1 ? 
ATOM   137  N  N   . LEU A 1 16  ? -39.993 6.434  -18.717 1.000 64.910  0 16  LEU A N   1 ? 
ATOM   138  C  CA  . LEU A 1 16  ? -41.042 5.590  -18.163 1.000 61.650  0 16  LEU A CA  1 ? 
ATOM   139  C  C   . LEU A 1 16  ? -42.121 6.442  -17.502 1.000 65.640  0 16  LEU A C   1 ? 
ATOM   140  O  O   . LEU A 1 16  ? -43.298 6.246  -17.785 1.000 64.410  0 16  LEU A O   1 ? 
ATOM   141  C  CB  . LEU A 1 16  ? -40.430 4.576  -17.204 1.000 62.590  0 16  LEU A CB  1 ? 
ATOM   142  C  CG  . LEU A 1 16  ? -39.753 3.409  -17.913 1.000 62.940  0 16  LEU A CG  1 ? 
ATOM   143  C  CD1 . LEU A 1 16  ? -38.988 2.551  -16.927 1.000 62.760  0 16  LEU A CD1 1 ? 
ATOM   144  C  CD2 . LEU A 1 16  ? -40.774 2.577  -18.682 1.000 68.720  0 16  LEU A CD2 1 ? 
ATOM   145  N  N   . ASP A 1 17  ? -41.732 7.462  -16.725 1.000 65.430  0 17  ASP A N   1 ? 
ATOM   146  C  CA  . ASP A 1 17  ? -42.727 8.247  -16.002 1.000 65.940  0 17  ASP A CA  1 ? 
ATOM   147  C  C   . ASP A 1 17  ? -43.630 9.029  -16.950 1.000 59.460  0 17  ASP A C   1 ? 
ATOM   148  O  O   . ASP A 1 17  ? -44.826 9.139  -16.701 1.000 60.120  0 17  ASP A O   1 ? 
ATOM   149  C  CB  . ASP A 1 17  ? -42.127 9.229  -14.984 1.000 64.710  0 17  ASP A CB  1 ? 
ATOM   150  C  CG  . ASP A 1 17  ? -43.185 10.032 -14.235 1.000 72.220  0 17  ASP A CG  1 ? 
ATOM   151  O  OD1 . ASP A 1 17  ? -43.883 9.440  -13.370 1.000 69.430  0 17  ASP A OD1 1 ? 
ATOM   152  O  OD2 . ASP A 1 17  ? -43.350 11.239 -14.552 1.000 76.750  0 17  ASP A OD2 1 ? 
ATOM   153  N  N   . GLU A 1 18  ? -43.077 9.654  -17.993 1.000 73.050  0 18  GLU A N   1 ? 
ATOM   154  C  CA  . GLU A 1 18  ? -43.890 10.570 -18.790 1.000 73.260  0 18  GLU A CA  1 ? 
ATOM   155  C  C   . GLU A 1 18  ? -44.849 9.806  -19.704 1.000 68.480  0 18  GLU A C   1 ? 
ATOM   156  O  O   . GLU A 1 18  ? -45.795 10.401 -20.225 1.000 66.260  0 18  GLU A O   1 ? 
ATOM   157  C  CB  . GLU A 1 18  ? -43.053 11.604 -19.549 1.000 79.560  0 18  GLU A CB  1 ? 
ATOM   158  C  CG  . GLU A 1 18  ? -41.745 11.097 -20.124 1.000 95.250  0 18  GLU A CG  1 ? 
ATOM   159  C  CD  . GLU A 1 18  ? -40.761 12.195 -20.515 1.000 107.480 0 18  GLU A CD  1 ? 
ATOM   160  O  OE1 . GLU A 1 18  ? -40.502 13.097 -19.677 1.000 105.590 0 18  GLU A OE1 1 ? 
ATOM   161  O  OE2 . GLU A 1 18  ? -40.230 12.138 -21.650 1.000 104.960 0 18  GLU A OE2 1 ? 
ATOM   162  N  N   . GLU A 1 19  ? -44.647 8.487  -19.827 1.000 75.770  0 19  GLU A N   1 ? 
ATOM   163  C  CA  . GLU A 1 19  ? -45.501 7.634  -20.643 1.000 79.910  0 19  GLU A CA  1 ? 
ATOM   164  C  C   . GLU A 1 19  ? -46.467 6.813  -19.779 1.000 83.490  0 19  GLU A C   1 ? 
ATOM   165  O  O   . GLU A 1 19  ? -47.057 5.857  -20.273 1.000 92.550  0 19  GLU A O   1 ? 
ATOM   166  C  CB  . GLU A 1 19  ? -44.616 6.711  -21.492 1.000 72.680  0 19  GLU A CB  1 ? 
ATOM   167  C  CG  . GLU A 1 19  ? -43.780 7.444  -22.534 1.000 70.180  0 19  GLU A CG  1 ? 
ATOM   168  C  CD  . GLU A 1 19  ? -42.925 6.564  -23.439 1.000 75.310  0 19  GLU A CD  1 ? 
ATOM   169  O  OE1 . GLU A 1 19  ? -43.047 5.319  -23.362 1.000 78.380  0 19  GLU A OE1 1 ? 
ATOM   170  O  OE2 . GLU A 1 19  ? -42.119 7.120  -24.221 1.000 73.350  0 19  GLU A OE2 1 ? 
ATOM   171  N  N   . GLY A 1 20  ? -46.619 7.151  -18.487 1.000 80.280  0 20  GLY A N   1 ? 
ATOM   172  C  CA  . GLY A 1 20  ? -47.587 6.487  -17.615 1.000 67.110  0 20  GLY A CA  1 ? 
ATOM   173  C  C   . GLY A 1 20  ? -47.103 5.142  -17.072 1.000 65.010  0 20  GLY A C   1 ? 
ATOM   174  O  O   . GLY A 1 20  ? -47.893 4.251  -16.772 1.000 72.570  0 20  GLY A O   1 ? 
ATOM   175  N  N   . HIS A 1 21  ? -45.792 4.990  -16.938 1.000 61.170  0 21  HIS A N   1 ? 
ATOM   176  C  CA  . HIS A 1 21  ? -45.216 3.788  -16.373 1.000 65.520  0 21  HIS A CA  1 ? 
ATOM   177  C  C   . HIS A 1 21  ? -44.524 4.149  -15.060 1.000 61.700  0 21  HIS A C   1 ? 
ATOM   178  O  O   . HIS A 1 21  ? -43.385 3.752  -14.829 1.000 62.760  0 21  HIS A O   1 ? 
ATOM   179  C  CB  . HIS A 1 21  ? -44.269 3.136  -17.384 1.000 66.560  0 21  HIS A CB  1 ? 
ATOM   180  C  CG  . HIS A 1 21  ? -44.870 2.896  -18.730 1.000 73.820  0 21  HIS A CG  1 ? 
ATOM   181  N  ND1 . HIS A 1 21  ? -46.105 2.305  -18.903 1.000 72.680  0 21  HIS A ND1 1 ? 
ATOM   182  C  CD2 . HIS A 1 21  ? -44.399 3.146  -19.967 1.000 66.000  0 21  HIS A CD2 1 ? 
ATOM   183  C  CE1 . HIS A 1 21  ? -46.371 2.214  -20.197 1.000 75.660  0 21  HIS A CE1 1 ? 
ATOM   184  N  NE2 . HIS A 1 21  ? -45.353 2.715  -20.859 1.000 75.190  0 21  HIS A NE2 1 ? 
ATOM   185  N  N   . GLY A 1 22  ? -45.259 4.862  -14.199 1.000 69.000  0 22  GLY A N   1 ? 
ATOM   186  C  CA  . GLY A 1 22  ? -44.793 5.285  -12.883 1.000 59.000  0 22  GLY A CA  1 ? 
ATOM   187  C  C   . GLY A 1 22  ? -44.126 4.173  -12.082 1.000 57.950  0 22  GLY A C   1 ? 
ATOM   188  O  O   . GLY A 1 22  ? -43.036 4.342  -11.525 1.000 62.420  0 22  GLY A O   1 ? 
ATOM   189  N  N   . GLU A 1 23  ? -44.782 3.021  -12.008 1.000 60.650  0 23  GLU A N   1 ? 
ATOM   190  C  CA  . GLU A 1 23  ? -44.270 1.968  -11.159 1.000 57.330  0 23  GLU A CA  1 ? 
ATOM   191  C  C   . GLU A 1 23  ? -42.929 1.492  -11.668 1.000 61.070  0 23  GLU A C   1 ? 
ATOM   192  O  O   . GLU A 1 23  ? -42.017 1.240  -10.885 1.000 59.970  0 23  GLU A O   1 ? 
ATOM   193  C  CB  . GLU A 1 23  ? -45.224 0.777  -11.089 1.000 65.850  0 23  GLU A CB  1 ? 
ATOM   194  C  CG  . GLU A 1 23  ? -46.078 0.796  -9.847  1.000 64.360  0 23  GLU A CG  1 ? 
ATOM   195  C  CD  . GLU A 1 23  ? -46.876 -0.465 -9.617  1.000 56.870  0 23  GLU A CD  1 ? 
ATOM   196  O  OE1 . GLU A 1 23  ? -47.808 -0.683 -10.386 1.000 62.210  0 23  GLU A OE1 1 ? 
ATOM   197  O  OE2 . GLU A 1 23  ? -46.561 -1.198 -8.653  1.000 57.700  0 23  GLU A OE2 1 ? 
ATOM   198  N  N   . ALA A 1 24  ? -42.848 1.312  -12.987 1.000 63.690  0 24  ALA A N   1 ? 
ATOM   199  C  CA  . ALA A 1 24  ? -41.594 0.902  -13.590 1.000 58.660  0 24  ALA A CA  1 ? 
ATOM   200  C  C   . ALA A 1 24  ? -40.551 1.987  -13.326 1.000 46.070  0 24  ALA A C   1 ? 
ATOM   201  O  O   . ALA A 1 24  ? -39.394 1.681  -13.059 1.000 55.250  0 24  ALA A O   1 ? 
ATOM   202  C  CB  . ALA A 1 24  ? -41.783 0.631  -15.079 1.000 55.720  0 24  ALA A CB  1 ? 
ATOM   203  N  N   . SER A 1 25  ? -40.958 3.253  -13.426 1.000 51.500  0 25  SER A N   1 ? 
ATOM   204  C  CA  . SER A 1 25  ? -40.023 4.339  -13.172 1.000 56.980  0 25  SER A CA  1 ? 
ATOM   205  C  C   . SER A 1 25  ? -39.419 4.165  -11.784 1.000 58.760  0 25  SER A C   1 ? 
ATOM   206  O  O   . SER A 1 25  ? -38.199 4.206  -11.612 1.000 64.230  0 25  SER A O   1 ? 
ATOM   207  C  CB  . SER A 1 25  ? -40.672 5.690  -13.345 1.000 54.920  0 25  SER A CB  1 ? 
ATOM   208  O  OG  . SER A 1 25  ? -39.704 6.718  -13.173 1.000 62.150  0 25  SER A OG  1 ? 
ATOM   209  N  N   . LEU A 1 26  ? -40.286 3.867  -10.807 1.000 59.030  0 26  LEU A N   1 ? 
ATOM   210  C  CA  . LEU A 1 26  ? -39.852 3.742  -9.425  1.000 53.110  0 26  LEU A CA  1 ? 
ATOM   211  C  C   . LEU A 1 26  ? -38.849 2.607  -9.271  1.000 57.340  0 26  LEU A C   1 ? 
ATOM   212  O  O   . LEU A 1 26  ? -37.914 2.689  -8.469  1.000 55.640  0 26  LEU A O   1 ? 
ATOM   213  C  CB  . LEU A 1 26  ? -41.082 3.523  -8.550  1.000 54.230  0 26  LEU A CB  1 ? 
ATOM   214  C  CG  . LEU A 1 26  ? -41.926 4.770  -8.325  1.000 53.940  0 26  LEU A CG  1 ? 
ATOM   215  C  CD1 . LEU A 1 26  ? -43.238 4.402  -7.658  1.000 57.140  0 26  LEU A CD1 1 ? 
ATOM   216  C  CD2 . LEU A 1 26  ? -41.164 5.770  -7.472  1.000 60.150  0 26  LEU A CD2 1 ? 
ATOM   217  N  N   . MET A 1 27  ? -38.994 1.576  -10.101 1.000 58.020  0 27  MET A N   1 ? 
ATOM   218  C  CA  . MET A 1 27  ? -38.137 0.409  -9.959  1.000 55.270  0 27  MET A CA  1 ? 
ATOM   219  C  C   . MET A 1 27  ? -36.766 0.715  -10.565 1.000 50.000  0 27  MET A C   1 ? 
ATOM   220  O  O   . MET A 1 27  ? -35.754 0.212  -10.079 1.000 56.780  0 27  MET A O   1 ? 
ATOM   221  C  CB  . MET A 1 27  ? -38.787 -0.805 -10.635 1.000 60.690  0 27  MET A CB  1 ? 
ATOM   222  C  CG  . MET A 1 27  ? -40.070 -1.270 -9.935  1.000 63.360  0 27  MET A CG  1 ? 
ATOM   223  S  SD  . MET A 1 27  ? -41.112 -2.366 -10.968 1.000 68.490  0 27  MET A SD  1 ? 
ATOM   224  C  CE  . MET A 1 27  ? -39.940 -3.693 -11.292 1.000 55.080  0 27  MET A CE  1 ? 
ATOM   225  N  N   . VAL A 1 28  ? -36.735 1.549  -11.615 1.000 53.850  0 28  VAL A N   1 ? 
ATOM   226  C  CA  . VAL A 1 28  ? -35.471 2.003  -12.191 1.000 56.300  0 28  VAL A CA  1 ? 
ATOM   227  C  C   . VAL A 1 28  ? -34.803 2.966  -11.210 1.000 53.500  0 28  VAL A C   1 ? 
ATOM   228  O  O   . VAL A 1 28  ? -33.625 2.791  -10.888 1.000 59.490  0 28  VAL A O   1 ? 
ATOM   229  C  CB  . VAL A 1 28  ? -35.631 2.620  -13.595 1.000 59.550  0 28  VAL A CB  1 ? 
ATOM   230  C  CG1 . VAL A 1 28  ? -34.271 2.926  -14.233 1.000 53.960  0 28  VAL A CG1 1 ? 
ATOM   231  C  CG2 . VAL A 1 28  ? -36.434 1.718  -14.527 1.000 57.350  0 28  VAL A CG2 1 ? 
ATOM   232  N  N   . SER A 1 29  ? -35.574 3.898  -10.636 1.000 57.220  0 29  SER A N   1 ? 
ATOM   233  C  CA  . SER A 1 29  ? -35.064 4.666  -9.502  1.000 61.760  0 29  SER A CA  1 ? 
ATOM   234  C  C   . SER A 1 29  ? -34.223 3.779  -8.575  1.000 55.420  0 29  SER A C   1 ? 
ATOM   235  O  O   . SER A 1 29  ? -33.070 4.082  -8.267  1.000 59.720  0 29  SER A O   1 ? 
ATOM   236  C  CB  . SER A 1 29  ? -36.151 5.367  -8.739  1.000 60.220  0 29  SER A CB  1 ? 
ATOM   237  O  OG  . SER A 1 29  ? -35.601 6.076  -7.638  1.000 62.240  0 29  SER A OG  1 ? 
ATOM   238  N  N   . ASP A 1 30  ? -34.777 2.653  -8.152  1.000 50.270  0 30  ASP A N   1 ? 
ATOM   239  C  CA  . ASP A 1 30  ? -34.083 1.788  -7.210  1.000 55.190  0 30  ASP A CA  1 ? 
ATOM   240  C  C   . ASP A 1 30  ? -32.754 1.290  -7.769  1.000 53.550  0 30  ASP A C   1 ? 
ATOM   241  O  O   . ASP A 1 30  ? -31.812 1.082  -7.009  1.000 54.730  0 30  ASP A O   1 ? 
ATOM   242  C  CB  . ASP A 1 30  ? -34.941 0.587  -6.804  1.000 56.470  0 30  ASP A CB  1 ? 
ATOM   243  C  CG  . ASP A 1 30  ? -36.172 0.955  -5.991  1.000 66.400  0 30  ASP A CG  1 ? 
ATOM   244  O  OD1 . ASP A 1 30  ? -36.148 2.017  -5.329  1.000 66.860  0 30  ASP A OD1 1 ? 
ATOM   245  O  OD2 . ASP A 1 30  ? -37.150 0.179  -6.037  1.000 62.700  0 30  ASP A OD2 1 ? 
ATOM   246  N  N   . LEU A 1 31  ? -32.705 1.049  -9.086  1.000 61.450  0 31  LEU A N   1 ? 
ATOM   247  C  CA  . LEU A 1 31  ? -31.502 0.541  -9.726  1.000 60.420  0 31  LEU A CA  1 ? 
ATOM   248  C  C   . LEU A 1 31  ? -30.428 1.623  -9.719  1.000 53.620  0 31  LEU A C   1 ? 
ATOM   249  O  O   . LEU A 1 31  ? -29.280 1.320  -9.466  1.000 57.510  0 31  LEU A O   1 ? 
ATOM   250  C  CB  . LEU A 1 31  ? -31.814 0.106  -11.161 1.000 62.520  0 31  LEU A CB  1 ? 
ATOM   251  C  CG  . LEU A 1 31  ? -30.605 -0.364 -11.970 1.000 66.330  0 31  LEU A CG  1 ? 
ATOM   252  C  CD1 . LEU A 1 31  ? -29.947 -1.577 -11.322 1.000 63.530  0 31  LEU A CD1 1 ? 
ATOM   253  C  CD2 . LEU A 1 31  ? -31.015 -0.687 -13.391 1.000 67.730  0 31  LEU A CD2 1 ? 
ATOM   254  N  N   . ILE A 1 32  ? -30.813 2.878  -9.970  1.000 57.030  0 32  ILE A N   1 ? 
ATOM   255  C  CA  . ILE A 1 32  ? -29.867 3.982  -9.912  1.000 58.550  0 32  ILE A CA  1 ? 
ATOM   256  C  C   . ILE A 1 32  ? -29.195 4.008  -8.540  1.000 67.430  0 32  ILE A C   1 ? 
ATOM   257  O  O   . ILE A 1 32  ? -27.967 3.952  -8.444  1.000 65.970  0 32  ILE A O   1 ? 
ATOM   258  C  CB  . ILE A 1 32  ? -30.540 5.316  -10.268 1.000 64.140  0 32  ILE A CB  1 ? 
ATOM   259  C  CG1 . ILE A 1 32  ? -30.961 5.317  -11.746 1.000 62.230  0 32  ILE A CG1 1 ? 
ATOM   260  C  CG2 . ILE A 1 32  ? -29.610 6.484  -9.926  1.000 64.000  0 32  ILE A CG2 1 ? 
ATOM   261  C  CD1 . ILE A 1 32  ? -31.878 6.451  -12.157 1.000 64.450  0 32  ILE A CD1 1 ? 
ATOM   262  N  N   . TYR A 1 33  ? -30.008 4.064  -7.479  1.000 66.290  0 33  TYR A N   1 ? 
ATOM   263  C  CA  . TYR A 1 33  ? -29.473 4.003  -6.130  1.000 58.180  0 33  TYR A CA  1 ? 
ATOM   264  C  C   . TYR A 1 33  ? -28.466 2.865  -6.014  1.000 61.670  0 33  TYR A C   1 ? 
ATOM   265  O  O   . TYR A 1 33  ? -27.381 3.050  -5.478  1.000 58.820  0 33  TYR A O   1 ? 
ATOM   266  C  CB  . TYR A 1 33  ? -30.568 3.797  -5.077  1.000 62.020  0 33  TYR A CB  1 ? 
ATOM   267  C  CG  . TYR A 1 33  ? -29.983 3.475  -3.729  1.000 56.430  0 33  TYR A CG  1 ? 
ATOM   268  C  CD1 . TYR A 1 33  ? -29.372 4.454  -2.954  1.000 56.850  0 33  TYR A CD1 1 ? 
ATOM   269  C  CD2 . TYR A 1 33  ? -29.909 2.162  -3.302  1.000 50.640  0 33  TYR A CD2 1 ? 
ATOM   270  C  CE1 . TYR A 1 33  ? -28.786 4.139  -1.739  1.000 55.390  0 33  TYR A CE1 1 ? 
ATOM   271  C  CE2 . TYR A 1 33  ? -29.323 1.832  -2.097  1.000 53.920  0 33  TYR A CE2 1 ? 
ATOM   272  C  CZ  . TYR A 1 33  ? -28.742 2.816  -1.321  1.000 55.800  0 33  TYR A CZ  1 ? 
ATOM   273  O  OH  . TYR A 1 33  ? -28.161 2.418  -0.140  1.000 56.020  0 33  TYR A OH  1 ? 
ATOM   274  N  N   . GLU A 1 34  ? -28.842 1.670  -6.480  1.000 64.180  0 34  GLU A N   1 ? 
ATOM   275  C  CA  . GLU A 1 34  ? -28.019 0.487  -6.263  1.000 69.260  0 34  GLU A CA  1 ? 
ATOM   276  C  C   . GLU A 1 34  ? -26.704 0.644  -7.028  1.000 66.250  0 34  GLU A C   1 ? 
ATOM   277  O  O   . GLU A 1 34  ? -25.629 0.329  -6.521  1.000 71.270  0 34  GLU A O   1 ? 
ATOM   278  C  CB  . GLU A 1 34  ? -28.757 -0.777 -6.722  1.000 81.120  0 34  GLU A CB  1 ? 
ATOM   279  C  CG  . GLU A 1 34  ? -28.448 -2.001 -5.884  1.000 91.820  0 34  GLU A CG  1 ? 
ATOM   280  C  CD  . GLU A 1 34  ? -28.996 -1.896 -4.468  1.000 109.480 0 34  GLU A CD  1 ? 
ATOM   281  O  OE1 . GLU A 1 34  ? -30.231 -1.747 -4.329  1.000 114.770 0 34  GLU A OE1 1 ? 
ATOM   282  O  OE2 . GLU A 1 34  ? -28.190 -1.931 -3.506  1.000 106.330 0 34  GLU A OE2 1 ? 
ATOM   283  N  N   . PHE A 1 35  ? -26.813 1.132  -8.264  1.000 65.720  0 35  PHE A N   1 ? 
ATOM   284  C  CA  . PHE A 1 35  ? -25.678 1.231  -9.162  1.000 72.660  0 35  PHE A CA  1 ? 
ATOM   285  C  C   . PHE A 1 35  ? -24.691 2.301  -8.684  1.000 66.390  0 35  PHE A C   1 ? 
ATOM   286  O  O   . PHE A 1 35  ? -23.492 2.111  -8.821  1.000 64.670  0 35  PHE A O   1 ? 
ATOM   287  C  CB  . PHE A 1 35  ? -26.163 1.487  -10.595 1.000 72.690  0 35  PHE A CB  1 ? 
ATOM   288  C  CG  . PHE A 1 35  ? -25.063 1.546  -11.630 1.000 78.970  0 35  PHE A CG  1 ? 
ATOM   289  C  CD1 . PHE A 1 35  ? -24.023 0.623  -11.622 1.000 79.700  0 35  PHE A CD1 1 ? 
ATOM   290  C  CD2 . PHE A 1 35  ? -25.070 2.513  -12.628 1.000 75.410  0 35  PHE A CD2 1 ? 
ATOM   291  C  CE1 . PHE A 1 35  ? -23.013 0.675  -12.577 1.000 84.000  0 35  PHE A CE1 1 ? 
ATOM   292  C  CE2 . PHE A 1 35  ? -24.059 2.564  -13.578 1.000 81.790  0 35  PHE A CE2 1 ? 
ATOM   293  C  CZ  . PHE A 1 35  ? -23.032 1.645  -13.551 1.000 76.910  0 35  PHE A CZ  1 ? 
ATOM   294  N  N   . MET A 1 36  ? -25.182 3.416  -8.126  1.000 74.350  0 36  MET A N   1 ? 
ATOM   295  C  CA  . MET A 1 36  ? -24.308 4.522  -7.752  1.000 74.080  0 36  MET A CA  1 ? 
ATOM   296  C  C   . MET A 1 36  ? -23.646 4.288  -6.395  1.000 89.130  0 36  MET A C   1 ? 
ATOM   297  O  O   . MET A 1 36  ? -22.496 4.670  -6.200  1.000 97.000  0 36  MET A O   1 ? 
ATOM   298  C  CB  . MET A 1 36  ? -25.094 5.821  -7.711  1.000 64.710  0 36  MET A CB  1 ? 
ATOM   299  C  CG  . MET A 1 36  ? -25.470 6.266  -9.092  1.000 71.670  0 36  MET A CG  1 ? 
ATOM   300  S  SD  . MET A 1 36  ? -26.245 7.876  -9.079  1.000 86.900  0 36  MET A SD  1 ? 
ATOM   301  C  CE  . MET A 1 36  ? -24.865 8.852  -8.476  1.000 90.660  0 36  MET A CE  1 ? 
ATOM   302  N  N   . LYS A 1 37  ? -24.372 3.648  -5.472  1.000 99.630  0 37  LYS A N   1 ? 
ATOM   303  C  CA  . LYS A 1 37  ? -23.827 3.240  -4.185  1.000 108.640 0 37  LYS A CA  1 ? 
ATOM   304  C  C   . LYS A 1 37  ? -22.576 2.380  -4.386  1.000 113.900 0 37  LYS A C   1 ? 
ATOM   305  O  O   . LYS A 1 37  ? -21.713 2.326  -3.515  1.000 109.290 0 37  LYS A O   1 ? 
ATOM   306  C  CB  . LYS A 1 37  ? -24.903 2.460  -3.423  1.000 105.920 0 37  LYS A CB  1 ? 
ATOM   307  C  CG  . LYS A 1 37  ? -24.562 2.039  -2.001  1.000 112.440 0 37  LYS A CG  1 ? 
ATOM   308  C  CD  . LYS A 1 37  ? -25.510 0.978  -1.484  1.000 120.160 0 37  LYS A CD  1 ? 
ATOM   309  C  CE  . LYS A 1 37  ? -25.461 0.800  0.018   1.000 128.250 0 37  LYS A CE  1 ? 
ATOM   310  N  NZ  . LYS A 1 37  ? -26.477 -0.175 0.480   1.000 132.820 0 37  LYS A NZ  1 ? 
ATOM   311  N  N   . ARG A 1 38  ? -22.477 1.733  -5.555  1.000 123.460 0 38  ARG A N   1 ? 
ATOM   312  C  CA  . ARG A 1 38  ? -21.565 0.620  -5.774  1.000 126.530 0 38  ARG A CA  1 ? 
ATOM   313  C  C   . ARG A 1 38  ? -20.199 1.117  -6.250  1.000 139.710 0 38  ARG A C   1 ? 
ATOM   314  O  O   . ARG A 1 38  ? -20.035 2.294  -6.573  1.000 144.790 0 38  ARG A O   1 ? 
ATOM   315  C  CB  . ARG A 1 38  ? -22.180 -0.321 -6.816  1.000 114.010 0 38  ARG A CB  1 ? 
ATOM   316  C  CG  . ARG A 1 38  ? -21.777 -1.780 -6.675  1.000 103.560 0 38  ARG A CG  1 ? 
ATOM   317  C  CD  . ARG A 1 38  ? -22.290 -2.616 -7.828  1.000 98.030  0 38  ARG A CD  1 ? 
ATOM   318  N  NE  . ARG A 1 38  ? -21.620 -3.906 -7.868  1.000 97.530  0 38  ARG A NE  1 ? 
ATOM   319  C  CZ  . ARG A 1 38  ? -20.650 -4.241 -8.716  1.000 106.510 0 38  ARG A CZ  1 ? 
ATOM   320  N  NH1 . ARG A 1 38  ? -20.237 -3.389 -9.642  1.000 98.820  0 38  ARG A NH1 1 ? 
ATOM   321  N  NH2 . ARG A 1 38  ? -20.091 -5.439 -8.631  1.000 107.320 0 38  ARG A NH2 1 ? 
ATOM   322  N  N   . ASP A 1 39  ? -19.228 0.189  -6.253  1.000 147.200 0 39  ASP A N   1 ? 
ATOM   323  C  CA  . ASP A 1 39  ? -17.956 0.315  -6.952  1.000 148.150 0 39  ASP A CA  1 ? 
ATOM   324  C  C   . ASP A 1 39  ? -18.083 1.323  -8.106  1.000 153.460 0 39  ASP A C   1 ? 
ATOM   325  O  O   . ASP A 1 39  ? -18.848 1.026  -9.047  1.000 172.180 0 39  ASP A O   1 ? 
ATOM   326  C  CB  . ASP A 1 39  ? -17.505 -1.075 -7.423  1.000 140.240 0 39  ASP A CB  1 ? 
ATOM   327  C  CG  . ASP A 1 39  ? -16.303 -1.097 -8.352  1.000 139.450 0 39  ASP A CG  1 ? 
ATOM   328  O  OD1 . ASP A 1 39  ? -16.401 -0.530 -9.463  1.000 130.370 0 39  ASP A OD1 1 ? 
ATOM   329  O  OD2 . ASP A 1 39  ? -15.286 -1.708 -7.972  1.000 131.130 0 39  ASP A OD2 1 ? 
ATOM   330  O  OXT . ASP A 1 39  ? -17.416 2.375  -8.022  1.000 135.000 0 39  ASP A OXT 1 ? 
ATOM   331  N  N   . ASN B 2 2   ? -52.459 20.285 27.692  1.000 102.730 0 334 ASN B N   1 ? 
ATOM   332  C  CA  . ASN B 2 2   ? -52.777 19.336 28.794  1.000 106.310 0 334 ASN B CA  1 ? 
ATOM   333  C  C   . ASN B 2 2   ? -52.678 17.890 28.305  1.000 108.700 0 334 ASN B C   1 ? 
ATOM   334  O  O   . ASN B 2 2   ? -51.895 17.109 28.839  1.000 111.920 0 334 ASN B O   1 ? 
ATOM   335  C  CB  . ASN B 2 2   ? -54.159 19.595 29.400  1.000 105.750 0 334 ASN B CB  1 ? 
ATOM   336  C  CG  . ASN B 2 2   ? -54.656 18.399 30.183  1.000 107.680 0 334 ASN B CG  1 ? 
ATOM   337  O  OD1 . ASN B 2 2   ? -54.034 17.995 31.165  1.000 97.420  0 334 ASN B OD1 1 ? 
ATOM   338  N  ND2 . ASN B 2 2   ? -55.743 17.797 29.726  1.000 108.140 0 334 ASN B ND2 1 ? 
ATOM   339  N  N   . LEU B 2 3   ? -53.502 17.519 27.329  1.000 99.340  0 335 LEU B N   1 ? 
ATOM   340  C  CA  . LEU B 2 3   ? -53.393 16.183 26.746  1.000 95.950  0 335 LEU B CA  1 ? 
ATOM   341  C  C   . LEU B 2 3   ? -52.508 16.290 25.536  1.000 78.500  0 335 LEU B C   1 ? 
ATOM   342  O  O   . LEU B 2 3   ? -52.632 17.221 24.759  1.000 80.600  0 335 LEU B O   1 ? 
ATOM   343  C  CB  . LEU B 2 3   ? -54.744 15.611 26.372  1.000 95.980  0 335 LEU B CB  1 ? 
ATOM   344  C  CG  . LEU B 2 3   ? -54.686 14.151 25.943  1.000 94.290  0 335 LEU B CG  1 ? 
ATOM   345  C  CD1 . LEU B 2 3   ? -55.961 13.436 26.356  1.000 90.570  0 335 LEU B CD1 1 ? 
ATOM   346  C  CD2 . LEU B 2 3   ? -54.468 14.059 24.443  1.000 91.800  0 335 LEU B CD2 1 ? 
ATOM   347  N  N   . CYS B 2 4   ? -51.627 15.333 25.349  1.000 76.130  0 336 CYS B N   1 ? 
ATOM   348  C  CA  . CYS B 2 4   ? -50.645 15.454 24.280  1.000 75.950  0 336 CYS B CA  1 ? 
ATOM   349  C  C   . CYS B 2 4   ? -51.340 15.370 22.920  1.000 64.360  0 336 CYS B C   1 ? 
ATOM   350  O  O   . CYS B 2 4   ? -52.146 14.465 22.693  1.000 64.630  0 336 CYS B O   1 ? 
ATOM   351  C  CB  . CYS B 2 4   ? -49.566 14.382 24.398  1.000 76.910  0 336 CYS B CB  1 ? 
ATOM   352  S  SG  . CYS B 2 4   ? -48.428 14.613 25.795  1.000 73.940  0 336 CYS B SG  1 ? 
ATOM   353  N  N   . PRO B 2 5   ? -51.068 16.312 21.985  1.000 64.190  0 337 PRO B N   1 ? 
ATOM   354  C  CA  . PRO B 2 5   ? -51.723 16.334 20.677  1.000 65.130  0 337 PRO B CA  1 ? 
ATOM   355  C  C   . PRO B 2 5   ? -51.159 15.357 19.643  1.000 68.020  0 337 PRO B C   1 ? 
ATOM   356  O  O   . PRO B 2 5   ? -50.588 15.772 18.638  1.000 81.970  0 337 PRO B O   1 ? 
ATOM   357  C  CB  . PRO B 2 5   ? -51.483 17.785 20.226  1.000 61.660  0 337 PRO B CB  1 ? 
ATOM   358  C  CG  . PRO B 2 5   ? -50.118 18.104 20.775  1.000 60.050  0 337 PRO B CG  1 ? 
ATOM   359  C  CD  . PRO B 2 5   ? -50.120 17.431 22.136  1.000 71.920  0 337 PRO B CD  1 ? 
ATOM   360  N  N   . PHE B 2 6   ? -51.362 14.055 19.871  1.000 67.450  0 338 PHE B N   1 ? 
ATOM   361  C  CA  . PHE B 2 6   ? -50.917 13.038 18.932  1.000 74.330  0 338 PHE B CA  1 ? 
ATOM   362  C  C   . PHE B 2 6   ? -51.881 12.943 17.757  1.000 71.380  0 338 PHE B C   1 ? 
ATOM   363  O  O   . PHE B 2 6   ? -51.448 12.758 16.623  1.000 72.820  0 338 PHE B O   1 ? 
ATOM   364  C  CB  . PHE B 2 6   ? -50.781 11.681 19.617  1.000 79.280  0 338 PHE B CB  1 ? 
ATOM   365  C  CG  . PHE B 2 6   ? -49.658 11.611 20.614  1.000 74.340  0 338 PHE B CG  1 ? 
