data_8YDU
# 
_entry.id   8YDU 
# 
_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   8YDU         pdb_00008ydu 10.2210/pdb8ydu/pdb 
WWPDB D_1300045366 ?            ?                   
# 
_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                        8YDU 
_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'                       26304.348 1   ? ? ? ? 
3 non-polymer syn GLYCEROL                                 92.094    1   ? ? ? ? 
4 water       nat water                                    18.015    154 ? ? ? ? 
# 
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 
;TNLCPFDEVFNATRFASVYAWNRKRISNCVADYSVLYNFAPFSAFKCYGVSPTKLNDLCFTNVYADSFVIRGNEVSQIAP
GQTGNIADYNYKLPDDFTGCVIAWNSNKLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGNKPCNGVAGFNCYFPL
RSYGFRPTYGVGHQPYRVVVLSFELLHAPATVCGSNSENLYFQGSHHHHHHHHHHGLNDIFEAQKIEWHE
;
;TNLCPFDEVFNATRFASVYAWNRKRISNCVADYSVLYNFAPFSAFKCYGVSPTKLNDLCFTNVYADSFVIRGNEVSQIAP
GQTGNIADYNYKLPDDFTGCVIAWNSNKLDSKVGGNYNYLYRLFRKSNLKPFERDISTEIYQAGNKPCNGVAGFNCYFPL
RSYGFRPTYGVGHQPYRVVVLSFELLHAPATVCGSNSENLYFQGSHHHHHHHHHHGLNDIFEAQKIEWHE
;
B ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 GLYCEROL GOL 
4 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   ASP 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  ARG 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  LEU 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 VAL n 
2 114 GLY 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 ASN 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 PHE n 
2 155 ASN n 
2 156 CYS n 
2 157 TYR n 
2 158 PHE 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            ? 
_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 
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   ASP 7   339 339 ASP ASP 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  ARG 14  346 346 ARG ARG 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  LEU 36  368 368 LEU LEU 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 ?   ?   ?   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 VAL 113 445 445 VAL VAL B . n 
B 2 114 GLY 114 446 446 GLY GLY 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 ASN 128 460 460 ASN ASN 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 PHE 154 486 486 PHE PHE 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 PHE 158 490 490 PHE PHE 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   601 101 GOL GOL B . 
D 4 HOH 1   101 203 HOH HOH A . 
D 4 HOH 2   102 8   HOH HOH A . 
D 4 HOH 3   103 81  HOH HOH A . 
D 4 HOH 4   104 65  HOH HOH A . 
D 4 HOH 5   105 6   HOH HOH A . 
D 4 HOH 6   106 3   HOH HOH A . 
D 4 HOH 7   107 36  HOH HOH A . 
D 4 HOH 8   108 108 HOH HOH A . 
D 4 HOH 9   109 16  HOH HOH A . 
D 4 HOH 10  110 28  HOH HOH A . 
D 4 HOH 11  111 34  HOH HOH A . 
D 4 HOH 12  112 185 HOH HOH A . 
D 4 HOH 13  113 123 HOH HOH A . 
D 4 HOH 14  114 52  HOH HOH A . 
D 4 HOH 15  115 41  HOH HOH A . 
D 4 HOH 16  116 120 HOH HOH A . 
D 4 HOH 17  117 124 HOH HOH A . 
D 4 HOH 18  118 152 HOH HOH A . 
D 4 HOH 19  119 205 HOH HOH A . 
D 4 HOH 20  120 125 HOH HOH A . 
D 4 HOH 21  121 195 HOH HOH A . 
D 4 HOH 22  122 122 HOH HOH A . 
D 4 HOH 23  123 79  HOH HOH A . 
D 4 HOH 24  124 68  HOH HOH A . 
E 4 HOH 1   701 133 HOH HOH B . 
E 4 HOH 2   702 70  HOH HOH B . 
E 4 HOH 3   703 4   HOH HOH B . 
E 4 HOH 4   704 56  HOH HOH B . 
E 4 HOH 5   705 186 HOH HOH B . 
E 4 HOH 6   706 96  HOH HOH B . 
E 4 HOH 7   707 93  HOH HOH B . 
E 4 HOH 8   708 39  HOH HOH B . 
E 4 HOH 9   709 10  HOH HOH B . 
E 4 HOH 10  710 66  HOH HOH B . 
E 4 HOH 11  711 5   HOH HOH B . 
E 4 HOH 12  712 15  HOH HOH B . 
E 4 HOH 13  713 71  HOH HOH B . 
E 4 HOH 14  714 21  HOH HOH B . 
E 4 HOH 15  715 154 HOH HOH B . 
E 4 HOH 16  716 26  HOH HOH B . 
E 4 HOH 17  717 24  HOH HOH B . 
E 4 HOH 18  718 23  HOH HOH B . 
E 4 HOH 19  719 136 HOH HOH B . 
E 4 HOH 20  720 42  HOH HOH B . 
E 4 HOH 21  721 60  HOH HOH B . 
E 4 HOH 22  722 61  HOH HOH B . 
E 4 HOH 23  723 25  HOH HOH B . 
E 4 HOH 24  724 45  HOH HOH B . 
E 4 HOH 25  725 20  HOH HOH B . 
E 4 HOH 26  726 83  HOH HOH B . 
E 4 HOH 27  727 199 HOH HOH B . 
E 4 HOH 28  728 43  HOH HOH B . 
E 4 HOH 29  729 48  HOH HOH B . 
E 4 HOH 30  730 2   HOH HOH B . 
E 4 HOH 31  731 11  HOH HOH B . 
E 4 HOH 32  732 160 HOH HOH B . 
E 4 HOH 33  733 57  HOH HOH B . 
E 4 HOH 34  734 146 HOH HOH B . 
E 4 HOH 35  735 17  HOH HOH B . 
E 4 HOH 36  736 9   HOH HOH B . 
E 4 HOH 37  737 1   HOH HOH B . 
E 4 HOH 38  738 18  HOH HOH B . 
E 4 HOH 39  739 40  HOH HOH B . 
E 4 HOH 40  740 182 HOH HOH B . 
E 4 HOH 41  741 99  HOH HOH B . 
E 4 HOH 42  742 50  HOH HOH B . 
E 4 HOH 43  743 32  HOH HOH B . 
E 4 HOH 44  744 14  HOH HOH B . 
E 4 HOH 45  745 35  HOH HOH B . 
E 4 HOH 46  746 27  HOH HOH B . 
E 4 HOH 47  747 13  HOH HOH B . 
E 4 HOH 48  748 7   HOH HOH B . 
E 4 HOH 49  749 77  HOH HOH B . 
E 4 HOH 50  750 30  HOH HOH B . 
E 4 HOH 51  751 112 HOH HOH B . 
E 4 HOH 52  752 97  HOH HOH B . 
E 4 HOH 53  753 115 HOH HOH B . 
E 4 HOH 54  754 75  HOH HOH B . 
E 4 HOH 55  755 78  HOH HOH B . 
E 4 HOH 56  756 139 HOH HOH B . 
E 4 HOH 57  757 140 HOH HOH B . 
E 4 HOH 58  758 62  HOH HOH B . 
E 4 HOH 59  759 204 HOH HOH B . 
E 4 HOH 60  760 31  HOH HOH B . 
E 4 HOH 61  761 169 HOH HOH B . 
E 4 HOH 62  762 85  HOH HOH B . 
E 4 HOH 63  763 88  HOH HOH B . 
E 4 HOH 64  764 22  HOH HOH B . 
E 4 HOH 65  765 12  HOH HOH B . 
E 4 HOH 66  766 69  HOH HOH B . 
E 4 HOH 67  767 130 HOH HOH B . 
E 4 HOH 68  768 19  HOH HOH B . 
E 4 HOH 69  769 47  HOH HOH B . 
E 4 HOH 70  770 67  HOH HOH B . 
E 4 HOH 71  771 114 HOH HOH B . 
E 4 HOH 72  772 116 HOH HOH B . 
E 4 HOH 73  773 177 HOH HOH B . 
E 4 HOH 74  774 207 HOH HOH B . 
E 4 HOH 75  775 54  HOH HOH B . 
E 4 HOH 76  776 55  HOH HOH B . 
E 4 HOH 77  777 49  HOH HOH B . 
E 4 HOH 78  778 64  HOH HOH B . 
E 4 HOH 79  779 137 HOH HOH B . 
E 4 HOH 80  780 103 HOH HOH B . 
E 4 HOH 81  781 87  HOH HOH B . 
E 4 HOH 82  782 171 HOH HOH B . 
E 4 HOH 83  783 98  HOH HOH B . 
E 4 HOH 84  784 37  HOH HOH B . 
E 4 HOH 85  785 29  HOH HOH B . 
E 4 HOH 86  786 95  HOH HOH B . 
E 4 HOH 87  787 63  HOH HOH B . 
E 4 HOH 88  788 181 HOH HOH B . 
E 4 HOH 89  789 198 HOH HOH B . 
E 4 HOH 90  790 135 HOH HOH B . 
E 4 HOH 91  791 196 HOH HOH B . 
E 4 HOH 92  792 58  HOH HOH B . 
E 4 HOH 93  793 91  HOH HOH B . 
E 4 HOH 94  794 163 HOH HOH B . 
E 4 HOH 95  795 101 HOH HOH B . 
E 4 HOH 96  796 53  HOH HOH B . 
E 4 HOH 97  797 158 HOH HOH B . 
E 4 HOH 98  798 74  HOH HOH B . 
E 4 HOH 99  799 168 HOH HOH B . 
E 4 HOH 100 800 46  HOH HOH B . 
E 4 HOH 101 801 82  HOH HOH B . 
E 4 HOH 102 802 51  HOH HOH B . 
E 4 HOH 103 803 38  HOH HOH B . 
E 4 HOH 104 804 173 HOH HOH B . 
E 4 HOH 105 805 110 HOH HOH B . 
E 4 HOH 106 806 209 HOH HOH B . 
E 4 HOH 107 807 104 HOH HOH B . 
E 4 HOH 108 808 170 HOH HOH B . 
E 4 HOH 109 809 76  HOH HOH B . 
E 4 HOH 110 810 165 HOH HOH B . 