ATOM   366  C  CD1 . PHE B 2 6   ? -48.349 11.815 20.212  1.000 79.380  0 338 PHE B CD1 1 ? 
ATOM   367  C  CD2 . PHE B 2 6   ? -49.913 11.350 21.950  1.000 86.840  0 338 PHE B CD2 1 ? 
ATOM   368  C  CE1 . PHE B 2 6   ? -47.312 11.755 21.128  1.000 79.290  0 338 PHE B CE1 1 ? 
ATOM   369  C  CE2 . PHE B 2 6   ? -48.875 11.288 22.864  1.000 89.000  0 338 PHE B CE2 1 ? 
ATOM   370  C  CZ  . PHE B 2 6   ? -47.578 11.493 22.451  1.000 87.250  0 338 PHE B CZ  1 ? 
ATOM   371  N  N   . HIS B 2 7   ? -53.181 13.072 18.033  1.000 69.390  0 339 HIS B N   1 ? 
ATOM   372  C  CA  . HIS B 2 7   ? -54.186 13.040 16.984  1.000 78.030  0 339 HIS B CA  1 ? 
ATOM   373  C  C   . HIS B 2 7   ? -53.739 13.917 15.812  1.000 73.490  0 339 HIS B C   1 ? 
ATOM   374  O  O   . HIS B 2 7   ? -53.806 13.494 14.662  1.000 77.090  0 339 HIS B O   1 ? 
ATOM   375  C  CB  . HIS B 2 7   ? -55.569 13.412 17.535  1.000 82.400  0 339 HIS B CB  1 ? 
ATOM   376  C  CG  . HIS B 2 7   ? -56.636 13.477 16.489  1.000 95.350  0 339 HIS B CG  1 ? 
ATOM   377  N  ND1 . HIS B 2 7   ? -57.162 12.363 15.862  1.000 91.540  0 339 HIS B ND1 1 ? 
ATOM   378  C  CD2 . HIS B 2 7   ? -57.269 14.542 15.961  1.000 98.290  0 339 HIS B CD2 1 ? 
ATOM   379  C  CE1 . HIS B 2 7   ? -58.084 12.751 14.989  1.000 95.510  0 339 HIS B CE1 1 ? 
ATOM   380  N  NE2 . HIS B 2 7   ? -58.160 14.070 15.028  1.000 102.190 0 339 HIS B NE2 1 ? 
ATOM   381  N  N   . GLU B 2 8   ? -53.256 15.125 16.100  1.000 64.760  0 340 GLU B N   1 ? 
ATOM   382  C  CA  . GLU B 2 8   ? -52.907 16.082 15.059  1.000 72.390  0 340 GLU B CA  1 ? 
ATOM   383  C  C   . GLU B 2 8   ? -51.670 15.654 14.266  1.000 77.150  0 340 GLU B C   1 ? 
ATOM   384  O  O   . GLU B 2 8   ? -51.499 16.093 13.131  1.000 76.110  0 340 GLU B O   1 ? 
ATOM   385  C  CB  . GLU B 2 8   ? -52.763 17.468 15.692  1.000 88.060  0 340 GLU B CB  1 ? 
ATOM   386  C  CG  . GLU B 2 8   ? -54.100 17.995 16.208  1.000 103.880 0 340 GLU B CG  1 ? 
ATOM   387  C  CD  . GLU B 2 8   ? -54.070 19.336 16.922  1.000 114.710 0 340 GLU B CD  1 ? 
ATOM   388  O  OE1 . GLU B 2 8   ? -52.966 19.829 17.212  1.000 128.580 0 340 GLU B OE1 1 ? 
ATOM   389  O  OE2 . GLU B 2 8   ? -55.162 19.885 17.189  1.000 120.220 0 340 GLU B OE2 1 ? 
ATOM   390  N  N   . VAL B 2 9   ? -50.805 14.813 14.848  1.000 69.720  0 341 VAL B N   1 ? 
ATOM   391  C  CA  . VAL B 2 9   ? -49.681 14.263 14.104  1.000 72.000  0 341 VAL B CA  1 ? 
ATOM   392  C  C   . VAL B 2 9   ? -50.200 13.156 13.190  1.000 65.130  0 341 VAL B C   1 ? 
ATOM   393  O  O   . VAL B 2 9   ? -49.984 13.179 11.986  1.000 62.900  0 341 VAL B O   1 ? 
ATOM   394  C  CB  . VAL B 2 9   ? -48.570 13.724 15.030  1.000 69.790  0 341 VAL B CB  1 ? 
ATOM   395  C  CG1 . VAL B 2 9   ? -47.433 13.092 14.243  1.000 67.430  0 341 VAL B CG1 1 ? 
ATOM   396  C  CG2 . VAL B 2 9   ? -48.030 14.792 15.976  1.000 70.780  0 341 VAL B CG2 1 ? 
ATOM   397  N  N   . PHE B 2 10  ? -50.876 12.172 13.783  1.000 62.810  0 342 PHE B N   1 ? 
ATOM   398  C  CA  . PHE B 2 10  ? -51.307 10.999 13.047  1.000 64.770  0 342 PHE B CA  1 ? 
ATOM   399  C  C   . PHE B 2 10  ? -52.398 11.340 12.031  1.000 66.490  0 342 PHE B C   1 ? 
ATOM   400  O  O   . PHE B 2 10  ? -52.427 10.720 10.966  1.000 79.330  0 342 PHE B O   1 ? 
ATOM   401  C  CB  . PHE B 2 10  ? -51.775 9.902  14.000  1.000 59.780  0 342 PHE B CB  1 ? 
ATOM   402  C  CG  . PHE B 2 10  ? -50.667 9.220  14.743  1.000 55.670  0 342 PHE B CG  1 ? 
ATOM   403  C  CD1 . PHE B 2 10  ? -50.134 9.777  15.895  1.000 62.320  0 342 PHE B CD1 1 ? 
ATOM   404  C  CD2 . PHE B 2 10  ? -50.114 8.042  14.265  1.000 53.040  0 342 PHE B CD2 1 ? 
ATOM   405  C  CE1 . PHE B 2 10  ? -49.098 9.153  16.574  1.000 59.450  0 342 PHE B CE1 1 ? 
ATOM   406  C  CE2 . PHE B 2 10  ? -49.066 7.430  14.930  1.000 51.780  0 342 PHE B CE2 1 ? 
ATOM   407  C  CZ  . PHE B 2 10  ? -48.555 7.987  16.087  1.000 58.160  0 342 PHE B CZ  1 ? 
ATOM   408  N  N   . ASN B 2 11  ? -53.264 12.321 12.335  1.000 66.870  0 343 ASN B N   1 ? 
ATOM   409  C  CA  . ASN B 2 11  ? -54.477 12.549 11.555  1.000 69.240  0 343 ASN B CA  1 ? 
ATOM   410  C  C   . ASN B 2 11  ? -54.372 13.813 10.702  1.000 66.110  0 343 ASN B C   1 ? 
ATOM   411  O  O   . ASN B 2 11  ? -55.367 14.257 10.131  1.000 71.760  0 343 ASN B O   1 ? 
ATOM   412  C  CB  . ASN B 2 11  ? -55.728 12.616 12.441  1.000 80.380  0 343 ASN B CB  1 ? 
ATOM   413  C  CG  . ASN B 2 11  ? -57.033 12.465 11.679  1.000 84.320  0 343 ASN B CG  1 ? 
ATOM   414  O  OD1 . ASN B 2 11  ? -57.344 11.378 11.195  1.000 82.790  0 343 ASN B OD1 1 ? 
ATOM   415  N  ND2 . ASN B 2 11  ? -57.813 13.533 11.586  1.000 83.030  0 343 ASN B ND2 1 ? 
ATOM   416  N  N   . ALA B 2 12  ? -53.167 14.363 10.559  1.000 65.630  0 344 ALA B N   1 ? 
ATOM   417  C  CA  . ALA B 2 12  ? -52.952 15.508 9.682   1.000 62.510  0 344 ALA B CA  1 ? 
ATOM   418  C  C   . ALA B 2 12  ? -53.434 15.198 8.263   1.000 70.460  0 344 ALA B C   1 ? 
ATOM   419  O  O   . ALA B 2 12  ? -53.352 14.056 7.815   1.000 66.610  0 344 ALA B O   1 ? 
ATOM   420  C  CB  . ALA B 2 12  ? -51.490 15.867 9.692   1.000 59.960  0 344 ALA B CB  1 ? 
ATOM   421  N  N   . THR B 2 13  ? -53.918 16.233 7.559   1.000 65.880  0 345 THR B N   1 ? 
ATOM   422  C  CA  . THR B 2 13  ? -54.520 16.083 6.246   1.000 67.270  0 345 THR B CA  1 ? 
ATOM   423  C  C   . THR B 2 13  ? -53.482 15.601 5.237   1.000 66.480  0 345 THR B C   1 ? 
ATOM   424  O  O   . THR B 2 13  ? -53.704 14.591 4.573   1.000 65.390  0 345 THR B O   1 ? 
ATOM   425  C  CB  . THR B 2 13  ? -55.199 17.390 5.823   1.000 76.190  0 345 THR B CB  1 ? 
ATOM   426  O  OG1 . THR B 2 13  ? -56.296 17.539 6.721   1.000 76.660  0 345 THR B OG1 1 ? 
ATOM   427  C  CG2 . THR B 2 13  ? -55.704 17.396 4.396   1.000 82.330  0 345 THR B CG2 1 ? 
ATOM   428  N  N   . THR B 2 14  ? -52.365 16.329 5.136   1.000 63.930  0 346 THR B N   1 ? 
ATOM   429  C  CA  . THR B 2 14  ? -51.214 15.884 4.375   1.000 64.050  0 346 THR B CA  1 ? 
ATOM   430  C  C   . THR B 2 14  ? -49.997 15.759 5.283   1.000 65.360  0 346 THR B C   1 ? 
ATOM   431  O  O   . THR B 2 14  ? -49.951 16.357 6.353   1.000 64.050  0 346 THR B O   1 ? 
ATOM   432  C  CB  . THR B 2 14  ? -50.913 16.812 3.195   1.000 69.020  0 346 THR B CB  1 ? 
ATOM   433  O  OG1 . THR B 2 14  ? -50.488 18.066 3.720   1.000 69.530  0 346 THR B OG1 1 ? 
ATOM   434  C  CG2 . THR B 2 14  ? -52.106 16.989 2.283   1.000 79.230  0 346 THR B CG2 1 ? 
ATOM   435  N  N   . PHE B 2 15  ? -49.022 14.966 4.812   1.000 57.530  0 347 PHE B N   1 ? 
ATOM   436  C  CA  . PHE B 2 15  ? -47.786 14.697 5.520   1.000 51.240  0 347 PHE B CA  1 ? 
ATOM   437  C  C   . PHE B 2 15  ? -46.642 15.334 4.750   1.000 50.820  0 347 PHE B C   1 ? 
ATOM   438  O  O   . PHE B 2 15  ? -46.837 15.790 3.624   1.000 57.020  0 347 PHE B O   1 ? 
ATOM   439  C  CB  . PHE B 2 15  ? -47.569 13.186 5.673   1.000 50.550  0 347 PHE B CB  1 ? 
ATOM   440  C  CG  . PHE B 2 15  ? -48.070 12.561 6.960   1.000 50.080  0 347 PHE B CG  1 ? 
ATOM   441  C  CD1 . PHE B 2 15  ? -49.312 12.883 7.479   1.000 54.840  0 347 PHE B CD1 1 ? 
ATOM   442  C  CD2 . PHE B 2 15  ? -47.324 11.590 7.613   1.000 53.340  0 347 PHE B CD2 1 ? 
ATOM   443  C  CE1 . PHE B 2 15  ? -49.781 12.276 8.634   1.000 59.570  0 347 PHE B CE1 1 ? 
ATOM   444  C  CE2 . PHE B 2 15  ? -47.792 10.987 8.772   1.000 55.460  0 347 PHE B CE2 1 ? 
ATOM   445  C  CZ  . PHE B 2 15  ? -49.020 11.336 9.284   1.000 55.080  0 347 PHE B CZ  1 ? 
ATOM   446  N  N   . ALA B 2 16  ? -45.456 15.344 5.359   1.000 50.890  0 348 ALA B N   1 ? 
ATOM   447  C  CA  . ALA B 2 16  ? -44.265 15.901 4.727   1.000 50.360  0 348 ALA B CA  1 ? 
ATOM   448  C  C   . ALA B 2 16  ? -43.683 14.902 3.736   1.000 53.410  0 348 ALA B C   1 ? 
ATOM   449  O  O   . ALA B 2 16  ? -43.949 13.707 3.843   1.000 57.230  0 348 ALA B O   1 ? 
ATOM   450  C  CB  . ALA B 2 16  ? -43.234 16.245 5.768   1.000 48.620  0 348 ALA B CB  1 ? 
ATOM   451  N  N   . SER B 2 17  ? -42.883 15.406 2.785   1.000 50.350  0 349 SER B N   1 ? 
ATOM   452  C  CA  . SER B 2 17  ? -42.010 14.566 1.987   1.000 49.650  0 349 SER B CA  1 ? 
ATOM   453  C  C   . SER B 2 17  ? -40.917 14.059 2.891   1.000 50.700  0 349 SER B C   1 ? 
ATOM   454  O  O   . SER B 2 17  ? -40.496 14.752 3.808   1.000 51.910  0 349 SER B O   1 ? 
ATOM   455  C  CB  . SER B 2 17  ? -41.358 15.272 0.826   1.000 47.580  0 349 SER B CB  1 ? 
ATOM   456  O  OG  . SER B 2 17  ? -42.323 15.653 -0.121  1.000 51.080  0 349 SER B OG  1 ? 
ATOM   457  N  N   . VAL B 2 18  ? -40.423 12.876 2.572   1.000 48.130  0 350 VAL B N   1 ? 
ATOM   458  C  CA  . VAL B 2 18  ? -39.488 12.250 3.478   1.000 43.900  0 350 VAL B CA  1 ? 
ATOM   459  C  C   . VAL B 2 18  ? -38.173 13.036 3.496   1.000 44.100  0 350 VAL B C   1 ? 
ATOM   460  O  O   . VAL B 2 18  ? -37.548 13.076 4.553   1.000 44.520  0 350 VAL B O   1 ? 
ATOM   461  C  CB  . VAL B 2 18  ? -39.268 10.763 3.125   1.000 40.710  0 350 VAL B CB  1 ? 
ATOM   462  C  CG1 . VAL B 2 18  ? -38.777 10.599 1.698   1.000 45.310  0 350 VAL B CG1 1 ? 
ATOM   463  C  CG2 . VAL B 2 18  ? -38.318 10.094 4.100   1.000 40.190  0 350 VAL B CG2 1 ? 
ATOM   464  N  N   . TYR B 2 19  ? -37.719 13.592 2.353   1.000 47.450  0 351 TYR B N   1 ? 
ATOM   465  C  CA  . TYR B 2 19  ? -36.428 14.285 2.337   1.000 54.050  0 351 TYR B CA  1 ? 
ATOM   466  C  C   . TYR B 2 19  ? -36.546 15.555 3.174   1.000 48.400  0 351 TYR B C   1 ? 
ATOM   467  O  O   . TYR B 2 19  ? -35.576 15.954 3.797   1.000 50.780  0 351 TYR B O   1 ? 
ATOM   468  C  CB  . TYR B 2 19  ? -35.918 14.641 0.931   1.000 52.880  0 351 TYR B CB  1 ? 
ATOM   469  C  CG  . TYR B 2 19  ? -36.428 15.946 0.376   1.000 53.290  0 351 TYR B CG  1 ? 
ATOM   470  C  CD1 . TYR B 2 19  ? -37.696 16.036 -0.166  1.000 55.230  0 351 TYR B CD1 1 ? 
ATOM   471  C  CD2 . TYR B 2 19  ? -35.673 17.109 0.452   1.000 60.440  0 351 TYR B CD2 1 ? 
ATOM   472  C  CE1 . TYR B 2 19  ? -38.188 17.232 -0.656  1.000 62.480  0 351 TYR B CE1 1 ? 
ATOM   473  C  CE2 . TYR B 2 19  ? -36.148 18.322 -0.032  1.000 52.820  0 351 TYR B CE2 1 ? 
ATOM   474  C  CZ  . TYR B 2 19  ? -37.401 18.373 -0.607  1.000 58.850  0 351 TYR B CZ  1 ? 
ATOM   475  O  OH  . TYR B 2 19  ? -37.933 19.520 -1.098  1.000 62.350  0 351 TYR B OH  1 ? 
ATOM   476  N  N   . ALA B 2 20  ? -37.757 16.129 3.230   1.000 46.340  0 352 ALA B N   1 ? 
ATOM   477  C  CA  . ALA B 2 20  ? -38.036 17.318 4.028   1.000 52.510  0 352 ALA B CA  1 ? 
ATOM   478  C  C   . ALA B 2 20  ? -38.910 16.945 5.217   1.000 51.710  0 352 ALA B C   1 ? 
ATOM   479  O  O   . ALA B 2 20  ? -39.960 17.536 5.426   1.000 51.030  0 352 ALA B O   1 ? 
ATOM   480  C  CB  . ALA B 2 20  ? -38.745 18.375 3.207   1.000 51.920  0 352 ALA B CB  1 ? 
ATOM   481  N  N   . TRP B 2 21  ? -38.469 15.955 5.991   1.000 51.130  0 353 TRP B N   1 ? 
ATOM   482  C  CA  . TRP B 2 21  ? -39.352 15.354 6.968   1.000 51.910  0 353 TRP B CA  1 ? 
ATOM   483  C  C   . TRP B 2 21  ? -39.737 16.337 8.064   1.000 55.920  0 353 TRP B C   1 ? 
ATOM   484  O  O   . TRP B 2 21  ? -38.970 17.212 8.436   1.000 54.680  0 353 TRP B O   1 ? 
ATOM   485  C  CB  . TRP B 2 21  ? -38.730 14.088 7.557   1.000 51.730  0 353 TRP B CB  1 ? 
ATOM   486  C  CG  . TRP B 2 21  ? -37.291 14.194 7.941   1.000 45.040  0 353 TRP B CG  1 ? 
ATOM   487  C  CD1 . TRP B 2 21  ? -36.188 14.002 7.161   1.000 47.110  0 353 TRP B CD1 1 ? 
ATOM   488  C  CD2 . TRP B 2 21  ? -36.810 14.511 9.249   1.000 46.460  0 353 TRP B CD2 1 ? 
ATOM   489  N  NE1 . TRP B 2 21  ? -35.048 14.173 7.898   1.000 49.050  0 353 TRP B NE1 1 ? 
ATOM   490  C  CE2 . TRP B 2 21  ? -35.405 14.468 9.190   1.000 49.640  0 353 TRP B CE2 1 ? 
ATOM   491  C  CE3 . TRP B 2 21  ? -37.446 14.785 10.468  1.000 51.350  0 353 TRP B CE3 1 ? 
ATOM   492  C  CZ2 . TRP B 2 21  ? -34.618 14.661 10.319  1.000 53.930  0 353 TRP B CZ2 1 ? 
ATOM   493  C  CZ3 . TRP B 2 21  ? -36.666 14.984 11.582  1.000 52.010  0 353 TRP B CZ3 1 ? 
ATOM   494  C  CH2 . TRP B 2 21  ? -35.269 14.932 11.500  1.000 55.970  0 353 TRP B CH2 1 ? 
ATOM   495  N  N   . ASN B 2 22  ? -40.950 16.160 8.584   1.000 50.500  0 354 ASN B N   1 ? 
ATOM   496  C  CA  . ASN B 2 22  ? -41.476 17.051 9.592   1.000 54.890  0 354 ASN B CA  1 ? 
ATOM   497  C  C   . ASN B 2 22  ? -41.132 16.524 10.987  1.000 59.910  0 354 ASN B C   1 ? 
ATOM   498  O  O   . ASN B 2 22  ? -41.101 15.314 11.220  1.000 52.840  0 354 ASN B O   1 ? 
ATOM   499  C  CB  . ASN B 2 22  ? -42.980 17.219 9.432   1.000 59.720  0 354 ASN B CB  1 ? 
ATOM   500  C  CG  . ASN B 2 22  ? -43.522 18.130 10.507  1.000 72.220  0 354 ASN B CG  1 ? 
ATOM   501  O  OD1 . ASN B 2 22  ? -44.098 17.670 11.494  1.000 68.480  0 354 ASN B OD1 1 ? 
ATOM   502  N  ND2 . ASN B 2 22  ? -43.258 19.417 10.358  1.000 71.190  0 354 ASN B ND2 1 ? 
ATOM   503  N  N   . ARG B 2 23  ? -40.872 17.450 11.913  1.000 48.150  0 355 ARG B N   1 ? 
ATOM   504  C  CA  . ARG B 2 23  ? -40.682 17.137 13.314  1.000 52.330  0 355 ARG B CA  1 ? 
ATOM   505  C  C   . ARG B 2 23  ? -41.613 17.978 14.182  1.000 55.690  0 355 ARG B C   1 ? 
ATOM   506  O  O   . ARG B 2 23  ? -41.661 19.195 14.054  1.000 57.150  0 355 ARG B O   1 ? 
ATOM   507  C  CB  . ARG B 2 23  ? -39.256 17.402 13.783  1.000 53.760  0 355 ARG B CB  1 ? 
ATOM   508  C  CG  . ARG B 2 23  ? -39.140 17.234 15.296  1.000 53.640  0 355 ARG B CG  1 ? 
ATOM   509  C  CD  . ARG B 2 23  ? -37.732 17.029 15.788  1.000 51.890  0 355 ARG B CD  1 ? 
ATOM   510  N  NE  . ARG B 2 23  ? -37.265 15.700 15.461  1.000 57.720  0 355 ARG B NE  1 ? 
ATOM   511  C  CZ  . ARG B 2 23  ? -36.080 15.220 15.790  1.000 52.300  0 355 ARG B CZ  1 ? 
ATOM   512  N  NH1 . ARG B 2 23  ? -35.201 15.985 16.403  1.000 61.630  0 355 ARG B NH1 1 ? 
ATOM   513  N  NH2 . ARG B 2 23  ? -35.763 13.976 15.497  1.000 56.970  0 355 ARG B NH2 1 ? 
ATOM   514  N  N   . LYS B 2 24  ? -42.357 17.320 15.070  1.000 53.450  0 356 LYS B N   1 ? 
ATOM   515  C  CA  . LYS B 2 24  ? -43.208 18.023 16.011  1.000 58.610  0 356 LYS B CA  1 ? 
ATOM   516  C  C   . LYS B 2 24  ? -42.682 17.735 17.413  1.000 60.730  0 356 LYS B C   1 ? 
ATOM   517  O  O   . LYS B 2 24  ? -42.442 16.574 17.762  1.000 60.820  0 356 LYS B O   1 ? 
ATOM   518  C  CB  . LYS B 2 24  ? -44.671 17.603 15.845  1.000 62.800  0 356 LYS B CB  1 ? 
ATOM   519  C  CG  . LYS B 2 24  ? -45.660 18.338 16.745  1.000 76.620  0 356 LYS B CG  1 ? 
ATOM   520  C  CD  . LYS B 2 24  ? -46.440 19.429 16.045  1.000 79.810  0 356 LYS B CD  1 ? 
ATOM   521  C  CE  . LYS B 2 24  ? -47.526 20.034 16.911  1.000 81.280  0 356 LYS B CE  1 ? 
ATOM   522  N  NZ  . LYS B 2 24  ? -46.970 21.020 17.870  1.000 83.170  0 356 LYS B NZ  1 ? 
ATOM   523  N  N   . ARG B 2 25  ? -42.450 18.804 18.183  1.000 54.970  0 357 ARG B N   1 ? 
ATOM   524  C  CA  . ARG B 2 25  ? -42.035 18.674 19.574  1.000 57.910  0 357 ARG B CA  1 ? 
ATOM   525  C  C   . ARG B 2 25  ? -43.286 18.545 20.436  1.000 53.210  0 357 ARG B C   1 ? 
ATOM   526  O  O   . ARG B 2 25  ? -44.240 19.277 20.229  1.000 60.170  0 357 ARG B O   1 ? 
ATOM   527  C  CB  . ARG B 2 25  ? -41.173 19.855 20.021  1.000 64.560  0 357 ARG B CB  1 ? 
ATOM   528  C  CG  . ARG B 2 25  ? -40.607 19.690 21.431  1.000 77.000  0 357 ARG B CG  1 ? 
ATOM   529  C  CD  . ARG B 2 25  ? -39.787 20.857 21.977  1.000 69.870  0 357 ARG B CD  1 ? 
ATOM   530  N  NE  . ARG B 2 25  ? -40.426 22.140 21.730  1.000 83.090  0 357 ARG B NE  1 ? 
ATOM   531  C  CZ  . ARG B 2 25  ? -41.284 22.752 22.544  1.000 90.710  0 357 ARG B CZ  1 ? 
ATOM   532  N  NH1 . ARG B 2 25  ? -41.889 22.090 23.512  1.000 93.300  0 357 ARG B NH1 1 ? 
ATOM   533  N  NH2 . ARG B 2 25  ? -41.592 24.020 22.335  1.000 95.160  0 357 ARG B NH2 1 ? 
ATOM   534  N  N   . ILE B 2 26  ? -43.300 17.565 21.343  1.000 56.280  0 358 ILE B N   1 ? 
ATOM   535  C  CA  . ILE B 2 26  ? -44.429 17.346 22.229  1.000 65.700  0 358 ILE B CA  1 ? 
ATOM   536  C  C   . ILE B 2 26  ? -43.914 17.569 23.647  1.000 65.260  0 358 ILE B C   1 ? 
ATOM   537  O  O   . ILE B 2 26  ? -42.917 16.956 24.026  1.000 54.750  0 358 ILE B O   1 ? 
ATOM   538  C  CB  . ILE B 2 26  ? -45.027 15.931 22.082  1.000 70.450  0 358 ILE B CB  1 ? 
ATOM   539  C  CG1 . ILE B 2 26  ? -45.423 15.580 20.643  1.000 75.240  0 358 ILE B CG1 1 ? 
ATOM   540  C  CG2 . ILE B 2 26  ? -46.190 15.736 23.053  1.000 70.610  0 358 ILE B CG2 1 ? 
ATOM   541  C  CD1 . ILE B 2 26  ? -46.643 16.298 20.121  1.000 78.580  0 358 ILE B CD1 1 ? 
ATOM   542  N  N   . SER B 2 27  ? -44.588 18.458 24.393  1.000 68.310  0 359 SER B N   1 ? 
ATOM   543  C  CA  . SER B 2 27  ? -44.121 18.907 25.700  1.000 78.160  0 359 SER B CA  1 ? 
ATOM   544  C  C   . SER B 2 27  ? -45.306 19.200 26.612  1.000 77.930  0 359 SER B C   1 ? 
ATOM   545  O  O   . SER B 2 27  ? -46.348 19.641 26.136  1.000 66.800  0 359 SER B O   1 ? 
ATOM   546  C  CB  . SER B 2 27  ? -43.260 20.148 25.576  1.000 73.360  0 359 SER B CB  1 ? 
ATOM   547  O  OG  . SER B 2 27  ? -42.061 19.855 24.875  1.000 91.110  0 359 SER B OG  1 ? 
ATOM   548  N  N   . ASN B 2 28  ? -45.118 19.012 27.926  1.000 82.940  0 360 ASN B N   1 ? 
ATOM   549  C  CA  . ASN B 2 28  ? -46.017 19.613 28.900  1.000 78.560  0 360 ASN B CA  1 ? 
ATOM   550  C  C   . ASN B 2 28  ? -47.447 19.126 28.682  1.000 69.340  0 360 ASN B C   1 ? 
ATOM   551  O  O   . ASN B 2 28  ? -48.368 19.899 28.428  1.000 71.930  0 360 ASN B O   1 ? 
ATOM   552  C  CB  . ASN B 2 28  ? -45.881 21.136 28.875  1.000 83.210  0 360 ASN B CB  1 ? 
ATOM   553  C  CG  . ASN B 2 28  ? -45.005 21.593 30.017  1.000 100.860 0 360 ASN B CG  1 ? 
ATOM   554  O  OD1 . ASN B 2 28  ? -45.472 21.654 31.154  1.000 100.610 0 360 ASN B OD1 1 ? 
ATOM   555  N  ND2 . ASN B 2 28  ? -43.739 21.856 29.738  1.000 104.190 0 360 ASN B ND2 1 ? 
ATOM   556  N  N   . CYS B 2 29  ? -47.622 17.811 28.785  1.000 63.230  0 361 CYS B N   1 ? 
ATOM   557  C  CA  . CYS B 2 29  ? -48.910 17.228 28.482  1.000 61.410  0 361 CYS B CA  1 ? 
ATOM   558  C  C   . CYS B 2 29  ? -48.928 15.792 28.976  1.000 60.330  0 361 CYS B C   1 ? 
ATOM   559  O  O   . CYS B 2 29  ? -47.881 15.223 29.271  1.000 59.910  0 361 CYS B O   1 ? 
ATOM   560  C  CB  . CYS B 2 29  ? -49.255 17.310 26.992  1.000 71.840  0 361 CYS B CB  1 ? 
ATOM   561  S  SG  . CYS B 2 29  ? -48.032 16.607 25.842  1.000 71.120  0 361 CYS B SG  1 ? 
ATOM   562  N  N   . VAL B 2 30  ? -50.137 15.224 29.063  1.000 61.860  0 362 VAL B N   1 ? 
ATOM   563  C  CA  . VAL B 2 30  ? -50.288 13.823 29.399  1.000 68.350  0 362 VAL B CA  1 ? 
ATOM   564  C  C   . VAL B 2 30  ? -50.579 13.063 28.108  1.000 67.200  0 362 VAL B C   1 ? 
ATOM   565  O  O   . VAL B 2 30  ? -51.187 13.587 27.178  1.000 65.570  0 362 VAL B O   1 ? 
ATOM   566  C  CB  . VAL B 2 30  ? -51.382 13.610 30.459  1.000 77.420  0 362 VAL B CB  1 ? 
ATOM   567  C  CG1 . VAL B 2 30  ? -51.329 12.205 31.037  1.000 80.540  0 362 VAL B CG1 1 ? 
ATOM   568  C  CG2 . VAL B 2 30  ? -51.287 14.649 31.567  1.000 77.920  0 362 VAL B CG2 1 ? 
ATOM   569  N  N   . ALA B 2 31  ? -50.104 11.822 28.065  1.000 66.420  0 363 ALA B N   1 ? 
ATOM   570  C  CA  . ALA B 2 31  ? -50.152 11.005 26.872  1.000 73.170  0 363 ALA B CA  1 ? 
ATOM   571  C  C   . ALA B 2 31  ? -50.760 9.655  27.222  1.000 69.320  0 363 ALA B C   1 ? 
ATOM   572  O  O   . ALA B 2 31  ? -50.121 8.868  27.917  1.000 67.410  0 363 ALA B O   1 ? 
ATOM   573  C  CB  . ALA B 2 31  ? -48.737 10.840 26.347  1.000 73.860  0 363 ALA B CB  1 ? 
ATOM   574  N  N   . ASP B 2 32  ? -51.977 9.366  26.752  1.000 79.210  0 364 ASP B N   1 ? 
ATOM   575  C  CA  . ASP B 2 32  ? -52.348 7.964  26.684  1.000 87.450  0 364 ASP B CA  1 ? 
ATOM   576  C  C   . ASP B 2 32  ? -51.819 7.480  25.346  1.000 86.820  0 364 ASP B C   1 ? 
ATOM   577  O  O   . ASP B 2 32  ? -52.155 8.053  24.310  1.000 79.450  0 364 ASP B O   1 ? 
ATOM   578  C  CB  . ASP B 2 32  ? -53.840 7.661  26.882  1.000 93.220  0 364 ASP B CB  1 ? 
ATOM   579  C  CG  . ASP B 2 32  ? -54.113 6.212  27.293  1.000 99.880  0 364 ASP B CG  1 ? 
ATOM   580  O  OD1 . ASP B 2 32  ? -53.219 5.327  27.072  1.000 86.150  0 364 ASP B OD1 1 ? 
ATOM   581  O  OD2 . ASP B 2 32  ? -55.195 5.969  27.891  1.000 88.040  0 364 ASP B OD2 1 ? 
ATOM   582  N  N   . TYR B 2 33  ? -50.982 6.465  25.398  1.000 100.540 0 365 TYR B N   1 ? 
ATOM   583  C  CA  . TYR B 2 33  ? -50.428 5.923  24.193  1.000 102.580 0 365 TYR B CA  1 ? 
ATOM   584  C  C   . TYR B 2 33  ? -51.328 4.810  23.728  1.000 119.600 0 365 TYR B C   1 ? 
ATOM   585  O  O   . TYR B 2 33  ? -50.849 3.743  23.347  1.000 120.340 0 365 TYR B O   1 ? 
ATOM   586  C  CB  . TYR B 2 33  ? -49.036 5.390  24.467  1.000 96.190  0 365 TYR B CB  1 ? 
ATOM   587  C  CG  . TYR B 2 33  ? -48.013 6.446  24.809  1.000 93.080  0 365 TYR B CG  1 ? 
ATOM   588  C  CD1 . TYR B 2 33  ? -47.435 7.221  23.819  1.000 87.800  0 365 TYR B CD1 1 ? 
ATOM   589  C  CD2 . TYR B 2 33  ? -47.614 6.655  26.121  1.000 85.580  0 365 TYR B CD2 1 ? 
ATOM   590  C  CE1 . TYR B 2 33  ? -46.493 8.181  24.123  1.000 80.300  0 365 TYR B CE1 1 ? 
ATOM   591  C  CE2 . TYR B 2 33  ? -46.673 7.613  26.433  1.000 81.280  0 365 TYR B CE2 1 ? 
ATOM   592  C  CZ  . TYR B 2 33  ? -46.116 8.372  25.428  1.000 78.340  0 365 TYR B CZ  1 ? 
ATOM   593  O  OH  . TYR B 2 33  ? -45.179 9.329  25.726  1.000 65.830  0 365 TYR B OH  1 ? 
ATOM   594  N  N   . SER B 2 34  ? -52.635 5.032  23.779  1.000 117.710 0 366 SER B N   1 ? 
ATOM   595  C  CA  . SER B 2 34  ? -53.574 4.039  23.285  1.000 108.570 0 366 SER B CA  1 ? 
ATOM   596  C  C   . SER B 2 34  ? -54.349 4.713  22.203  1.000 100.390 0 366 SER B C   1 ? 
ATOM   597  O  O   . SER B 2 34  ? -54.675 4.117  21.185  1.000 92.150  0 366 SER B O   1 ? 
ATOM   598  C  CB  . SER B 2 34  ? -54.491 3.572  24.394  1.000 109.630 0 366 SER B CB  1 ? 
ATOM   599  O  OG  . SER B 2 34  ? -53.753 2.897  25.397  1.000 117.340 0 366 SER B OG  1 ? 
ATOM   600  N  N   . VAL B 2 35  ? -54.651 5.972  22.420  1.000 101.050 0 367 VAL B N   1 ? 
ATOM   601  C  CA  . VAL B 2 35  ? -55.311 6.733  21.400  1.000 103.640 0 367 VAL B CA  1 ? 
ATOM   602  C  C   . VAL B 2 35  ? -54.524 6.532  20.142  1.000 115.160 0 367 VAL B C   1 ? 
ATOM   603  O  O   . VAL B 2 35  ? -55.024 6.732  19.040  1.000 101.850 0 367 VAL B O   1 ? 
ATOM   604  C  CB  . VAL B 2 35  ? -55.254 8.211  21.730  1.000 117.130 0 367 VAL B CB  1 ? 
ATOM   605  C  CG1 . VAL B 2 35  ? -56.318 8.974  20.961  1.000 114.770 0 367 VAL B CG1 1 ? 
ATOM   606  C  CG2 . VAL B 2 35  ? -55.399 8.422  23.227  1.000 124.010 0 367 VAL B CG2 1 ? 
ATOM   607  N  N   . ILE B 2 36  ? -53.266 6.155  20.300  1.000 109.590 0 368 ILE B N   1 ? 
ATOM   608  C  CA  . ILE B 2 36  ? -52.432 5.926  19.163  1.000 101.020 0 368 ILE B CA  1 ? 
ATOM   609  C  C   . ILE B 2 36  ? -52.552 4.495  18.766  1.000 96.260  0 368 ILE B C   1 ? 
ATOM   610  O  O   . ILE B 2 36  ? -52.874 4.197  17.626  1.000 80.750  0 368 ILE B O   1 ? 
ATOM   611  C  CB  . ILE B 2 36  ? -50.960 6.198  19.507  1.000 97.470  0 368 ILE B CB  1 ? 
ATOM   612  C  CG1 . ILE B 2 36  ? -50.753 7.681  19.801  1.000 100.980 0 368 ILE B CG1 1 ? 
ATOM   613  C  CG2 . ILE B 2 36  ? -50.052 5.732  18.380  1.000 94.570  0 368 ILE B CG2 1 ? 
ATOM   614  C  CD1 . ILE B 2 36  ? -50.799 8.008  21.275  1.000 108.840 0 368 ILE B CD1 1 ? 
ATOM   615  N  N   . TYR B 2 37  ? -52.336 3.590  19.712  1.000 112.100 0 369 TYR B N   1 ? 
ATOM   616  C  CA  . TYR B 2 37  ? -52.290 2.188  19.322  1.000 109.310 0 369 TYR B CA  1 ? 
ATOM   617  C  C   . TYR B 2 37  ? -53.516 1.820  18.475  1.000 105.960 0 369 TYR B C   1 ? 
ATOM   618  O  O   . TYR B 2 37  ? -53.428 0.921  17.641  1.000 98.250  0 369 TYR B O   1 ? 
ATOM   619  C  CB  . TYR B 2 37  ? -52.111 1.271  20.538  1.000 96.210  0 369 TYR B CB  1 ? 
ATOM   620  C  CG  . TYR B 2 37  ? -51.250 0.064  20.252  1.000 110.470 0 369 TYR B CG  1 ? 
ATOM   621  C  CD1 . TYR B 2 37  ? -51.428 -0.688 19.098  1.000 115.410 0 369 TYR B CD1 1 ? 
ATOM   622  C  CD2 . TYR B 2 37  ? -50.239 -0.326 21.119  1.000 111.290 0 369 TYR B CD2 1 ? 
ATOM   623  C  CE1 . TYR B 2 37  ? -50.638 -1.791 18.811  1.000 119.260 0 369 TYR B CE1 1 ? 
ATOM   624  C  CE2 . TYR B 2 37  ? -49.444 -1.432 20.852  1.000 114.730 0 369 TYR B CE2 1 ? 
ATOM   625  C  CZ  . TYR B 2 37  ? -49.643 -2.168 19.694  1.000 116.830 0 369 TYR B CZ  1 ? 
ATOM   626  O  OH  . TYR B 2 37  ? -48.878 -3.270 19.391  1.000 99.360  0 369 TYR B OH  1 ? 
ATOM   627  N  N   . ASN B 2 38  ? -54.589 2.582  18.612  1.000 95.700  0 370 ASN B N   1 ? 
ATOM   628  C  CA  . ASN B 2 38  ? -55.802 2.272  17.885  1.000 99.610  0 370 ASN B CA  1 ? 
ATOM   629  C  C   . ASN B 2 38  ? -56.169 3.292  16.824  1.000 101.170 0 370 ASN B C   1 ? 
ATOM   630  O  O   . ASN B 2 38  ? -57.204 3.171  16.180  1.000 113.410 0 370 ASN B O   1 ? 
ATOM   631  C  CB  . ASN B 2 38  ? -56.956 2.147  18.873  1.000 107.040 0 370 ASN B CB  1 ? 
ATOM   632  C  CG  . ASN B 2 38  ? -57.209 3.426  19.647  1.000 110.540 0 370 ASN B CG  1 ? 
ATOM   633  O  OD1 . ASN B 2 38  ? -57.366 4.501  19.069  1.000 106.650 0 370 ASN B OD1 1 ? 
ATOM   634  N  ND2 . ASN B 2 38  ? -57.262 3.310  20.967  1.000 112.290 0 370 ASN B ND2 1 ? 
ATOM   635  N  N   . PHE B 2 39  ? -55.344 4.304  16.648  1.000 102.470 0 371 PHE B N   1 ? 
ATOM   636  C  CA  . PHE B 2 39  ? -55.613 5.328  15.645  1.000 99.930  0 371 PHE B CA  1 ? 
ATOM   637  C  C   . PHE B 2 39  ? -56.062 4.671  14.342  1.000 97.550  0 371 PHE B C   1 ? 
ATOM   638  O  O   . PHE B 2 39  ? -57.163 4.931  13.866  1.000 111.110 0 371 PHE B O   1 ? 
ATOM   639  C  CB  . PHE B 2 39  ? -54.397 6.216  15.344  1.000 94.420  0 371 PHE B CB  1 ? 
ATOM   640  C  CG  . PHE B 2 39  ? -54.573 7.076  14.111  1.000 95.600  0 371 PHE B CG  1 ? 
ATOM   641  C  CD1 . PHE B 2 39  ? -55.396 8.196  14.132  1.000 96.600  0 371 PHE B CD1 1 ? 
ATOM   642  C  CD2 . PHE B 2 39  ? -53.970 6.729  12.905  1.000 93.170  0 371 PHE B CD2 1 ? 
ATOM   643  C  CE1 . PHE B 2 39  ? -55.587 8.961  12.986  1.000 104.860 0 371 PHE B CE1 1 ? 
ATOM   644  C  CE2 . PHE B 2 39  ? -54.170 7.488  11.757  1.000 84.920  0 371 PHE B CE2 1 ? 
ATOM   645  C  CZ  . PHE B 2 39  ? -54.974 8.606  11.798  1.000 91.250  0 371 PHE B CZ  1 ? 
ATOM   646  N  N   . ALA B 2 40  ? -55.188 3.830  13.777  1.000 82.510  0 372 ALA B N   1 ? 
ATOM   647  C  CA  . ALA B 2 40  ? -55.455 3.168  12.514  1.000 89.820  0 372 ALA B CA  1 ? 
ATOM   648  C  C   . ALA B 2 40  ? -54.965 1.730  12.598  1.000 86.280  0 372 ALA B C   1 ? 
ATOM   649  O  O   . ALA B 2 40  ? -54.263 1.366  13.541  1.000 86.090  0 372 ALA B O   1 ? 
ATOM   650  C  CB  . ALA B 2 40  ? -54.782 3.903  11.376  1.000 89.450  0 372 ALA B CB  1 ? 
ATOM   651  N  N   . PRO B 2 41  ? -55.350 0.872  11.625  1.000 85.000  0 373 PRO B N   1 ? 
ATOM   652  C  CA  . PRO B 2 41  ? -54.639 -0.383 11.387  1.000 75.550  0 373 PRO B CA  1 ? 
ATOM   653  C  C   . PRO B 2 41  ? -53.238 -0.101 10.827  1.000 70.590  0 373 PRO B C   1 ? 
ATOM   654  O  O   . PRO B 2 41  ? -53.104 0.409  9.716   1.000 72.420  0 373 PRO B O   1 ? 
ATOM   655  C  CB  . PRO B 2 41  ? -55.547 -1.112 10.379  1.000 79.920  0 373 PRO B CB  1 ? 
ATOM   656  C  CG  . PRO B 2 41  ? -56.275 -0.002 9.650   1.000 82.050  0 373 PRO B CG  1 ? 
ATOM   657  C  CD  . PRO B 2 41  ? -56.480 1.073  10.698  1.000 86.680  0 373 PRO B CD  1 ? 
ATOM   658  N  N   . PHE B 2 42  ? -52.216 -0.422 11.625  1.000 61.220  0 374 PHE B N   1 ? 
ATOM   659  C  CA  . PHE B 2 42  ? -50.820 -0.209 11.285  1.000 67.510  0 374 PHE B CA  1 ? 
ATOM   660  C  C   . PHE B 2 42  ? -50.218 -1.426 10.598  1.000 69.230  0 374 PHE B C   1 ? 
ATOM   661  O  O   . PHE B 2 42  ? -50.548 -2.563 10.917  1.000 76.590  0 374 PHE B O   1 ? 
ATOM   662  C  CB  . PHE B 2 42  ? -49.987 0.091  12.534  1.000 65.270  0 374 PHE B CB  1 ? 
ATOM   663  C  CG  . PHE B 2 42  ? -50.486 1.292  13.281  1.000 62.060  0 374 PHE B CG  1 ? 
ATOM   664  C  CD1 . PHE B 2 42  ? -50.527 2.530  12.657  1.000 68.920  0 374 PHE B CD1 1 ? 
ATOM   665  C  CD2 . PHE B 2 42  ? -50.990 1.179  14.567  1.000 65.000  0 374 PHE B CD2 1 ? 
ATOM   666  C  CE1 . PHE B 2 42  ? -51.024 3.647  13.313  1.000 65.320  0 374 PHE B CE1 1 ? 
ATOM   667  C  CE2 . PHE B 2 42  ? -51.482 2.297  15.226  1.000 63.760  0 374 PHE B CE2 1 ? 
ATOM   668  C  CZ  . PHE B 2 42  ? -51.504 3.523  14.598  1.000 69.880  0 374 PHE B CZ  1 ? 
ATOM   669  N  N   . SER B 2 43  ? -49.292 -1.133 9.680   1.000 59.610  0 375 SER B N   1 ? 
ATOM   670  C  CA  . SER B 2 43  ? -48.469 -2.109 9.002   1.000 55.790  0 375 SER B CA  1 ? 
ATOM   671  C  C   . SER B 2 43  ? -47.127 -2.269 9.715   1.000 52.550  0 375 SER B C   1 ? 
ATOM   672  O  O   . SER B 2 43  ? -46.341 -3.147 9.390   1.000 56.420  0 375 SER B O   1 ? 
ATOM   673  C  CB  . SER B 2 43  ? -48.279 -1.671 7.558   1.000 64.620  0 375 SER B CB  1 ? 
ATOM   674  O  OG  . SER B 2 43  ? -47.606 -0.403 7.495   1.000 60.650  0 375 SER B OG  1 ? 
ATOM   675  N  N   . ALA B 2 44  ? -46.790 -1.340 10.614  1.000 61.960  0 376 ALA B N   1 ? 
ATOM   676  C  CA  . ALA B 2 44  ? -45.565 -1.459 11.393  1.000 55.960  0 376 ALA B CA  1 ? 
ATOM   677  C  C   . ALA B 2 44  ? -45.757 -0.724 12.719  1.000 60.380  0 376 ALA B C   1 ? 
ATOM   678  O  O   . ALA B 2 44  ? -46.460 0.295  12.751  1.000 57.760  0 376 ALA B O   1 ? 
ATOM   679  C  CB  . ALA B 2 44  ? -44.403 -0.906 10.621  1.000 56.850  0 376 ALA B CB  1 ? 
ATOM   680  N  N   . PHE B 2 45  ? -45.191 -1.292 13.800  1.000 57.280  0 377 PHE B N   1 ? 
ATOM   681  C  CA  . PHE B 2 45  ? -45.254 -0.683 15.119  1.000 63.510  0 377 PHE B CA  1 ? 
ATOM   682  C  C   . PHE B 2 45  ? -44.183 -1.287 16.017  1.000 62.620  0 377 PHE B C   1 ? 
ATOM   683  O  O   . PHE B 2 45  ? -44.496 -2.012 16.942  1.000 71.330  0 377 PHE B O   1 ? 
ATOM   684  C  CB  . PHE B 2 45  ? -46.652 -0.814 15.730  1.000 67.000  0 377 PHE B CB  1 ? 
ATOM   685  C  CG  . PHE B 2 45  ? -46.994 0.243  16.757  1.000 59.230  0 377 PHE B CG  1 ? 
ATOM   686  C  CD1 . PHE B 2 45  ? -46.266 0.371  17.925  1.000 56.580  0 377 PHE B CD1 1 ? 
ATOM   687  C  CD2 . PHE B 2 45  ? -48.059 1.108  16.551  1.000 67.380  0 377 PHE B CD2 1 ? 
ATOM   688  C  CE1 . PHE B 2 45  ? -46.576 1.357  18.852  1.000 66.270  0 377 PHE B CE1 1 ? 
ATOM   689  C  CE2 . PHE B 2 45  ? -48.391 2.078  17.489  1.000 65.740  0 377 PHE B CE2 1 ? 
ATOM   690  C  CZ  . PHE B 2 45  ? -47.641 2.208  18.637  1.000 65.870  0 377 PHE B CZ  1 ? 
ATOM   691  N  N   . LYS B 2 46  ? -42.918 -0.980 15.735  1.000 64.500  0 378 LYS B N   1 ? 
ATOM   692  C  CA  . LYS B 2 46  ? -41.795 -1.539 16.469  1.000 63.620  0 378 LYS B CA  1 ? 
ATOM   693  C  C   . LYS B 2 46  ? -41.205 -0.454 17.370  1.000 69.400  0 378 LYS B C   1 ? 
ATOM   694  O  O   . LYS B 2 46  ? -40.718 0.561  16.873  1.000 71.490  0 378 LYS B O   1 ? 
ATOM   695  C  CB  . LYS B 2 46  ? -40.755 -2.070 15.479  1.000 62.000  0 378 LYS B CB  1 ? 
ATOM   696  C  CG  . LYS B 2 46  ? -39.527 -2.727 16.095  1.000 70.470  0 378 LYS B CG  1 ? 
ATOM   697  C  CD  . LYS B 2 46  ? -39.781 -4.122 16.639  1.000 84.680  0 378 LYS B CD  1 ? 
ATOM   698  C  CE  . LYS B 2 46  ? -38.636 -4.693 17.453  1.000 87.420  0 378 LYS B CE  1 ? 
ATOM   699  N  NZ  . LYS B 2 46  ? -37.381 -4.741 16.664  1.000 90.840  0 378 LYS B NZ  1 ? 
ATOM   700  N  N   . CYS B 2 47  ? -41.247 -0.684 18.690  1.000 65.170  0 379 CYS B N   1 ? 
ATOM   701  C  CA  . CYS B 2 47  ? -40.501 0.112  19.655  1.000 64.760  0 379 CYS B CA  1 ? 
ATOM   702  C  C   . CYS B 2 47  ? -39.184 -0.576 19.986  1.000 66.560  0 379 CYS B C   1 ? 
ATOM   703  O  O   . CYS B 2 47  ? -39.081 -1.798 19.908  1.000 82.010  0 379 CYS B O   1 ? 
ATOM   704  C  CB  . CYS B 2 47  ? -41.316 0.348  20.916  1.000 63.860  0 379 CYS B CB  1 ? 
ATOM   705  S  SG  . CYS B 2 47  ? -42.877 1.201  20.596  1.000 73.620  0 379 CYS B SG  1 ? 
ATOM   706  N  N   . TYR B 2 48  ? -38.170 0.208  20.348  1.000 65.880  0 380 TYR B N   1 ? 
ATOM   707  C  CA  . TYR B 2 48  ? -36.820 -0.323 20.444  1.000 73.100  0 380 TYR B CA  1 ? 
ATOM   708  C  C   . TYR B 2 48  ? -36.346 -0.387 21.895  1.000 83.140  0 380 TYR B C   1 ? 
ATOM   709  O  O   . TYR B 2 48  ? -36.021 -1.468 22.380  1.000 100.830 0 380 TYR B O   1 ? 
ATOM   710  C  CB  . TYR B 2 48  ? -35.885 0.460  19.521  1.000 74.130  0 380 TYR B CB  1 ? 
ATOM   711  C  CG  . TYR B 2 48  ? -36.113 0.083  18.083  1.000 71.620  0 380 TYR B CG  1 ? 
ATOM   712  C  CD1 . TYR B 2 48  ? -37.078 0.724  17.329  1.000 66.960  0 380 TYR B CD1 1 ? 
ATOM   713  C  CD2 . TYR B 2 48  ? -35.455 -0.999 17.521  1.000 71.320  0 380 TYR B CD2 1 ? 
ATOM   714  C  CE1 . TYR B 2 48  ? -37.346 0.334  16.033  1.000 68.090  0 380 TYR B CE1 1 ? 
ATOM   715  C  CE2 . TYR B 2 48  ? -35.710 -1.399 16.221  1.000 73.740  0 380 TYR B CE2 1 ? 
ATOM   716  C  CZ  . TYR B 2 48  ? -36.660 -0.728 15.475  1.000 65.890  0 380 TYR B CZ  1 ? 
ATOM   717  O  OH  . TYR B 2 48  ? -36.928 -1.090 14.184  1.000 61.680  0 380 TYR B OH  1 ? 
ATOM   718  N  N   . GLY B 2 49  ? -36.286 0.758  22.579  1.000 84.990  0 381 GLY B N   1 ? 
ATOM   719  C  CA  . GLY B 2 49  ? -35.997 0.760  24.003  1.000 89.000  0 381 GLY B CA  1 ? 
ATOM   720  C  C   . GLY B 2 49  ? -37.184 0.196  24.777  1.000 96.110  0 381 GLY B C   1 ? 
ATOM   721  O  O   . GLY B 2 49  ? -37.131 -0.908 25.314  1.000 110.090 0 381 GLY B O   1 ? 
ATOM   722  N  N   . VAL B 2 50  ? -38.291 0.933  24.723  1.000 98.160  0 382 VAL B N   1 ? 
ATOM   723  C  CA  . VAL B 2 50  ? -39.408 0.722  25.621  1.000 93.120  0 382 VAL B CA  1 ? 
ATOM   724  C  C   . VAL B 2 50  ? -40.437 -0.147 24.902  1.000 85.180  0 382 VAL B C   1 ? 
ATOM   725  O  O   . VAL B 2 50  ? -40.127 -0.713 23.860  1.000 86.480  0 382 VAL B O   1 ? 
ATOM   726  C  CB  . VAL B 2 50  ? -39.981 2.080  26.076  1.000 112.560 0 382 VAL B CB  1 ? 
ATOM   727  C  CG1 . VAL B 2 50  ? -40.787 1.934  27.362  1.000 114.680 0 382 VAL B CG1 1 ? 
ATOM   728  C  CG2 . VAL B 2 50  ? -38.890 3.135  26.258  1.000 110.180 0 382 VAL B CG2 1 ? 
ATOM   729  N  N   . SER B 2 51  ? -41.629 -0.292 25.498  1.000 76.020  0 383 SER B N   1 ? 
ATOM   730  C  CA  . SER B 2 51  ? -42.782 -0.888 24.850  1.000 75.210  0 383 SER B CA  1 ? 
ATOM   731  C  C   . SER B 2 51  ? -43.992 -0.004 25.127  1.000 79.720  0 383 SER B C   1 ? 
ATOM   732  O  O   . SER B 2 51  ? -43.984 0.771  26.079  1.000 72.630  0 383 SER B O   1 ? 
ATOM   733  C  CB  . SER B 2 51  ? -43.033 -2.279 25.358  1.000 84.340  0 383 SER B CB  1 ? 
ATOM   734  O  OG  . SER B 2 51  ? -43.777 -2.240 26.571  1.000 86.680  0 383 SER B OG  1 ? 
ATOM   735  N  N   . PRO B 2 52  ? -45.072 -0.090 24.322  1.000 82.680  0 384 PRO B N   1 ? 
ATOM   736  C  CA  . PRO B 2 52  ? -46.258 0.745  24.538  1.000 85.450  0 384 PRO B CA  1 ? 
ATOM   737  C  C   . PRO B 2 52  ? -46.854 0.741  25.943  1.000 91.270  0 384 PRO B C   1 ? 
ATOM   738  O  O   . PRO B 2 52  ? -47.092 1.805  26.515  1.000 90.970  0 384 PRO B O   1 ? 
ATOM   739  C  CB  . PRO B 2 52  ? -47.259 0.172  23.526  1.000 80.450  0 384 PRO B CB  1 ? 
ATOM   740  C  CG  . PRO B 2 52  ? -46.366 -0.296 22.399  1.000 82.100  0 384 PRO B CG  1 ? 
ATOM   741  C  CD  . PRO B 2 52  ? -45.157 -0.890 23.090  1.000 80.380  0 384 PRO B CD  1 ? 
ATOM   742  N  N   . THR B 2 53  ? -47.116 -0.448 26.498  1.000 99.450  0 385 THR B N   1 ? 
ATOM   743  C  CA  . THR B 2 53  ? -47.778 -0.524 27.794  1.000 97.180  0 385 THR B CA  1 ? 
ATOM   744  C  C   . THR B 2 53  ? -46.878 0.123  28.848  1.000 85.660  0 385 THR B C   1 ? 
ATOM   745  O  O   . THR B 2 53  ? -47.361 0.922  29.652  1.000 78.650  0 385 THR B O   1 ? 
ATOM   746  C  CB  . THR B 2 53  ? -48.210 -1.960 28.123  1.000 103.100 0 385 THR B CB  1 ? 
ATOM   747  O  OG1 . THR B 2 53  ? -47.108 -2.842 27.890  1.000 99.570  0 385 THR B OG1 1 ? 
ATOM   748  C  CG2 . THR B 2 53  ? -49.410 -2.393 27.307  1.000 102.320 0 385 THR B CG2 1 ? 
ATOM   749  N  N   . LYS B 2 54  ? -45.569 -0.188 28.791  1.000 80.290  0 386 LYS B N   1 ? 
ATOM   750  C  CA  . LYS B 2 54  ? -44.553 0.432  29.639  1.000 86.710  0 386 LYS B CA  1 ? 
ATOM   751  C  C   . LYS B 2 54  ? -44.502 1.954  29.470  1.000 81.280  0 386 LYS B C   1 ? 
ATOM   752  O  O   . LYS B 2 54  ? -44.049 2.653  30.381  1.000 73.390  0 386 LYS B O   1 ? 
ATOM   753  C  CB  . LYS B 2 54  ? -43.149 -0.126 29.359  1.000 90.590  0 386 LYS B CB  1 ? 
ATOM   754  C  CG  . LYS B 2 54  ? -42.747 -1.358 30.167  1.000 93.860  0 386 LYS B CG  1 ? 
ATOM   755  C  CD  . LYS B 2 54  ? -43.448 -2.646 29.753  1.000 101.490 0 386 LYS B CD  1 ? 
ATOM   756  C  CE  . LYS B 2 54  ? -43.006 -3.859 30.545  1.000 101.180 0 386 LYS B CE  1 ? 
ATOM   757  N  NZ  . LYS B 2 54  ? -41.533 -3.983 30.612  1.000 106.160 0 386 LYS B NZ  1 ? 
ATOM   758  N  N   . LEU B 2 55  ? -44.929 2.463  28.305  1.000 77.400  0 387 LEU B N   1 ? 
ATOM   759  C  CA  . LEU B 2 55  ? -44.819 3.885  28.016  1.000 79.810  0 387 LEU B CA  1 ? 
ATOM   760  C  C   . LEU B 2 55  ? -45.863 4.646  28.818  1.000 79.200  0 387 LEU B C   1 ? 
ATOM   761  O  O   . LEU B 2 55  ? -45.652 5.811  29.145  1.000 72.740  0 387 LEU B O   1 ? 
ATOM   762  C  CB  . LEU B 2 55  ? -45.005 4.169  26.520  1.000 81.900  0 387 LEU B CB  1 ? 
ATOM   763  C  CG  . LEU B 2 55  ? -43.801 3.933  25.605  1.000 83.040  0 387 LEU B CG  1 ? 
ATOM   764  C  CD1 . LEU B 2 55  ? -44.138 4.352  24.178  1.000 76.430  0 387 LEU B CD1 1 ? 
ATOM   765  C  CD2 . LEU B 2 55  ? -42.556 4.669  26.090  1.000 84.100  0 387 LEU B CD2 1 ? 
ATOM   766  N  N   . ASN B 2 56  ? -46.981 3.986  29.136  1.000 80.530  0 388 ASN B N   1 ? 
ATOM   767  C  CA  . ASN B 2 56  ? -48.056 4.668  29.833  1.000 78.620  0 388 ASN B CA  1 ? 
ATOM   768  C  C   . ASN B 2 56  ? -47.642 4.965  31.279  1.000 75.480  0 388 ASN B C   1 ? 
ATOM   769  O  O   . ASN B 2 56  ? -48.324 5.726  31.956  1.000 81.360  0 388 ASN B O   1 ? 
ATOM   770  C  CB  . ASN B 2 56  ? -49.387 3.923  29.675  1.000 89.130  0 388 ASN B CB  1 ? 
ATOM   771  C  CG  . ASN B 2 56  ? -50.351 4.601  28.714  1.000 100.310 0 388 ASN B CG  1 ? 
ATOM   772  O  OD1 . ASN B 2 56  ? -50.224 5.786  28.394  1.000 84.830  0 388 ASN B OD1 1 ? 
ATOM   773  N  ND2 . ASN B 2 56  ? -51.363 3.868  28.280  1.000 107.540 0 388 ASN B ND2 1 ? 
ATOM   774  N  N   . ASP B 2 57  ? -46.503 4.429  31.737  1.000 66.280  0 389 ASP B N   1 ? 
ATOM   775  C  CA  . ASP B 2 57  ? -46.035 4.679  33.090  1.000 82.270  0 389 ASP B CA  1 ? 
ATOM   776  C  C   . ASP B 2 57  ? -44.939 5.747  33.128  1.000 87.270  0 389 ASP B C   1 ? 
ATOM   777  O  O   . ASP B 2 57  ? -44.606 6.232  34.207  1.000 83.250  0 389 ASP B O   1 ? 
ATOM   778  C  CB  . ASP B 2 57  ? -45.442 3.430  33.754  1.000 89.780  0 389 ASP B CB  1 ? 
ATOM   779  C  CG  . ASP B 2 57  ? -46.274 2.161  33.664  1.000 93.370  0 389 ASP B CG  1 ? 
ATOM   780  O  OD1 . ASP B 2 57  ? -47.428 2.232  33.167  1.000 89.170  0 389 ASP B OD1 1 ? 
ATOM   781  O  OD2 . ASP B 2 57  ? -45.773 1.115  34.130  1.000 81.970  0 389 ASP B OD2 1 ? 
ATOM   782  N  N   . LEU B 2 58  ? -44.352 6.097  31.978  1.000 87.060  0 390 LEU B N   1 ? 
ATOM   783  C  CA  . LEU B 2 58  ? -43.093 6.828  31.996  1.000 78.080  0 390 LEU B CA  1 ? 
ATOM   784  C  C   . LEU B 2 58  ? -43.299 8.302  31.657  1.000 69.040  0 390 LEU B C   1 ? 
ATOM   785  O  O   . LEU B 2 58  ? -44.254 8.672  30.977  1.000 70.720  0 390 LEU B O   1 ? 
ATOM   786  C  CB  . LEU B 2 58  ? -42.098 6.147  31.052  1.000 74.500  0 390 LEU B CB  1 ? 
ATOM   787  C  CG  . LEU B 2 58  ? -41.491 4.856  31.599  1.000 75.710  0 390 LEU B CG  1 ? 
ATOM   788  C  CD1 . LEU B 2 58  ? -40.624 4.158  30.561  1.000 75.030  0 390 LEU B CD1 1 ? 
ATOM   789  C  CD2 . LEU B 2 58  ? -40.682 5.134  32.856  1.000 74.390  0 390 LEU B CD2 1 ? 
ATOM   790  N  N   . CYS B 2 59  ? -42.391 9.122  32.207  1.000 69.430  0 391 CYS B N   1 ? 
ATOM   791  C  CA  . CYS B 2 59  ? -42.321 10.547 31.936  1.000 69.880  0 391 CYS B CA  1 ? 
ATOM   792  C  C   . CYS B 2 59  ? -41.028 10.863 31.177  1.000 61.700  0 391 CYS B C   1 ? 
ATOM   793  O  O   . CYS B 2 59  ? -39.977 10.266 31.411  1.000 60.810  0 391 CYS B O   1 ? 
ATOM   794  C  CB  . CYS B 2 59  ? -42.424 11.347 33.234  1.000 75.830  0 391 CYS B CB  1 ? 
ATOM   795  S  SG  . CYS B 2 59  ? -44.008 11.154 34.108  1.000 73.210  0 391 CYS B SG  1 ? 
ATOM   796  N  N   . PHE B 2 60  ? -41.123 11.797 30.232  1.000 56.100  0 392 PHE B N   1 ? 
ATOM   797  C  CA  . PHE B 2 60  ? -39.967 12.260 29.484  1.000 55.500  0 392 PHE B CA  1 ? 
ATOM   798  C  C   . PHE B 2 60  ? -39.956 13.772 29.504  1.000 53.260  0 392 PHE B C   1 ? 
ATOM   799  O  O   . PHE B 2 60  ? -40.996 14.376 29.768  1.000 55.910  0 392 PHE B O   1 ? 
ATOM   800  C  CB  . PHE B 2 60  ? -40.044 11.766 28.040  1.000 54.290  0 392 PHE B CB  1 ? 
ATOM   801  C  CG  . PHE B 2 60  ? -39.993 10.269 27.957  1.000 58.190  0 392 PHE B CG  1 ? 
ATOM   802  C  CD1 . PHE B 2 60  ? -38.786 9.608  28.113  1.000 56.030  0 392 PHE B CD1 1 ? 
ATOM   803  C  CD2 . PHE B 2 60  ? -41.160 9.525  27.823  1.000 60.020  0 392 PHE B CD2 1 ? 
ATOM   804  C  CE1 . PHE B 2 60  ? -38.732 8.223  28.085  1.000 56.820  0 392 PHE B CE1 1 ? 
ATOM   805  C  CE2 . PHE B 2 60  ? -41.111 8.142  27.803  1.000 58.020  0 392 PHE B CE2 1 ? 
ATOM   806  C  CZ  . PHE B 2 60  ? -39.899 7.491  27.953  1.000 57.970  0 392 PHE B CZ  1 ? 
ATOM   807  N  N   . THR B 2 61  ? -38.797 14.341 29.157  1.000 55.730  0 393 THR B N   1 ? 
ATOM   808  C  CA  . THR B 2 61  ? -38.622 15.778 29.045  1.000 53.190  0 393 THR B CA  1 ? 
ATOM   809  C  C   . THR B 2 61  ? -39.382 16.298 27.837  1.000 56.360  0 393 THR B C   1 ? 
ATOM   810  O  O   . THR B 2 61  ? -40.188 17.238 27.939  1.000 63.320  0 393 THR B O   1 ? 
ATOM   811  C  CB  . THR B 2 61  ? -37.138 16.137 28.883  1.000 62.480  0 393 THR B CB  1 ? 
ATOM   812  O  OG1 . THR B 2 61  ? -36.419 15.691 30.033  1.000 55.830  0 393 THR B OG1 1 ? 
ATOM   813  C  CG2 . THR B 2 61  ? -36.939 17.621 28.660  1.000 63.790  0 393 THR B CG2 1 ? 
ATOM   814  N  N   . ASN B 2 62  ? -39.089 15.649 26.701  1.000 55.210  0 394 ASN B N   1 ? 
ATOM   815  C  CA  . ASN B 2 62  ? -39.685 15.946 25.412  1.000 53.980  0 394 ASN B CA  1 ? 
ATOM   816  C  C   . ASN B 2 62  ? -39.944 14.640 24.666  1.000 51.900  0 394 ASN B C   1 ? 
ATOM   817  O  O   . ASN B 2 62  ? -39.161 13.700 24.783  1.000 47.500  0 394 ASN B O   1 ? 
ATOM   818  C  CB  . ASN B 2 62  ? -38.771 16.851 24.575  1.000 64.190  0 394 ASN B CB  1 ? 
ATOM   819  C  CG  . ASN B 2 62  ? -38.507 18.194 25.237  1.000 67.670  0 394 ASN B CG  1 ? 
ATOM   820  O  OD1 . ASN B 2 62  ? -39.398 19.028 25.376  1.000 59.990  0 394 ASN B OD1 1 ? 
ATOM   821  N  ND2 . ASN B 2 62  ? -37.286 18.394 25.684  1.000 62.160  0 394 ASN B ND2 1 ? 
ATOM   822  N  N   . VAL B 2 63  ? -41.024 14.624 23.875  1.000 57.460  0 395 VAL B N   1 ? 
ATOM   823  C  CA  . VAL B 2 63  ? -41.162 13.667 22.793  1.000 55.400  0 395 VAL B CA  1 ? 
ATOM   824  C  C   . VAL B 2 63  ? -41.177 14.418 21.463  1.000 52.840  0 395 VAL B C   1 ? 
ATOM   825  O  O   . VAL B 2 63  ? -41.754 15.505 21.343  1.000 58.080  0 395 VAL B O   1 ? 
ATOM   826  C  CB  . VAL B 2 63  ? -42.404 12.764 22.975  1.000 59.730  0 395 VAL B CB  1 ? 
ATOM   827  C  CG1 . VAL B 2 63  ? -42.537 11.723 21.866  1.000 55.960  0 395 VAL B CG1 1 ? 
ATOM   828  C  CG2 . VAL B 2 63  ? -42.364 12.055 24.321  1.000 56.470  0 395 VAL B CG2 1 ? 
ATOM   829  N  N   . TYR B 2 64  ? -40.456 13.833 20.501  1.000 44.720  0 396 TYR B N   1 ? 