E 4 HOH 111 811 143 HOH HOH B . 
E 4 HOH 112 812 113 HOH HOH B . 
E 4 HOH 113 813 117 HOH HOH B . 
E 4 HOH 114 814 141 HOH HOH B . 
E 4 HOH 115 815 92  HOH HOH B . 
E 4 HOH 116 816 164 HOH HOH B . 
E 4 HOH 117 817 80  HOH HOH B . 
E 4 HOH 118 818 118 HOH HOH B . 
E 4 HOH 119 819 176 HOH HOH B . 
E 4 HOH 120 820 206 HOH HOH B . 
E 4 HOH 121 821 44  HOH HOH B . 
E 4 HOH 122 822 200 HOH HOH B . 
E 4 HOH 123 823 73  HOH HOH B . 
E 4 HOH 124 824 72  HOH HOH B . 
E 4 HOH 125 825 33  HOH HOH B . 
E 4 HOH 126 826 180 HOH HOH B . 
E 4 HOH 127 827 179 HOH HOH B . 
E 4 HOH 128 828 208 HOH HOH B . 
E 4 HOH 129 829 84  HOH HOH B . 
E 4 HOH 130 830 197 HOH HOH B . 
# 
loop_
_pdbx_unobs_or_zero_occ_atoms.id 
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 
_pdbx_unobs_or_zero_occ_atoms.polymer_flag 
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id 
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id 
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id 
_pdbx_unobs_or_zero_occ_atoms.label_alt_id 
_pdbx_unobs_or_zero_occ_atoms.label_asym_id 
_pdbx_unobs_or_zero_occ_atoms.label_comp_id 
_pdbx_unobs_or_zero_occ_atoms.label_seq_id 
_pdbx_unobs_or_zero_occ_atoms.label_atom_id 
1  1 Y 1 A ASP 39  ? CG  ? A ASP 39  CG  
2  1 Y 1 A ASP 39  ? OD1 ? A ASP 39  OD1 
3  1 Y 1 A ASP 39  ? OD2 ? A ASP 39  OD2 
4  1 Y 1 B TYR 369 ? CG  ? B TYR 37  CG  
5  1 Y 1 B TYR 369 ? CD1 ? B TYR 37  CD1 
6  1 Y 1 B TYR 369 ? CD2 ? B TYR 37  CD2 
7  1 Y 1 B TYR 369 ? CE1 ? B TYR 37  CE1 
8  1 Y 1 B TYR 369 ? CE2 ? B TYR 37  CE2 
9  1 Y 1 B TYR 369 ? CZ  ? B TYR 37  CZ  
10 1 Y 1 B TYR 369 ? OH  ? B TYR 37  OH  
11 1 Y 1 B ASN 370 ? CG  ? B ASN 38  CG  
12 1 Y 1 B ASN 370 ? OD1 ? B ASN 38  OD1 
13 1 Y 1 B ASN 370 ? ND2 ? B ASN 38  ND2 
14 1 Y 1 B ASN 528 ? CG  ? B ASN 196 CG  
15 1 Y 1 B ASN 528 ? OD1 ? B ASN 196 OD1 
16 1 Y 1 B ASN 528 ? ND2 ? B ASN 196 ND2 
17 1 Y 1 B SER 529 ? OG  ? B SER 197 OG  
18 1 Y 1 B GLU 530 ? CG  ? B GLU 198 CG  
19 1 Y 1 B GLU 530 ? CD  ? B GLU 198 CD  
20 1 Y 1 B GLU 530 ? OE1 ? B GLU 198 OE1 
21 1 Y 1 B GLU 530 ? OE2 ? B GLU 198 OE2 
# 
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       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.20.1_4487 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                     8YDU 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     74.260 
_cell.length_a_esd                 ? 
_cell.length_b                     74.260 
_cell.length_b_esd                 ? 
_cell.length_c                     99.760 
_cell.length_c_esd                 ? 
_cell.volume                       476427.654 
_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                         8YDU 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                152 
_symmetry.space_group_name_Hall            
;P 31 2"
;
_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                   8YDU 
_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             2.56 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          51.94 
_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 BIS-Tris (pH 5.5), 0.1 M ammonium acetate, 17% PEG 1000' 
_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         2022-06-22 
_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                          32.05 
_reflns.entry_id                                       8YDU 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.63 
_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                                     40065 
_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                           99.3 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                8.3 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          10.44 
_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                                    1.63 
_reflns_shell.d_res_low                                     1.73 
_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                             6419 
_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                                  0.561 
_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]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               43.45 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_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                                 8YDU 
_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                            1.70 
_refine.ls_d_res_low                             39.41 
_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                     35358 
_refine.ls_number_reflns_R_free                  1772 
_refine.ls_number_reflns_R_work                  33586 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.30 
_refine.ls_percent_reflns_R_free                 5.01 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2218 
_refine.ls_R_factor_R_free                       0.2523 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2201 
_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                    'FLAT BULK SOLVENT MODEL' 
_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                          1.34 
_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       'GeoStd + Monomer Library + CDL v1.2' 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.1000 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.9000 
_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                 36.7436 
_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                            0.2395 
_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.details                          ? 
_refine_hist.d_res_high                       1.70 
_refine_hist.d_res_low                        39.41 
_refine_hist.number_atoms_solvent             154 
_refine_hist.number_atoms_total               2025 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        1865 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         6 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
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' ? 0.0058  ? 1918 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 0.7096  ? 2599 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0490  ? 274  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0063  ? 337  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 12.5606 ? 686  ? f_dihedral_angle_d ? ? 
# 
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' 1.70 1.75  . . 131 2531 98.08  . . . . 0.4088 . . . . . . . . . . . 0.4349 
'X-RAY DIFFRACTION' 1.75 1.80  . . 134 2514 98.62  . . . . 0.3700 . . . . . . . . . . . 0.4351 
'X-RAY DIFFRACTION' 1.80 1.86  . . 137 2575 98.91  . . . . 0.3246 . . . . . . . . . . . 0.3528 
'X-RAY DIFFRACTION' 1.86 1.92  . . 128 2512 98.91  . . . . 0.3085 . . . . . . . . . . . 0.3231 
'X-RAY DIFFRACTION' 1.92 2.00  . . 134 2552 98.90  . . . . 0.2903 . . . . . . . . . . . 0.3562 
'X-RAY DIFFRACTION' 2.00 2.09  . . 135 2564 99.41  . . . . 0.2666 . . . . . . . . . . . 0.3336 
'X-RAY DIFFRACTION' 2.09 2.20  . . 135 2548 99.26  . . . . 0.2698 . . . . . . . . . . . 0.3183 
'X-RAY DIFFRACTION' 2.20 2.34  . . 137 2584 99.45  . . . . 0.2528 . . . . . . . . . . . 0.3035 
'X-RAY DIFFRACTION' 2.34 2.52  . . 135 2568 99.70  . . . . 0.2432 . . . . . . . . . . . 0.2832 
'X-RAY DIFFRACTION' 2.52 2.77  . . 136 2612 99.85  . . . . 0.2412 . . . . . . . . . . . 0.3125 
'X-RAY DIFFRACTION' 2.77 3.17  . . 137 2617 99.93  . . . . 0.2187 . . . . . . . . . . . 0.2515 
'X-RAY DIFFRACTION' 3.17 4.00  . . 144 2645 100.00 . . . . 0.1969 . . . . . . . . . . . 0.2279 
'X-RAY DIFFRACTION' 4.00 39.41 . . 149 2764 99.83  . . . . 0.1734 . . . . . . . . . . . 0.1830 
# 
_struct.entry_id                     8YDU 
_struct.title                        
'Crystal structure of the receptor binding domain of SARS-CoV-2 Omicron BA.2 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        8YDU 
_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 4 ? 