ATOM   830  C  CA  . TYR B 2 64  ? -40.411 14.257 19.120  1.000 45.640  0 396 TYR B CA  1 ? 
ATOM   831  C  C   . TYR B 2 64  ? -41.073 13.204 18.233  1.000 47.190  0 396 TYR B C   1 ? 
ATOM   832  O  O   . TYR B 2 64  ? -40.728 12.020 18.284  1.000 54.120  0 396 TYR B O   1 ? 
ATOM   833  C  CB  . TYR B 2 64  ? -38.960 14.469 18.688  1.000 54.730  0 396 TYR B CB  1 ? 
ATOM   834  C  CG  . TYR B 2 64  ? -38.237 15.440 19.585  1.000 58.010  0 396 TYR B CG  1 ? 
ATOM   835  C  CD1 . TYR B 2 64  ? -38.482 16.801 19.501  1.000 60.900  0 396 TYR B CD1 1 ? 
ATOM   836  C  CD2 . TYR B 2 64  ? -37.352 14.997 20.548  1.000 64.400  0 396 TYR B CD2 1 ? 
ATOM   837  C  CE1 . TYR B 2 64  ? -37.843 17.701 20.339  1.000 61.770  0 396 TYR B CE1 1 ? 
ATOM   838  C  CE2 . TYR B 2 64  ? -36.700 15.885 21.390  1.000 67.350  0 396 TYR B CE2 1 ? 
ATOM   839  C  CZ  . TYR B 2 64  ? -36.941 17.240 21.274  1.000 61.750  0 396 TYR B CZ  1 ? 
ATOM   840  O  OH  . TYR B 2 64  ? -36.309 18.107 22.124  1.000 68.850  0 396 TYR B OH  1 ? 
ATOM   841  N  N   . ALA B 2 65  ? -42.039 13.688 17.458  1.000 49.760  0 397 ALA B N   1 ? 
ATOM   842  C  CA  . ALA B 2 65  ? -42.748 12.963 16.418  1.000 53.630  0 397 ALA B CA  1 ? 
ATOM   843  C  C   . ALA B 2 65  ? -42.307 13.437 15.033  1.000 54.500  0 397 ALA B C   1 ? 
ATOM   844  O  O   . ALA B 2 65  ? -42.761 14.486 14.549  1.000 50.330  0 397 ALA B O   1 ? 
ATOM   845  C  CB  . ALA B 2 65  ? -44.218 13.210 16.620  1.000 52.950  0 397 ALA B CB  1 ? 
ATOM   846  N  N   . ASP B 2 66  ? -41.423 12.654 14.400  1.000 48.560  0 398 ASP B N   1 ? 
ATOM   847  C  CA  . ASP B 2 66  ? -41.071 12.872 13.002  1.000 48.350  0 398 ASP B CA  1 ? 
ATOM   848  C  C   . ASP B 2 66  ? -42.090 12.157 12.116  1.000 49.840  0 398 ASP B C   1 ? 
ATOM   849  O  O   . ASP B 2 66  ? -42.459 11.024 12.414  1.000 54.370  0 398 ASP B O   1 ? 
ATOM   850  C  CB  . ASP B 2 66  ? -39.639 12.386 12.755  1.000 45.370  0 398 ASP B CB  1 ? 
ATOM   851  C  CG  . ASP B 2 66  ? -38.626 13.034 13.673  1.000 47.560  0 398 ASP B CG  1 ? 
ATOM   852  O  OD1 . ASP B 2 66  ? -38.932 14.133 14.160  1.000 49.970  0 398 ASP B OD1 1 ? 
ATOM   853  O  OD2 . ASP B 2 66  ? -37.526 12.456 13.851  1.000 46.240  0 398 ASP B OD2 1 ? 
ATOM   854  N  N   . SER B 2 67  ? -42.544 12.805 11.030  1.000 47.390  0 399 SER B N   1 ? 
ATOM   855  C  CA  . SER B 2 67  ? -43.535 12.221 10.144  1.000 48.040  0 399 SER B CA  1 ? 
ATOM   856  C  C   . SER B 2 67  ? -43.230 12.554 8.674   1.000 59.530  0 399 SER B C   1 ? 
ATOM   857  O  O   . SER B 2 67  ? -42.667 13.610 8.345   1.000 49.960  0 399 SER B O   1 ? 
ATOM   858  C  CB  . SER B 2 67  ? -44.925 12.617 10.562  1.000 52.950  0 399 SER B CB  1 ? 
ATOM   859  O  OG  . SER B 2 67  ? -45.146 14.021 10.485  1.000 51.900  0 399 SER B OG  1 ? 
ATOM   860  N  N   . PHE B 2 68  ? -43.572 11.597 7.799   1.000 50.410  0 400 PHE B N   1 ? 
ATOM   861  C  CA  . PHE B 2 68  ? -43.396 11.708 6.356   1.000 44.850  0 400 PHE B CA  1 ? 
ATOM   862  C  C   . PHE B 2 68  ? -44.108 10.574 5.631   1.000 47.070  0 400 PHE B C   1 ? 
ATOM   863  O  O   . PHE B 2 68  ? -44.665 9.703  6.292   1.000 47.570  0 400 PHE B O   1 ? 
ATOM   864  C  CB  . PHE B 2 68  ? -41.922 11.621 5.978   1.000 39.480  0 400 PHE B CB  1 ? 
ATOM   865  C  CG  . PHE B 2 68  ? -41.165 10.540 6.697   1.000 44.330  0 400 PHE B CG  1 ? 
ATOM   866  C  CD1 . PHE B 2 68  ? -41.054 9.276  6.138   1.000 48.980  0 400 PHE B CD1 1 ? 
ATOM   867  C  CD2 . PHE B 2 68  ? -40.506 10.788 7.880   1.000 47.980  0 400 PHE B CD2 1 ? 
ATOM   868  C  CE1 . PHE B 2 68  ? -40.345 8.282  6.784   1.000 45.000  0 400 PHE B CE1 1 ? 
ATOM   869  C  CE2 . PHE B 2 68  ? -39.773 9.795  8.516   1.000 53.480  0 400 PHE B CE2 1 ? 
ATOM   870  C  CZ  . PHE B 2 68  ? -39.695 8.543  7.963   1.000 43.950  0 400 PHE B CZ  1 ? 
ATOM   871  N  N   . VAL B 2 69  ? -44.015 10.582 4.287   1.000 48.230  0 401 VAL B N   1 ? 
ATOM   872  C  CA  . VAL B 2 69  ? -44.529 9.517  3.426   1.000 48.240  0 401 VAL B CA  1 ? 
ATOM   873  C  C   . VAL B 2 69  ? -43.400 8.893  2.608   1.000 53.490  0 401 VAL B C   1 ? 
ATOM   874  O  O   . VAL B 2 69  ? -42.558 9.594  2.035   1.000 49.510  0 401 VAL B O   1 ? 
ATOM   875  C  CB  . VAL B 2 69  ? -45.663 10.073 2.544   1.000 53.880  0 401 VAL B CB  1 ? 
ATOM   876  C  CG1 . VAL B 2 69  ? -46.012 9.202  1.352   1.000 56.800  0 401 VAL B CG1 1 ? 
ATOM   877  C  CG2 . VAL B 2 69  ? -46.899 10.324 3.386   1.000 54.950  0 401 VAL B CG2 1 ? 
ATOM   878  N  N   . ILE B 2 70  ? -43.347 7.554  2.625   1.000 51.130  0 402 ILE B N   1 ? 
ATOM   879  C  CA  . ILE B 2 70  ? -42.479 6.783  1.756   1.000 44.960  0 402 ILE B CA  1 ? 
ATOM   880  C  C   . ILE B 2 70  ? -43.289 5.664  1.090   1.000 50.820  0 402 ILE B C   1 ? 
ATOM   881  O  O   . ILE B 2 70  ? -44.484 5.533  1.309   1.000 49.210  0 402 ILE B O   1 ? 
ATOM   882  C  CB  . ILE B 2 70  ? -41.288 6.185  2.520   1.000 47.530  0 402 ILE B CB  1 ? 
ATOM   883  C  CG1 . ILE B 2 70  ? -41.749 5.434  3.771   1.000 48.430  0 402 ILE B CG1 1 ? 
ATOM   884  C  CG2 . ILE B 2 70  ? -40.233 7.250  2.799   1.000 52.920  0 402 ILE B CG2 1 ? 
ATOM   885  C  CD1 . ILE B 2 70  ? -40.643 4.769  4.526   1.000 47.590  0 402 ILE B CD1 1 ? 
ATOM   886  N  N   . ARG B 2 71  ? -42.615 4.884  0.241   1.000 46.410  0 403 ARG B N   1 ? 
ATOM   887  C  CA  . ARG B 2 71  ? -43.210 3.704  -0.369  1.000 53.840  0 403 ARG B CA  1 ? 
ATOM   888  C  C   . ARG B 2 71  ? -43.288 2.586  0.649   1.000 47.080  0 403 ARG B C   1 ? 
ATOM   889  O  O   . ARG B 2 71  ? -42.408 2.427  1.496   1.000 46.470  0 403 ARG B O   1 ? 
ATOM   890  C  CB  . ARG B 2 71  ? -42.370 3.136  -1.509  1.000 49.930  0 403 ARG B CB  1 ? 
ATOM   891  C  CG  . ARG B 2 71  ? -42.508 3.914  -2.802  1.000 46.870  0 403 ARG B CG  1 ? 
ATOM   892  C  CD  . ARG B 2 71  ? -41.244 3.837  -3.598  1.000 46.940  0 403 ARG B CD  1 ? 
ATOM   893  N  NE  . ARG B 2 71  ? -40.907 2.491  -4.041  1.000 50.870  0 403 ARG B NE  1 ? 
ATOM   894  C  CZ  . ARG B 2 71  ? -39.893 2.222  -4.847  1.000 53.220  0 403 ARG B CZ  1 ? 
ATOM   895  N  NH1 . ARG B 2 71  ? -39.272 3.207  -5.475  1.000 53.770  0 403 ARG B NH1 1 ? 
ATOM   896  N  NH2 . ARG B 2 71  ? -39.508 0.972  -5.046  1.000 47.320  0 403 ARG B NH2 1 ? 
ATOM   897  N  N   . GLY B 2 72  ? -44.332 1.780  0.500   1.000 49.200  0 404 GLY B N   1 ? 
ATOM   898  C  CA  . GLY B 2 72  ? -44.463 0.577  1.307   1.000 50.300  0 404 GLY B CA  1 ? 
ATOM   899  C  C   . GLY B 2 72  ? -43.173 -0.220 1.438   1.000 39.970  0 404 GLY B C   1 ? 
ATOM   900  O  O   . GLY B 2 72  ? -42.816 -0.645 2.545   1.000 45.680  0 404 GLY B O   1 ? 
ATOM   901  N  N   . ASN B 2 73  ? -42.448 -0.432 0.345   1.000 45.790  0 405 ASN B N   1 ? 
ATOM   902  C  CA  . ASN B 2 73  ? -41.271 -1.303 0.398   1.000 45.520  0 405 ASN B CA  1 ? 
ATOM   903  C  C   . ASN B 2 73  ? -40.104 -0.647 1.132   1.000 53.470  0 405 ASN B C   1 ? 
ATOM   904  O  O   . ASN B 2 73  ? -39.104 -1.323 1.416   1.000 46.070  0 405 ASN B O   1 ? 
ATOM   905  C  CB  . ASN B 2 73  ? -40.777 -1.696 -1.001  1.000 57.500  0 405 ASN B CB  1 ? 
ATOM   906  C  CG  . ASN B 2 73  ? -40.181 -0.526 -1.767  1.000 56.910  0 405 ASN B CG  1 ? 
ATOM   907  O  OD1 . ASN B 2 73  ? -40.905 0.358  -2.195  1.000 47.970  0 405 ASN B OD1 1 ? 
ATOM   908  N  ND2 . ASN B 2 73  ? -38.869 -0.498 -1.933  1.000 50.300  0 405 ASN B ND2 1 ? 
ATOM   909  N  N   . GLU B 2 74  ? -40.204 0.679  1.375   1.000 51.220  0 406 GLU B N   1 ? 
ATOM   910  C  CA  . GLU B 2 74  ? -39.136 1.457  2.001   1.000 51.550  0 406 GLU B CA  1 ? 
ATOM   911  C  C   . GLU B 2 74  ? -39.307 1.495  3.518   1.000 46.160  0 406 GLU B C   1 ? 
ATOM   912  O  O   . GLU B 2 74  ? -38.411 1.904  4.247   1.000 49.260  0 406 GLU B O   1 ? 
ATOM   913  C  CB  . GLU B 2 74  ? -39.141 2.891  1.434   1.000 52.250  0 406 GLU B CB  1 ? 
ATOM   914  C  CG  . GLU B 2 74  ? -38.509 2.984  0.059   1.000 48.620  0 406 GLU B CG  1 ? 
ATOM   915  C  CD  . GLU B 2 74  ? -38.780 4.209  -0.791  1.000 45.020  0 406 GLU B CD  1 ? 
ATOM   916  O  OE1 . GLU B 2 74  ? -39.705 5.007  -0.457  1.000 49.170  0 406 GLU B OE1 1 ? 
ATOM   917  O  OE2 . GLU B 2 74  ? -38.097 4.329  -1.847  1.000 47.100  0 406 GLU B OE2 1 ? 
ATOM   918  N  N   . VAL B 2 75  ? -40.483 1.110  4.008   1.000 47.800  0 407 VAL B N   1 ? 
ATOM   919  C  CA  . VAL B 2 75  ? -40.806 1.237  5.426   1.000 52.570  0 407 VAL B CA  1 ? 
ATOM   920  C  C   . VAL B 2 75  ? -39.757 0.533  6.289   1.000 54.830  0 407 VAL B C   1 ? 
ATOM   921  O  O   . VAL B 2 75  ? -39.364 1.045  7.350   1.000 50.160  0 407 VAL B O   1 ? 
ATOM   922  C  CB  . VAL B 2 75  ? -42.233 0.730  5.718   1.000 52.610  0 407 VAL B CB  1 ? 
ATOM   923  C  CG1 . VAL B 2 75  ? -42.521 0.628  7.204   1.000 58.870  0 407 VAL B CG1 1 ? 
ATOM   924  C  CG2 . VAL B 2 75  ? -43.261 1.596  5.046   1.000 47.660  0 407 VAL B CG2 1 ? 
ATOM   925  N  N   . SER B 2 76  ? -39.265 -0.612 5.806   1.000 48.390  0 408 SER B N   1 ? 
ATOM   926  C  CA  . SER B 2 76  ? -38.319 -1.408 6.557   1.000 48.690  0 408 SER B CA  1 ? 
ATOM   927  C  C   . SER B 2 76  ? -36.982 -0.696 6.699   1.000 51.930  0 408 SER B C   1 ? 
ATOM   928  O  O   . SER B 2 76  ? -36.187 -1.040 7.576   1.000 55.020  0 408 SER B O   1 ? 
ATOM   929  C  CB  . SER B 2 76  ? -38.136 -2.758 5.917   1.000 55.310  0 408 SER B CB  1 ? 
ATOM   930  O  OG  . SER B 2 76  ? -37.718 -2.627 4.570   1.000 56.000  0 408 SER B OG  1 ? 
ATOM   931  N  N   . GLN B 2 77  ? -36.719 0.310  5.861   1.000 52.930  0 409 GLN B N   1 ? 
ATOM   932  C  CA  . GLN B 2 77  ? -35.535 1.139  6.071   1.000 50.860  0 409 GLN B CA  1 ? 
ATOM   933  C  C   . GLN B 2 77  ? -35.647 2.028  7.304   1.000 52.660  0 409 GLN B C   1 ? 
ATOM   934  O  O   . GLN B 2 77  ? -34.634 2.516  7.809   1.000 51.070  0 409 GLN B O   1 ? 
ATOM   935  C  CB  . GLN B 2 77  ? -35.288 2.007  4.855   1.000 56.010  0 409 GLN B CB  1 ? 
ATOM   936  C  CG  . GLN B 2 77  ? -34.727 1.176  3.718   1.000 56.060  0 409 GLN B CG  1 ? 
ATOM   937  C  CD  . GLN B 2 77  ? -34.386 2.053  2.549   1.000 54.030  0 409 GLN B CD  1 ? 
ATOM   938  O  OE1 . GLN B 2 77  ? -33.626 3.017  2.679   1.000 55.600  0 409 GLN B OE1 1 ? 
ATOM   939  N  NE2 . GLN B 2 77  ? -34.943 1.702  1.402   1.000 48.680  0 409 GLN B NE2 1 ? 
ATOM   940  N  N   . ILE B 2 78  ? -36.869 2.262  7.794   1.000 51.510  0 410 ILE B N   1 ? 
ATOM   941  C  CA  . ILE B 2 78  ? -36.996 3.112  8.957   1.000 50.720  0 410 ILE B CA  1 ? 
ATOM   942  C  C   . ILE B 2 78  ? -36.777 2.259  10.205  1.000 52.290  0 410 ILE B C   1 ? 
ATOM   943  O  O   . ILE B 2 78  ? -37.707 1.980  10.946  1.000 49.110  0 410 ILE B O   1 ? 
ATOM   944  C  CB  . ILE B 2 78  ? -38.322 3.879  8.981   1.000 43.940  0 410 ILE B CB  1 ? 
ATOM   945  C  CG1 . ILE B 2 78  ? -38.636 4.532  7.633   1.000 45.640  0 410 ILE B CG1 1 ? 
ATOM   946  C  CG2 . ILE B 2 78  ? -38.297 4.880  10.125  1.000 44.690  0 410 ILE B CG2 1 ? 
ATOM   947  C  CD1 . ILE B 2 78  ? -37.484 5.317  7.002   1.000 53.190  0 410 ILE B CD1 1 ? 
ATOM   948  N  N   . ALA B 2 79  ? -35.516 1.866  10.401  1.000 55.100  0 411 ALA B N   1 ? 
ATOM   949  C  CA  . ALA B 2 79  ? -35.087 1.049  11.516  1.000 58.340  0 411 ALA B CA  1 ? 
ATOM   950  C  C   . ALA B 2 79  ? -33.593 1.252  11.699  1.000 58.340  0 411 ALA B C   1 ? 
ATOM   951  O  O   . ALA B 2 79  ? -32.899 1.690  10.777  1.000 55.080  0 411 ALA B O   1 ? 
ATOM   952  C  CB  . ALA B 2 79  ? -35.425 -0.403 11.281  1.000 66.080  0 411 ALA B CB  1 ? 
ATOM   953  N  N   . PRO B 2 80  ? -33.065 0.987  12.910  1.000 67.310  0 412 PRO B N   1 ? 
ATOM   954  C  CA  . PRO B 2 80  ? -31.638 1.173  13.185  1.000 64.990  0 412 PRO B CA  1 ? 
ATOM   955  C  C   . PRO B 2 80  ? -30.793 0.210  12.367  1.000 61.310  0 412 PRO B C   1 ? 
ATOM   956  O  O   . PRO B 2 80  ? -31.197 -0.928 12.160  1.000 63.450  0 412 PRO B O   1 ? 
ATOM   957  C  CB  . PRO B 2 80  ? -31.489 0.857  14.685  1.000 68.310  0 412 PRO B CB  1 ? 
ATOM   958  C  CG  . PRO B 2 80  ? -32.901 0.917  15.236  1.000 73.730  0 412 PRO B CG  1 ? 
ATOM   959  C  CD  . PRO B 2 80  ? -33.816 0.526  14.089  1.000 65.770  0 412 PRO B CD  1 ? 
ATOM   960  N  N   . GLY B 2 81  ? -29.620 0.673  11.915  1.000 75.210  0 413 GLY B N   1 ? 
ATOM   961  C  CA  . GLY B 2 81  ? -28.677 -0.168 11.186  1.000 71.890  0 413 GLY B CA  1 ? 
ATOM   962  C  C   . GLY B 2 81  ? -29.069 -0.466 9.731   1.000 70.250  0 413 GLY B C   1 ? 
ATOM   963  O  O   . GLY B 2 81  ? -28.391 -1.241 9.070   1.000 70.720  0 413 GLY B O   1 ? 
ATOM   964  N  N   . GLN B 2 82  ? -30.131 0.160  9.206   1.000 70.290  0 414 GLN B N   1 ? 
ATOM   965  C  CA  . GLN B 2 82  ? -30.591 -0.109 7.850   1.000 64.460  0 414 GLN B CA  1 ? 
ATOM   966  C  C   . GLN B 2 82  ? -29.773 0.692  6.851   1.000 62.510  0 414 GLN B C   1 ? 
ATOM   967  O  O   . GLN B 2 82  ? -29.245 1.740  7.194   1.000 58.890  0 414 GLN B O   1 ? 
ATOM   968  C  CB  . GLN B 2 82  ? -32.065 0.270  7.672   1.000 66.650  0 414 GLN B CB  1 ? 
ATOM   969  C  CG  . GLN B 2 82  ? -33.034 -0.714 8.298   1.000 69.210  0 414 GLN B CG  1 ? 
ATOM   970  C  CD  . GLN B 2 82  ? -33.019 -2.022 7.547   1.000 67.230  0 414 GLN B CD  1 ? 
ATOM   971  O  OE1 . GLN B 2 82  ? -33.280 -2.078 6.346   1.000 76.150  0 414 GLN B OE1 1 ? 
ATOM   972  N  NE2 . GLN B 2 82  ? -32.688 -3.088 8.248   1.000 78.130  0 414 GLN B NE2 1 ? 
ATOM   973  N  N   . THR B 2 83  ? -29.700 0.197  5.611   1.000 67.600  0 415 THR B N   1 ? 
ATOM   974  C  CA  . THR B 2 83  ? -29.156 0.967  4.508   1.000 72.940  0 415 THR B CA  1 ? 
ATOM   975  C  C   . THR B 2 83  ? -30.158 0.994  3.355   1.000 68.550  0 415 THR B C   1 ? 
ATOM   976  O  O   . THR B 2 83  ? -31.131 0.243  3.339   1.000 71.190  0 415 THR B O   1 ? 
ATOM   977  C  CB  . THR B 2 83  ? -27.795 0.413  4.083   1.000 86.010  0 415 THR B CB  1 ? 
ATOM   978  O  OG1 . THR B 2 83  ? -27.223 1.381  3.200   1.000 94.350  0 415 THR B OG1 1 ? 
ATOM   979  C  CG2 . THR B 2 83  ? -27.898 -0.950 3.433   1.000 86.890  0 415 THR B CG2 1 ? 
ATOM   980  N  N   . GLY B 2 84  ? -29.919 1.885  2.389   1.000 59.840  0 416 GLY B N   1 ? 
ATOM   981  C  CA  . GLY B 2 84  ? -30.829 2.042  1.269   1.000 59.940  0 416 GLY B CA  1 ? 
ATOM   982  C  C   . GLY B 2 84  ? -31.104 3.508  0.968   1.000 56.320  0 416 GLY B C   1 ? 
ATOM   983  O  O   . GLY B 2 84  ? -30.576 4.385  1.640   1.000 52.790  0 416 GLY B O   1 ? 
ATOM   984  N  N   . ASN B 2 85  ? -31.958 3.740  -0.030  1.000 51.690  0 417 ASN B N   1 ? 
ATOM   985  C  CA  . ASN B 2 85  ? -32.128 5.057  -0.612  1.000 55.100  0 417 ASN B CA  1 ? 
ATOM   986  C  C   . ASN B 2 85  ? -32.675 6.029  0.439   1.000 56.310  0 417 ASN B C   1 ? 
ATOM   987  O  O   . ASN B 2 85  ? -32.295 7.210  0.447   1.000 49.590  0 417 ASN B O   1 ? 
ATOM   988  C  CB  . ASN B 2 85  ? -33.005 4.989  -1.869  1.000 52.960  0 417 ASN B CB  1 ? 
ATOM   989  C  CG  . ASN B 2 85  ? -34.417 4.495  -1.598  1.000 53.710  0 417 ASN B CG  1 ? 
ATOM   990  O  OD1 . ASN B 2 85  ? -34.612 3.519  -0.871  1.000 55.130  0 417 ASN B OD1 1 ? 
ATOM   991  N  ND2 . ASN B 2 85  ? -35.412 5.175  -2.140  1.000 54.050  0 417 ASN B ND2 1 ? 
ATOM   992  N  N   . ILE B 2 86  ? -33.619 5.530  1.261   1.000 54.810  0 418 ILE B N   1 ? 
ATOM   993  C  CA  . ILE B 2 86  ? -34.246 6.318  2.308   1.000 53.820  0 418 ILE B CA  1 ? 
ATOM   994  C  C   . ILE B 2 86  ? -33.310 6.472  3.499   1.000 53.050  0 418 ILE B C   1 ? 
ATOM   995  O  O   . ILE B 2 86  ? -33.127 7.588  3.968   1.000 49.920  0 418 ILE B O   1 ? 
ATOM   996  C  CB  . ILE B 2 86  ? -35.602 5.742  2.747   1.000 49.560  0 418 ILE B CB  1 ? 
ATOM   997  C  CG1 . ILE B 2 86  ? -36.548 5.607  1.557   1.000 49.280  0 418 ILE B CG1 1 ? 
ATOM   998  C  CG2 . ILE B 2 86  ? -36.212 6.618  3.832   1.000 50.410  0 418 ILE B CG2 1 ? 
ATOM   999  C  CD1 . ILE B 2 86  ? -36.740 6.895  0.797   1.000 58.440  0 418 ILE B CD1 1 ? 
ATOM   1000 N  N   . ALA B 2 87  ? -32.744 5.378  4.006   1.000 55.680  0 419 ALA B N   1 ? 
ATOM   1001 C  CA  . ALA B 2 87  ? -31.843 5.477  5.152   1.000 55.350  0 419 ALA B CA  1 ? 
ATOM   1002 C  C   . ALA B 2 87  ? -30.588 6.284  4.797   1.000 61.940  0 419 ALA B C   1 ? 
ATOM   1003 O  O   . ALA B 2 87  ? -30.064 7.027  5.630   1.000 62.020  0 419 ALA B O   1 ? 
ATOM   1004 C  CB  . ALA B 2 87  ? -31.437 4.101  5.641   1.000 55.200  0 419 ALA B CB  1 ? 
ATOM   1005 N  N   . ASP B 2 88  ? -30.044 6.060  3.597   1.000 59.400  0 420 ASP B N   1 ? 
ATOM   1006 C  CA  . ASP B 2 88  ? -28.811 6.717  3.209   1.000 61.180  0 420 ASP B CA  1 ? 
ATOM   1007 C  C   . ASP B 2 88  ? -29.092 8.206  3.015   1.000 57.970  0 420 ASP B C   1 ? 
ATOM   1008 O  O   . ASP B 2 88  ? -28.330 9.010  3.519   1.000 61.900  0 420 ASP B O   1 ? 
ATOM   1009 C  CB  . ASP B 2 88  ? -28.147 6.056  1.994   1.000 60.920  0 420 ASP B CB  1 ? 
ATOM   1010 C  CG  . ASP B 2 88  ? -27.627 4.649  2.243   1.000 66.090  0 420 ASP B CG  1 ? 
ATOM   1011 O  OD1 . ASP B 2 88  ? -27.950 4.068  3.295   1.000 67.310  0 420 ASP B OD1 1 ? 
ATOM   1012 O  OD2 . ASP B 2 88  ? -26.899 4.141  1.382   1.000 72.920  0 420 ASP B OD2 1 ? 
ATOM   1013 N  N   . TYR B 2 89  ? -30.170 8.599  2.314   1.000 53.210  0 421 TYR B N   1 ? 
ATOM   1014 C  CA  . TYR B 2 89  ? -30.198 9.943  1.733   1.000 47.110  0 421 TYR B CA  1 ? 
ATOM   1015 C  C   . TYR B 2 89  ? -31.406 10.777 2.156   1.000 50.890  0 421 TYR B C   1 ? 
ATOM   1016 O  O   . TYR B 2 89  ? -31.497 11.948 1.766   1.000 52.030  0 421 TYR B O   1 ? 
ATOM   1017 C  CB  . TYR B 2 89  ? -30.153 9.892  0.195   1.000 52.690  0 421 TYR B CB  1 ? 
ATOM   1018 C  CG  . TYR B 2 89  ? -29.009 9.129  -0.440  1.000 51.280  0 421 TYR B CG  1 ? 
ATOM   1019 C  CD1 . TYR B 2 89  ? -27.843 8.846  0.250   1.000 60.300  0 421 TYR B CD1 1 ? 
ATOM   1020 C  CD2 . TYR B 2 89  ? -29.084 8.675  -1.759  1.000 54.180  0 421 TYR B CD2 1 ? 
ATOM   1021 C  CE1 . TYR B 2 89  ? -26.809 8.104  -0.313  1.000 58.650  0 421 TYR B CE1 1 ? 
ATOM   1022 C  CE2 . TYR B 2 89  ? -28.050 7.953  -2.346  1.000 50.610  0 421 TYR B CE2 1 ? 
ATOM   1023 C  CZ  . TYR B 2 89  ? -26.909 7.650  -1.614  1.000 61.300  0 421 TYR B CZ  1 ? 
ATOM   1024 O  OH  . TYR B 2 89  ? -25.832 6.917  -2.088  1.000 62.960  0 421 TYR B OH  1 ? 
ATOM   1025 N  N   . ASN B 2 90  ? -32.305 10.232 2.992   1.000 48.290  0 422 ASN B N   1 ? 
ATOM   1026 C  CA  . ASN B 2 90  ? -33.519 10.962 3.318   1.000 48.240  0 422 ASN B CA  1 ? 
ATOM   1027 C  C   . ASN B 2 90  ? -33.789 11.054 4.817   1.000 48.670  0 422 ASN B C   1 ? 
ATOM   1028 O  O   . ASN B 2 90  ? -34.042 12.164 5.314   1.000 53.240  0 422 ASN B O   1 ? 
ATOM   1029 C  CB  . ASN B 2 90  ? -34.733 10.343 2.641   1.000 50.040  0 422 ASN B CB  1 ? 
ATOM   1030 C  CG  . ASN B 2 90  ? -34.738 10.613 1.165   1.000 47.970  0 422 ASN B CG  1 ? 
ATOM   1031 O  OD1 . ASN B 2 90  ? -35.435 11.524 0.712   1.000 49.340  0 422 ASN B OD1 1 ? 
ATOM   1032 N  ND2 . ASN B 2 90  ? -33.951 9.838  0.434   1.000 47.750  0 422 ASN B ND2 1 ? 
ATOM   1033 N  N   . TYR B 2 91  ? -33.787 9.908  5.519   1.000 47.820  0 423 TYR B N   1 ? 
ATOM   1034 C  CA  . TYR B 2 91  ? -34.102 9.875  6.946   1.000 48.640  0 423 TYR B CA  1 ? 
ATOM   1035 C  C   . TYR B 2 91  ? -33.387 8.712  7.624   1.000 58.540  0 423 TYR B C   1 ? 
ATOM   1036 O  O   . TYR B 2 91  ? -33.640 7.555  7.300   1.000 55.480  0 423 TYR B O   1 ? 
ATOM   1037 C  CB  . TYR B 2 91  ? -35.612 9.823  7.182   1.000 48.320  0 423 TYR B CB  1 ? 
ATOM   1038 C  CG  . TYR B 2 91  ? -36.024 9.903  8.635   1.000 52.560  0 423 TYR B CG  1 ? 
ATOM   1039 C  CD1 . TYR B 2 91  ? -36.029 8.776  9.437   1.000 50.070  0 423 TYR B CD1 1 ? 
ATOM   1040 C  CD2 . TYR B 2 91  ? -36.387 11.110 9.224   1.000 52.630  0 423 TYR B CD2 1 ? 
ATOM   1041 C  CE1 . TYR B 2 91  ? -36.400 8.832  10.771  1.000 53.700  0 423 TYR B CE1 1 ? 
ATOM   1042 C  CE2 . TYR B 2 91  ? -36.730 11.191 10.564  1.000 56.860  0 423 TYR B CE2 1 ? 
ATOM   1043 C  CZ  . TYR B 2 91  ? -36.755 10.041 11.343  1.000 55.180  0 423 TYR B CZ  1 ? 
ATOM   1044 O  OH  . TYR B 2 91  ? -37.095 10.056 12.684  1.000 52.280  0 423 TYR B OH  1 ? 
ATOM   1045 N  N   . LYS B 2 92  ? -32.523 9.041  8.596   1.000 51.840  0 424 LYS B N   1 ? 
ATOM   1046 C  CA  . LYS B 2 92  ? -31.603 8.071  9.163   1.000 54.890  0 424 LYS B CA  1 ? 
ATOM   1047 C  C   . LYS B 2 92  ? -31.829 7.985  10.667  1.000 55.730  0 424 LYS B C   1 ? 
ATOM   1048 O  O   . LYS B 2 92  ? -31.845 8.999  11.357  1.000 56.810  0 424 LYS B O   1 ? 
ATOM   1049 C  CB  . LYS B 2 92  ? -30.152 8.484  8.886   1.000 60.270  0 424 LYS B CB  1 ? 
ATOM   1050 C  CG  . LYS B 2 92  ? -29.095 7.579  9.495   1.000 65.670  0 424 LYS B CG  1 ? 
ATOM   1051 C  CD  . LYS B 2 92  ? -29.294 6.132  9.143   1.000 67.370  0 424 LYS B CD  1 ? 
ATOM   1052 C  CE  . LYS B 2 92  ? -28.132 5.250  9.537   1.000 63.650  0 424 LYS B CE  1 ? 
ATOM   1053 N  NZ  . LYS B 2 92  ? -28.394 3.856  9.109   1.000 57.780  0 424 LYS B NZ  1 ? 
ATOM   1054 N  N   . LEU B 2 93  ? -32.043 6.761  11.149  1.000 59.810  0 425 LEU B N   1 ? 
ATOM   1055 C  CA  . LEU B 2 93  ? -32.106 6.475  12.570  1.000 55.860  0 425 LEU B CA  1 ? 
ATOM   1056 C  C   . LEU B 2 93  ? -30.724 6.066  13.060  1.000 58.170  0 425 LEU B C   1 ? 
ATOM   1057 O  O   . LEU B 2 93  ? -30.047 5.294  12.393  1.000 70.690  0 425 LEU B O   1 ? 
ATOM   1058 C  CB  . LEU B 2 93  ? -33.073 5.314  12.808  1.000 56.410  0 425 LEU B CB  1 ? 
ATOM   1059 C  CG  . LEU B 2 93  ? -34.554 5.659  12.777  1.000 57.510  0 425 LEU B CG  1 ? 
ATOM   1060 C  CD1 . LEU B 2 93  ? -35.367 4.459  13.209  1.000 61.010  0 425 LEU B CD1 1 ? 