# 
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 8YDU        8YDU   ? 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 8YDU A 1 ? 39  ? 8YDU   1   ? 39  ? 1   39  
2 2 8YDU 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 8YDU ASP B 7   ? UNP P0DTC2 GLY 339 variant          339 1  
2 8YDU PHE B 39  ? UNP P0DTC2 SER 371 variant          371 2  
2 8YDU PRO B 41  ? UNP P0DTC2 SER 373 variant          373 3  
2 8YDU ALA B 44  ? UNP P0DTC2 THR 376 variant          376 4  
2 8YDU ASN B 73  ? UNP P0DTC2 ASP 405 variant          405 5  
2 8YDU SER B 76  ? UNP P0DTC2 ARG 408 variant          408 6  
2 8YDU ASN B 85  ? UNP P0DTC2 LYS 417 variant          417 7  
2 8YDU LYS B 108 ? UNP P0DTC2 ASN 440 variant          440 8  
2 8YDU ASN B 145 ? UNP P0DTC2 SER 477 variant          477 9  
2 8YDU LYS B 146 ? UNP P0DTC2 THR 478 variant          478 10 
2 8YDU ALA B 152 ? UNP P0DTC2 GLU 484 variant          484 11 
2 8YDU ARG B 161 ? UNP P0DTC2 GLN 493 variant          493 12 
2 8YDU ARG B 166 ? UNP P0DTC2 GLN 498 variant          498 13 
2 8YDU TYR B 169 ? UNP P0DTC2 ASN 501 variant          501 14 
2 8YDU HIS B 173 ? UNP P0DTC2 TYR 505 variant          505 15 
2 8YDU SER B 195 ? UNP P0DTC2 ?   ?   'expression tag' 527 16 
2 8YDU ASN B 196 ? UNP P0DTC2 ?   ?   'expression tag' 528 17 
2 8YDU SER B 197 ? UNP P0DTC2 ?   ?   'expression tag' 529 18 
2 8YDU GLU B 198 ? UNP P0DTC2 ?   ?   'expression tag' 530 19 
2 8YDU ASN B 199 ? UNP P0DTC2 ?   ?   'expression tag' 531 20 
2 8YDU LEU B 200 ? UNP P0DTC2 ?   ?   'expression tag' 532 21 
2 8YDU TYR B 201 ? UNP P0DTC2 ?   ?   'expression tag' 533 22 
2 8YDU PHE B 202 ? UNP P0DTC2 ?   ?   'expression tag' 534 23 
2 8YDU GLN B 203 ? UNP P0DTC2 ?   ?   'expression tag' 535 24 
2 8YDU GLY B 204 ? UNP P0DTC2 ?   ?   'expression tag' 536 25 
2 8YDU SER B 205 ? UNP P0DTC2 ?   ?   'expression tag' 537 26 
2 8YDU HIS B 206 ? UNP P0DTC2 ?   ?   'expression tag' 538 27 
2 8YDU HIS B 207 ? UNP P0DTC2 ?   ?   'expression tag' 539 28 
2 8YDU HIS B 208 ? UNP P0DTC2 ?   ?   'expression tag' 540 29 
2 8YDU HIS B 209 ? UNP P0DTC2 ?   ?   'expression tag' 541 30 
2 8YDU HIS B 210 ? UNP P0DTC2 ?   ?   'expression tag' 542 31 
2 8YDU HIS B 211 ? UNP P0DTC2 ?   ?   'expression tag' 543 32 
2 8YDU HIS B 212 ? UNP P0DTC2 ?   ?   'expression tag' 544 33 
2 8YDU HIS B 213 ? UNP P0DTC2 ?   ?   'expression tag' 545 34 
2 8YDU HIS B 214 ? UNP P0DTC2 ?   ?   'expression tag' 546 35 
2 8YDU HIS B 215 ? UNP P0DTC2 ?   ?   'expression tag' 547 36 
2 8YDU GLY B 216 ? UNP P0DTC2 ?   ?   'expression tag' 548 37 
2 8YDU LEU B 217 ? UNP P0DTC2 ?   ?   'expression tag' 549 38 
2 8YDU ASN B 218 ? UNP P0DTC2 ?   ?   'expression tag' 550 39 
2 8YDU ASP B 219 ? UNP P0DTC2 ?   ?   'expression tag' 551 40 
2 8YDU ILE B 220 ? UNP P0DTC2 ?   ?   'expression tag' 552 41 
2 8YDU PHE B 221 ? UNP P0DTC2 ?   ?   'expression tag' 553 42 
2 8YDU GLU B 222 ? UNP P0DTC2 ?   ?   'expression tag' 554 43 
2 8YDU ALA B 223 ? UNP P0DTC2 ?   ?   'expression tag' 555 44 
2 8YDU GLN B 224 ? UNP P0DTC2 ?   ?   'expression tag' 556 45 
2 8YDU LYS B 225 ? UNP P0DTC2 ?   ?   'expression tag' 557 46 
2 8YDU ILE B 226 ? UNP P0DTC2 ?   ?   'expression tag' 558 47 
2 8YDU GLU B 227 ? UNP P0DTC2 ?   ?   'expression tag' 559 48 
2 8YDU TRP B 228 ? UNP P0DTC2 ?   ?   'expression tag' 560 49 
2 8YDU HIS B 229 ? UNP P0DTC2 ?   ?   'expression tag' 561 50 
2 8YDU GLU B 230 ? UNP P0DTC2 ?   ?   'expression tag' 562 51 
# 
_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)' 2260  ? 
1 MORE         -6    ? 
1 'SSA (A^2)'  11930 ? 
# 
_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 
# 
_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  ? LYS A 37  ? HIS A 21  LYS A 37  1 ? 17 
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 17  ? TRP B 21  ? SER B 349 TRP B 353 5 ? 5  
HELX_P HELX_P5  AA5 ASP B 32  ? ASN B 38  ? ASP B 364 ASN B 370 1 ? 7  
HELX_P HELX_P6  AA6 SER B 51  ? ASN B 56  ? SER B 383 ASN B 388 1 ? 6  
HELX_P HELX_P7  AA7 ASN B 73  ? ILE B 78  ? ASN B 405 ILE B 410 5 ? 6  
HELX_P HELX_P8  AA8 GLY B 84  ? ASN B 90  ? GLY B 416 ASN B 422 1 ? 7  
HELX_P HELX_P9  AA9 SER B 106 ? SER B 111 ? SER B 438 SER B 443 1 ? 6  
HELX_P HELX_P10 AB1 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 ? ? ? ? ? ? ? 2.036 ? ? 
disulf2 disulf ? ? B CYS 47  SG ? ? ? 1_555 B CYS 100 SG ? ? B CYS 379 B CYS 432 1_555 ? ? ? ? ? ? ? 2.058 ? ? 
disulf3 disulf ? ? B CYS 59  SG ? ? ? 1_555 B CYS 193 SG ? ? B CYS 391 B CYS 525 1_555 ? ? ? ? ? ? ? 2.046 ? ? 
disulf4 disulf ? ? B CYS 148 SG ? ? ? 1_555 B CYS 156 SG ? ? B CYS 480 B CYS 488 1_555 ? ? ? ? ? ? ? 2.056 ? ? 
# 
_struct_conn_type.id          disulf 
_struct_conn_type.criteria    ? 
_struct_conn_type.reference   ? 
# 
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 GLY B 99  ? ASN B 105 ? GLY B 431 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 ASP B 66  ? N ASP B 398 O VAL B 180 ? O VAL B 512 
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                   8YDU 
_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  ? ? -109.04 63.51  
2 1 PHE B 377 ? ? -163.51 96.80  
3 1 ASN B 422 ? ? -129.42 -57.27 
# 
_pdbx_struct_special_symmetry.id              1 
_pdbx_struct_special_symmetry.PDB_model_num   1 
_pdbx_struct_special_symmetry.auth_asym_id    A 
_pdbx_struct_special_symmetry.auth_comp_id    HOH 
_pdbx_struct_special_symmetry.auth_seq_id     119 
_pdbx_struct_special_symmetry.PDB_ins_code    ? 
_pdbx_struct_special_symmetry.label_asym_id   D 
_pdbx_struct_special_symmetry.label_comp_id   HOH 
_pdbx_struct_special_symmetry.label_seq_id    . 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z          
2 -y,x-y,z+1/3   
3 -x+y,-x,z+2/3  
4 x-y,-y,-z+2/3  
5 -x,-x+y,-z+1/3 
6 y,x,-z         
# 
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 PHE 371 ? B PHE 39  
3  1 Y 1 B ASN 531 ? B ASN 199 
4  1 Y 1 B LEU 532 ? B LEU 200 
5  1 Y 1 B TYR 533 ? B TYR 201 
6  1 Y 1 B PHE 534 ? B PHE 202 
7  1 Y 1 B GLN 535 ? B GLN 203 
8  1 Y 1 B GLY 536 ? B GLY 204 
9  1 Y 1 B SER 537 ? B SER 205 
10 1 Y 1 B HIS 538 ? B HIS 206 
11 1 Y 1 B HIS 539 ? B HIS 207 
12 1 Y 1 B HIS 540 ? B HIS 208 
13 1 Y 1 B HIS 541 ? B HIS 209 
14 1 Y 1 B HIS 542 ? B HIS 210 
15 1 Y 1 B HIS 543 ? B HIS 211 
16 1 Y 1 B HIS 544 ? B HIS 212 
17 1 Y 1 B HIS 545 ? B HIS 213 
18 1 Y 1 B HIS 546 ? B HIS 214 
19 1 Y 1 B HIS 547 ? B HIS 215 
20 1 Y 1 B GLY 548 ? B GLY 216 
21 1 Y 1 B LEU 549 ? B LEU 217 
22 1 Y 1 B ASN 550 ? B ASN 218 
23 1 Y 1 B ASP 551 ? B ASP 219 
24 1 Y 1 B ILE 552 ? B ILE 220 
25 1 Y 1 B PHE 553 ? B PHE 221 
26 1 Y 1 B GLU 554 ? B GLU 222 
27 1 Y 1 B ALA 555 ? B ALA 223 
28 1 Y 1 B GLN 556 ? B GLN 224 
29 1 Y 1 B LYS 557 ? B LYS 225 
30 1 Y 1 B ILE 558 ? B ILE 226 
31 1 Y 1 B GLU 559 ? B GLU 227 
32 1 Y 1 B TRP 560 ? B TRP 228 
33 1 Y 1 B HIS 561 ? B HIS 229 
34 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 
PHE N    N N N 264 
PHE CA   C N S 265 
PHE C    C N N 266 
PHE O    O N N 267 
PHE CB   C N N 268 
PHE CG   C Y N 269 
PHE CD1  C Y N 270 
PHE CD2  C Y N 271 
PHE CE1  C Y N 272 
PHE CE2  C Y N 273 
PHE CZ   C Y N 274 
PHE OXT  O N N 275 
PHE H    H N N 276 
PHE H2   H N N 277 
PHE HA   H N N 278 
PHE HB2  H N N 279 
PHE HB3  H N N 280 
PHE HD1  H N N 281 
PHE HD2  H N N 282 
PHE HE1  H N N 283 
PHE HE2  H N N 284 
PHE HZ   H N N 285 
PHE HXT  H N N 286 
PRO N    N N N 287 
PRO CA   C N S 288 
PRO C    C N N 289 
PRO O    O N N 290 
PRO CB   C N N 291 
PRO CG   C N N 292 
PRO CD   C N N 293 
PRO OXT  O N N 294 
PRO H    H N N 295 
PRO HA   H N N 296 
PRO HB2  H N N 297 
PRO HB3  H N N 298 
PRO HG2  H N N 299 
PRO HG3  H N N 300 
PRO HD2  H N N 301 
PRO HD3  H N N 302 
PRO HXT  H N N 303 
SER N    N N N 304 
SER CA   C N S 305 
SER C    C N N 306 
SER O    O N N 307 
SER CB   C N N 308 
SER OG   O N N 309 
SER OXT  O N N 310 
SER H    H N N 311 
SER H2   H N N 312 
SER HA   H N N 313 
SER HB2  H N N 314 
SER HB3  H N N 315 
SER HG   H N N 316 
SER HXT  H N N 317 
THR N    N N N 318 
THR CA   C N S 319 
THR C    C N N 320 
THR O    O N N 321 
THR CB   C N R 322 
THR OG1  O N N 323 
THR CG2  C N N 324 
THR OXT  O N N 325 
THR H    H N N 326 
THR H2   H N N 327 
THR HA   H N N 328 
THR HB   H N N 329 
THR HG1  H N N 330 
THR HG21 H N N 331 
THR HG22 H N N 332 
THR HG23 H N N 333 
THR HXT  H N N 334 
TRP N    N N N 335 
TRP CA   C N S 336 
TRP C    C N N 337 
TRP O    O N N 338 
TRP CB   C N N 339 
TRP CG   C Y N 340 
TRP CD1  C Y N 341 
TRP CD2  C Y N 342 
TRP NE1  N Y N 343 
TRP CE2  C Y N 344 
TRP CE3  C Y N 345 
TRP CZ2  C Y N 346 
TRP CZ3  C Y N 347 
TRP CH2  C Y N 348 
TRP OXT  O N N 349 
TRP H    H N N 350 
TRP H2   H N N 351 
TRP HA   H N N 352 
TRP HB2  H N N 353 
TRP HB3  H N N 354 
TRP HD1  H N N 355 
TRP HE1  H N N 356 
TRP HE3  H N N 357 
TRP HZ2  H N N 358 
TRP HZ3  H N N 359 
TRP HH2  H N N 360 
TRP HXT  H N N 361 
TYR N    N N N 362 
TYR CA   C N S 363 
TYR C    C N N 364 
TYR O    O N N 365 
TYR CB   C N N 366 
TYR CG   C Y N 367 
TYR CD1  C Y N 368 
TYR CD2  C Y N 369 
TYR CE1  C Y N 370 
TYR CE2  C Y N 371 
TYR CZ   C Y N 372 
TYR OH   O N N 373 
TYR OXT  O N N 374 
TYR H    H N N 375 
TYR H2   H N N 376 
TYR HA   H N N 377 
TYR HB2  H N N 378 
TYR HB3  H N N 379 
TYR HD1  H N N 380 
TYR HD2  H N N 381 
TYR HE1  H N N 382 
TYR HE2  H N N 383 
TYR HH   H N N 384 
TYR HXT  H N N 385 
VAL N    N N N 386 
VAL CA   C N S 387 
VAL C    C N N 388 
VAL O    O N N 389 
VAL CB   C N N 390 
VAL CG1  C N N 391 
VAL CG2  C N N 392 
VAL OXT  O N N 393 
VAL H    H N N 394 
VAL H2   H N N 395 
VAL HA   H N N 396 
VAL HB   H N N 397 
VAL HG11 H N N 398 
VAL HG12 H N N 399 
VAL HG13 H N N 400 
VAL HG21 H N N 401 
VAL HG22 H N N 402 
VAL HG23 H N N 403 
VAL HXT  H N N 404 
# 
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          ? 