ATOM   1061 C  CD2 . LEU B 2 93  ? -34.852 6.849  13.678  1.000 62.850  0 425 LEU B CD2 1 ? 
ATOM   1062 N  N   . PRO B 2 94  ? -30.314 6.492  14.274  1.000 64.960  0 426 PRO B N   1 ? 
ATOM   1063 C  CA  . PRO B 2 94  ? -29.084 5.994  14.895  1.000 69.950  0 426 PRO B CA  1 ? 
ATOM   1064 C  C   . PRO B 2 94  ? -29.269 4.575  15.415  1.000 68.890  0 426 PRO B C   1 ? 
ATOM   1065 O  O   . PRO B 2 94  ? -30.395 4.162  15.686  1.000 60.610  0 426 PRO B O   1 ? 
ATOM   1066 C  CB  . PRO B 2 94  ? -28.898 6.942  16.079  1.000 68.240  0 426 PRO B CB  1 ? 
ATOM   1067 C  CG  . PRO B 2 94  ? -30.322 7.235  16.491  1.000 71.990  0 426 PRO B CG  1 ? 
ATOM   1068 C  CD  . PRO B 2 94  ? -31.049 7.400  15.169  1.000 69.860  0 426 PRO B CD  1 ? 
ATOM   1069 N  N   . ASP B 2 95  ? -28.147 3.876  15.617  1.000 70.870  0 427 ASP B N   1 ? 
ATOM   1070 C  CA  . ASP B 2 95  ? -28.166 2.475  16.004  1.000 81.520  0 427 ASP B CA  1 ? 
ATOM   1071 C  C   . ASP B 2 95  ? -28.723 2.324  17.422  1.000 73.540  0 427 ASP B C   1 ? 
ATOM   1072 O  O   . ASP B 2 95  ? -29.357 1.322  17.730  1.000 79.820  0 427 ASP B O   1 ? 
ATOM   1073 C  CB  . ASP B 2 95  ? -26.774 1.849  15.842  1.000 91.470  0 427 ASP B CB  1 ? 
ATOM   1074 C  CG  . ASP B 2 95  ? -26.144 2.117  14.485  1.000 85.630  0 427 ASP B CG  1 ? 
ATOM   1075 O  OD1 . ASP B 2 95  ? -25.461 3.139  14.352  1.000 91.440  0 427 ASP B OD1 1 ? 
ATOM   1076 O  OD2 . ASP B 2 95  ? -26.410 1.344  13.557  1.000 86.350  0 427 ASP B OD2 1 ? 
ATOM   1077 N  N   . ASP B 2 96  ? -28.527 3.343  18.264  1.000 76.050  0 428 ASP B N   1 ? 
ATOM   1078 C  CA  . ASP B 2 96  ? -28.907 3.300  19.668  1.000 82.420  0 428 ASP B CA  1 ? 
ATOM   1079 C  C   . ASP B 2 96  ? -30.268 3.964  19.860  1.000 84.270  0 428 ASP B C   1 ? 
ATOM   1080 O  O   . ASP B 2 96  ? -30.507 4.634  20.862  1.000 89.360  0 428 ASP B O   1 ? 
ATOM   1081 C  CB  . ASP B 2 96  ? -27.865 4.017  20.534  1.000 83.220  0 428 ASP B CB  1 ? 
ATOM   1082 C  CG  . ASP B 2 96  ? -27.726 5.500  20.215  1.000 96.790  0 428 ASP B CG  1 ? 
ATOM   1083 O  OD1 . ASP B 2 96  ? -28.298 5.929  19.186  1.000 91.960  0 428 ASP B OD1 1 ? 
ATOM   1084 O  OD2 . ASP B 2 96  ? -27.071 6.225  21.007  1.000 87.660  0 428 ASP B OD2 1 ? 
ATOM   1085 N  N   . PHE B 2 97  ? -31.154 3.787  18.880  1.000 91.920  0 429 PHE B N   1 ? 
ATOM   1086 C  CA  . PHE B 2 97  ? -32.470 4.401  18.909  1.000 80.560  0 429 PHE B CA  1 ? 
ATOM   1087 C  C   . PHE B 2 97  ? -33.369 3.636  19.876  1.000 72.070  0 429 PHE B C   1 ? 
ATOM   1088 O  O   . PHE B 2 97  ? -33.433 2.409  19.806  1.000 71.500  0 429 PHE B O   1 ? 
ATOM   1089 C  CB  . PHE B 2 97  ? -33.065 4.348  17.505  1.000 73.850  0 429 PHE B CB  1 ? 
ATOM   1090 C  CG  . PHE B 2 97  ? -34.457 4.898  17.405  1.000 61.010  0 429 PHE B CG  1 ? 
ATOM   1091 C  CD1 . PHE B 2 97  ? -34.707 6.228  17.687  1.000 61.540  0 429 PHE B CD1 1 ? 
ATOM   1092 C  CD2 . PHE B 2 97  ? -35.520 4.077  17.086  1.000 56.870  0 429 PHE B CD2 1 ? 
ATOM   1093 C  CE1 . PHE B 2 97  ? -35.993 6.732  17.605  1.000 52.610  0 429 PHE B CE1 1 ? 
ATOM   1094 C  CE2 . PHE B 2 97  ? -36.804 4.588  17.000  1.000 56.390  0 429 PHE B CE2 1 ? 
ATOM   1095 C  CZ  . PHE B 2 97  ? -37.034 5.911  17.267  1.000 54.650  0 429 PHE B CZ  1 ? 
ATOM   1096 N  N   . THR B 2 98  ? -34.106 4.355  20.726  1.000 81.240  0 430 THR B N   1 ? 
ATOM   1097 C  CA  . THR B 2 98  ? -34.891 3.684  21.755  1.000 92.690  0 430 THR B CA  1 ? 
ATOM   1098 C  C   . THR B 2 98  ? -36.387 4.014  21.676  1.000 89.440  0 430 THR B C   1 ? 
ATOM   1099 O  O   . THR B 2 98  ? -37.145 3.551  22.531  1.000 98.090  0 430 THR B O   1 ? 
ATOM   1100 C  CB  . THR B 2 98  ? -34.315 3.975  23.148  1.000 82.690  0 430 THR B CB  1 ? 
ATOM   1101 O  OG1 . THR B 2 98  ? -34.359 5.387  23.356  1.000 76.430  0 430 THR B OG1 1 ? 
ATOM   1102 C  CG2 . THR B 2 98  ? -32.897 3.469  23.316  1.000 82.830  0 430 THR B CG2 1 ? 
ATOM   1103 N  N   . GLY B 2 99  ? -36.828 4.757  20.646  1.000 68.630  0 431 GLY B N   1 ? 
ATOM   1104 C  CA  . GLY B 2 99  ? -38.234 5.118  20.510  1.000 62.100  0 431 GLY B CA  1 ? 
ATOM   1105 C  C   . GLY B 2 99  ? -39.035 4.111  19.676  1.000 60.180  0 431 GLY B C   1 ? 
ATOM   1106 O  O   . GLY B 2 99  ? -38.680 2.935  19.605  1.000 61.730  0 431 GLY B O   1 ? 
ATOM   1107 N  N   . CYS B 2 100 ? -40.091 4.601  19.005  1.000 58.110  0 432 CYS B N   1 ? 
ATOM   1108 C  CA  . CYS B 2 100 ? -40.989 3.762  18.219  1.000 58.980  0 432 CYS B CA  1 ? 
ATOM   1109 C  C   . CYS B 2 100 ? -41.108 4.244  16.768  1.000 57.690  0 432 CYS B C   1 ? 
ATOM   1110 O  O   . CYS B 2 100 ? -41.218 5.446  16.498  1.000 55.400  0 432 CYS B O   1 ? 
ATOM   1111 C  CB  . CYS B 2 100 ? -42.396 3.737  18.810  1.000 56.830  0 432 CYS B CB  1 ? 
ATOM   1112 S  SG  . CYS B 2 100 ? -42.422 3.293  20.565  1.000 66.510  0 432 CYS B SG  1 ? 
ATOM   1113 N  N   . VAL B 2 101 ? -41.141 3.264  15.852  1.000 53.190  0 433 VAL B N   1 ? 
ATOM   1114 C  CA  . VAL B 2 101 ? -41.463 3.471  14.446  1.000 56.700  0 433 VAL B CA  1 ? 
ATOM   1115 C  C   . VAL B 2 101 ? -42.841 2.884  14.153  1.000 55.560  0 433 VAL B C   1 ? 
ATOM   1116 O  O   . VAL B 2 101 ? -43.055 1.690  14.333  1.000 55.570  0 433 VAL B O   1 ? 
ATOM   1117 C  CB  . VAL B 2 101 ? -40.403 2.832  13.537  1.000 56.300  0 433 VAL B CB  1 ? 
ATOM   1118 C  CG1 . VAL B 2 101 ? -40.737 3.022  12.071  1.000 54.350  0 433 VAL B CG1 1 ? 
ATOM   1119 C  CG2 . VAL B 2 101 ? -39.007 3.346  13.847  1.000 55.790  0 433 VAL B CG2 1 ? 
ATOM   1120 N  N   . ILE B 2 102 ? -43.736 3.735  13.643  1.000 49.890  0 434 ILE B N   1 ? 
ATOM   1121 C  CA  . ILE B 2 102 ? -45.117 3.407  13.355  1.000 47.670  0 434 ILE B CA  1 ? 
ATOM   1122 C  C   . ILE B 2 102 ? -45.373 3.737  11.887  1.000 58.530  0 434 ILE B C   1 ? 
ATOM   1123 O  O   . ILE B 2 102 ? -45.009 4.837  11.470  1.000 58.270  0 434 ILE B O   1 ? 
ATOM   1124 C  CB  . ILE B 2 102 ? -46.040 4.181  14.313  1.000 50.740  0 434 ILE B CB  1 ? 
ATOM   1125 C  CG1 . ILE B 2 102 ? -45.710 3.895  15.784  1.000 57.180  0 434 ILE B CG1 1 ? 
ATOM   1126 C  CG2 . ILE B 2 102 ? -47.507 3.924  14.014  1.000 50.990  0 434 ILE B CG2 1 ? 
ATOM   1127 C  CD1 . ILE B 2 102 ? -46.111 4.996  16.741  1.000 56.380  0 434 ILE B CD1 1 ? 
ATOM   1128 N  N   . ALA B 2 103 ? -45.919 2.773  11.102  1.000 51.280  0 435 ALA B N   1 ? 
ATOM   1129 C  CA  . ALA B 2 103 ? -46.299 3.002  9.709   1.000 50.450  0 435 ALA B CA  1 ? 
ATOM   1130 C  C   . ALA B 2 103 ? -47.706 2.486  9.404   1.000 55.890  0 435 ALA B C   1 ? 
ATOM   1131 O  O   . ALA B 2 103 ? -48.140 1.507  10.010  1.000 58.700  0 435 ALA B O   1 ? 
ATOM   1132 C  CB  . ALA B 2 103 ? -45.291 2.360  8.807   1.000 58.060  0 435 ALA B CB  1 ? 
ATOM   1133 N  N   . TRP B 2 104 ? -48.432 3.154  8.485   1.000 55.660  0 436 TRP B N   1 ? 
ATOM   1134 C  CA  . TRP B 2 104 ? -49.668 2.602  7.936   1.000 57.930  0 436 TRP B CA  1 ? 
ATOM   1135 C  C   . TRP B 2 104 ? -49.868 2.991  6.475   1.000 62.920  0 436 TRP B C   1 ? 
ATOM   1136 O  O   . TRP B 2 104 ? -49.333 4.000  6.022   1.000 54.930  0 436 TRP B O   1 ? 
ATOM   1137 C  CB  . TRP B 2 104 ? -50.904 3.001  8.745   1.000 51.630  0 436 TRP B CB  1 ? 
ATOM   1138 C  CG  . TRP B 2 104 ? -51.203 4.467  8.761   1.000 54.440  0 436 TRP B CG  1 ? 
ATOM   1139 C  CD1 . TRP B 2 104 ? -52.190 5.108  8.080   1.000 56.500  0 436 TRP B CD1 1 ? 
ATOM   1140 C  CD2 . TRP B 2 104 ? -50.535 5.487  9.538   1.000 54.130  0 436 TRP B CD2 1 ? 
ATOM   1141 N  NE1 . TRP B 2 104 ? -52.149 6.457  8.342   1.000 54.660  0 436 TRP B NE1 1 ? 
ATOM   1142 C  CE2 . TRP B 2 104 ? -51.157 6.714  9.238   1.000 52.130  0 436 TRP B CE2 1 ? 
ATOM   1143 C  CE3 . TRP B 2 104 ? -49.467 5.486  10.442  1.000 53.000  0 436 TRP B CE3 1 ? 
ATOM   1144 C  CZ2 . TRP B 2 104 ? -50.779 7.915  9.837   1.000 57.580  0 436 TRP B CZ2 1 ? 
ATOM   1145 C  CZ3 . TRP B 2 104 ? -49.066 6.684  11.013  1.000 50.540  0 436 TRP B CZ3 1 ? 
ATOM   1146 C  CH2 . TRP B 2 104 ? -49.727 7.872  10.726  1.000 50.320  0 436 TRP B CH2 1 ? 
ATOM   1147 N  N   . ASN B 2 105 ? -50.704 2.195  5.776   1.000 58.530  0 437 ASN B N   1 ? 
ATOM   1148 C  CA  . ASN B 2 105 ? -51.042 2.412  4.381   1.000 49.600  0 437 ASN B CA  1 ? 
ATOM   1149 C  C   . ASN B 2 105 ? -51.852 3.677  4.232   1.000 52.270  0 437 ASN B C   1 ? 
ATOM   1150 O  O   . ASN B 2 105 ? -52.860 3.827  4.891   1.000 57.150  0 437 ASN B O   1 ? 
ATOM   1151 C  CB  . ASN B 2 105 ? -51.937 1.296  3.831   1.000 62.370  0 437 ASN B CB  1 ? 
ATOM   1152 C  CG  . ASN B 2 105 ? -52.013 1.296  2.323   1.000 48.530  0 437 ASN B CG  1 ? 
ATOM   1153 O  OD1 . ASN B 2 105 ? -52.676 2.136  1.727   1.000 55.410  0 437 ASN B OD1 1 ? 
ATOM   1154 N  ND2 . ASN B 2 105 ? -51.298 0.374  1.705   1.000 55.030  0 437 ASN B ND2 1 ? 
ATOM   1155 N  N   . SER B 2 106 ? -51.456 4.573  3.328   1.000 52.780  0 438 SER B N   1 ? 
ATOM   1156 C  CA  . SER B 2 106 ? -52.229 5.786  3.160   1.000 52.600  0 438 SER B CA  1 ? 
ATOM   1157 C  C   . SER B 2 106 ? -52.658 5.902  1.712   1.000 50.410  0 438 SER B C   1 ? 
ATOM   1158 O  O   . SER B 2 106 ? -52.896 7.012  1.234   1.000 53.420  0 438 SER B O   1 ? 
ATOM   1159 C  CB  . SER B 2 106 ? -51.434 6.999  3.594   1.000 60.890  0 438 SER B CB  1 ? 
ATOM   1160 O  OG  . SER B 2 106 ? -50.386 7.272  2.674   1.000 50.890  0 438 SER B OG  1 ? 
ATOM   1161 N  N   . ASN B 2 107 ? -52.771 4.752  1.029   1.000 56.760  0 439 ASN B N   1 ? 
ATOM   1162 C  CA  . ASN B 2 107 ? -53.148 4.742  -0.383  1.000 55.870  0 439 ASN B CA  1 ? 
ATOM   1163 C  C   . ASN B 2 107 ? -54.392 5.605  -0.601  1.000 56.660  0 439 ASN B C   1 ? 
ATOM   1164 O  O   . ASN B 2 107 ? -54.430 6.415  -1.524  1.000 56.190  0 439 ASN B O   1 ? 
ATOM   1165 C  CB  . ASN B 2 107 ? -53.302 3.319  -0.931  1.000 61.040  0 439 ASN B CB  1 ? 
ATOM   1166 C  CG  . ASN B 2 107 ? -53.394 3.288  -2.445  1.000 66.180  0 439 ASN B CG  1 ? 
ATOM   1167 O  OD1 . ASN B 2 107 ? -52.513 3.792  -3.143  1.000 64.720  0 439 ASN B OD1 1 ? 
ATOM   1168 N  ND2 . ASN B 2 107 ? -54.468 2.720  -2.968  1.000 61.730  0 439 ASN B ND2 1 ? 
ATOM   1169 N  N   . LYS B 2 108 ? -55.387 5.511  0.289   1.000 64.250  0 440 LYS B N   1 ? 
ATOM   1170 C  CA  . LYS B 2 108 ? -56.626 6.250  0.080   1.000 65.630  0 440 LYS B CA  1 ? 
ATOM   1171 C  C   . LYS B 2 108 ? -56.417 7.749  0.194   1.000 63.450  0 440 LYS B C   1 ? 
ATOM   1172 O  O   . LYS B 2 108 ? -57.124 8.510  -0.447  1.000 75.380  0 440 LYS B O   1 ? 
ATOM   1173 C  CB  . LYS B 2 108 ? -57.712 5.854  1.080   1.000 84.370  0 440 LYS B CB  1 ? 
ATOM   1174 C  CG  . LYS B 2 108 ? -58.105 4.384  1.075   1.000 90.890  0 440 LYS B CG  1 ? 
ATOM   1175 C  CD  . LYS B 2 108 ? -59.004 4.026  2.246   1.000 105.550 0 440 LYS B CD  1 ? 
ATOM   1176 C  CE  . LYS B 2 108 ? -59.251 2.538  2.381   1.000 112.420 0 440 LYS B CE  1 ? 
ATOM   1177 N  NZ  . LYS B 2 108 ? -59.910 1.988  1.175   1.000 112.140 0 440 LYS B NZ  1 ? 
ATOM   1178 N  N   . LEU B 2 109 ? -55.434 8.191  0.981   1.000 69.100  0 441 LEU B N   1 ? 
ATOM   1179 C  CA  . LEU B 2 109 ? -55.279 9.615  1.250   1.000 70.360  0 441 LEU B CA  1 ? 
ATOM   1180 C  C   . LEU B 2 109 ? -54.298 10.290 0.290   1.000 66.320  0 441 LEU B C   1 ? 
ATOM   1181 O  O   . LEU B 2 109 ? -54.431 11.473 -0.025  1.000 65.200  0 441 LEU B O   1 ? 
ATOM   1182 C  CB  . LEU B 2 109 ? -54.780 9.755  2.690   1.000 82.860  0 441 LEU B CB  1 ? 
ATOM   1183 C  CG  . LEU B 2 109 ? -55.877 9.784  3.750   1.000 90.770  0 441 LEU B CG  1 ? 
ATOM   1184 C  CD1 . LEU B 2 109 ? -55.348 9.314  5.102   1.000 85.660  0 441 LEU B CD1 1 ? 
ATOM   1185 C  CD2 . LEU B 2 109 ? -56.458 11.192 3.850   1.000 96.020  0 441 LEU B CD2 1 ? 
ATOM   1186 N  N   . ASP B 2 110 ? -53.251 9.564  -0.086  1.000 62.940  0 442 ASP B N   1 ? 
ATOM   1187 C  CA  . ASP B 2 110 ? -52.088 10.182 -0.696  1.000 64.150  0 442 ASP B CA  1 ? 
ATOM   1188 C  C   . ASP B 2 110 ? -51.978 9.827  -2.180  1.000 62.170  0 442 ASP B C   1 ? 
ATOM   1189 O  O   . ASP B 2 110 ? -51.399 10.611 -2.924  1.000 71.420  0 442 ASP B O   1 ? 
ATOM   1190 C  CB  . ASP B 2 110 ? -50.835 9.820  0.103   1.000 64.270  0 442 ASP B CB  1 ? 
ATOM   1191 C  CG  . ASP B 2 110 ? -50.835 10.438 1.490   1.000 65.860  0 442 ASP B CG  1 ? 
ATOM   1192 O  OD1 . ASP B 2 110 ? -51.136 11.651 1.593   1.000 57.500  0 442 ASP B OD1 1 ? 
ATOM   1193 O  OD2 . ASP B 2 110 ? -50.528 9.705  2.448   1.000 54.760  0 442 ASP B OD2 1 ? 
ATOM   1194 N  N   . SER B 2 111 ? -52.530 8.676  -2.606  1.000 59.110  0 443 SER B N   1 ? 
ATOM   1195 C  CA  . SER B 2 111 ? -52.586 8.323  -4.018  1.000 59.750  0 443 SER B CA  1 ? 
ATOM   1196 C  C   . SER B 2 111 ? -53.618 9.186  -4.753  1.000 65.640  0 443 SER B C   1 ? 
ATOM   1197 O  O   . SER B 2 111 ? -54.653 9.547  -4.196  1.000 70.600  0 443 SER B O   1 ? 
ATOM   1198 C  CB  . SER B 2 111 ? -52.861 6.865  -4.191  1.000 58.310  0 443 SER B CB  1 ? 
ATOM   1199 O  OG  . SER B 2 111 ? -51.751 6.082  -3.772  1.000 55.670  0 443 SER B OG  1 ? 
ATOM   1200 N  N   . LYS B 2 112 ? -53.320 9.519  -6.014  1.000 68.580  0 444 LYS B N   1 ? 
ATOM   1201 C  CA  . LYS B 2 112 ? -54.248 10.235 -6.881  1.000 73.200  0 444 LYS B CA  1 ? 
ATOM   1202 C  C   . LYS B 2 112 ? -54.255 9.590  -8.265  1.000 69.670  0 444 LYS B C   1 ? 
ATOM   1203 O  O   . LYS B 2 112 ? -53.239 9.073  -8.729  1.000 68.130  0 444 LYS B O   1 ? 
ATOM   1204 C  CB  . LYS B 2 112 ? -53.877 11.714 -7.048  1.000 72.080  0 444 LYS B CB  1 ? 
ATOM   1205 C  CG  . LYS B 2 112 ? -53.630 12.494 -5.763  1.000 82.640  0 444 LYS B CG  1 ? 
ATOM   1206 C  CD  . LYS B 2 112 ? -54.860 12.713 -4.901  1.000 88.930  0 444 LYS B CD  1 ? 
ATOM   1207 C  CE  . LYS B 2 112 ? -54.531 13.393 -3.584  1.000 86.020  0 444 LYS B CE  1 ? 
ATOM   1208 N  NZ  . LYS B 2 112 ? -55.592 13.180 -2.572  1.000 81.700  0 444 LYS B NZ  1 ? 
ATOM   1209 N  N   . PRO B 2 113 ? -55.403 9.605  -8.981  1.000 79.920  0 445 PRO B N   1 ? 
ATOM   1210 C  CA  . PRO B 2 113 ? -55.532 8.872  -10.245 1.000 80.540  0 445 PRO B CA  1 ? 
ATOM   1211 C  C   . PRO B 2 113 ? -54.438 9.150  -11.273 1.000 68.370  0 445 PRO B C   1 ? 
ATOM   1212 O  O   . PRO B 2 113 ? -53.910 8.209  -11.840 1.000 70.410  0 445 PRO B O   1 ? 
ATOM   1213 C  CB  . PRO B 2 113 ? -56.916 9.311  -10.744 1.000 83.710  0 445 PRO B CB  1 ? 
ATOM   1214 C  CG  . PRO B 2 113 ? -57.666 9.543  -9.462  1.000 82.230  0 445 PRO B CG  1 ? 
ATOM   1215 C  CD  . PRO B 2 113 ? -56.656 10.269 -8.597  1.000 78.160  0 445 PRO B CD  1 ? 
ATOM   1216 N  N   . SER B 2 114 ? -54.073 10.424 -11.490 1.000 72.120  0 446 SER B N   1 ? 
ATOM   1217 C  CA  . SER B 2 114 ? -52.983 10.734 -12.404 1.000 74.500  0 446 SER B CA  1 ? 
ATOM   1218 C  C   . SER B 2 114 ? -51.664 10.851 -11.645 1.000 76.710  0 446 SER B C   1 ? 
ATOM   1219 O  O   . SER B 2 114 ? -50.695 11.399 -12.169 1.000 67.570  0 446 SER B O   1 ? 
ATOM   1220 C  CB  . SER B 2 114 ? -53.254 11.978 -13.213 1.000 79.760  0 446 SER B CB  1 ? 
ATOM   1221 O  OG  . SER B 2 114 ? -53.037 13.139 -12.426 1.000 88.770  0 446 SER B OG  1 ? 
ATOM   1222 N  N   . GLY B 2 115 ? -51.622 10.326 -10.413 1.000 72.350  0 447 GLY B N   1 ? 
ATOM   1223 C  CA  . GLY B 2 115 ? -50.382 10.290 -9.660  1.000 70.540  0 447 GLY B CA  1 ? 
ATOM   1224 C  C   . GLY B 2 115 ? -50.169 11.549 -8.818  1.000 68.540  0 447 GLY B C   1 ? 
ATOM   1225 O  O   . GLY B 2 115 ? -50.494 12.654 -9.239  1.000 71.500  0 447 GLY B O   1 ? 
ATOM   1226 N  N   . ASN B 2 116 ? -49.623 11.349 -7.609  1.000 69.760  0 448 ASN B N   1 ? 
ATOM   1227 C  CA  . ASN B 2 116 ? -49.315 12.429 -6.686  1.000 59.240  0 448 ASN B CA  1 ? 
ATOM   1228 C  C   . ASN B 2 116 ? -47.824 12.730 -6.724  1.000 60.580  0 448 ASN B C   1 ? 
ATOM   1229 O  O   . ASN B 2 116 ? -47.026 11.997 -6.136  1.000 57.690  0 448 ASN B O   1 ? 
ATOM   1230 C  CB  . ASN B 2 116 ? -49.701 12.080 -5.252  1.000 63.210  0 448 ASN B CB  1 ? 
ATOM   1231 C  CG  . ASN B 2 116 ? -49.593 13.260 -4.313  1.000 59.410  0 448 ASN B CG  1 ? 
ATOM   1232 O  OD1 . ASN B 2 116 ? -48.975 14.276 -4.630  1.000 64.000  0 448 ASN B OD1 1 ? 
ATOM   1233 N  ND2 . ASN B 2 116 ? -50.205 13.128 -3.153  1.000 61.300  0 448 ASN B ND2 1 ? 
ATOM   1234 N  N   . TYR B 2 117 ? -47.501 13.877 -7.324  1.000 52.820  0 449 TYR B N   1 ? 
ATOM   1235 C  CA  . TYR B 2 117 ? -46.138 14.296 -7.587  1.000 63.650  0 449 TYR B CA  1 ? 
ATOM   1236 C  C   . TYR B 2 117 ? -45.641 15.241 -6.491  1.000 59.380  0 449 TYR B C   1 ? 
ATOM   1237 O  O   . TYR B 2 117 ? -44.503 15.687 -6.550  1.000 61.010  0 449 TYR B O   1 ? 
ATOM   1238 C  CB  . TYR B 2 117 ? -46.099 14.845 -9.018  1.000 65.980  0 449 TYR B CB  1 ? 
ATOM   1239 C  CG  . TYR B 2 117 ? -46.121 13.736 -10.042 1.000 62.300  0 449 TYR B CG  1 ? 
ATOM   1240 C  CD1 . TYR B 2 117 ? -44.961 13.050 -10.332 1.000 61.590  0 449 TYR B CD1 1 ? 
ATOM   1241 C  CD2 . TYR B 2 117 ? -47.295 13.304 -10.644 1.000 63.340  0 449 TYR B CD2 1 ? 
ATOM   1242 C  CE1 . TYR B 2 117 ? -44.934 12.010 -11.243 1.000 64.130  0 449 TYR B CE1 1 ? 
ATOM   1243 C  CE2 . TYR B 2 117 ? -47.290 12.266 -11.565 1.000 62.410  0 449 TYR B CE2 1 ? 
ATOM   1244 C  CZ  . TYR B 2 117 ? -46.105 11.607 -11.853 1.000 67.090  0 449 TYR B CZ  1 ? 
ATOM   1245 O  OH  . TYR B 2 117 ? -46.004 10.557 -12.729 1.000 69.500  0 449 TYR B OH  1 ? 
ATOM   1246 N  N   . ASN B 2 118 ? -46.469 15.467 -5.467  1.000 59.000  0 450 ASN B N   1 ? 
ATOM   1247 C  CA  . ASN B 2 118 ? -46.158 16.395 -4.386  1.000 61.400  0 450 ASN B CA  1 ? 
ATOM   1248 C  C   . ASN B 2 118 ? -45.262 15.801 -3.309  1.000 53.600  0 450 ASN B C   1 ? 
ATOM   1249 O  O   . ASN B 2 118 ? -44.652 16.543 -2.550  1.000 49.920  0 450 ASN B O   1 ? 
ATOM   1250 C  CB  . ASN B 2 118 ? -47.421 16.844 -3.664  1.000 56.510  0 450 ASN B CB  1 ? 
ATOM   1251 C  CG  . ASN B 2 118 ? -48.275 17.682 -4.574  1.000 56.810  0 450 ASN B CG  1 ? 
ATOM   1252 O  OD1 . ASN B 2 118 ? -47.760 18.599 -5.209  1.000 64.220  0 450 ASN B OD1 1 ? 
ATOM   1253 N  ND2 . ASN B 2 118 ? -49.548 17.341 -4.682  1.000 62.170  0 450 ASN B ND2 1 ? 
ATOM   1254 N  N   . TYR B 2 119 ? -45.254 14.470 -3.196  1.000 53.700  0 451 TYR B N   1 ? 
ATOM   1255 C  CA  . TYR B 2 119 ? -44.394 13.804 -2.247  1.000 46.290  0 451 TYR B CA  1 ? 
ATOM   1256 C  C   . TYR B 2 119 ? -43.107 13.491 -2.974  1.000 49.490  0 451 TYR B C   1 ? 
ATOM   1257 O  O   . TYR B 2 119 ? -43.174 12.936 -4.075  1.000 59.590  0 451 TYR B O   1 ? 
ATOM   1258 C  CB  . TYR B 2 119 ? -45.083 12.539 -1.724  1.000 50.740  0 451 TYR B CB  1 ? 
ATOM   1259 C  CG  . TYR B 2 119 ? -46.167 12.773 -0.709  1.000 48.300  0 451 TYR B CG  1 ? 
ATOM   1260 C  CD1 . TYR B 2 119 ? -45.860 13.168 0.584   1.000 50.870  0 451 TYR B CD1 1 ? 
ATOM   1261 C  CD2 . TYR B 2 119 ? -47.502 12.644 -1.045  1.000 55.760  0 451 TYR B CD2 1 ? 
ATOM   1262 C  CE1 . TYR B 2 119 ? -46.847 13.340 1.539   1.000 49.710  0 451 TYR B CE1 1 ? 
ATOM   1263 C  CE2 . TYR B 2 119 ? -48.503 12.829 -0.108  1.000 57.370  0 451 TYR B CE2 1 ? 
ATOM   1264 C  CZ  . TYR B 2 119 ? -48.174 13.169 1.190   1.000 57.000  0 451 TYR B CZ  1 ? 
ATOM   1265 O  OH  . TYR B 2 119 ? -49.157 13.362 2.115   1.000 55.840  0 451 TYR B OH  1 ? 
ATOM   1266 N  N   . LEU B 2 120 ? -41.964 13.814 -2.336  1.000 48.030  0 452 LEU B N   1 ? 
ATOM   1267 C  CA  . LEU B 2 120 ? -40.652 13.669 -2.937  1.000 43.450  0 452 LEU B CA  1 ? 
ATOM   1268 C  C   . LEU B 2 120 ? -39.712 12.812 -2.088  1.000 44.820  0 452 LEU B C   1 ? 
ATOM   1269 O  O   . LEU B 2 120 ? -39.926 12.636 -0.905  1.000 53.480  0 452 LEU B O   1 ? 
ATOM   1270 C  CB  . LEU B 2 120 ? -40.045 15.067 -3.083  1.000 54.390  0 452 LEU B CB  1 ? 
ATOM   1271 C  CG  . LEU B 2 120 ? -40.810 16.034 -3.988  1.000 62.090  0 452 LEU B CG  1 ? 
ATOM   1272 C  CD1 . LEU B 2 120 ? -40.651 17.477 -3.523  1.000 68.450  0 452 LEU B CD1 1 ? 
ATOM   1273 C  CD2 . LEU B 2 120 ? -40.324 15.901 -5.409  1.000 67.380  0 452 LEU B CD2 1 ? 
ATOM   1274 N  N   . TYR B 2 121 ? -38.643 12.327 -2.723  1.000 42.440  0 453 TYR B N   1 ? 
ATOM   1275 C  CA  . TYR B 2 121 ? -37.514 11.698 -2.064  1.000 43.320  0 453 TYR B CA  1 ? 
ATOM   1276 C  C   . TYR B 2 121 ? -36.252 12.152 -2.790  1.000 47.500  0 453 TYR B C   1 ? 
ATOM   1277 O  O   . TYR B 2 121 ? -36.351 12.579 -3.935  1.000 55.800  0 453 TYR B O   1 ? 
ATOM   1278 C  CB  . TYR B 2 121 ? -37.635 10.167 -2.083  1.000 46.690  0 453 TYR B CB  1 ? 
ATOM   1279 C  CG  . TYR B 2 121 ? -37.704 9.554  -3.460  1.000 47.180  0 453 TYR B CG  1 ? 
ATOM   1280 C  CD1 . TYR B 2 121 ? -38.850 9.618  -4.242  1.000 46.930  0 453 TYR B CD1 1 ? 
ATOM   1281 C  CD2 . TYR B 2 121 ? -36.610 8.892  -3.983  1.000 47.070  0 453 TYR B CD2 1 ? 
ATOM   1282 C  CE1 . TYR B 2 121 ? -38.893 9.024  -5.499  1.000 53.420  0 453 TYR B CE1 1 ? 
ATOM   1283 C  CE2 . TYR B 2 121 ? -36.636 8.313  -5.240  1.000 46.800  0 453 TYR B CE2 1 ? 
ATOM   1284 C  CZ  . TYR B 2 121 ? -37.781 8.383  -6.007  1.000 50.110  0 453 TYR B CZ  1 ? 
ATOM   1285 O  OH  . TYR B 2 121 ? -37.727 7.796  -7.256  1.000 47.560  0 453 TYR B OH  1 ? 
ATOM   1286 N  N   . ARG B 2 122 ? -35.105 12.091 -2.094  1.000 48.170  0 454 ARG B N   1 ? 
ATOM   1287 C  CA  . ARG B 2 122 ? -33.784 12.332 -2.654  1.000 49.060  0 454 ARG B CA  1 ? 