# 
_space_group.name_H-M_alt     'P 31 2 1' 
_space_group.name_Hall        
;P 31 2"
;
_space_group.IT_number        152 
_space_group.crystal_system   trigonal 
_space_group.id               1 
# 
_atom_sites.entry_id                    8YDU 
_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]   0.013466 
_atom_sites.fract_transf_matrix[1][2]   0.007775 
_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]   0.015549 
_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]   0.010024 
_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.scat_dispersion_real 
_atom_type.scat_dispersion_imag 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
_atom_type.scat_source 
_atom_type.scat_dispersion_source 
C ? ? 3.54356 2.42580 ? ? 25.62398 1.50364  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
N ? ? 4.01032 2.96436 ? ? 19.97189 1.75589  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
O ? ? 4.49882 3.47563 ? ? 15.80542 1.70748  ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
S ? ? 9.55732 6.39887 ? ? 1.23737  29.19336 ? ? 0.0 
;2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31.
;
? 
# 
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   1    N N   . ASP A 1 1   ? -18.14554 3.30443  -20.63476 1.000 65.70572 ? 1   ASP A N   1 
ATOM   2    C CA  . ASP A 1 1   ? -17.77365 3.18195  -19.22826 1.000 69.46387 ? 1   ASP A CA  1 
ATOM   3    C C   . ASP A 1 1   ? -19.00061 3.30189  -18.32340 1.000 66.26940 ? 1   ASP A C   1 
ATOM   4    O O   . ASP A 1 1   ? -20.13478 3.11952  -18.77556 1.000 65.55454 ? 1   ASP A O   1 
ATOM   5    C CB  . ASP A 1 1   ? -16.73467 4.24139  -18.85197 1.000 71.24467 ? 1   ASP A CB  1 
ATOM   6    C CG  . ASP A 1 1   ? -17.31781 5.64293  -18.81248 1.000 76.90749 ? 1   ASP A CG  1 
ATOM   7    O OD1 . ASP A 1 1   ? -18.13354 5.97857  -19.70035 1.000 63.40736 ? 1   ASP A OD1 1 
ATOM   8    O OD2 . ASP A 1 1   ? -16.96754 6.40184  -17.88093 1.000 76.36352 ? 1   ASP A OD2 1 
ATOM   9    N N   . LYS A 1 2   ? -18.76405 3.61368  -17.04419 1.000 57.70536 ? 2   LYS A N   1 
ATOM   10   C CA  . LYS A 1 2   ? -19.85951 3.69360  -16.08316 1.000 50.18403 ? 2   LYS A CA  1 
ATOM   11   C C   . LYS A 1 2   ? -20.75575 4.90095  -16.33755 1.000 47.15569 ? 2   LYS A C   1 
ATOM   12   O O   . LYS A 1 2   ? -21.97024 4.82477  -16.12479 1.000 50.39061 ? 2   LYS A O   1 
ATOM   13   C CB  . LYS A 1 2   ? -19.29978 3.72672  -14.66088 1.000 57.09084 ? 2   LYS A CB  1 
ATOM   14   C CG  . LYS A 1 2   ? -20.35844 3.88183  -13.58435 1.000 60.18359 ? 2   LYS A CG  1 
ATOM   15   C CD  . LYS A 1 2   ? -19.81758 3.57951  -12.19788 1.000 64.11373 ? 2   LYS A CD  1 
ATOM   16   C CE  . LYS A 1 2   ? -20.93339 3.62294  -11.15773 1.000 55.43217 ? 2   LYS A CE  1 
ATOM   17   N NZ  . LYS A 1 2   ? -20.60474 2.82173  -9.94837  1.000 58.27555 ? 2   LYS A NZ  1 
ATOM   18   N N   . LEU A 1 3   ? -20.19032 6.00907  -16.81467 1.000 49.07055 ? 3   LEU A N   1 
ATOM   19   C CA  . LEU A 1 3   ? -20.97507 7.23211  -16.94666 1.000 47.75765 ? 3   LEU A CA  1 
ATOM   20   C C   . LEU A 1 3   ? -21.98315 7.13867  -18.08419 1.000 51.88974 ? 3   LEU A C   1 
ATOM   21   O O   . LEU A 1 3   ? -23.08014 7.70686  -17.99653 1.000 42.66724 ? 3   LEU A O   1 
ATOM   22   C CB  . LEU A 1 3   ? -20.04812 8.42871  -17.15223 1.000 51.85736 ? 3   LEU A CB  1 
ATOM   23   C CG  . LEU A 1 3   ? -19.17072 8.80470  -15.95631 1.000 53.58486 ? 3   LEU A CG  1 
ATOM   24   C CD1 . LEU A 1 3   ? -18.31257 10.02527 -16.28909 1.000 52.75107 ? 3   LEU A CD1 1 
ATOM   25   C CD2 . LEU A 1 3   ? -20.03799 9.04241  -14.72001 1.000 49.57464 ? 3   LEU A CD2 1 
ATOM   26   N N   . TRP A 1 4   ? -21.62839 6.45075  -19.17190 1.000 46.81292 ? 4   TRP A N   1 
ATOM   27   C CA  . TRP A 1 4   ? -22.54932 6.35860  -20.29702 1.000 42.08880 ? 4   TRP A CA  1 
ATOM   28   C C   . TRP A 1 4   ? -23.82608 5.62990  -19.89673 1.000 37.64704 ? 4   TRP A C   1 
ATOM   29   O O   . TRP A 1 4   ? -24.93688 6.11161  -20.15245 1.000 38.02329 ? 4   TRP A O   1 
ATOM   30   C CB  . TRP A 1 4   ? -21.87138 5.66608  -21.48031 1.000 51.92642 ? 4   TRP A CB  1 
ATOM   31   C CG  . TRP A 1 4   ? -22.75557 5.59471  -22.67517 1.000 47.02593 ? 4   TRP A CG  1 
ATOM   32   C CD1 . TRP A 1 4   ? -22.88069 6.52922  -23.66438 1.000 47.39628 ? 4   TRP A CD1 1 
ATOM   33   C CD2 . TRP A 1 4   ? -23.66435 4.53878  -23.00375 1.000 47.74924 ? 4   TRP A CD2 1 
ATOM   34   N NE1 . TRP A 1 4   ? -23.80464 6.11353  -24.59167 1.000 49.20007 ? 4   TRP A NE1 1 
ATOM   35   C CE2 . TRP A 1 4   ? -24.30144 4.89573  -24.20852 1.000 47.16594 ? 4   TRP A CE2 1 
ATOM   36   C CE3 . TRP A 1 4   ? -23.99877 3.32492  -22.39652 1.000 48.52630 ? 4   TRP A CE3 1 
ATOM   37   C CZ2 . TRP A 1 4   ? -25.25420 4.08180  -24.81965 1.000 51.09462 ? 4   TRP A CZ2 1 
ATOM   38   C CZ3 . TRP A 1 4   ? -24.94258 2.51768  -23.00578 1.000 52.08974 ? 4   TRP A CZ3 1 
ATOM   39   C CH2 . TRP A 1 4   ? -25.55880 2.90005  -24.20451 1.000 48.53543 ? 4   TRP A CH2 1 
ATOM   40   N N   . ILE A 1 5   ? -23.68525 4.47563  -19.24253 1.000 41.53849 ? 5   ILE A N   1 
ATOM   41   C CA  . ILE A 1 5   ? -24.85798 3.67383  -18.90852 1.000 46.87034 ? 5   ILE A CA  1 
ATOM   42   C C   . ILE A 1 5   ? -25.65507 4.33019  -17.78623 1.000 38.13637 ? 5   ILE A C   1 
ATOM   43   O O   . ILE A 1 5   ? -26.89083 4.26288  -17.76689 1.000 38.80249 ? 5   ILE A O   1 
ATOM   44   C CB  . ILE A 1 5   ? -24.44419 2.23053  -18.56118 1.000 44.70549 ? 5   ILE A CB  1 
ATOM   45   C CG1 . ILE A 1 5   ? -25.68227 1.35289  -18.34060 1.000 42.98332 ? 5   ILE A CG1 1 
ATOM   46   C CG2 . ILE A 1 5   ? -23.53806 2.19687  -17.35167 1.000 43.50656 ? 5   ILE A CG2 1 
ATOM   47   C CD1 . ILE A 1 5   ? -26.56686 1.19962  -19.57210 1.000 41.41017 ? 5   ILE A CD1 1 
ATOM   48   N N   . LEU A 1 6   ? -24.97327 4.99792  -16.85327 1.000 41.48552 ? 6   LEU A N   1 
ATOM   49   C CA  . LEU A 1 6   ? -25.69821 5.75749  -15.83726 1.000 36.85513 ? 6   LEU A CA  1 
ATOM   50   C C   . LEU A 1 6   ? -26.61658 6.77308  -16.49482 1.000 35.34686 ? 6   LEU A C   1 