ATOM   1288 C  C   . ARG B 2 122 ? -33.202 11.040 -3.219  1.000 46.460  0 454 ARG B C   1 ? 
ATOM   1289 O  O   . ARG B 2 122 ? -33.039 10.091 -2.469  1.000 46.800  0 454 ARG B O   1 ? 
ATOM   1290 C  CB  . ARG B 2 122 ? -32.840 12.873 -1.560  1.000 49.140  0 454 ARG B CB  1 ? 
ATOM   1291 C  CG  . ARG B 2 122 ? -31.468 13.356 -2.037  1.000 51.410  0 454 ARG B CG  1 ? 
ATOM   1292 C  CD  . ARG B 2 122 ? -30.584 14.029 -0.981  1.000 48.180  0 454 ARG B CD  1 ? 
ATOM   1293 N  NE  . ARG B 2 122 ? -31.179 15.247 -0.426  1.000 51.560  0 454 ARG B NE  1 ? 
ATOM   1294 C  CZ  . ARG B 2 122 ? -31.327 16.411 -1.067  1.000 59.640  0 454 ARG B CZ  1 ? 
ATOM   1295 N  NH1 . ARG B 2 122 ? -30.718 16.613 -2.225  1.000 60.360  0 454 ARG B NH1 1 ? 
ATOM   1296 N  NH2 . ARG B 2 122 ? -32.037 17.393 -0.522  1.000 55.510  0 454 ARG B NH2 1 ? 
ATOM   1297 N  N   . LEU B 2 123 ? -32.773 11.063 -4.495  1.000 44.870  0 455 LEU B N   1 ? 
ATOM   1298 C  CA  . LEU B 2 123 ? -32.196 9.920  -5.188  1.000 50.660  0 455 LEU B CA  1 ? 
ATOM   1299 C  C   . LEU B 2 123 ? -30.667 9.953  -5.201  1.000 54.120  0 455 LEU B C   1 ? 
ATOM   1300 O  O   . LEU B 2 123 ? -30.000 8.907  -5.296  1.000 53.670  0 455 LEU B O   1 ? 
ATOM   1301 C  CB  . LEU B 2 123 ? -32.742 9.931  -6.619  1.000 53.200  0 455 LEU B CB  1 ? 
ATOM   1302 C  CG  . LEU B 2 123 ? -32.292 8.790  -7.537  1.000 52.070  0 455 LEU B CG  1 ? 
ATOM   1303 C  CD1 . LEU B 2 123 ? -32.337 7.460  -6.839  1.000 51.480  0 455 LEU B CD1 1 ? 
ATOM   1304 C  CD2 . LEU B 2 123 ? -33.169 8.723  -8.778  1.000 55.090  0 455 LEU B CD2 1 ? 
ATOM   1305 N  N   . PHE B 2 124 ? -30.103 11.160 -5.095  1.000 53.730  0 456 PHE B N   1 ? 
ATOM   1306 C  CA  . PHE B 2 124 ? -28.677 11.345 -5.326  1.000 58.500  0 456 PHE B CA  1 ? 
ATOM   1307 C  C   . PHE B 2 124 ? -28.056 12.082 -4.155  1.000 56.430  0 456 PHE B C   1 ? 
ATOM   1308 O  O   . PHE B 2 124 ? -28.507 13.182 -3.834  1.000 54.990  0 456 PHE B O   1 ? 
ATOM   1309 C  CB  . PHE B 2 124 ? -28.433 12.201 -6.574  1.000 60.810  0 456 PHE B CB  1 ? 
ATOM   1310 C  CG  . PHE B 2 124 ? -28.859 11.580 -7.882  1.000 55.340  0 456 PHE B CG  1 ? 
ATOM   1311 C  CD1 . PHE B 2 124 ? -28.137 10.538 -8.437  1.000 59.030  0 456 PHE B CD1 1 ? 
ATOM   1312 C  CD2 . PHE B 2 124 ? -29.999 12.019 -8.534  1.000 58.810  0 456 PHE B CD2 1 ? 
ATOM   1313 C  CE1 . PHE B 2 124 ? -28.530 9.974  -9.642  1.000 52.360  0 456 PHE B CE1 1 ? 
ATOM   1314 C  CE2 . PHE B 2 124 ? -30.388 11.454 -9.737  1.000 61.450  0 456 PHE B CE2 1 ? 
ATOM   1315 C  CZ  . PHE B 2 124 ? -29.651 10.432 -10.286 1.000 53.930  0 456 PHE B CZ  1 ? 
ATOM   1316 N  N   . ARG B 2 125 ? -27.008 11.495 -3.561  1.000 64.350  0 457 ARG B N   1 ? 
ATOM   1317 C  CA  . ARG B 2 125 ? -26.283 12.190 -2.511  1.000 70.410  0 457 ARG B CA  1 ? 
ATOM   1318 C  C   . ARG B 2 125 ? -24.824 11.757 -2.484  1.000 67.070  0 457 ARG B C   1 ? 
ATOM   1319 O  O   . ARG B 2 125 ? -24.503 10.597 -2.719  1.000 63.820  0 457 ARG B O   1 ? 
ATOM   1320 C  CB  . ARG B 2 125 ? -26.928 11.922 -1.151  1.000 67.750  0 457 ARG B CB  1 ? 
ATOM   1321 C  CG  . ARG B 2 125 ? -26.639 13.019 -0.141  1.000 69.360  0 457 ARG B CG  1 ? 
ATOM   1322 C  CD  . ARG B 2 125 ? -27.331 12.828 1.194   1.000 63.840  0 457 ARG B CD  1 ? 
ATOM   1323 N  NE  . ARG B 2 125 ? -27.413 14.132 1.836   1.000 73.220  0 457 ARG B NE  1 ? 
ATOM   1324 C  CZ  . ARG B 2 125 ? -26.577 14.597 2.760   1.000 64.320  0 457 ARG B CZ  1 ? 
ATOM   1325 N  NH1 . ARG B 2 125 ? -25.610 13.845 3.245   1.000 56.410  0 457 ARG B NH1 1 ? 
ATOM   1326 N  NH2 . ARG B 2 125 ? -26.720 15.832 3.199   1.000 68.410  0 457 ARG B NH2 1 ? 
ATOM   1327 N  N   . LYS B 2 126 ? -23.943 12.692 -2.127  1.000 76.160  0 458 LYS B N   1 ? 
ATOM   1328 C  CA  . LYS B 2 126 ? -22.518 12.394 -2.101  1.000 80.180  0 458 LYS B CA  1 ? 
ATOM   1329 C  C   . LYS B 2 126 ? -22.146 11.480 -0.936  1.000 73.250  0 458 LYS B C   1 ? 
ATOM   1330 O  O   . LYS B 2 126 ? -21.139 10.780 -1.019  1.000 86.390  0 458 LYS B O   1 ? 
ATOM   1331 C  CB  . LYS B 2 126 ? -21.695 13.683 -2.070  1.000 86.870  0 458 LYS B CB  1 ? 
ATOM   1332 C  CG  . LYS B 2 126 ? -21.113 14.092 -3.417  1.000 98.930  0 458 LYS B CG  1 ? 
ATOM   1333 C  CD  . LYS B 2 126 ? -20.047 15.167 -3.310  1.000 102.280 0 458 LYS B CD  1 ? 
ATOM   1334 C  CE  . LYS B 2 126 ? -20.576 16.439 -2.684  1.000 102.910 0 458 LYS B CE  1 ? 
ATOM   1335 N  NZ  . LYS B 2 126 ? -19.564 17.515 -2.717  1.000 108.440 0 458 LYS B NZ  1 ? 
ATOM   1336 N  N   . SER B 2 127 ? -22.931 11.489 0.150   1.000 66.000  0 459 SER B N   1 ? 
ATOM   1337 C  CA  . SER B 2 127 ? -22.720 10.557 1.253   1.000 67.550  0 459 SER B CA  1 ? 
ATOM   1338 C  C   . SER B 2 127 ? -23.997 10.361 2.067   1.000 64.450  0 459 SER B C   1 ? 
ATOM   1339 O  O   . SER B 2 127 ? -24.960 11.107 1.914   1.000 58.840  0 459 SER B O   1 ? 
ATOM   1340 C  CB  . SER B 2 127 ? -21.620 11.037 2.161   1.000 65.880  0 459 SER B CB  1 ? 
ATOM   1341 O  OG  . SER B 2 127 ? -21.983 12.286 2.717   1.000 68.160  0 459 SER B OG  1 ? 
ATOM   1342 N  N   . LYS B 2 128 ? -23.942 9.376  2.972   1.000 66.550  0 460 LYS B N   1 ? 
ATOM   1343 C  CA  . LYS B 2 128 ? -25.035 9.027  3.870   1.000 61.940  0 460 LYS B CA  1 ? 
ATOM   1344 C  C   . LYS B 2 128 ? -25.298 10.132 4.900   1.000 67.370  0 460 LYS B C   1 ? 
ATOM   1345 O  O   . LYS B 2 128 ? -24.359 10.707 5.443   1.000 69.070  0 460 LYS B O   1 ? 
ATOM   1346 C  CB  . LYS B 2 128 ? -24.656 7.751  4.618   1.000 71.700  0 460 LYS B CB  1 ? 
ATOM   1347 C  CG  . LYS B 2 128 ? -24.213 6.583  3.755   1.000 73.250  0 460 LYS B CG  1 ? 
ATOM   1348 C  CD  . LYS B 2 128 ? -23.869 5.357  4.565   1.000 76.290  0 460 LYS B CD  1 ? 
ATOM   1349 C  CE  . LYS B 2 128 ? -24.116 4.104  3.757   1.000 75.040  0 460 LYS B CE  1 ? 
ATOM   1350 N  NZ  . LYS B 2 128 ? -23.599 2.901  4.435   1.000 81.600  0 460 LYS B NZ  1 ? 
ATOM   1351 N  N   . LEU B 2 129 ? -26.582 10.401 5.191   1.000 62.220  0 461 LEU B N   1 ? 
ATOM   1352 C  CA  . LEU B 2 129 ? -26.994 11.266 6.291   1.000 56.580  0 461 LEU B CA  1 ? 
ATOM   1353 C  C   . LEU B 2 129 ? -26.486 10.719 7.619   1.000 58.810  0 461 LEU B C   1 ? 
ATOM   1354 O  O   . LEU B 2 129 ? -26.343 9.507  7.810   1.000 59.780  0 461 LEU B O   1 ? 
ATOM   1355 C  CB  . LEU B 2 129 ? -28.525 11.354 6.367   1.000 59.010  0 461 LEU B CB  1 ? 
ATOM   1356 C  CG  . LEU B 2 129 ? -29.234 12.113 5.253   1.000 55.300  0 461 LEU B CG  1 ? 
ATOM   1357 C  CD1 . LEU B 2 129 ? -30.744 12.009 5.407   1.000 53.750  0 461 LEU B CD1 1 ? 
ATOM   1358 C  CD2 . LEU B 2 129 ? -28.822 13.568 5.239   1.000 59.560  0 461 LEU B CD2 1 ? 
ATOM   1359 N  N   . LYS B 2 130 ? -26.245 11.631 8.562   1.000 65.140  0 462 LYS B N   1 ? 
ATOM   1360 C  CA  . LYS B 2 130 ? -26.022 11.219 9.939   1.000 66.180  0 462 LYS B CA  1 ? 
ATOM   1361 C  C   . LYS B 2 130 ? -27.390 11.030 10.587  1.000 62.420  0 462 LYS B C   1 ? 
ATOM   1362 O  O   . LYS B 2 130 ? -28.398 11.508 10.078  1.000 61.030  0 462 LYS B O   1 ? 
ATOM   1363 C  CB  . LYS B 2 130 ? -25.239 12.274 10.725  1.000 79.080  0 462 LYS B CB  1 ? 
ATOM   1364 C  CG  . LYS B 2 130 ? -23.834 12.563 10.223  1.000 83.080  0 462 LYS B CG  1 ? 
ATOM   1365 C  CD  . LYS B 2 130 ? -23.310 13.909 10.684  1.000 100.190 0 462 LYS B CD  1 ? 
ATOM   1366 C  CE  . LYS B 2 130 ? -23.927 15.077 9.942   1.000 106.730 0 462 LYS B CE  1 ? 
ATOM   1367 N  NZ  . LYS B 2 130 ? -23.393 16.369 10.433  1.000 112.500 0 462 LYS B NZ  1 ? 
ATOM   1368 N  N   . PRO B 2 131 ? -27.488 10.325 11.725  1.000 63.440  0 463 PRO B N   1 ? 
ATOM   1369 C  CA  . PRO B 2 131 ? -28.778 10.171 12.383  1.000 60.990  0 463 PRO B CA  1 ? 
ATOM   1370 C  C   . PRO B 2 131 ? -29.453 11.518 12.598  1.000 62.150  0 463 PRO B C   1 ? 
ATOM   1371 O  O   . PRO B 2 131 ? -28.836 12.471 13.051  1.000 66.370  0 463 PRO B O   1 ? 
ATOM   1372 C  CB  . PRO B 2 131 ? -28.387 9.411  13.649  1.000 66.240  0 463 PRO B CB  1 ? 
ATOM   1373 C  CG  . PRO B 2 131 ? -27.230 8.556  13.179  1.000 63.770  0 463 PRO B CG  1 ? 
ATOM   1374 C  CD  . PRO B 2 131 ? -26.422 9.532  12.356  1.000 66.590  0 463 PRO B CD  1 ? 
ATOM   1375 N  N   . PHE B 2 132 ? -30.697 11.596 12.129  1.000 61.300  0 464 PHE B N   1 ? 
ATOM   1376 C  CA  . PHE B 2 132 ? -31.596 12.721 12.333  1.000 55.330  0 464 PHE B CA  1 ? 
ATOM   1377 C  C   . PHE B 2 132 ? -31.158 13.943 11.544  1.000 53.120  0 464 PHE B C   1 ? 
ATOM   1378 O  O   . PHE B 2 132 ? -31.696 15.021 11.774  1.000 55.540  0 464 PHE B O   1 ? 
ATOM   1379 C  CB  . PHE B 2 132 ? -31.771 13.052 13.821  1.000 58.490  0 464 PHE B CB  1 ? 
ATOM   1380 C  CG  . PHE B 2 132 ? -32.456 11.978 14.634  1.000 58.650  0 464 PHE B CG  1 ? 
ATOM   1381 C  CD1 . PHE B 2 132 ? -33.664 11.431 14.217  1.000 58.020  0 464 PHE B CD1 1 ? 
ATOM   1382 C  CD2 . PHE B 2 132 ? -31.908 11.519 15.822  1.000 62.910  0 464 PHE B CD2 1 ? 
ATOM   1383 C  CE1 . PHE B 2 132 ? -34.282 10.428 14.947  1.000 58.330  0 464 PHE B CE1 1 ? 
ATOM   1384 C  CE2 . PHE B 2 132 ? -32.537 10.520 16.560  1.000 59.100  0 464 PHE B CE2 1 ? 
ATOM   1385 C  CZ  . PHE B 2 132 ? -33.726 9.986  16.127  1.000 60.310  0 464 PHE B CZ  1 ? 
ATOM   1386 N  N   . GLU B 2 133 ? -30.249 13.791 10.575  1.000 56.300  0 465 GLU B N   1 ? 
ATOM   1387 C  CA  . GLU B 2 133 ? -29.981 14.906 9.667   1.000 57.270  0 465 GLU B CA  1 ? 
ATOM   1388 C  C   . GLU B 2 133 ? -31.141 15.112 8.688   1.000 63.790  0 465 GLU B C   1 ? 
ATOM   1389 O  O   . GLU B 2 133 ? -31.807 14.161 8.295   1.000 56.360  0 465 GLU B O   1 ? 
ATOM   1390 C  CB  . GLU B 2 133 ? -28.679 14.672 8.906   1.000 64.520  0 465 GLU B CB  1 ? 
ATOM   1391 C  CG  . GLU B 2 133 ? -28.257 15.849 8.046   1.000 56.140  0 465 GLU B CG  1 ? 
ATOM   1392 C  CD  . GLU B 2 133 ? -26.852 15.700 7.480   1.000 65.230  0 465 GLU B CD  1 ? 
ATOM   1393 O  OE1 . GLU B 2 133 ? -26.398 16.665 6.821   1.000 71.600  0 465 GLU B OE1 1 ? 
ATOM   1394 O  OE2 . GLU B 2 133 ? -26.205 14.611 7.694   1.000 60.330  0 465 GLU B OE2 1 ? 
ATOM   1395 N  N   . ARG B 2 134 ? -31.376 16.377 8.315   1.000 56.810  0 466 ARG B N   1 ? 
ATOM   1396 C  CA  . ARG B 2 134 ? -32.377 16.746 7.337   1.000 57.460  0 466 ARG B CA  1 ? 
ATOM   1397 C  C   . ARG B 2 134 ? -31.749 17.619 6.248   1.000 66.150  0 466 ARG B C   1 ? 
ATOM   1398 O  O   . ARG B 2 134 ? -31.496 18.799 6.468   1.000 68.530  0 466 ARG B O   1 ? 
ATOM   1399 C  CB  . ARG B 2 134 ? -33.505 17.481 8.052   1.000 56.050  0 466 ARG B CB  1 ? 
ATOM   1400 C  CG  . ARG B 2 134 ? -34.608 17.986 7.145   1.000 55.570  0 466 ARG B CG  1 ? 
ATOM   1401 C  CD  . ARG B 2 134 ? -35.827 18.410 7.952   1.000 58.090  0 466 ARG B CD  1 ? 
ATOM   1402 N  NE  . ARG B 2 134 ? -36.559 19.346 7.118   1.000 75.670  0 466 ARG B NE  1 ? 
ATOM   1403 C  CZ  . ARG B 2 134 ? -37.663 20.008 7.450   1.000 89.540  0 466 ARG B CZ  1 ? 
ATOM   1404 N  NH1 . ARG B 2 134 ? -38.208 19.871 8.648   1.000 105.120 0 466 ARG B NH1 1 ? 
ATOM   1405 N  NH2 . ARG B 2 134 ? -38.215 20.818 6.562   1.000 83.460  0 466 ARG B NH2 1 ? 
ATOM   1406 N  N   . ASP B 2 135 ? -31.540 17.032 5.062   1.000 59.210  0 467 ASP B N   1 ? 
ATOM   1407 C  CA  . ASP B 2 135 ? -30.952 17.718 3.923   1.000 50.430  0 467 ASP B CA  1 ? 
ATOM   1408 C  C   . ASP B 2 135 ? -32.020 18.114 2.930   1.000 59.090  0 467 ASP B C   1 ? 
ATOM   1409 O  O   . ASP B 2 135 ? -32.577 17.245 2.239   1.000 54.740  0 467 ASP B O   1 ? 
ATOM   1410 C  CB  . ASP B 2 135 ? -29.993 16.815 3.161   1.000 59.450  0 467 ASP B CB  1 ? 
ATOM   1411 C  CG  . ASP B 2 135 ? -29.313 17.539 2.018   1.000 61.810  0 467 ASP B CG  1 ? 
ATOM   1412 O  OD1 . ASP B 2 135 ? -29.698 18.728 1.751   1.000 62.180  0 467 ASP B OD1 1 ? 
ATOM   1413 O  OD2 . ASP B 2 135 ? -28.411 16.913 1.417   1.000 63.570  0 467 ASP B OD2 1 ? 
ATOM   1414 N  N   . ILE B 2 136 ? -32.234 19.435 2.842   1.000 56.520  0 468 ILE B N   1 ? 
ATOM   1415 C  CA  . ILE B 2 136 ? -33.253 20.017 1.994   1.000 53.060  0 468 ILE B CA  1 ? 
ATOM   1416 C  C   . ILE B 2 136 ? -32.616 20.750 0.808   1.000 56.680  0 468 ILE B C   1 ? 
ATOM   1417 O  O   . ILE B 2 136 ? -33.328 21.471 0.105   1.000 59.330  0 468 ILE B O   1 ? 
ATOM   1418 C  CB  . ILE B 2 136 ? -34.182 20.928 2.809   1.000 68.020  0 468 ILE B CB  1 ? 
ATOM   1419 C  CG1 . ILE B 2 136 ? -33.404 22.024 3.556   1.000 72.580  0 468 ILE B CG1 1 ? 
ATOM   1420 C  CG2 . ILE B 2 136 ? -35.033 20.098 3.751   1.000 71.130  0 468 ILE B CG2 1 ? 
ATOM   1421 C  CD1 . ILE B 2 136 ? -34.283 23.124 4.096   1.000 67.080  0 468 ILE B CD1 1 ? 
ATOM   1422 N  N   . SER B 2 137 ? -31.357 20.452 0.519   1.000 59.160  0 469 SER B N   1 ? 
ATOM   1423 C  CA  . SER B 2 137 ? -30.648 21.070 -0.600  1.000 67.710  0 469 SER B CA  1 ? 
ATOM   1424 C  C   . SER B 2 137 ? -31.142 20.711 -1.977  1.000 74.380  0 469 SER B C   1 ? 
ATOM   1425 O  O   . SER B 2 137 ? -31.728 19.662 -2.171  1.000 67.160  0 469 SER B O   1 ? 
ATOM   1426 C  CB  . SER B 2 137 ? -29.187 20.665 -0.553  1.000 66.730  0 469 SER B CB  1 ? 
ATOM   1427 O  OG  . SER B 2 137 ? -29.026 19.306 -0.902  1.000 75.420  0 469 SER B OG  1 ? 
ATOM   1428 N  N   . THR B 2 138 ? -30.862 21.574 -2.944  1.000 79.260  0 470 THR B N   1 ? 
ATOM   1429 C  CA  . THR B 2 138 ? -31.281 21.342 -4.310  1.000 71.840  0 470 THR B CA  1 ? 
ATOM   1430 C  C   . THR B 2 138 ? -30.087 21.448 -5.246  1.000 73.680  0 470 THR B C   1 ? 
ATOM   1431 O  O   . THR B 2 138 ? -30.244 21.613 -6.444  1.000 76.680  0 470 THR B O   1 ? 
ATOM   1432 C  CB  . THR B 2 138 ? -32.376 22.328 -4.714  1.000 77.110  0 470 THR B CB  1 ? 
ATOM   1433 O  OG1 . THR B 2 138 ? -33.295 22.475 -3.629  1.000 79.760  0 470 THR B OG1 1 ? 
ATOM   1434 C  CG2 . THR B 2 138 ? -33.137 21.819 -5.916  1.000 76.750  0 470 THR B CG2 1 ? 
ATOM   1435 N  N   . GLU B 2 139 ? -28.886 21.342 -4.707  1.000 73.950  0 471 GLU B N   1 ? 
ATOM   1436 C  CA  . GLU B 2 139 ? -27.701 21.343 -5.548  1.000 77.250  0 471 GLU B CA  1 ? 
ATOM   1437 C  C   . GLU B 2 139 ? -27.896 20.288 -6.641  1.000 80.250  0 471 GLU B C   1 ? 
ATOM   1438 O  O   . GLU B 2 139 ? -28.257 19.152 -6.343  1.000 72.950  0 471 GLU B O   1 ? 
ATOM   1439 C  CB  . GLU B 2 139 ? -26.459 21.049 -4.696  1.000 84.240  0 471 GLU B CB  1 ? 
ATOM   1440 C  CG  . GLU B 2 139 ? -25.200 21.778 -5.146  1.000 96.860  0 471 GLU B CG  1 ? 
ATOM   1441 C  CD  . GLU B 2 139 ? -25.198 23.287 -4.923  1.000 106.690 0 471 GLU B CD  1 ? 
ATOM   1442 O  OE1 . GLU B 2 139 ? -24.193 23.929 -5.296  1.000 107.360 0 471 GLU B OE1 1 ? 
ATOM   1443 O  OE2 . GLU B 2 139 ? -26.199 23.826 -4.377  1.000 98.580  0 471 GLU B OE2 1 ? 
ATOM   1444 N  N   . ILE B 2 140 ? -27.672 20.666 -7.906  1.000 74.100  0 472 ILE B N   1 ? 
ATOM   1445 C  CA  . ILE B 2 140 ? -27.573 19.691 -8.976  1.000 66.060  0 472 ILE B CA  1 ? 
ATOM   1446 C  C   . ILE B 2 140 ? -26.399 18.787 -8.619  1.000 72.930  0 472 ILE B C   1 ? 
ATOM   1447 O  O   . ILE B 2 140 ? -25.344 19.271 -8.238  1.000 77.260  0 472 ILE B O   1 ? 
ATOM   1448 C  CB  . ILE B 2 140 ? -27.398 20.342 -10.367 1.000 70.180  0 472 ILE B CB  1 ? 
ATOM   1449 C  CG1 . ILE B 2 140 ? -28.512 21.325 -10.744 1.000 66.620  0 472 ILE B CG1 1 ? 
ATOM   1450 C  CG2 . ILE B 2 140 ? -27.278 19.261 -11.437 1.000 72.870  0 472 ILE B CG2 1 ? 
ATOM   1451 C  CD1 . ILE B 2 140 ? -29.912 20.761 -10.778 1.000 83.460  0 472 ILE B CD1 1 ? 
ATOM   1452 N  N   . TYR B 2 141 ? -26.592 17.475 -8.741  1.000 76.050  0 473 TYR B N   1 ? 
ATOM   1453 C  CA  . TYR B 2 141 ? -25.579 16.513 -8.352  1.000 70.360  0 473 TYR B CA  1 ? 
ATOM   1454 C  C   . TYR B 2 141 ? -24.642 16.235 -9.529  1.000 72.860  0 473 TYR B C   1 ? 
ATOM   1455 O  O   . TYR B 2 141 ? -25.090 16.151 -10.666 1.000 79.260  0 473 TYR B O   1 ? 
ATOM   1456 C  CB  . TYR B 2 141 ? -26.284 15.254 -7.845  1.000 63.490  0 473 TYR B CB  1 ? 
ATOM   1457 C  CG  . TYR B 2 141 ? -25.369 14.115 -7.486  1.000 62.520  0 473 TYR B CG  1 ? 
ATOM   1458 C  CD1 . TYR B 2 141 ? -24.934 13.216 -8.439  1.000 65.660  0 473 TYR B CD1 1 ? 
ATOM   1459 C  CD2 . TYR B 2 141 ? -24.953 13.924 -6.183  1.000 73.080  0 473 TYR B CD2 1 ? 
ATOM   1460 C  CE1 . TYR B 2 141 ? -24.105 12.156 -8.109  1.000 65.570  0 473 TYR B CE1 1 ? 
ATOM   1461 C  CE2 . TYR B 2 141 ? -24.124 12.871 -5.835  1.000 73.830  0 473 TYR B CE2 1 ? 
ATOM   1462 C  CZ  . TYR B 2 141 ? -23.703 11.977 -6.799  1.000 69.030  0 473 TYR B CZ  1 ? 
ATOM   1463 O  OH  . TYR B 2 141 ? -22.882 10.939 -6.439  1.000 74.330  0 473 TYR B OH  1 ? 
ATOM   1464 N  N   . GLN B 2 142 ? -23.353 16.049 -9.222  1.000 70.970  0 474 GLN B N   1 ? 
ATOM   1465 C  CA  . GLN B 2 142 ? -22.307 15.833 -10.208 1.000 72.100  0 474 GLN B CA  1 ? 
ATOM   1466 C  C   . GLN B 2 142 ? -21.929 14.366 -10.187 1.000 70.800  0 474 GLN B C   1 ? 
ATOM   1467 O  O   . GLN B 2 142 ? -21.344 13.919 -9.208  1.000 67.070  0 474 GLN B O   1 ? 
ATOM   1468 C  CB  . GLN B 2 142 ? -21.049 16.656 -9.880  1.000 80.100  0 474 GLN B CB  1 ? 
ATOM   1469 C  CG  . GLN B 2 142 ? -19.856 16.405 -10.820 1.000 76.350  0 474 GLN B CG  1 ? 
ATOM   1470 C  CD  . GLN B 2 142 ? -18.541 17.023 -10.379 1.000 74.560  0 474 GLN B CD  1 ? 
ATOM   1471 O  OE1 . GLN B 2 142 ? -18.469 18.180 -9.968  1.000 56.560  0 474 GLN B OE1 1 ? 
ATOM   1472 N  NE2 . GLN B 2 142 ? -17.464 16.260 -10.478 1.000 69.360  0 474 GLN B NE2 1 ? 
ATOM   1473 N  N   . ALA B 2 143 ? -22.232 13.635 -11.269 1.000 74.610  0 475 ALA B N   1 ? 
ATOM   1474 C  CA  . ALA B 2 143 ? -21.983 12.200 -11.285 1.000 74.380  0 475 ALA B CA  1 ? 
ATOM   1475 C  C   . ALA B 2 143 ? -20.604 11.888 -11.855 1.000 69.910  0 475 ALA B C   1 ? 
ATOM   1476 O  O   . ALA B 2 143 ? -19.934 10.977 -11.388 1.000 85.090  0 475 ALA B O   1 ? 
ATOM   1477 C  CB  . ALA B 2 143 ? -23.057 11.498 -12.063 1.000 81.890  0 475 ALA B CB  1 ? 
ATOM   1478 N  N   . GLY B 2 144 ? -20.177 12.641 -12.867 1.000 73.010  0 476 GLY B N   1 ? 
ATOM   1479 C  CA  . GLY B 2 144 ? -18.947 12.326 -13.574 1.000 81.020  0 476 GLY B CA  1 ? 
ATOM   1480 C  C   . GLY B 2 144 ? -17.735 13.117 -13.082 1.000 88.600  0 476 GLY B C   1 ? 
ATOM   1481 O  O   . GLY B 2 144 ? -17.625 13.485 -11.906 1.000 76.550  0 476 GLY B O   1 ? 
ATOM   1482 N  N   . ASN B 2 145 ? -16.787 13.313 -14.001 1.000 86.830  0 477 ASN B N   1 ? 
ATOM   1483 C  CA  . ASN B 2 145 ? -15.539 13.970 -13.664 1.000 98.820  0 477 ASN B CA  1 ? 
ATOM   1484 C  C   . ASN B 2 145 ? -15.625 15.446 -14.046 1.000 85.940  0 477 ASN B C   1 ? 
ATOM   1485 O  O   . ASN B 2 145 ? -14.776 16.231 -13.648 1.000 92.400  0 477 ASN B O   1 ? 
ATOM   1486 C  CB  . ASN B 2 145 ? -14.346 13.268 -14.314 1.000 99.990  0 477 ASN B CB  1 ? 
ATOM   1487 C  CG  . ASN B 2 145 ? -13.031 13.607 -13.639 1.000 118.620 0 477 ASN B CG  1 ? 
ATOM   1488 O  OD1 . ASN B 2 145 ? -12.993 14.371 -12.674 1.000 115.950 0 477 ASN B OD1 1 ? 
ATOM   1489 N  ND2 . ASN B 2 145 ? -11.944 13.042 -14.140 1.000 124.710 0 477 ASN B ND2 1 ? 
ATOM   1490 N  N   . LYS B 2 146 ? -16.669 15.814 -14.795 1.000 85.830  0 478 LYS B N   1 ? 
ATOM   1491 C  CA  . LYS B 2 146 ? -16.877 17.184 -15.219 1.000 88.530  0 478 LYS B CA  1 ? 
ATOM   1492 C  C   . LYS B 2 146 ? -17.801 17.891 -14.235 1.000 84.460  0 478 LYS B C   1 ? 
ATOM   1493 O  O   . LYS B 2 146 ? -18.869 17.370 -13.899 1.000 65.460  0 478 LYS B O   1 ? 
ATOM   1494 C  CB  . LYS B 2 146 ? -17.498 17.238 -16.617 1.000 103.340 0 478 LYS B CB  1 ? 
ATOM   1495 C  CG  . LYS B 2 146 ? -17.916 18.627 -17.084 1.000 112.940 0 478 LYS B CG  1 ? 
ATOM   1496 C  CD  . LYS B 2 146 ? -18.310 18.685 -18.541 1.000 120.590 0 478 LYS B CD  1 ? 
ATOM   1497 C  CE  . LYS B 2 146 ? -17.283 18.043 -19.450 1.000 124.870 0 478 LYS B CE  1 ? 
ATOM   1498 N  NZ  . LYS B 2 146 ? -17.372 18.565 -20.833 1.000 135.590 0 478 LYS B NZ  1 ? 
ATOM   1499 N  N   . PRO B 2 147 ? -17.415 19.103 -13.766 1.000 80.710  0 479 PRO B N   1 ? 
ATOM   1500 C  CA  . PRO B 2 147 ? -18.274 19.915 -12.905 1.000 78.190  0 479 PRO B CA  1 ? 
ATOM   1501 C  C   . PRO B 2 147 ? -19.516 20.417 -13.628 1.000 65.040  0 479 PRO B C   1 ? 
ATOM   1502 O  O   . PRO B 2 147 ? -19.451 20.747 -14.800 1.000 65.150  0 479 PRO B O   1 ? 
ATOM   1503 C  CB  . PRO B 2 147 ? -17.383 21.105 -12.491 1.000 87.950  0 479 PRO B CB  1 ? 
ATOM   1504 C  CG  . PRO B 2 147 ? -16.330 21.187 -13.578 1.000 83.480  0 479 PRO B CG  1 ? 
ATOM   1505 C  CD  . PRO B 2 147 ? -16.119 19.753 -14.023 1.000 86.340  0 479 PRO B CD  1 ? 
ATOM   1506 N  N   . CYS B 2 148 ? -20.617 20.532 -12.880 1.000 68.460  0 480 CYS B N   1 ? 
ATOM   1507 C  CA  . CYS B 2 148 ? -21.934 20.811 -13.430 1.000 69.100  0 480 CYS B CA  1 ? 
ATOM   1508 C  C   . CYS B 2 148 ? -22.210 22.299 -13.530 1.000 66.530  0 480 CYS B C   1 ? 
ATOM   1509 O  O   . CYS B 2 148 ? -23.062 22.705 -14.320 1.000 67.550  0 480 CYS B O   1 ? 
ATOM   1510 C  CB  . CYS B 2 148 ? -23.031 20.211 -12.549 1.000 80.430  0 480 CYS B CB  1 ? 
ATOM   1511 S  SG  . CYS B 2 148 ? -22.906 18.408 -12.417 1.000 77.430  0 480 CYS B SG  1 ? 
ATOM   1512 N  N   . ASN B 2 149 ? -21.570 23.075 -12.648 1.000 70.880  0 481 ASN B N   1 ? 
ATOM   1513 C  CA  . ASN B 2 149 ? -21.732 24.520 -12.598 1.000 85.230  0 481 ASN B CA  1 ? 
ATOM   1514 C  C   . ASN B 2 149 ? -23.209 24.888 -12.456 1.000 80.710  0 481 ASN B C   1 ? 
ATOM   1515 O  O   . ASN B 2 149 ? -23.696 25.775 -13.150 1.000 68.520  0 481 ASN B O   1 ? 
ATOM   1516 C  CB  . ASN B 2 149 ? -21.052 25.180 -13.803 1.000 82.840  0 481 ASN B CB  1 ? 
ATOM   1517 C  CG  . ASN B 2 149 ? -19.556 24.939 -13.777 1.000 91.890  0 481 ASN B CG  1 ? 
ATOM   1518 O  OD1 . ASN B 2 149 ? -18.880 25.297 -12.812 1.000 89.390  0 481 ASN B OD1 1 ? 
ATOM   1519 N  ND2 . ASN B 2 149 ? -19.037 24.293 -14.808 1.000 93.180  0 481 ASN B ND2 1 ? 
ATOM   1520 N  N   . GLY B 2 150 ? -23.904 24.206 -11.533 1.000 82.390  0 482 GLY B N   1 ? 
ATOM   1521 C  CA  . GLY B 2 150 ? -25.304 24.479 -11.238 1.000 77.170  0 482 GLY B CA  1 ? 
ATOM   1522 C  C   . GLY B 2 150 ? -26.235 24.278 -12.438 1.000 83.740  0 482 GLY B C   1 ? 
ATOM   1523 O  O   . GLY B 2 150 ? -27.334 24.836 -12.456 1.000 78.060  0 482 GLY B O   1 ? 
ATOM   1524 N  N   . VAL B 2 151 ? -25.800 23.465 -13.418 1.000 83.150  0 483 VAL B N   1 ? 
ATOM   1525 C  CA  . VAL B 2 151 ? -26.567 23.215 -14.633 1.000 95.510  0 483 VAL B CA  1 ? 
ATOM   1526 C  C   . VAL B 2 151 ? -26.949 21.735 -14.715 1.000 93.420  0 483 VAL B C   1 ? 
ATOM   1527 O  O   . VAL B 2 151 ? -26.091 20.854 -14.623 1.000 88.720  0 483 VAL B O   1 ? 
ATOM   1528 C  CB  . VAL B 2 151 ? -25.784 23.631 -15.892 1.000 97.760  0 483 VAL B CB  1 ? 
ATOM   1529 C  CG1 . VAL B 2 151 ? -26.542 23.299 -17.173 1.000 89.660  0 483 VAL B CG1 1 ? 
ATOM   1530 C  CG2 . VAL B 2 151 ? -25.403 25.105 -15.850 1.000 109.950 0 483 VAL B CG2 1 ? 
ATOM   1531 N  N   . ALA B 2 152 ? -28.242 21.485 -14.946 1.000 83.620  0 484 ALA B N   1 ? 
ATOM   1532 C  CA  . ALA B 2 152 ? -28.748 20.132 -15.118 1.000 86.700  0 484 ALA B CA  1 ? 
ATOM   1533 C  C   . ALA B 2 152 ? -28.356 19.583 -16.492 1.000 80.190  0 484 ALA B C   1 ? 
ATOM   1534 O  O   . ALA B 2 152 ? -28.640 20.211 -17.504 1.000 83.320  0 484 ALA B O   1 ? 
ATOM   1535 C  CB  . ALA B 2 152 ? -30.249 20.143 -14.950 1.000 73.180  0 484 ALA B CB  1 ? 
ATOM   1536 N  N   . GLY B 2 153 ? -27.773 18.392 -16.522 1.000 75.280  0 485 GLY B N   1 ? 
ATOM   1537 C  CA  . GLY B 2 153 ? -27.441 17.764 -17.785 1.000 71.860  0 485 GLY B CA  1 ? 
ATOM   1538 C  C   . GLY B 2 153 ? -26.677 16.463 -17.667 1.000 74.120  0 485 GLY B C   1 ? 
ATOM   1539 O  O   . GLY B 2 153 ? -26.736 15.786 -16.655 1.000 79.000  0 485 GLY B O   1 ? 
ATOM   1540 N  N   . PRO B 2 154 ? -25.961 16.100 -18.718 1.000 71.930  0 486 PRO B N   1 ? 
ATOM   1541 C  CA  . PRO B 2 154 ? -25.169 14.878 -18.696 1.000 77.000  0 486 PRO B CA  1 ? 
ATOM   1542 C  C   . PRO B 2 154 ? -24.350 14.699 -17.435 1.000 75.810  0 486 PRO B C   1 ? 
ATOM   1543 O  O   . PRO B 2 154 ? -23.480 15.505 -17.176 1.000 63.150  0 486 PRO B O   1 ? 
ATOM   1544 C  CB  . PRO B 2 154 ? -24.242 15.084 -19.875 1.000 76.530  0 486 PRO B CB  1 ? 
ATOM   1545 C  CG  . PRO B 2 154 ? -25.066 15.845 -20.850 1.000 78.510  0 486 PRO B CG  1 ? 
ATOM   1546 C  CD  . PRO B 2 154 ? -25.957 16.740 -20.040 1.000 69.260  0 486 PRO B CD  1 ? 
ATOM   1547 N  N   . ASN B 2 155 ? -24.621 13.645 -16.679 1.000 76.110  0 487 ASN B N   1 ? 
ATOM   1548 C  CA  . ASN B 2 155 ? -23.900 13.368 -15.439 1.000 73.970  0 487 ASN B CA  1 ? 
ATOM   1549 C  C   . ASN B 2 155 ? -24.131 14.487 -14.447 1.000 60.350  0 487 ASN B C   1 ? 
ATOM   1550 O  O   . ASN B 2 155 ? -23.392 14.630 -13.489 1.000 72.090  0 487 ASN B O   1 ? 
ATOM   1551 C  CB  . ASN B 2 155 ? -22.433 13.119 -15.746 1.000 72.220  0 487 ASN B CB  1 ? 
ATOM   1552 C  CG  . ASN B 2 155 ? -22.240 12.050 -16.797 1.000 76.170  0 487 ASN B CG  1 ? 
ATOM   1553 O  OD1 . ASN B 2 155 ? -23.165 11.310 -17.117 1.000 100.880 0 487 ASN B OD1 1 ? 
ATOM   1554 N  ND2 . ASN B 2 155 ? -21.036 11.962 -17.339 1.000 79.140  0 487 ASN B ND2 1 ? 
ATOM   1555 N  N   . CYS B 2 156 ? -25.180 15.252 -14.661 1.000 57.510  0 488 CYS B N   1 ? 
ATOM   1556 C  CA  . CYS B 2 156 ? -25.545 16.360 -13.806 1.000 64.670  0 488 CYS B CA  1 ? 
ATOM   1557 C  C   . CYS B 2 156 ? -27.063 16.344 -13.573 1.000 60.930  0 488 CYS B C   1 ? 
ATOM   1558 O  O   . CYS B 2 156 ? -27.811 16.923 -14.345 1.000 66.450  0 488 CYS B O   1 ? 
ATOM   1559 C  CB  . CYS B 2 156 ? -25.043 17.661 -14.434 1.000 68.350  0 488 CYS B CB  1 ? 
ATOM   1560 S  SG  . CYS B 2 156 ? -23.230 17.789 -14.378 1.000 69.670  0 488 CYS B SG  1 ? 
ATOM   1561 N  N   . TYR B 2 157 ? -27.466 15.709 -12.491 1.000 67.330  0 489 TYR B N   1 ? 
ATOM   1562 C  CA  . TYR B 2 157 ? -28.882 15.516 -12.265 1.000 60.390  0 489 TYR B CA  1 ? 
ATOM   1563 C  C   . TYR B 2 157 ? -29.503 16.194 -11.093 1.000 57.940  0 489 TYR B C   1 ? 
ATOM   1564 O  O   . TYR B 2 157 ? -28.869 16.372 -10.066 1.000 63.400  0 489 TYR B O   1 ? 
ATOM   1565 C  CB  . TYR B 2 157 ? -29.089 14.023 -12.047 1.000 60.500  0 489 TYR B CB  1 ? 
ATOM   1566 C  CG  . TYR B 2 157 ? -28.365 13.108 -12.996 1.000 50.830  0 489 TYR B CG  1 ? 
ATOM   1567 C  CD1 . TYR B 2 157 ? -28.810 12.931 -14.292 1.000 61.420  0 489 TYR B CD1 1 ? 
ATOM   1568 C  CD2 . TYR B 2 157 ? -27.258 12.392 -12.583 1.000 61.760  0 489 TYR B CD2 1 ? 
ATOM   1569 C  CE1 . TYR B 2 157 ? -28.158 12.082 -15.160 1.000 60.140  0 489 TYR B CE1 1 ? 
ATOM   1570 C  CE2 . TYR B 2 157 ? -26.598 11.540 -13.443 1.000 60.180  0 489 TYR B CE2 1 ? 
ATOM   1571 C  CZ  . TYR B 2 157 ? -27.054 11.390 -14.731 1.000 62.580  0 489 TYR B CZ  1 ? 
ATOM   1572 O  OH  . TYR B 2 157 ? -26.401 10.544 -15.591 1.000 64.070  0 489 TYR B OH  1 ? 
ATOM   1573 N  N   . SER B 2 158 ? -30.755 16.577 -11.241 1.000 61.310  0 490 SER B N   1 ? 
ATOM   1574 C  CA  . SER B 2 158 ? -31.476 17.094 -10.117 1.000 69.520  0 490 SER B CA  1 ? 
ATOM   1575 C  C   . SER B 2 158 ? -31.444 15.979 -9.090  1.000 62.290  0 490 SER B C   1 ? 
ATOM   1576 O  O   . SER B 2 158 ? -31.462 14.812 -9.439  1.000 54.490  0 490 SER B O   1 ? 
ATOM   1577 C  CB  . SER B 2 158 ? -32.892 17.442 -10.518 1.000 74.860  0 490 SER B CB  1 ? 
ATOM   1578 O  OG  . SER B 2 158 ? -32.905 18.486 -11.467 1.000 75.080  0 490 SER B OG  1 ? 
ATOM   1579 N  N   . PRO B 2 159 ? -31.421 16.330 -7.812  1.000 62.000  0 491 PRO B N   1 ? 
ATOM   1580 C  CA  . PRO B 2 159 ? -31.225 15.293 -6.802  1.000 58.520  0 491 PRO B CA  1 ? 
ATOM   1581 C  C   . PRO B 2 159 ? -32.524 14.636 -6.324  1.000 52.320  0 491 PRO B C   1 ? 
ATOM   1582 O  O   . PRO B 2 159 ? -32.483 13.534 -5.808  1.000 57.900  0 491 PRO B O   1 ? 
ATOM   1583 C  CB  . PRO B 2 159 ? -30.501 16.086 -5.705  1.000 55.470  0 491 PRO B CB  1 ? 
ATOM   1584 C  CG  . PRO B 2 159 ? -31.102 17.485 -5.785  1.000 56.800  0 491 PRO B CG  1 ? 
ATOM   1585 C  CD  . PRO B 2 159 ? -31.461 17.688 -7.245  1.000 60.750  0 491 PRO B CD  1 ? 
ATOM   1586 N  N   . LEU B 2 160 ? -33.660 15.319 -6.488  1.000 53.000  0 492 LEU B N   1 ? 
ATOM   1587 C  CA  . LEU B 2 160 ? -34.944 14.844 -5.994  1.000 55.390  0 492 LEU B CA  1 ? 
ATOM   1588 C  C   . LEU B 2 160 ? -35.786 14.242 -7.123  1.000 56.710  0 492 LEU B C   1 ? 
ATOM   1589 O  O   . LEU B 2 160 ? -35.679 14.659 -8.267  1.000 60.580  0 492 LEU B O   1 ? 
ATOM   1590 C  CB  . LEU B 2 160 ? -35.718 16.026 -5.412  1.000 53.820  0 492 LEU B CB  1 ? 
ATOM   1591 C  CG  . LEU B 2 160 ? -34.998 16.892 -4.381  1.000 54.930  0 492 LEU B CG  1 ? 
ATOM   1592 C  CD1 . LEU B 2 160 ? -35.946 17.984 -3.898  1.000 57.260  0 492 LEU B CD1 1 ? 
ATOM   1593 C  CD2 . LEU B 2 160 ? -34.503 16.067 -3.211  1.000 56.100  0 492 LEU B CD2 1 ? 
ATOM   1594 N  N   . ARG B 2 161 ? -36.649 13.286 -6.760  1.000 53.110  0 493 ARG B N   1 ? 
ATOM   1595 C  CA  . ARG B 2 161 ? -37.689 12.741 -7.623  1.000 55.870  0 493 ARG B CA  1 ? 
ATOM   1596 C  C   . ARG B 2 161 ? -39.004 12.749 -6.862  1.000 48.190  0 493 ARG B C   1 ? 
ATOM   1597 O  O   . ARG B 2 161 ? -38.988 12.606 -5.636  1.000 50.880  0 493 ARG B O   1 ? 
ATOM   1598 C  CB  . ARG B 2 161 ? -37.415 11.269 -7.942  1.000 55.800  0 493 ARG B CB  1 ? 
ATOM   1599 C  CG  . ARG B 2 161 ? -36.152 11.025 -8.747  1.000 60.790  0 493 ARG B CG  1 ? 
ATOM   1600 C  CD  . ARG B 2 161 ? -36.233 11.650 -10.124 1.000 61.880  0 493 ARG B CD  1 ? 
ATOM   1601 N  NE  . ARG B 2 161 ? -37.357 11.136 -10.879 1.000 66.630  0 493 ARG B NE  1 ? 
ATOM   1602 C  CZ  . ARG B 2 161 ? -37.734 11.562 -12.076 1.000 69.900  0 493 ARG B CZ  1 ? 
ATOM   1603 N  NH1 . ARG B 2 161 ? -37.068 12.531 -12.683 1.000 74.560  0 493 ARG B NH1 1 ? 
ATOM   1604 N  NH2 . ARG B 2 161 ? -38.770 10.990 -12.673 1.000 57.880  0 493 ARG B NH2 1 ? 
ATOM   1605 N  N   . SER B 2 162 ? -40.113 12.863 -7.589  1.000 48.640  0 494 SER B N   1 ? 
ATOM   1606 C  CA  . SER B 2 162 ? -41.449 12.672 -7.035  1.000 56.020  0 494 SER B CA  1 ? 
ATOM   1607 C  C   . SER B 2 162 ? -41.845 11.202 -7.060  1.000 57.330  0 494 SER B C   1 ? 
ATOM   1608 O  O   . SER B 2 162 ? -41.356 10.446 -7.886  1.000 55.680  0 494 SER B O   1 ? 
ATOM   1609 C  CB  . SER B 2 162 ? -42.439 13.480 -7.777  1.000 60.260  0 494 SER B CB  1 ? 
ATOM   1610 O  OG  . SER B 2 162 ? -42.023 14.835 -7.786  1.000 72.620  0 494 SER B OG  1 ? 
ATOM   1611 N  N   . TYR B 2 163 ? -42.742 10.811 -6.148  1.000 57.220  0 495 TYR B N   1 ? 
ATOM   1612 C  CA  . TYR B 2 163 ? -43.169 9.422  -6.046  1.000 53.830  0 495 TYR B CA  1 ? 
ATOM   1613 C  C   . TYR B 2 163 ? -44.272 9.085  -7.060  1.000 54.860  0 495 TYR B C   1 ? 
ATOM   1614 O  O   . TYR B 2 163 ? -44.362 7.956  -7.511  1.000 53.870  0 495 TYR B O   1 ? 
ATOM   1615 C  CB  . TYR B 2 163 ? -43.671 9.118  -4.636  1.000 47.630  0 495 TYR B CB  1 ? 
ATOM   1616 C  CG  . TYR B 2 163 ? -42.625 8.766  -3.618  1.000 43.030  0 495 TYR B CG  1 ? 
ATOM   1617 C  CD1 . TYR B 2 163 ? -41.900 7.607  -3.731  1.000 46.670  0 495 TYR B CD1 1 ? 
ATOM   1618 C  CD2 . TYR B 2 163 ? -42.426 9.535  -2.493  1.000 45.490  0 495 TYR B CD2 1 ? 
ATOM   1619 C  CE1 . TYR B 2 163 ? -40.991 7.226  -2.768  1.000 44.490  0 495 TYR B CE1 1 ? 
ATOM   1620 C  CE2 . TYR B 2 163 ? -41.513 9.173  -1.514  1.000 49.200  0 495 TYR B CE2 1 ? 
ATOM   1621 C  CZ  . TYR B 2 163 ? -40.783 8.011  -1.657  1.000 46.950  0 495 TYR B CZ  1 ? 
ATOM   1622 O  OH  . TYR B 2 163 ? -39.846 7.610  -0.736  1.000 43.840  0 495 TYR B OH  1 ? 
ATOM   1623 N  N   . GLY B 2 164 ? -45.170 10.025 -7.336  1.000 53.420  0 496 GLY B N   1 ? 
ATOM   1624 C  CA  . GLY B 2 164 ? -46.203 9.845  -8.348  1.000 60.360  0 496 GLY B CA  1 ? 
ATOM   1625 C  C   . GLY B 2 164 ? -47.228 8.774  -7.986  1.000 68.620  0 496 GLY B C   1 ? 
ATOM   1626 O  O   . GLY B 2 164 ? -47.662 8.011  -8.855  1.000 65.460  0 496 GLY B O   1 ? 
ATOM   1627 N  N   . PHE B 2 165 ? -47.630 8.752  -6.705  1.000 64.140  0 497 PHE B N   1 ? 
ATOM   1628 C  CA  . PHE B 2 165 ? -48.429 7.664  -6.164  1.000 58.520  0 497 PHE B CA  1 ? 
ATOM   1629 C  C   . PHE B 2 165 ? -49.776 7.589  -6.888  1.000 58.380  0 497 PHE B C   1 ? 
ATOM   1630 O  O   . PHE B 2 165 ? -50.478 8.592  -6.998  1.000 53.630  0 497 PHE B O   1 ? 
ATOM   1631 C  CB  . PHE B 2 165 ? -48.656 7.842  -4.657  1.000 58.830  0 497 PHE B CB  1 ? 
ATOM   1632 C  CG  . PHE B 2 165 ? -47.438 7.696  -3.777  1.000 49.910  0 497 PHE B CG  1 ? 
ATOM   1633 C  CD1 . PHE B 2 165 ? -46.719 6.508  -3.735  1.000 45.270  0 497 PHE B CD1 1 ? 
ATOM   1634 C  CD2 . PHE B 2 165 ? -47.022 8.747  -2.979  1.000 50.790  0 497 PHE B CD2 1 ? 
ATOM   1635 C  CE1 . PHE B 2 165 ? -45.603 6.387  -2.921  1.000 50.380  0 497 PHE B CE1 1 ? 
ATOM   1636 C  CE2 . PHE B 2 165 ? -45.899 8.629  -2.177  1.000 49.430  0 497 PHE B CE2 1 ? 
ATOM   1637 C  CZ  . PHE B 2 165 ? -45.207 7.445  -2.132  1.000 54.880  0 497 PHE B CZ  1 ? 
ATOM   1638 N  N   . ARG B 2 166 ? -50.155 6.380  -7.325  1.000 59.790  0 498 ARG B N   1 ? 
ATOM   1639 C  CA  . ARG B 2 166 ? -51.467 6.133  -7.911  1.000 67.000  0 498 ARG B CA  1 ? 
ATOM   1640 C  C   . ARG B 2 166 ? -52.144 4.969  -7.196  1.000 59.430  0 498 ARG B C   1 ? 
ATOM   1641 O  O   . ARG B 2 166 ? -51.479 4.007  -6.822  1.000 55.230  0 498 ARG B O   1 ? 
ATOM   1642 C  CB  . ARG B 2 166 ? -51.368 5.785  -9.402  1.000 64.710  0 498 ARG B CB  1 ? 
ATOM   1643 C  CG  . ARG B 2 166 ? -51.143 6.980  -10.311 1.000 69.330  0 498 ARG B CG  1 ? 
ATOM   1644 C  CD  . ARG B 2 166 ? -50.599 6.523  -11.656 1.000 71.750  0 498 ARG B CD  1 ? 
ATOM   1645 N  NE  . ARG B 2 166 ? -50.199 7.614  -12.533 1.000 72.400  0 498 ARG B NE  1 ? 
ATOM   1646 C  CZ  . ARG B 2 166 ? -50.624 7.797  -13.784 1.000 87.370  0 498 ARG B CZ  1 ? 
ATOM   1647 N  NH1 . ARG B 2 166 ? -51.516 6.990  -14.334 1.000 87.330  0 498 ARG B NH1 1 ? 
ATOM   1648 N  NH2 . ARG B 2 166 ? -50.158 8.810  -14.493 1.000 96.160  0 498 ARG B NH2 1 ? 
ATOM   1649 N  N   . PRO B 2 167 ? -53.495 4.966  -7.096  1.000 55.910  0 499 PRO B N   1 ? 
ATOM   1650 C  CA  . PRO B 2 167 ? -54.199 3.985  -6.281  1.000 58.040  0 499 PRO B CA  1 ? 
ATOM   1651 C  C   . PRO B 2 167 ? -54.015 2.556  -6.775  1.000 64.600  0 499 PRO B C   1 ? 
ATOM   1652 O  O   . PRO B 2 167 ? -54.084 1.629  -5.979  1.000 67.140  0 499 PRO B O   1 ? 
ATOM   1653 C  CB  . PRO B 2 167 ? -55.676 4.406  -6.339  1.000 63.100  0 499 PRO B CB  1 ? 
ATOM   1654 C  CG  . PRO B 2 167 ? -55.675 5.803  -6.931  1.000 65.660  0 499 PRO B CG  1 ? 
ATOM   1655 C  CD  . PRO B 2 167 ? -54.421 5.880  -7.774  1.000 64.620  0 499 PRO B CD  1 ? 
ATOM   1656 N  N   . THR B 2 168 ? -53.718 2.394  -8.071  1.000 61.490  0 500 THR B N   1 ? 
ATOM   1657 C  CA  . THR B 2 168 ? -53.654 1.084  -8.700  1.000 61.260  0 500 THR B CA  1 ? 
ATOM   1658 C  C   . THR B 2 168 ? -52.276 0.448  -8.606  1.000 61.330  0 500 THR B C   1 ? 
ATOM   1659 O  O   . THR B 2 168 ? -52.093 -0.650 -9.128  1.000 65.140  0 500 THR B O   1 ? 
ATOM   1660 C  CB  . THR B 2 168 ? -53.995 1.181  -10.195 1.000 72.780  0 500 THR B CB  1 ? 
ATOM   1661 O  OG1 . THR B 2 168 ? -52.929 1.904  -10.812 1.000 72.800  0 500 THR B OG1 1 ? 
ATOM   1662 C  CG2 . THR B 2 168 ? -55.307 1.884  -10.478 1.000 69.090  0 500 THR B CG2 1 ? 
ATOM   1663 N  N   . TYR B 2 169 ? -51.302 1.101  -7.952  1.000 60.960  0 501 TYR B N   1 ? 
ATOM   1664 C  CA  . TYR B 2 169 ? -49.981 0.496  -7.836  1.000 54.510  0 501 TYR B CA  1 ? 
ATOM   1665 C  C   . TYR B 2 169 ? -50.069 -0.695 -6.895  1.000 52.440  0 501 TYR B C   1 ? 
ATOM   1666 O  O   . TYR B 2 169 ? -50.942 -0.723 -6.034  1.000 54.140  0 501 TYR B O   1 ? 
ATOM   1667 C  CB  . TYR B 2 169 ? -48.940 1.493  -7.310  1.000 57.250  0 501 TYR B CB  1 ? 
ATOM   1668 C  CG  . TYR B 2 169 ? -48.510 2.588  -8.257  1.000 58.290  0 501 TYR B CG  1 ? 
ATOM   1669 C  CD1 . TYR B 2 169 ? -49.032 2.703  -9.538  1.000 61.480  0 501 TYR B CD1 1 ? 
ATOM   1670 C  CD2 . TYR B 2 169 ? -47.560 3.517  -7.865  1.000 57.790  0 501 TYR B CD2 1 ? 
ATOM   1671 C  CE1 . TYR B 2 169 ? -48.606 3.694  -10.403 1.000 64.310  0 501 TYR B CE1 1 ? 
ATOM   1672 C  CE2 . TYR B 2 169 ? -47.122 4.515  -8.717  1.000 51.610  0 501 TYR B CE2 1 ? 
ATOM   1673 C  CZ  . TYR B 2 169 ? -47.656 4.613  -9.987  1.000 63.730  0 501 TYR B CZ  1 ? 
ATOM   1674 O  OH  . TYR B 2 169 ? -47.257 5.627  -10.820 1.000 61.090  0 501 TYR B OH  1 ? 
ATOM   1675 N  N   . GLY B 2 170 ? -49.122 -1.638 -7.020  1.000 50.620  0 502 GLY B N   1 ? 
ATOM   1676 C  CA  . GLY B 2 170 ? -48.928 -2.667 -6.015  1.000 53.380  0 502 GLY B CA  1 ? 
ATOM   1677 C  C   . GLY B 2 170 ? -48.636 -2.019 -4.661  1.000 69.960  0 502 GLY B C   1 ? 
ATOM   1678 O  O   . GLY B 2 170 ? -48.253 -0.842 -4.619  1.000 61.760  0 502 GLY B O   1 ? 
ATOM   1679 N  N   . VAL B 2 171 ? -48.821 -2.785 -3.572  1.000 62.820  0 503 VAL B N   1 ? 
ATOM   1680 C  CA  . VAL B 2 171 ? -48.854 -2.207 -2.238  1.000 64.040  0 503 VAL B CA  1 ? 
ATOM   1681 C  C   . VAL B 2 171 ? -47.462 -1.733 -1.836  1.000 58.700  0 503 VAL B C   1 ? 
ATOM   1682 O  O   . VAL B 2 171 ? -47.362 -0.782 -1.072  1.000 59.650  0 503 VAL B O   1 ? 
ATOM   1683 C  CB  . VAL B 2 171 ? -49.434 -3.152 -1.165  1.000 69.940  0 503 VAL B CB  1 ? 
ATOM   1684 C  CG1 . VAL B 2 171 ? -50.933 -3.337 -1.334  1.000 79.480  0 503 VAL B CG1 1 ? 
ATOM   1685 C  CG2 . VAL B 2 171 ? -48.713 -4.488 -1.113  1.000 72.500  0 503 VAL B CG2 1 ? 
ATOM   1686 N  N   . GLY B 2 172 ? -46.416 -2.418 -2.320  1.000 55.180  0 504 GLY B N   1 ? 
ATOM   1687 C  CA  . GLY B 2 172 ? -45.036 -2.045 -2.069  1.000 56.310  0 504 GLY B CA  1 ? 
ATOM   1688 C  C   . GLY B 2 172 ? -44.680 -0.657 -2.622  1.000 55.500  0 504 GLY B C   1 ? 
ATOM   1689 O  O   . GLY B 2 172 ? -43.744 -0.026 -2.140  1.000 68.740  0 504 GLY B O   1 ? 
ATOM   1690 N  N   . HIS B 2 173 ? -45.426 -0.214 -3.639  1.000 54.600  0 505 HIS B N   1 ? 
ATOM   1691 C  CA  . HIS B 2 173 ? -45.242 1.059  -4.319  1.000 54.110  0 505 HIS B CA  1 ? 
ATOM   1692 C  C   . HIS B 2 173 ? -46.352 2.040  -3.957  1.000 49.740  0 505 HIS B C   1 ? 
ATOM   1693 O  O   . HIS B 2 173 ? -46.511 3.085  -4.588  1.000 55.950  0 505 HIS B O   1 ? 
ATOM   1694 C  CB  . HIS B 2 173 ? -45.219 0.813  -5.834  1.000 51.150  0 505 HIS B CB  1 ? 
ATOM   1695 C  CG  . HIS B 2 173 ? -44.075 -0.058 -6.246  1.000 53.910  0 505 HIS B CG  1 ? 
ATOM   1696 N  ND1 . HIS B 2 173 ? -44.092 -0.859 -7.368  1.000 59.250  0 505 HIS B ND1 1 ? 
ATOM   1697 C  CD2 . HIS B 2 173 ? -42.886 -0.274 -5.660  1.000 63.430  0 505 HIS B CD2 1 ? 
ATOM   1698 C  CE1 . HIS B 2 173 ? -42.928 -1.494 -7.471  1.000 60.910  0 505 HIS B CE1 1 ? 
ATOM   1699 N  NE2 . HIS B 2 173 ? -42.183 -1.156 -6.445  1.000 68.570  0 505 HIS B NE2 1 ? 
ATOM   1700 N  N   . GLN B 2 174 ? -47.184 1.655  -2.993  1.000 49.050  0 506 GLN B N   1 ? 
ATOM   1701 C  CA  . GLN B 2 174 ? -48.200 2.543  -2.467  1.000 53.930  0 506 GLN B CA  1 ? 
ATOM   1702 C  C   . GLN B 2 174 ? -47.577 3.346  -1.329  1.000 45.640  0 506 GLN B C   1 ? 
ATOM   1703 O  O   . GLN B 2 174 ? -46.633 2.892  -0.679  1.000 47.410  0 506 GLN B O   1 ? 
ATOM   1704 C  CB  . GLN B 2 174 ? -49.392 1.750  -1.924  1.000 58.510  0 506 GLN B CB  1 ? 
ATOM   1705 C  CG  . GLN B 2 174 ? -50.442 1.401  -2.967  1.000 62.960  0 506 GLN B CG  1 ? 
ATOM   1706 C  CD  . GLN B 2 174 ? -51.442 0.404  -2.427  1.000 64.920  0 506 GLN B CD  1 ? 
ATOM   1707 O  OE1 . GLN B 2 174 ? -51.889 0.496  -1.290  1.000 62.350  0 506 GLN B OE1 1 ? 
ATOM   1708 N  NE2 . GLN B 2 174 ? -51.741 -0.615 -3.215  1.000 68.600  0 506 GLN B NE2 1 ? 
ATOM   1709 N  N   . PRO B 2 175 ? -48.149 4.523  -1.029  1.000 48.020  0 507 PRO B N   1 ? 
ATOM   1710 C  CA  . PRO B 2 175 ? -47.619 5.411  0.000   1.000 50.010  0 507 PRO B CA  1 ? 
ATOM   1711 C  C   . PRO B 2 175 ? -48.009 4.916  1.380   1.000 56.620  0 507 PRO B C   1 ? 
ATOM   1712 O  O   . PRO B 2 175 ? -49.118 4.417  1.573   1.000 57.500  0 507 PRO B O   1 ? 
ATOM   1713 C  CB  . PRO B 2 175 ? -48.317 6.738  -0.298  1.000 48.010  0 507 PRO B CB  1 ? 
ATOM   1714 C  CG  . PRO B 2 175 ? -49.653 6.316  -0.874  1.000 51.770  0 507 PRO B CG  1 ? 
ATOM   1715 C  CD  . PRO B 2 175 ? -49.354 5.065  -1.675  1.000 50.320  0 507 PRO B CD  1 ? 
ATOM   1716 N  N   . TYR B 2 176 ? -47.051 5.018  2.298   1.000 47.010  0 508 TYR B N   1 ? 
ATOM   1717 C  CA  . TYR B 2 176 ? -47.257 4.739  3.705   1.000 47.290  0 508 TYR B CA  1 ? 
ATOM   1718 C  C   . TYR B 2 176 ? -46.893 5.992  4.493   1.000 51.710  0 508 TYR B C   1 ? 
ATOM   1719 O  O   . TYR B 2 176 ? -45.904 6.659  4.189   1.000 47.450  0 508 TYR B O   1 ? 
ATOM   1720 C  CB  . TYR B 2 176 ? -46.434 3.535  4.133   1.000 50.240  0 508 TYR B CB  1 ? 
ATOM   1721 C  CG  . TYR B 2 176 ? -47.068 2.207  3.779   1.000 61.970  0 508 TYR B CG  1 ? 
ATOM   1722 C  CD1 . TYR B 2 176 ? -47.278 1.846  2.458   1.000 55.040  0 508 TYR B CD1 1 ? 
ATOM   1723 C  CD2 . TYR B 2 176 ? -47.450 1.303  4.760   1.000 61.650  0 508 TYR B CD2 1 ? 
ATOM   1724 C  CE1 . TYR B 2 176 ? -47.852 0.630  2.124   1.000 66.940  0 508 TYR B CE1 1 ? 
ATOM   1725 C  CE2 . TYR B 2 176 ? -48.021 0.075  4.439   1.000 66.070  0 508 TYR B CE2 1 ? 
ATOM   1726 C  CZ  . TYR B 2 176 ? -48.243 -0.255 3.115   1.000 64.410  0 508 TYR B CZ  1 ? 
ATOM   1727 O  OH  . TYR B 2 176 ? -48.791 -1.466 2.766   1.000 59.820  0 508 TYR B OH  1 ? 
ATOM   1728 N  N   . ARG B 2 177 ? -47.750 6.338  5.451   1.000 49.670  0 509 ARG B N   1 ? 
ATOM   1729 C  CA  . ARG B 2 177 ? -47.464 7.383  6.417   1.000 49.380  0 509 ARG B CA  1 ? 
ATOM   1730 C  C   . ARG B 2 177 ? -46.631 6.771  7.529   1.000 58.230  0 509 ARG B C   1 ? 
ATOM   1731 O  O   . ARG B 2 177 ? -46.870 5.624  7.914   1.000 49.710  0 509 ARG B O   1 ? 
ATOM   1732 C  CB  . ARG B 2 177 ? -48.757 8.010  6.920   1.000 46.280  0 509 ARG B CB  1 ? 
ATOM   1733 C  CG  . ARG B 2 177 ? -49.308 9.034  5.960   1.000 46.360  0 509 ARG B CG  1 ? 
ATOM   1734 C  CD  . ARG B 2 177 ? -50.776 9.362  6.171   1.000 50.680  0 509 ARG B CD  1 ? 
ATOM   1735 N  NE  . ARG B 2 177 ? -51.184 10.311 5.145   1.000 47.860  0 509 ARG B NE  1 ? 
ATOM   1736 C  CZ  . ARG B 2 177 ? -51.947 11.378 5.340   1.000 57.900  0 509 ARG B CZ  1 ? 
ATOM   1737 N  NH1 . ARG B 2 177 ? -52.581 11.549 6.486   1.000 60.900  0 509 ARG B NH1 1 ? 
ATOM   1738 N  NH2 . ARG B 2 177 ? -52.092 12.262 4.370   1.000 59.030  0 509 ARG B NH2 1 ? 
ATOM   1739 N  N   . VAL B 2 178 ? -45.580 7.502  7.934   1.000 48.490  0 510 VAL B N   1 ? 