ATOM   51   O O   . LEU A 1 6   ? -27.78649 6.90977  -16.11398 1.000 33.77786 ? 6   LEU A O   1 
ATOM   52   C CB  . LEU A 1 6   ? -24.72182 6.45363  -14.88849 1.000 38.60557 ? 6   LEU A CB  1 
ATOM   53   C CG  . LEU A 1 6   ? -25.40828 7.30174  -13.81208 1.000 40.68491 ? 6   LEU A CG  1 
ATOM   54   C CD1 . LEU A 1 6   ? -26.30258 6.42205  -12.98010 1.000 36.54554 ? 6   LEU A CD1 1 
ATOM   55   C CD2 . LEU A 1 6   ? -24.39656 8.01597  -12.94168 1.000 34.35222 ? 6   LEU A CD2 1 
ATOM   56   N N   . GLN A 1 7   ? -26.11571 7.46257  -17.52338 1.000 33.49644 ? 7   GLN A N   1 
ATOM   57   C CA  . GLN A 1 7   ? -26.94196 8.43941  -18.21827 1.000 34.27552 ? 7   GLN A CA  1 
ATOM   58   C C   . GLN A 1 7   ? -28.10847 7.76999  -18.93113 1.000 41.61260 ? 7   GLN A C   1 
ATOM   59   O O   . GLN A 1 7   ? -29.22250 8.30943  -18.95319 1.000 37.05567 ? 7   GLN A O   1 
ATOM   60   C CB  . GLN A 1 7   ? -26.09741 9.23658  -19.21061 1.000 35.03584 ? 7   GLN A CB  1 
ATOM   61   C CG  . GLN A 1 7   ? -26.89629 10.27509 -19.98385 1.000 31.93394 ? 7   GLN A CG  1 
ATOM   62   C CD  . GLN A 1 7   ? -27.38447 11.41425 -19.11398 1.000 35.14648 ? 7   GLN A CD  1 
ATOM   63   O OE1 . GLN A 1 7   ? -26.81036 11.69928 -18.06000 1.000 39.55420 ? 7   GLN A OE1 1 
ATOM   64   N NE2 . GLN A 1 7   ? -28.45864 12.06427 -19.53993 1.000 38.31131 ? 7   GLN A NE2 1 
ATOM   65   N N   . LYS A 1 8   ? -27.87347 6.60303  -19.53978 1.000 37.46486 ? 8   LYS A N   1 
ATOM   66   C CA  . LYS A 1 8   ? -28.96337 5.94155  -20.24628 1.000 38.03753 ? 8   LYS A CA  1 
ATOM   67   C C   . LYS A 1 8   ? -29.98970 5.37306  -19.27437 1.000 35.39038 ? 8   LYS A C   1 
ATOM   68   O O   . LYS A 1 8   ? -31.18896 5.32350  -19.59620 1.000 36.13918 ? 8   LYS A O   1 
ATOM   69   C CB  . LYS A 1 8   ? -28.41332 4.84684  -21.16635 1.000 42.89462 ? 8   LYS A CB  1 
ATOM   70   C CG  . LYS A 1 8   ? -27.67284 5.35680  -22.41641 1.000 42.31207 ? 8   LYS A CG  1 
ATOM   71   C CD  . LYS A 1 8   ? -28.47477 6.39997  -23.17258 1.000 40.06561 ? 8   LYS A CD  1 
ATOM   72   C CE  . LYS A 1 8   ? -27.83397 6.71513  -24.52367 1.000 55.89239 ? 8   LYS A CE  1 
ATOM   73   N NZ  . LYS A 1 8   ? -28.51091 7.84660  -25.22666 1.000 55.37755 ? 8   LYS A NZ  1 
ATOM   74   N N   . ILE A 1 9   ? -29.54432 4.96741  -18.08230 1.000 38.01907 ? 9   ILE A N   1 
ATOM   75   C CA  . ILE A 1 9   ? -30.47357 4.49247  -17.06064 1.000 39.22791 ? 9   ILE A CA  1 
ATOM   76   C C   . ILE A 1 9   ? -31.27918 5.65756  -16.50040 1.000 33.83579 ? 9   ILE A C   1 
ATOM   77   O O   . ILE A 1 9   ? -32.50616 5.57583  -16.37112 1.000 35.09201 ? 9   ILE A O   1 
ATOM   78   C CB  . ILE A 1 9   ? -29.72383 3.73209  -15.95597 1.000 39.61521 ? 9   ILE A CB  1 
ATOM   79   C CG1 . ILE A 1 9   ? -29.16113 2.42510  -16.50353 1.000 40.31604 ? 9   ILE A CG1 1 
ATOM   80   C CG2 . ILE A 1 9   ? -30.66244 3.39974  -14.82476 1.000 44.16372 ? 9   ILE A CG2 1 
ATOM   81   C CD1 . ILE A 1 9   ? -28.11273 1.81265  -15.64640 1.000 41.94922 ? 9   ILE A CD1 1 
ATOM   82   N N   . TYR A 1 10  ? -30.61111 6.77653  -16.20658 1.000 30.85143 ? 10  TYR A N   1 
ATOM   83   C CA  . TYR A 1 10  ? -31.34143 7.99102  -15.84335 1.000 35.55289 ? 10  TYR A CA  1 
ATOM   84   C C   . TYR A 1 10  ? -32.39221 8.35759  -16.88296 1.000 35.84436 ? 10  TYR A C   1 
ATOM   85   O O   . TYR A 1 10  ? -33.53761 8.66826  -16.53592 1.000 34.95676 ? 10  TYR A O   1 
ATOM   86   C CB  . TYR A 1 10  ? -30.37940 9.16444  -15.62849 1.000 37.59682 ? 10  TYR A CB  1 
ATOM   87   C CG  . TYR A 1 10  ? -31.10139 10.43195 -15.18725 1.000 40.34351 ? 10  TYR A CG  1 
ATOM   88   C CD1 . TYR A 1 10  ? -31.44232 10.62349 -13.85797 1.000 37.26273 ? 10  TYR A CD1 1 
ATOM   89   C CD2 . TYR A 1 10  ? -31.44490 11.43040 -16.09497 1.000 36.49212 ? 10  TYR A CD2 1 
ATOM   90   C CE1 . TYR A 1 10  ? -32.10719 11.76318 -13.45012 1.000 33.78752 ? 10  TYR A CE1 1 
ATOM   91   C CE2 . TYR A 1 10  ? -32.11726 12.58227 -15.68611 1.000 37.99853 ? 10  TYR A CE2 1 
ATOM   92   C CZ  . TYR A 1 10  ? -32.43601 12.73555 -14.34365 1.000 40.48598 ? 10  TYR A CZ  1 
ATOM   93   O OH  . TYR A 1 10  ? -33.09817 13.85217 -13.87820 1.000 40.49371 ? 10  TYR A OH  1 
ATOM   94   N N   . GLU A 1 11  ? -32.02135 8.33758  -18.18330 1.000 31.61242 ? 11  GLU A N   1 
ATOM   95   C CA  . GLU A 1 11  ? -32.96952 8.73135  -19.21532 1.000 36.93276 ? 11  GLU A CA  1 
ATOM   96   C C   . GLU A 1 11  ? -34.15126 7.77617  -19.29286 1.000 32.28798 ? 11  GLU A C   1 
ATOM   97   O O   . GLU A 1 11  ? -35.28065 8.20886  -19.54663 1.000 35.96290 ? 11  GLU A O   1 
ATOM   98   C CB  . GLU A 1 11  ? -32.26233 8.81739  -20.56691 1.000 35.13102 ? 11  GLU A CB  1 
ATOM   99   C CG  . GLU A 1 11  ? -31.33771 10.01342 -20.66372 1.000 41.56387 ? 11  GLU A CG  1 
ATOM   100  C CD  . GLU A 1 11  ? -30.57012 10.04178 -21.97269 1.000 44.86621 ? 11  GLU A CD  1 
ATOM   101  O OE1 . GLU A 1 11  ? -30.81984 9.16423  -22.82718 1.000 43.92992 ? 11  GLU A OE1 1 
ATOM   102  O OE2 . GLU A 1 11  ? -29.71994 10.93593 -22.13347 1.000 41.84978 ? 11  GLU A OE2 1 
ATOM   103  N N   . ILE A 1 12  ? -33.92074 6.48665  -19.05625 1.000 37.01459 ? 12  ILE A N   1 
ATOM   104  C CA  . ILE A 1 12  ? -35.02343 5.53522  -19.10482 1.000 34.39328 ? 12  ILE A CA  1 
ATOM   105  C C   . ILE A 1 12  ? -35.94136 5.72869  -17.89716 1.000 36.79967 ? 12  ILE A C   1 
ATOM   106  O O   . ILE A 1 12  ? -37.16835 5.63099  -18.00855 1.000 32.44473 ? 12  ILE A O   1 
ATOM   107  C CB  . ILE A 1 12  ? -34.46603 4.09951  -19.23848 1.000 42.68510 ? 12  ILE A CB  1 
ATOM   108  C CG1 . ILE A 1 12  ? -35.36149 3.24383  -20.13376 1.000 54.31516 ? 12  ILE A CG1 1 
ATOM   109  C CG2 . ILE A 1 12  ? -34.24969 3.41448  -17.90614 1.000 43.18424 ? 12  ILE A CG2 1 
ATOM   110  C CD1 . ILE A 1 12  ? -34.67262 1.97999  -20.63422 1.000 51.76057 ? 12  ILE A CD1 1 
ATOM   111  N N   . MET A 1 13  ? -35.37667 6.09092  -16.74856 1.000 36.63506 ? 13  MET A N   1 
ATOM   112  C CA  . MET A 1 13  ? -36.22560 6.40033  -15.60323 1.000 34.13453 ? 13  MET A CA  1 
ATOM   113  C C   . MET A 1 13  ? -37.16737 7.55229  -15.92775 1.000 29.08556 ? 13  MET A C   1 