ATOM   1740 C  CA  . VAL B 2 178 ? -44.676 7.039  8.966   1.000 45.790  0 510 VAL B CA  1 ? 
ATOM   1741 C  C   . VAL B 2 178 ? -44.590 8.085  10.084  1.000 52.870  0 510 VAL B C   1 ? 
ATOM   1742 O  O   . VAL B 2 178 ? -44.583 9.289  9.829   1.000 54.540  0 510 VAL B O   1 ? 
ATOM   1743 C  CB  . VAL B 2 178 ? -43.309 6.714  8.360   1.000 47.580  0 510 VAL B CB  1 ? 
ATOM   1744 C  CG1 . VAL B 2 178 ? -42.356 6.196  9.409   1.000 42.070  0 510 VAL B CG1 1 ? 
ATOM   1745 C  CG2 . VAL B 2 178 ? -43.427 5.733  7.218   1.000 47.420  0 510 VAL B CG2 1 ? 
ATOM   1746 N  N   . VAL B 2 179 ? -44.626 7.597  11.330  1.000 52.110  0 511 VAL B N   1 ? 
ATOM   1747 C  CA  . VAL B 2 179 ? -44.400 8.406  12.510  1.000 48.260  0 511 VAL B CA  1 ? 
ATOM   1748 C  C   . VAL B 2 179 ? -43.300 7.758  13.327  1.000 48.960  0 511 VAL B C   1 ? 
ATOM   1749 O  O   . VAL B 2 179 ? -43.409 6.590  13.721  1.000 48.470  0 511 VAL B O   1 ? 
ATOM   1750 C  CB  . VAL B 2 179 ? -45.672 8.632  13.344  1.000 46.180  0 511 VAL B CB  1 ? 
ATOM   1751 C  CG1 . VAL B 2 179 ? -45.348 9.343  14.641  1.000 46.750  0 511 VAL B CG1 1 ? 
ATOM   1752 C  CG2 . VAL B 2 179 ? -46.717 9.427  12.580  1.000 45.490  0 511 VAL B CG2 1 ? 
ATOM   1753 N  N   . VAL B 2 180 ? -42.234 8.539  13.561  1.000 48.600  0 512 VAL B N   1 ? 
ATOM   1754 C  CA  . VAL B 2 180 ? -41.142 8.135  14.418  1.000 46.040  0 512 VAL B CA  1 ? 
ATOM   1755 C  C   . VAL B 2 180 ? -41.243 8.969  15.706  1.000 53.390  0 512 VAL B C   1 ? 
ATOM   1756 O  O   . VAL B 2 180 ? -41.243 10.202 15.687  1.000 46.110  0 512 VAL B O   1 ? 
ATOM   1757 C  CB  . VAL B 2 180 ? -39.781 8.256  13.704  1.000 49.330  0 512 VAL B CB  1 ? 
ATOM   1758 C  CG1 . VAL B 2 180 ? -38.630 7.830  14.585  1.000 51.370  0 512 VAL B CG1 1 ? 
ATOM   1759 C  CG2 . VAL B 2 180 ? -39.736 7.487  12.392  1.000 51.990  0 512 VAL B CG2 1 ? 
ATOM   1760 N  N   . LEU B 2 181 ? -41.449 8.268  16.826  1.000 53.350  0 513 LEU B N   1 ? 
ATOM   1761 C  CA  . LEU B 2 181 ? -41.459 8.866  18.153  1.000 51.830  0 513 LEU B CA  1 ? 
ATOM   1762 C  C   . LEU B 2 181 ? -40.099 8.684  18.797  1.000 51.690  0 513 LEU B C   1 ? 
ATOM   1763 O  O   . LEU B 2 181 ? -39.634 7.548  18.885  1.000 59.090  0 513 LEU B O   1 ? 
ATOM   1764 C  CB  . LEU B 2 181 ? -42.514 8.151  18.991  1.000 47.560  0 513 LEU B CB  1 ? 
ATOM   1765 C  CG  . LEU B 2 181 ? -43.948 8.335  18.527  1.000 50.970  0 513 LEU B CG  1 ? 
ATOM   1766 C  CD1 . LEU B 2 181 ? -44.859 7.606  19.505  1.000 48.440  0 513 LEU B CD1 1 ? 
ATOM   1767 C  CD2 . LEU B 2 181 ? -44.307 9.829  18.397  1.000 46.020  0 513 LEU B CD2 1 ? 
ATOM   1768 N  N   . SER B 2 182 ? -39.482 9.799  19.218  1.000 49.400  0 514 SER B N   1 ? 
ATOM   1769 C  CA  . SER B 2 182 ? -38.263 9.774  20.017  1.000 51.180  0 514 SER B CA  1 ? 
ATOM   1770 C  C   . SER B 2 182 ? -38.556 10.343 21.407  1.000 47.900  0 514 SER B C   1 ? 
ATOM   1771 O  O   . SER B 2 182 ? -39.244 11.356 21.550  1.000 56.040  0 514 SER B O   1 ? 
ATOM   1772 C  CB  . SER B 2 182 ? -37.109 10.532 19.374  1.000 54.130  0 514 SER B CB  1 ? 
ATOM   1773 O  OG  . SER B 2 182 ? -36.683 9.945  18.174  1.000 76.570  0 514 SER B OG  1 ? 
ATOM   1774 N  N   . PHE B 2 183 ? -38.008 9.688  22.417  1.000 54.580  0 515 PHE B N   1 ? 
ATOM   1775 C  CA  . PHE B 2 183 ? -38.322 9.938  23.813  1.000 54.810  0 515 PHE B CA  1 ? 
ATOM   1776 C  C   . PHE B 2 183 ? -37.084 10.497 24.491  1.000 56.930  0 515 PHE B C   1 ? 
ATOM   1777 O  O   . PHE B 2 183 ? -36.085 9.799  24.568  1.000 52.380  0 515 PHE B O   1 ? 
ATOM   1778 C  CB  . PHE B 2 183 ? -38.722 8.623  24.478  1.000 54.220  0 515 PHE B CB  1 ? 
ATOM   1779 C  CG  . PHE B 2 183 ? -40.012 8.082  23.921  1.000 56.420  0 515 PHE B CG  1 ? 
ATOM   1780 C  CD1 . PHE B 2 183 ? -41.214 8.636  24.288  1.000 53.120  0 515 PHE B CD1 1 ? 
ATOM   1781 C  CD2 . PHE B 2 183 ? -40.000 7.086  22.966  1.000 56.390  0 515 PHE B CD2 1 ? 
ATOM   1782 C  CE1 . PHE B 2 183 ? -42.394 8.162  23.747  1.000 59.280  0 515 PHE B CE1 1 ? 
ATOM   1783 C  CE2 . PHE B 2 183 ? -41.181 6.596  22.446  1.000 55.130  0 515 PHE B CE2 1 ? 
ATOM   1784 C  CZ  . PHE B 2 183 ? -42.372 7.149  22.818  1.000 51.280  0 515 PHE B CZ  1 ? 
ATOM   1785 N  N   . GLU B 2 184 ? -37.130 11.757 24.914  1.000 59.090  0 516 GLU B N   1 ? 
ATOM   1786 C  CA  . GLU B 2 184 ? -35.910 12.416 25.361  1.000 63.580  0 516 GLU B CA  1 ? 
ATOM   1787 C  C   . GLU B 2 184 ? -35.912 12.551 26.886  1.000 59.730  0 516 GLU B C   1 ? 
ATOM   1788 O  O   . GLU B 2 184 ? -36.861 13.078 27.463  1.000 52.980  0 516 GLU B O   1 ? 
ATOM   1789 C  CB  . GLU B 2 184 ? -35.797 13.780 24.679  1.000 65.670  0 516 GLU B CB  1 ? 
ATOM   1790 C  CG  . GLU B 2 184 ? -34.493 14.484 24.983  1.000 66.560  0 516 GLU B CG  1 ? 
ATOM   1791 C  CD  . GLU B 2 184 ? -34.362 15.840 24.320  1.000 66.300  0 516 GLU B CD  1 ? 
ATOM   1792 O  OE1 . GLU B 2 184 ? -35.186 16.733 24.621  1.000 63.320  0 516 GLU B OE1 1 ? 
ATOM   1793 O  OE2 . GLU B 2 184 ? -33.453 15.982 23.486  1.000 73.480  0 516 GLU B OE2 1 ? 
ATOM   1794 N  N   . LEU B 2 185 ? -34.806 12.116 27.507  1.000 65.320  0 517 LEU B N   1 ? 
ATOM   1795 C  CA  . LEU B 2 185 ? -34.588 12.224 28.942  1.000 66.270  0 517 LEU B CA  1 ? 
ATOM   1796 C  C   . LEU B 2 185 ? -33.342 13.060 29.238  1.000 63.560  0 517 LEU B C   1 ? 
ATOM   1797 O  O   . LEU B 2 185 ? -32.239 12.534 29.241  1.000 60.330  0 517 LEU B O   1 ? 
ATOM   1798 C  CB  . LEU B 2 185 ? -34.426 10.809 29.495  1.000 73.350  0 517 LEU B CB  1 ? 
ATOM   1799 C  CG  . LEU B 2 185 ? -35.710 10.190 30.033  1.000 81.790  0 517 LEU B CG  1 ? 
ATOM   1800 C  CD1 . LEU B 2 185 ? -35.537 8.693  30.274  1.000 88.130  0 517 LEU B CD1 1 ? 
ATOM   1801 C  CD2 . LEU B 2 185 ? -36.131 10.911 31.312  1.000 83.250  0 517 LEU B CD2 1 ? 
ATOM   1802 N  N   . LEU B 2 186 ? -33.529 14.364 29.449  1.000 57.600  0 518 LEU B N   1 ? 
ATOM   1803 C  CA  . LEU B 2 186 ? -32.448 15.273 29.816  1.000 63.580  0 518 LEU B CA  1 ? 
ATOM   1804 C  C   . LEU B 2 186 ? -32.346 15.332 31.346  1.000 69.050  0 518 LEU B C   1 ? 
ATOM   1805 O  O   . LEU B 2 186 ? -33.085 14.629 32.022  1.000 61.140  0 518 LEU B O   1 ? 
ATOM   1806 C  CB  . LEU B 2 186 ? -32.765 16.649 29.222  1.000 55.460  0 518 LEU B CB  1 ? 
ATOM   1807 C  CG  . LEU B 2 186 ? -33.030 16.703 27.709  1.000 63.460  0 518 LEU B CG  1 ? 
ATOM   1808 C  CD1 . LEU B 2 186 ? -33.178 18.137 27.207  1.000 63.020  0 518 LEU B CD1 1 ? 
ATOM   1809 C  CD2 . LEU B 2 186 ? -31.947 16.000 26.914  1.000 62.380  0 518 LEU B CD2 1 ? 
ATOM   1810 N  N   . HIS B 2 187 ? -31.425 16.140 31.903  1.000 65.620  0 519 HIS B N   1 ? 
ATOM   1811 C  CA  . HIS B 2 187 ? -31.455 16.453 33.334  1.000 58.910  0 519 HIS B CA  1 ? 
ATOM   1812 C  C   . HIS B 2 187 ? -32.319 17.685 33.558  1.000 56.680  0 519 HIS B C   1 ? 
ATOM   1813 O  O   . HIS B 2 187 ? -31.815 18.813 33.573  1.000 61.580  0 519 HIS B O   1 ? 
ATOM   1814 C  CB  . HIS B 2 187 ? -30.060 16.699 33.904  1.000 59.920  0 519 HIS B CB  1 ? 
ATOM   1815 C  CG  . HIS B 2 187 ? -29.163 15.547 33.683  1.000 46.640  0 519 HIS B CG  1 ? 
ATOM   1816 N  ND1 . HIS B 2 187 ? -29.571 14.257 33.922  1.000 55.210  0 519 HIS B ND1 1 ? 
ATOM   1817 C  CD2 . HIS B 2 187 ? -27.935 15.470 33.172  1.000 49.670  0 519 HIS B CD2 1 ? 
ATOM   1818 C  CE1 . HIS B 2 187 ? -28.591 13.418 33.594  1.000 53.320  0 519 HIS B CE1 1 ? 
ATOM   1819 N  NE2 . HIS B 2 187 ? -27.578 14.140 33.143  1.000 56.090  0 519 HIS B NE2 1 ? 
ATOM   1820 N  N   . ALA B 2 188 ? -33.624 17.448 33.722  1.000 54.850  0 520 ALA B N   1 ? 
ATOM   1821 C  CA  . ALA B 2 188 ? -34.630 18.494 33.652  1.000 64.110  0 520 ALA B CA  1 ? 
ATOM   1822 C  C   . ALA B 2 188 ? -35.973 17.908 34.068  1.000 59.900  0 520 ALA B C   1 ? 
ATOM   1823 O  O   . ALA B 2 188 ? -36.141 16.697 34.080  1.000 60.590  0 520 ALA B O   1 ? 
ATOM   1824 C  CB  . ALA B 2 188 ? -34.727 19.073 32.254  1.000 62.360  0 520 ALA B CB  1 ? 
ATOM   1825 N  N   . PRO B 2 189 ? -36.973 18.744 34.401  1.000 55.090  0 521 PRO B N   1 ? 
ATOM   1826 C  CA  . PRO B 2 189 ? -38.290 18.242 34.779  1.000 64.530  0 521 PRO B CA  1 ? 
ATOM   1827 C  C   . PRO B 2 189 ? -38.920 17.573 33.558  1.000 69.510  0 521 PRO B C   1 ? 
ATOM   1828 O  O   . PRO B 2 189 ? -38.996 18.190 32.491  1.000 63.980  0 521 PRO B O   1 ? 
ATOM   1829 C  CB  . PRO B 2 189 ? -39.087 19.488 35.191  1.000 60.880  0 521 PRO B CB  1 ? 
ATOM   1830 C  CG  . PRO B 2 189 ? -38.054 20.607 35.275  1.000 60.990  0 521 PRO B CG  1 ? 
ATOM   1831 C  CD  . PRO B 2 189 ? -36.953 20.209 34.316  1.000 60.250  0 521 PRO B CD  1 ? 
ATOM   1832 N  N   . ALA B 2 190 ? -39.289 16.294 33.734  1.000 74.720  0 522 ALA B N   1 ? 
ATOM   1833 C  CA  . ALA B 2 190 ? -40.026 15.500 32.755  1.000 74.880  0 522 ALA B CA  1 ? 
ATOM   1834 C  C   . ALA B 2 190 ? -41.476 15.966 32.674  1.000 62.420  0 522 ALA B C   1 ? 
ATOM   1835 O  O   . ALA B 2 190 ? -42.255 15.700 33.575  1.000 79.640  0 522 ALA B O   1 ? 
ATOM   1836 C  CB  . ALA B 2 190 ? -39.940 14.041 33.134  1.000 71.760  0 522 ALA B CB  1 ? 
ATOM   1837 N  N   . THR B 2 191 ? -41.823 16.646 31.578  1.000 71.540  0 523 THR B N   1 ? 
ATOM   1838 C  CA  . THR B 2 191 ? -43.117 17.286 31.405  1.000 68.740  0 523 THR B CA  1 ? 
ATOM   1839 C  C   . THR B 2 191 ? -44.063 16.459 30.526  1.000 69.340  0 523 THR B C   1 ? 
ATOM   1840 O  O   . THR B 2 191 ? -45.173 16.908 30.240  1.000 71.680  0 523 THR B O   1 ? 
ATOM   1841 C  CB  . THR B 2 191 ? -42.952 18.657 30.739  1.000 77.140  0 523 THR B CB  1 ? 
ATOM   1842 O  OG1 . THR B 2 191 ? -42.689 18.488 29.341  1.000 77.450  0 523 THR B OG1 1 ? 
ATOM   1843 C  CG2 . THR B 2 191 ? -41.861 19.482 31.384  1.000 83.920  0 523 THR B CG2 1 ? 
ATOM   1844 N  N   . VAL B 2 192 ? -43.608 15.299 30.028  1.000 65.960  0 524 VAL B N   1 ? 
ATOM   1845 C  CA  . VAL B 2 192 ? -44.442 14.474 29.166  1.000 65.980  0 524 VAL B CA  1 ? 
ATOM   1846 C  C   . VAL B 2 192 ? -44.603 13.112 29.813  1.000 65.050  0 524 VAL B C   1 ? 
ATOM   1847 O  O   . VAL B 2 192 ? -43.674 12.300 29.782  1.000 63.550  0 524 VAL B O   1 ? 
ATOM   1848 C  CB  . VAL B 2 192 ? -43.877 14.317 27.745  1.000 67.660  0 524 VAL B CB  1 ? 
ATOM   1849 C  CG1 . VAL B 2 192 ? -44.497 13.129 27.020  1.000 77.040  0 524 VAL B CG1 1 ? 
ATOM   1850 C  CG2 . VAL B 2 192 ? -44.075 15.580 26.941  1.000 61.670  0 524 VAL B CG2 1 ? 
ATOM   1851 N  N   . CYS B 2 193 ? -45.807 12.872 30.345  1.000 68.750  0 525 CYS B N   1 ? 
ATOM   1852 C  CA  . CYS B 2 193 ? -46.028 11.724 31.210  1.000 74.190  0 525 CYS B CA  1 ? 
ATOM   1853 C  C   . CYS B 2 193 ? -47.070 10.784 30.628  1.000 67.670  0 525 CYS B C   1 ? 
ATOM   1854 O  O   . CYS B 2 193 ? -48.132 11.229 30.204  1.000 57.570  0 525 CYS B O   1 ? 
ATOM   1855 C  CB  . CYS B 2 193 ? -46.457 12.185 32.592  1.000 78.790  0 525 CYS B CB  1 ? 
ATOM   1856 S  SG  . CYS B 2 193 ? -45.058 12.833 33.539  1.000 73.610  0 525 CYS B SG  1 ? 
ATOM   1857 N  N   . GLY B 2 194 ? -46.726 9.491  30.619  1.000 72.980  0 526 GLY B N   1 ? 
ATOM   1858 C  CA  . GLY B 2 194 ? -47.701 8.418  30.453  1.000 77.540  0 526 GLY B CA  1 ? 
ATOM   1859 C  C   . GLY B 2 194 ? -48.878 8.510  31.436  1.000 79.720  0 526 GLY B C   1 ? 
ATOM   1860 O  O   . GLY B 2 194 ? -48.728 8.983  32.568  1.000 68.290  0 526 GLY B O   1 ? 
ATOM   1861 N  N   . SER B 2 195 ? -50.046 7.994  31.011  1.000 77.250  0 527 SER B N   1 ? 
ATOM   1862 C  CA  . SER B 2 195 ? -51.314 8.287  31.674  1.000 74.580  0 527 SER B CA  1 ? 
ATOM   1863 C  C   . SER B 2 195 ? -51.475 7.519  32.985  1.000 71.080  0 527 SER B C   1 ? 
ATOM   1864 O  O   . SER B 2 195 ? -52.402 7.816  33.727  1.000 80.550  0 527 SER B O   1 ? 
ATOM   1865 C  CB  . SER B 2 195 ? -52.487 8.036  30.759  1.000 79.460  0 527 SER B CB  1 ? 
ATOM   1866 O  OG  . SER B 2 195 ? -52.445 6.710  30.249  1.000 75.110  0 527 SER B OG  1 ? 
ATOM   1867 N  N   . ASN B 2 196 ? -50.581 6.556  33.265  1.000 80.140  0 528 ASN B N   1 ? 
ATOM   1868 C  CA  . ASN B 2 196 ? -50.606 5.786  34.502  1.000 91.830  0 528 ASN B CA  1 ? 
ATOM   1869 C  C   . ASN B 2 196 ? -49.309 5.981  35.288  1.000 94.010  0 528 ASN B C   1 ? 
ATOM   1870 O  O   . ASN B 2 196 ? -48.831 5.035  35.917  1.000 99.120  0 528 ASN B O   1 ? 
ATOM   1871 C  CB  . ASN B 2 196 ? -50.832 4.293  34.232  1.000 100.270 0 528 ASN B CB  1 ? 
ATOM   1872 C  CG  . ASN B 2 196 ? -52.127 4.026  33.493  1.000 100.470 0 528 ASN B CG  1 ? 
ATOM   1873 O  OD1 . ASN B 2 196 ? -53.212 4.261  34.021  1.000 103.050 0 528 ASN B OD1 1 ? 
ATOM   1874 N  ND2 . ASN B 2 196 ? -52.029 3.547  32.265  1.000 108.910 0 528 ASN B ND2 1 ? 
ATOM   1875 N  N   . SER B 2 197 ? -48.761 7.208  35.264  1.000 89.500  0 529 SER B N   1 ? 
ATOM   1876 C  CA  . SER B 2 197 ? -47.599 7.562  36.070  1.000 88.580  0 529 SER B CA  1 ? 
ATOM   1877 C  C   . SER B 2 197 ? -48.049 8.310  37.327  1.000 96.530  0 529 SER B C   1 ? 
ATOM   1878 O  O   . SER B 2 197 ? -49.233 8.631  37.458  1.000 95.710  0 529 SER B O   1 ? 
ATOM   1879 C  CB  . SER B 2 197 ? -46.616 8.373  35.260  1.000 86.910  0 529 SER B CB  1 ? 
ATOM   1880 O  OG  . SER B 2 197 ? -47.106 9.682  35.005  1.000 76.600  0 529 SER B OG  1 ? 
ATOM   1881 N  N   . GLU B 2 198 ? -47.083 8.586  38.224  1.000 98.210  0 530 GLU B N   1 ? 
ATOM   1882 C  CA  . GLU B 2 198 ? -47.276 9.300  39.486  1.000 96.410  0 530 GLU B CA  1 ? 
ATOM   1883 C  C   . GLU B 2 198 ? -48.724 9.165  39.978  1.000 95.160  0 530 GLU B C   1 ? 
ATOM   1884 O  O   . GLU B 2 198 ? -49.052 8.098  40.536  1.000 99.240  0 530 GLU B O   1 ? 
ATOM   1885 C  CB  . GLU B 2 198 ? -46.854 10.773 39.368  1.000 98.300  0 530 GLU B CB  1 ? 
ATOM   1886 C  CG  . GLU B 2 198 ? -47.687 11.620 38.404  1.000 98.130  0 530 GLU B CG  1 ? 
ATOM   1887 C  CD  . GLU B 2 198 ? -49.077 12.052 38.861  1.000 104.570 0 530 GLU B CD  1 ? 
ATOM   1888 O  OE1 . GLU B 2 198 ? -49.916 12.352 37.990  1.000 94.350  0 530 GLU B OE1 1 ? 
ATOM   1889 O  OE2 . GLU B 2 198 ? -49.323 12.111 40.085  1.000 116.080 0 530 GLU B OE2 1 ? 
HETATM 1890 C  C1  . GOL C 3 .   ? -41.888 7.843  -10.541 1.000 76.890  0 601 GOL B C1  1 ? 
HETATM 1891 O  O1  . GOL C 3 .   ? -43.033 8.228  -11.298 1.000 67.420  0 601 GOL B O1  1 ? 
HETATM 1892 C  C2  . GOL C 3 .   ? -40.693 8.737  -10.810 1.000 80.700  0 601 GOL B C2  1 ? 
HETATM 1893 O  O2  . GOL C 3 .   ? -40.601 9.034  -12.200 1.000 67.370  0 601 GOL B O2  1 ? 
HETATM 1894 C  C3  . GOL C 3 .   ? -39.374 8.143  -10.366 1.000 70.470  0 601 GOL B C3  1 ? 
HETATM 1895 O  O3  . GOL C 3 .   ? -38.884 8.796  -9.205  1.000 77.680  0 601 GOL B O3  1 ? 
HETATM 1896 NA NA  . NA  D 4 .   ? -39.166 -3.350 2.641   1.000 65.310  0 602 NA  B NA  1 ? 
HETATM 1897 O  O   . HOH E 5 .   ? -35.752 4.766  -5.522  1.000 52.330  0 101 HOH A O   1 ? 
HETATM 1898 O  O   . HOH E 5 .   ? -31.843 15.900 -13.808 1.000 59.230  0 102 HOH A O   1 ? 
HETATM 1899 O  O   . HOH E 5 .   ? -35.503 10.516 -20.895 1.000 66.070  0 103 HOH A O   1 ? 
HETATM 1900 O  O   . HOH E 5 .   ? -37.060 1.916  -2.868  1.000 49.090  0 104 HOH A O   1 ? 
HETATM 1901 O  O   . HOH E 5 .   ? -32.788 -0.902 -4.292  1.000 69.850  0 105 HOH A O   1 ? 
HETATM 1902 O  O   . HOH E 5 .   ? -45.160 -0.199 -18.546 1.000 53.850  0 106 HOH A O   1 ? 
HETATM 1903 O  O   . HOH E 5 .   ? -36.876 -2.531 -6.202  1.000 77.210  0 107 HOH A O   1 ? 
HETATM 1904 O  O   . HOH E 5 .   ? -49.420 -2.978 -9.990  1.000 63.910  0 108 HOH A O   1 ? 
HETATM 1905 O  O   . HOH E 5 .   ? -29.110 10.631 -24.441 1.000 76.010  0 109 HOH A O   1 ? 
HETATM 1906 O  O   . HOH E 5 .   ? -49.174 8.885  -17.640 1.000 72.930  0 110 HOH A O   1 ? 
HETATM 1907 O  O   . HOH E 5 .   ? -45.431 14.688 -13.982 1.000 76.430  0 111 HOH A O   1 ? 
HETATM 1908 O  O   . HOH F 5 .   ? -20.106 19.866 -10.130 1.000 52.940  0 701 HOH B O   1 ? 
HETATM 1909 O  O   . HOH F 5 .   ? -17.557 12.841 -9.594  1.000 79.590  0 702 HOH B O   1 ? 
HETATM 1910 O  O   . HOH F 5 .   ? -28.054 7.640  -6.038  1.000 61.780  0 703 HOH B O   1 ? 
HETATM 1911 O  O   . HOH F 5 .   ? -41.093 -2.044 3.646   1.000 57.520  0 704 HOH B O   1 ? 
HETATM 1912 O  O   . HOH F 5 .   ? -24.443 14.517 5.920   1.000 62.930  0 705 HOH B O   1 ? 
HETATM 1913 O  O   . HOH F 5 .   ? -48.019 14.406 10.974  1.000 58.760  0 706 HOH B O   1 ? 
HETATM 1914 O  O   . HOH F 5 .   ? -25.582 5.546  15.192  1.000 75.700  0 707 HOH B O   1 ? 
HETATM 1915 O  O   . HOH F 5 .   ? -38.677 0.016  12.652  1.000 55.210  0 708 HOH B O   1 ? 
HETATM 1916 O  O   . HOH F 5 .   ? -44.312 15.267 12.586  1.000 53.470  0 709 HOH B O   1 ? 
HETATM 1917 O  O   . HOH F 5 .   ? -35.066 -2.622 4.527   1.000 61.410  0 710 HOH B O   1 ? 
HETATM 1918 O  O   . HOH F 5 .   ? -45.671 15.267 8.234   1.000 58.240  0 711 HOH B O   1 ? 
HETATM 1919 O  O   . HOH F 5 .   ? -20.278 15.065 -13.877 1.000 59.790  0 712 HOH B O   1 ? 
HETATM 1920 O  O   . HOH F 5 .   ? -33.360 14.745 4.571   1.000 50.720  0 713 HOH B O   1 ? 
HETATM 1921 O  O   . HOH F 5 .   ? -31.202 3.448  9.763   1.000 66.900  0 714 HOH B O   1 ? 
HETATM 1922 O  O   . HOH F 5 .   ? -32.745 11.961 9.442   1.000 56.910  0 715 HOH B O   1 ? 
HETATM 1923 O  O   . HOH F 5 .   ? -53.193 9.869  8.447   1.000 58.430  0 716 HOH B O   1 ? 
HETATM 1924 O  O   . HOH F 5 .   ? -24.851 5.408  -0.117  1.000 72.520  0 717 HOH B O   1 ? 
HETATM 1925 O  O   . HOH F 5 .   ? -28.248 15.723 -3.027  1.000 58.930  0 718 HOH B O   1 ? 
HETATM 1926 O  O   . HOH F 5 .   ? -36.467 -0.904 1.138   1.000 51.920  0 719 HOH B O   1 ? 
HETATM 1927 O  O   . HOH F 5 .   ? -36.251 7.191  21.635  1.000 65.540  0 720 HOH B O   1 ? 
HETATM 1928 O  O   . HOH F 5 .   ? -32.611 14.398 1.746   1.000 49.190  0 721 HOH B O   1 ? 
HETATM 1929 O  O   . HOH F 5 .   ? -47.742 8.489  -11.776 1.000 54.600  0 722 HOH B O   1 ? 
HETATM 1930 O  O   . HOH F 5 .   ? -60.056 11.440 11.418  1.000 87.220  0 723 HOH B O   1 ? 
HETATM 1931 O  O   . HOH F 5 .   ? -54.075 -0.717 -0.195  1.000 60.790  0 724 HOH B O   1 ? 
HETATM 1932 O  O   . HOH F 5 .   ? -42.258 11.842 0.481   1.000 47.540  0 725 HOH B O   1 ? 
HETATM 1933 O  O   . HOH F 5 .   ? -12.427 17.654 -13.774 1.000 65.440  0 726 HOH B O   1 ? 
HETATM 1934 O  O   . HOH F 5 .   ? -27.418 7.298  6.388   1.000 61.870  0 727 HOH B O   1 ? 
HETATM 1935 O  O   . HOH F 5 .   ? -38.306 5.586  -4.314  1.000 51.560  0 728 HOH B O   1 ? 
HETATM 1936 O  O   . HOH F 5 .   ? -52.907 -4.002 10.635  1.000 71.620  0 729 HOH B O   1 ? 
HETATM 1937 O  O   . HOH F 5 .   ? -33.546 5.187  8.763   1.000 49.320  0 730 HOH B O   1 ? 
HETATM 1938 O  O   . HOH F 5 .   ? -52.168 0.165  7.080   1.000 54.950  0 731 HOH B O   1 ? 
HETATM 1939 O  O   . HOH F 5 .   ? -32.611 11.230 25.969  1.000 68.650  0 732 HOH B O   1 ? 
HETATM 1940 O  O   . HOH F 5 .   ? -50.294 -5.153 -4.294  1.000 60.180  0 733 HOH B O   1 ? 
HETATM 1941 O  O   . HOH F 5 .   ? -43.958 20.971 13.610  1.000 80.590  0 734 HOH B O   1 ? 
HETATM 1942 O  O   . HOH F 5 .   ? -32.907 1.162  -1.321  1.000 55.540  0 735 HOH B O   1 ? 
HETATM 1943 O  O   . HOH F 5 .   ? -37.344 -2.992 -1.450  1.000 61.240  0 736 HOH B O   1 ? 
HETATM 1944 O  O   . HOH F 5 .   ? -29.805 18.356 9.880   1.000 64.890  0 737 HOH B O   1 ? 
HETATM 1945 O  O   . HOH F 5 .   ? -38.544 -5.465 4.186   1.000 64.770  0 738 HOH B O   1 ? 
HETATM 1946 O  O   . HOH F 5 .   ? -25.680 9.266  -5.131  1.000 63.980  0 739 HOH B O   1 ? 
HETATM 1947 O  O   . HOH F 5 .   ? -53.917 -2.740 -3.462  1.000 67.080  0 740 HOH B O   1 ? 
HETATM 1948 O  O   . HOH F 5 .   ? -46.941 18.840 3.846   1.000 69.670  0 741 HOH B O   1 ? 
HETATM 1949 O  O   . HOH F 5 .   ? -49.244 16.174 -8.371  1.000 65.270  0 742 HOH B O   1 ? 
HETATM 1950 O  O   . HOH F 5 .   ? -21.400 15.342 -6.477  1.000 66.010  0 743 HOH B O   1 ? 
HETATM 1951 O  O   . HOH F 5 .   ? -26.291 1.837  10.149  1.000 76.880  0 744 HOH B O   1 ? 
HETATM 1952 O  O   . HOH F 5 .   ? -24.951 4.021  11.429  1.000 79.130  0 745 HOH B O   1 ? 
HETATM 1953 O  O   . HOH F 5 .   ? -26.943 23.634 -8.403  1.000 68.740  0 746 HOH B O   1 ? 
HETATM 1954 O  O   . HOH F 5 .   ? -45.101 -1.727 4.342   1.000 68.310  0 747 HOH B O   1 ? 
HETATM 1955 O  O   . HOH F 5 .   ? -35.442 18.850 17.607  1.000 65.250  0 748 HOH B O   1 ? 
HETATM 1956 O  O   . HOH F 5 .   ? -26.626 16.729 -1.159  1.000 68.040  0 749 HOH B O   1 ? 
HETATM 1957 O  O   . HOH F 5 .   ? -37.238 -3.886 1.144   1.000 63.430  0 750 HOH B O   1 ? 
HETATM 1958 O  O   . HOH F 5 .   ? -45.727 -3.534 -5.236  1.000 68.430  0 751 HOH B O   1 ? 
HETATM 1959 O  O   . HOH F 5 .   ? -40.363 -0.814 9.767   1.000 71.320  0 752 HOH B O   1 ? 
HETATM 1960 O  O   . HOH F 5 .   ? -47.192 19.556 22.851  1.000 71.130  0 753 HOH B O   1 ? 
HETATM 1961 O  O   . HOH F 5 .   ? -30.170 -2.968 5.243   1.000 66.170  0 754 HOH B O   1 ? 
HETATM 1962 O  O   . HOH F 5 .   ? -16.670 12.928 -17.281 1.000 80.590  0 755 HOH B O   1 ? 
HETATM 1963 O  O   . HOH F 5 .   ? -54.520 4.877  -11.234 1.000 74.640  0 756 HOH B O   1 ? 
HETATM 1964 O  O   . HOH F 5 .   ? -33.613 17.685 19.202  1.000 87.790  0 757 HOH B O   1 ? 
HETATM 1965 O  O   . HOH F 5 .   ? -34.916 -3.685 11.199  1.000 64.530  0 758 HOH B O   1 ? 
HETATM 1966 O  O   . HOH F 5 .   ? -41.072 -4.564 1.346   1.000 63.360  0 759 HOH B O   1 ? 
HETATM 1967 O  O   . HOH F 5 .   ? -46.668 19.195 6.228   1.000 70.670  0 760 HOH B O   1 ? 
HETATM 1968 O  O   . HOH F 5 .   ? -34.387 -2.386 1.922   1.000 75.940  0 761 HOH B O   1 ? 
HETATM 1969 O  O   . HOH F 5 .   ? -37.837 19.993 17.685  1.000 62.320  0 762 HOH B O   1 ? 
# 