ATOM   114  O O   . MET A 1 13  ? -38.37302 7.48286  -15.66092 1.000 33.02553 ? 13  MET A O   1 
ATOM   115  C CB  . MET A 1 13  ? -35.36553 6.73305  -14.38569 1.000 39.09604 ? 13  MET A CB  1 
ATOM   116  C CG  . MET A 1 13  ? -36.19071 7.11486  -13.18430 1.000 40.36631 ? 13  MET A CG  1 
ATOM   117  S SD  . MET A 1 13  ? -35.19359 7.58864  -11.76340 1.000 36.04345 ? 13  MET A SD  1 
ATOM   118  C CE  . MET A 1 13  ? -34.37279 9.07020  -12.37578 1.000 29.76993 ? 13  MET A CE  1 
ATOM   119  N N   . VAL A 1 14  ? -36.63611 8.61635  -16.53393 1.000 29.80622 ? 14  VAL A N   1 
ATOM   120  C CA  . VAL A 1 14  ? -37.46203 9.77647  -16.85044 1.000 33.22362 ? 14  VAL A CA  1 
ATOM   121  C C   . VAL A 1 14  ? -38.47319 9.43682  -17.93829 1.000 37.92604 ? 14  VAL A C   1 
ATOM   122  O O   . VAL A 1 14  ? -39.64649 9.82457  -17.85821 1.000 35.77997 ? 14  VAL A O   1 
ATOM   123  C CB  . VAL A 1 14  ? -36.57334 10.96733 -17.25465 1.000 41.33931 ? 14  VAL A CB  1 
ATOM   124  C CG1 . VAL A 1 14  ? -37.42887 12.11065 -17.76371 1.000 41.06709 ? 14  VAL A CG1 1 
ATOM   125  C CG2 . VAL A 1 14  ? -35.72084 11.42515 -16.06116 1.000 39.19707 ? 14  VAL A CG2 1 
ATOM   126  N N   . ARG A 1 15  ? -38.04104 8.70771  -18.96804 1.000 38.79163 ? 15  ARG A N   1 
ATOM   127  C CA  . ARG A 1 15  ? -38.95340 8.39728  -20.06507 1.000 39.56766 ? 15  ARG A CA  1 
ATOM   128  C C   . ARG A 1 15  ? -40.08633 7.49660  -19.59096 1.000 43.45941 ? 15  ARG A C   1 
ATOM   129  O O   . ARG A 1 15  ? -41.24862 7.70612  -19.96197 1.000 41.23100 ? 15  ARG A O   1 
ATOM   130  C CB  . ARG A 1 15  ? -38.19292 7.74757  -21.21987 1.000 38.45800 ? 15  ARG A CB  1 
ATOM   131  C CG  . ARG A 1 15  ? -39.03987 7.55390  -22.46717 1.000 49.26391 ? 15  ARG A CG  1 
ATOM   132  C CD  . ARG A 1 15  ? -38.22982 6.95025  -23.60996 1.000 56.91130 ? 15  ARG A CD  1 
ATOM   133  N NE  . ARG A 1 15  ? -39.03167 6.81086  -24.82173 1.000 71.69391 ? 15  ARG A NE  1 
ATOM   134  C CZ  . ARG A 1 15  ? -38.65358 6.14601  -25.90645 1.000 65.52422 ? 15  ARG A CZ  1 
ATOM   135  N NH1 . ARG A 1 15  ? -37.48073 5.53660  -25.97173 1.000 67.75811 ? 15  ARG A NH1 1 
ATOM   136  N NH2 . ARG A 1 15  ? -39.47607 6.08680  -26.95073 1.000 59.77622 ? 15  ARG A NH2 1 
ATOM   137  N N   . LEU A 1 16  ? -39.76607 6.50234  -18.75391 1.000 42.98098 ? 16  LEU A N   1 
ATOM   138  C CA  . LEU A 1 16  ? -40.79667 5.62763  -18.20481 1.000 39.18950 ? 16  LEU A CA  1 
ATOM   139  C C   . LEU A 1 16  ? -41.87197 6.42998  -17.49447 1.000 45.37944 ? 16  LEU A C   1 
ATOM   140  O O   . LEU A 1 16  ? -43.06624 6.16091  -17.65941 1.000 44.83571 ? 16  LEU A O   1 
ATOM   141  C CB  . LEU A 1 16  ? -40.17489 4.61028  -17.25006 1.000 36.55976 ? 16  LEU A CB  1 
ATOM   142  C CG  . LEU A 1 16  ? -39.37700 3.48080  -17.89544 1.000 41.77063 ? 16  LEU A CG  1 
ATOM   143  C CD1 . LEU A 1 16  ? -38.57385 2.73529  -16.86980 1.000 34.71376 ? 16  LEU A CD1 1 
ATOM   144  C CD2 . LEU A 1 16  ? -40.29857 2.53261  -18.62094 1.000 39.34060 ? 16  LEU A CD2 1 
ATOM   145  N N   . ASP A 1 17  ? -41.46519 7.43351  -16.70903 1.000 41.41408 ? 17  ASP A N   1 
ATOM   146  C CA  . ASP A 1 17  ? -42.43243 8.24033  -15.97345 1.000 45.24570 ? 17  ASP A CA  1 
ATOM   147  C C   . ASP A 1 17  ? -43.25556 9.11543  -16.91063 1.000 48.97038 ? 17  ASP A C   1 
ATOM   148  O O   . ASP A 1 17  ? -44.47588 9.23769  -16.74737 1.000 44.93414 ? 17  ASP A O   1 
ATOM   149  C CB  . ASP A 1 17  ? -41.71039 9.09300  -14.92753 1.000 38.96740 ? 17  ASP A CB  1 
ATOM   150  C CG  . ASP A 1 17  ? -42.63819 10.06022 -14.23131 1.000 47.97688 ? 17  ASP A CG  1 
ATOM   151  O OD1 . ASP A 1 17  ? -43.54929 9.58813  -13.51537 1.000 51.14274 ? 17  ASP A OD1 1 
ATOM   152  O OD2 . ASP A 1 17  ? -42.45881 11.28754 -14.39880 1.000 51.65127 ? 17  ASP A OD2 1 
ATOM   153  N N   . GLU A 1 18  ? -42.61032 9.72937  -17.90187 1.000 47.61235 ? 18  GLU A N   1 
ATOM   154  C CA  . GLU A 1 18  ? -43.34235 10.59823 -18.81648 1.000 49.70704 ? 18  GLU A CA  1 
ATOM   155  C C   . GLU A 1 18  ? -44.32307 9.80954  -19.67633 1.000 38.06329 ? 18  GLU A C   1 
ATOM   156  O O   . GLU A 1 18  ? -45.37185 10.33763 -20.06463 1.000 47.79357 ? 18  GLU A O   1 
ATOM   157  C CB  . GLU A 1 18  ? -42.35491 11.39834 -19.66919 1.000 49.79115 ? 18  GLU A CB  1 
ATOM   158  C CG  . GLU A 1 18  ? -41.83336 12.63775 -18.93573 1.000 53.48421 ? 18  GLU A CG  1 
ATOM   159  C CD  . GLU A 1 18  ? -40.56673 13.23874 -19.53847 1.000 73.52375 ? 18  GLU A CD  1 
ATOM   160  O OE1 . GLU A 1 18  ? -40.01856 12.67141 -20.51210 1.000 61.88919 ? 18  GLU A OE1 1 
ATOM   161  O OE2 . GLU A 1 18  ? -40.11639 14.28916 -19.02319 1.000 63.62053 ? 18  GLU A OE2 1 
ATOM   162  N N   . GLU A 1 19  ? -44.02996 8.53941  -19.94673 1.000 48.05520 ? 19  GLU A N   1 
ATOM   163  C CA  . GLU A 1 19  ? -44.90749 7.69418  -20.74712 1.000 41.23017 ? 19  GLU A CA  1 
ATOM   164  C C   . GLU A 1 19  ? -45.87563 6.86970  -19.89836 1.000 59.70544 ? 19  GLU A C   1 
ATOM   165  O O   . GLU A 1 19  ? -46.42698 5.87723  -20.39304 1.000 48.85342 ? 19  GLU A O   1 
ATOM   166  C CB  . GLU A 1 19  ? -44.07186 6.78463  -21.65084 1.000 46.81273 ? 19  GLU A CB  1 
ATOM   167  C CG  . GLU A 1 19  ? -43.21439 7.56950  -22.62951 1.000 43.91955 ? 19  GLU A CG  1 
ATOM   168  C CD  . GLU A 1 19  ? -42.44648 6.69676  -23.60191 1.000 52.51960 ? 19  GLU A CD  1 
ATOM   169  O OE1 . GLU A 1 19  ? -42.63717 5.45974  -23.59992 1.000 55.90498 ? 19  GLU A OE1 1 
ATOM   170  O OE2 . GLU A 1 19  ? -41.64411 7.26081  -24.37545 1.000 48.33265 ? 19  GLU A OE2 1 
ATOM   171  N N   . GLY A 1 20  ? -46.08081 7.24809  -18.63295 1.000 48.53166 ? 20  GLY A N   1 
ATOM   172  C CA  . GLY A 1 20  ? -47.10987 6.63312  -17.81515 1.000 45.73114 ? 20  GLY A CA  1 
ATOM   173  C C   . GLY A 1 20  ? -46.73270 5.33315  -17.14818 1.000 51.91723 ? 20  GLY A C   1 
ATOM   174  O O   . GLY A 1 20  ? -47.61680 4.59499  -16.69915 1.000 61.43997 ? 20  GLY A O   1 
ATOM   175  N N   . HIS A 1 21  ? -45.44771 5.02136  -17.06695 1.000 42.13922 ? 21  HIS A N   1 
ATOM   176  C CA  . HIS A 1 21  ? -45.01604 3.82393  -16.36754 1.000 38.87748 ? 21  HIS A CA  1 
ATOM   177  C C   . HIS A 1 21  ? -44.32310 4.24404  -15.07478 1.000 39.52592 ? 21  HIS A C   1 
ATOM   178  O O   . HIS A 1 21  ? -43.12215 4.02056  -14.90140 1.000 39.76286 ? 21  HIS A O   1 
ATOM   179  C CB  . HIS A 1 21  ? -44.10727 2.99237  -17.27306 1.000 37.52184 ? 21  HIS A CB  1 
ATOM   180  C CG  . HIS A 1 21  ? -44.66102 2.79788  -18.65308 1.000 41.43976 ? 21  HIS A CG  1 
ATOM   181  N ND1 . HIS A 1 21  ? -45.95477 2.37963  -18.88022 1.000 38.70973 ? 21  HIS A ND1 1 
ATOM   182  C CD2 . HIS A 1 21  ? -44.10478 2.97821  -19.87522 1.000 51.32716 ? 21  HIS A CD2 1 
ATOM   183  C CE1 . HIS A 1 21  ? -46.16924 2.30077  -20.18262 1.000 42.30187 ? 21  HIS A CE1 1 
ATOM   184  N NE2 . HIS A 1 21  ? -45.06203 2.65840  -20.80901 1.000 46.11608 ? 21  HIS A NE2 1 
ATOM   185  N N   . GLY A 1 22  ? -45.07789 4.88253  -14.17777 1.000 47.62108 ? 22  GLY A N   1 
ATOM   186  C CA  . GLY A 1 22  ? -44.48229 5.40842  -12.95252 1.000 48.07757 ? 22  GLY A CA  1 
ATOM   187  C C   . GLY A 1 22  ? -43.91431 4.32498  -12.05541 1.000 40.29947 ? 22  GLY A C   1 
ATOM   188  O O   . GLY A 1 22  ? -42.85488 4.49835  -11.44255 1.000 45.76237 ? 22  GLY A O   1 
ATOM   189  N N   . GLU A 1 23  ? -44.60918 3.19199  -11.96486 1.000 38.94797 ? 23  GLU A N   1 
ATOM   190  C CA  . GLU A 1 23  ? -44.12198 2.09736  -11.13941 1.000 34.67858 ? 23  GLU A CA  1 
ATOM   191  C C   . GLU A 1 23  ? -42.79291 1.57236  -11.66108 1.000 38.45490 ? 23  GLU A C   1 
ATOM   192  O O   . GLU A 1 23  ? -41.84996 1.35373  -10.89721 1.000 33.73644 ? 23  GLU A O   1 
ATOM   193  C CB  . GLU A 1 23  ? -45.17760 0.99636  -11.08358 1.000 43.52467 ? 23  GLU A CB  1 
ATOM   194  C CG  . GLU A 1 23  ? -45.10054 0.17103  -9.83908  1.000 42.09820 ? 23  GLU A CG  1 
ATOM   195  C CD  . GLU A 1 23  ? -46.39249 -0.54435 -9.50642  1.000 44.83229 ? 23  GLU A CD  1 
ATOM   196  O OE1 . GLU A 1 23  ? -47.26408 -0.65552 -10.38661 1.000 39.87049 ? 23  GLU A OE1 1 
ATOM   197  O OE2 . GLU A 1 23  ? -46.54227 -0.99369 -8.35010  1.000 41.59823 ? 23  GLU A OE2 1 
ATOM   198  N N   . ALA A 1 24  ? -42.69506 1.37204  -12.97642 1.000 34.54243 ? 24  ALA A N   1 
ATOM   199  C CA  . ALA A 1 24  ? -41.42602 0.96544  -13.56598 1.000 33.96687 ? 24  ALA A CA  1 
ATOM   200  C C   . ALA A 1 24  ? -40.34022 2.00451  -13.32595 1.000 28.20536 ? 24  ALA A C   1 
ATOM   201  O O   . ALA A 1 24  ? -39.16903 1.65569  -13.13870 1.000 31.66709 ? 24  ALA A O   1 
ATOM   202  C CB  . ALA A 1 24  ? -41.60823 0.73769  -15.07367 1.000 29.48587 ? 24  ALA A CB  1 
ATOM   203  N N   . SER A 1 25  ? -40.70357 3.28983  -13.37933 1.000 32.35130 ? 25  SER A N   1 
ATOM   204  C CA  . SER A 1 25  ? -39.72402 4.34381  -13.14839 1.000 31.08601 ? 25  SER A CA  1 
ATOM   205  C C   . SER A 1 25  ? -39.12736 4.22926  -11.75262 1.000 31.60280 ? 25  SER A C   1 
ATOM   206  O O   . SER A 1 25  ? -37.91296 4.38524  -11.56706 1.000 31.62426 ? 25  SER A O   1 
ATOM   207  C CB  . SER A 1 25  ? -40.37954 5.70684  -13.33542 1.000 33.33601 ? 25  SER A CB  1 
ATOM   208  O OG  . SER A 1 25  ? -39.41156 6.73803  -13.28638 1.000 36.69557 ? 25  SER A OG  1 
ATOM   209  N N   . LEU A 1 26  ? -39.97128 3.93230  -10.76573 1.000 32.42580 ? 26  LEU A N   1 
ATOM   210  C CA  . LEU A 1 26  ? -39.50155 3.79153  -9.38868  1.000 29.92742 ? 26  LEU A CA  1 
ATOM   211  C C   . LEU A 1 26  ? -38.53481 2.62359  -9.26334  1.000 29.94197 ? 26  LEU A C   1 
ATOM   212  O O   . LEU A 1 26  ? -37.55590 2.68622  -8.51121  1.000 37.54245 ? 26  LEU A O   1 
ATOM   213  C CB  . LEU A 1 26  ? -40.70219 3.60918  -8.46355  1.000 34.48335 ? 26  LEU A CB  1 
ATOM   214  C CG  . LEU A 1 26  ? -41.61008 4.82080  -8.27860  1.000 36.22308 ? 26  LEU A CG  1 
ATOM   215  C CD1 . LEU A 1 26  ? -42.88128 4.42045  -7.52973  1.000 39.55015 ? 26  LEU A CD1 1 
ATOM   216  C CD2 . LEU A 1 26  ? -40.85247 5.89216  -7.49836  1.000 38.64559 ? 26  LEU A CD2 1 
ATOM   217  N N   . MET A 1 27  ? -38.77809 1.55210  -10.01906 1.000 30.51051 ? 27  MET A N   1 
ATOM   218  C CA  . MET A 1 27  ? -37.86219 0.42235  -9.99745  1.000 30.77351 ? 27  MET A CA  1 
ATOM   219  C C   . MET A 1 27  ? -36.51344 0.79303  -10.60014 1.000 30.55614 ? 27  MET A C   1 
ATOM   220  O O   . MET A 1 27  ? -35.46900 0.34220  -10.11877 1.000 33.56696 ? 27  MET A O   1 
ATOM   221  C CB  . MET A 1 27  ? -38.50132 -0.76057 -10.73081 1.000 38.15394 ? 27  MET A CB  1 
ATOM   222  C CG  . MET A 1 27  ? -39.89157 -1.08814 -10.18014 1.000 45.26502 ? 27  MET A CG  1 
ATOM   223  S SD  . MET A 1 27  ? -40.75873 -2.45133 -10.98236 1.000 47.80919 ? 27  MET A SD  1 
ATOM   224  C CE  . MET A 1 27  ? -39.41094 -3.61624 -11.20465 1.000 42.28847 ? 27  MET A CE  1 
ATOM   225  N N   . VAL A 1 28  ? -36.51260 1.59685  -11.66811 1.000 35.97337 ? 28  VAL A N   1 
ATOM   226  C CA  . VAL A 1 28  ? -35.24833 2.05243  -12.22901 1.000 32.11450 ? 28  VAL A CA  1 
ATOM   227  C C   . VAL A 1 28  ? -34.56317 3.02996  -11.28399 1.000 33.67879 ? 28  VAL A C   1 
ATOM   228  O O   . VAL A 1 28  ? -33.33128 3.04575  -11.17484 1.000 35.57169 ? 28  VAL A O   1 
ATOM   229  C CB  . VAL A 1 28  ? -35.47726 2.65678  -13.62390 1.000 34.99442 ? 28  VAL A CB  1 
ATOM   230  C CG1 . VAL A 1 28  ? -34.16336 3.11886  -14.22329 1.000 39.46515 ? 28  VAL A CG1 1 
ATOM   231  C CG2 . VAL A 1 28  ? -36.14120 1.62168  -14.51549 1.000 34.21540 ? 28  VAL A CG2 1 
ATOM   232  N N   . SER A 1 29  ? -35.34145 3.85545  -10.58371 1.000 35.42395 ? 29  SER A N   1 
ATOM   233  C CA  . SER A 1 29  ? -34.76147 4.68687  -9.52561  1.000 35.67311 ? 29  SER A CA  1 
ATOM   234  C C   . SER A 1 29  ? -33.96012 3.84912  -8.52272  1.000 36.69260 ? 29  SER A C   1 
ATOM   235  O O   . SER A 1 29  ? -32.83388 4.21399  -8.15641  1.000 34.81144 ? 29  SER A O   1 
ATOM   236  C CB  . SER A 1 29  ? -35.86084 5.48642  -8.81841  1.000 34.74531 ? 29  SER A CB  1 
ATOM   237  O OG  . SER A 1 29  ? -35.31776 6.23737  -7.72363  1.000 34.63794 ? 29  SER A OG  1 
ATOM   238  N N   . ASP A 1 30  ? -34.51971 2.71451  -8.06863  1.000 30.92771 ? 30  ASP A N   1 
ATOM   239  C CA  . ASP A 1 30  ? -33.79018 1.85345  -7.13945  1.000 35.92294 ? 30  ASP A CA  1 
ATOM   240  C C   . ASP A 1 30  ? -32.48484 1.35719  -7.74528  1.000 35.85026 ? 30  ASP A C   1 
ATOM   241  O O   . ASP A 1 30  ? -31.46993 1.25597  -7.04955  1.000 32.97903 ? 30  ASP A O   1 
ATOM   242  C CB  . ASP A 1 30  ? -34.64739 0.65863  -6.70903  1.000 35.46666 ? 30  ASP A CB  1 
ATOM   243  C CG  . ASP A 1 30  ? -35.86938 1.06736  -5.90179  1.000 38.55361 ? 30  ASP A CG  1 
ATOM   244  O OD1 . ASP A 1 30  ? -35.83818 2.14063  -5.26461  1.000 38.58990 ? 30  ASP A OD1 1 
ATOM   245  O OD2 . ASP A 1 30  ? -36.86154 0.30864  -5.90474  1.000 39.71682 ? 30  ASP A OD2 1 
ATOM   246  N N   . LEU A 1 31  ? -32.49317 1.01540  -9.03694  1.000 39.12799 ? 31  LEU A N   1 
ATOM   247  C CA  . LEU A 1 31  ? -31.25801 0.56857  -9.67099  1.000 34.46940 ? 31  LEU A CA  1 
ATOM   248  C C   . LEU A 1 31  ? -30.21411 1.67845  -9.68704  1.000 31.47004 ? 31  LEU A C   1 
ATOM   249  O O   . LEU A 1 31  ? -29.02498 1.42288  -9.46650  1.000 35.22484 ? 31  LEU A O   1 
ATOM   250  C CB  . LEU A 1 31  ? -31.53805 0.07547  -11.09048 1.000 38.38806 ? 31  LEU A CB  1 
ATOM   251  C CG  . LEU A 1 31  ? -30.27576 -0.41414 -11.80298 1.000 45.38736 ? 31  LEU A CG  1 
ATOM   252  C CD1 . LEU A 1 31  ? -29.56023 -1.46420 -10.95734 1.000 41.32951 ? 31  LEU A CD1 1 
ATOM   253  C CD2 . LEU A 1 31  ? -30.61400 -0.96032 -13.17917 1.000 41.93973 ? 31  LEU A CD2 1 
ATOM   254  N N   . ILE A 1 32  ? -30.64151 2.91938  -9.93112  1.000 36.05209 ? 32  ILE A N   1 
ATOM   255  C CA  . ILE A 1 32  ? -29.69901 4.03429  -9.95027  1.000 32.14203 ? 32  ILE A CA  1 
ATOM   256  C C   . ILE A 1 32  ? -29.02596 4.18515  -8.58985  1.000 36.83805 ? 32  ILE A C   1 
ATOM   257  O O   . ILE A 1 32  ? -27.80583 4.37947  -8.50094  1.000 34.04954 ? 32  ILE A O   1 
ATOM   258  C CB  . ILE A 1 32  ? -30.41029 5.32475  -10.39495 1.000 28.68796 ? 32  ILE A CB  1 
ATOM   259  C CG1 . ILE A 1 32  ? -30.65795 5.30340  -11.91343 1.000 29.38603 ? 32  ILE A CG1 1 
ATOM   260  C CG2 . ILE A 1 32  ? -29.55528 6.54041  -10.07550 1.000 39.97533 ? 32  ILE A CG2 1 
ATOM   261  C CD1 . ILE A 1 32  ? -31.68065 6.30379  -12.38212 1.000 28.27670 ? 32  ILE A CD1 1 
ATOM   262  N N   . TYR A 1 33  ? -29.79630 4.04571  -7.50641  1.000 35.78194 ? 33  TYR A N   1 
ATOM   263  C CA  . TYR A 1 33  ? -29.19849 4.10408  -6.17458  1.000 34.53172 ? 33  TYR A CA  1 
ATOM   264  C C   . TYR A 1 33  ? -28.15654 3.00655  -5.98797  1.000 40.01236 ? 33  TYR A C   1 
ATOM   265  O O   . TYR A 1 33  ? -27.02499 3.27784  -5.57688  1.000 37.80066 ? 33  TYR A O   1 
ATOM   266  C CB  . TYR A 1 33  ? -30.26372 3.99688  -5.07918  1.000 37.00506 ? 33  TYR A CB  1 
ATOM   267  C CG  . TYR A 1 33  ? -29.63801 3.69549  -3.72114  1.000 40.85752 ? 33  TYR A CG  1 
ATOM   268  C CD1 . TYR A 1 33  ? -29.11130 4.71583  -2.92926  1.000 34.36389 ? 33  TYR A CD1 1 
ATOM   269  C CD2 . TYR A 1 33  ? -29.53923 2.38876  -3.25188  1.000 34.94017 ? 33  TYR A CD2 1 
ATOM   270  C CE1 . TYR A 1 33  ? -28.51524 4.43855  -1.71959  1.000 34.30307 ? 33  TYR A CE1 1 
ATOM   271  C CE2 . TYR A 1 33  ? -28.95098 2.10787  -2.04049  1.000 42.19173 ? 33  TYR A CE2 1 
ATOM   272  C CZ  . TYR A 1 33  ? -28.43944 3.13488  -1.27620  1.000 32.88772 ? 33  TYR A CZ  1 
ATOM   273  O OH  . TYR A 1 33  ? -27.85042 2.85221  -0.07455  1.000 39.63729 ? 33  TYR A OH  1 
ATOM   274  N N   . GLU A 1 34  ? -28.51986 1.75329  -6.28892  1.000 36.78740 ? 34  GLU A N   1 
ATOM   275  C CA  . GLU A 1 34  ? -27.60371 0.64417  -6.03359  1.000 40.04388 ? 34  GLU A CA  1 
ATOM   276  C C   . GLU A 1 34  ? -26.36195 0.73560  -6.90916  1.000 41.55956 ? 34  GLU A C   1 
ATOM   277  O O   . GLU A 1 34  ? -25.24659 0.46262  -6.44790  1.000 44.22801 ? 34  GLU A O   1 
ATOM   278  C CB  . GLU A 1 34  ? -28.31237 -0.69315 -6.25472  1.000 47.74337 ? 34  GLU A CB  1 
ATOM   279  C CG  . GLU A 1 34  ? -27.72989 -1.80709 -5.40841  1.000 63.78531 ? 34  GLU A CG  1 
ATOM   280  C CD  . GLU A 1 34  ? -28.16212 -3.19321 -5.84650  1.000 72.88988 ? 34  GLU A CD  1 
ATOM   281  O OE1 . GLU A 1 34  ? -29.12506 -3.30755 -6.63984  1.000 66.53810 ? 34  GLU A OE1 1 
ATOM   282  O OE2 . GLU A 1 34  ? -27.52580 -4.17114 -5.39185  1.000 70.93950 ? 34  GLU A OE2 1 
ATOM   283  N N   . PHE A 1 35  ? -26.54116 1.12188  -8.17045  1.000 39.84343 ? 35  PHE A N   1 
ATOM   284  C CA  . PHE A 1 35  ? -25.42425 1.21226  -9.10724  1.000 46.73790 ? 35  PHE A CA  1 
ATOM   285  C C   . PHE A 1 35  ? -24.39990 2.24172  -8.64854  1.000 41.56147 ? 35  PHE A C   1 
ATOM   286  O O   . PHE A 1 35  ? -23.19059 1.99374  -8.69901  1.000 47.03189 ? 35  PHE A O   1 
ATOM   287  C CB  . PHE A 1 35  ? -25.95297 1.56539  -10.49453 1.000 43.28821 ? 35  PHE A CB  1 
ATOM   288  C CG  . PHE A 1 35  ? -24.90281 1.56626  -11.57589 1.000 45.75090 ? 35  PHE A CG  1 
ATOM   289  C CD1 . PHE A 1 35  ? -23.76479 0.77834  -11.47563 1.000 44.22281 ? 35  PHE A CD1 1 
ATOM   290  C CD2 . PHE A 1 35  ? -25.06592 2.35924  -12.69881 1.000 45.19219 ? 35  PHE A CD2 1 
ATOM   291  C CE1 . PHE A 1 35  ? -22.80433 0.78514  -12.49156 1.000 49.53994 ? 35  PHE A CE1 1 
ATOM   292  C CE2 . PHE A 1 35  ? -24.11455 2.37703  -13.71455 1.000 42.01991 ? 35  PHE A CE2 1 
ATOM   293  C CZ  . PHE A 1 35  ? -22.98340 1.58805  -13.60676 1.000 45.44093 ? 35  PHE A CZ  1 
ATOM   294  N N   . MET A 1 36  ? -24.86529 3.41028  -8.20027  1.000 37.46823 ? 36  MET A N   1 
ATOM   295  C CA  . MET A 1 36  ? -23.93602 4.45915  -7.79268  1.000 39.47566 ? 36  MET A CA  1 
ATOM   296  C C   . MET A 1 36  ? -23.25832 4.17060  -6.45521  1.000 39.14296 ? 36  MET A C   1 
ATOM   297  O O   . MET A 1 36  ? -22.22770 4.78340  -6.16179  1.000 53.64431 ? 36  MET A O   1 
ATOM   298  C CB  . MET A 1 36  ? -24.65523 5.80521  -7.74761  1.000 36.79326 ? 36  MET A CB  1 
ATOM   299  C CG  . MET A 1 36  ? -25.06135 6.28114  -9.12389  1.000 34.98260 ? 36  MET A CG  1 
ATOM   300  S SD  . MET A 1 36  ? -26.00998 7.80432  -9.19186  1.000 40.00053 ? 36  MET A SD  1 
ATOM   301  C CE  . MET A 1 36  ? -24.71680 9.01479  -8.90537  1.000 46.09013 ? 36  MET A CE  1 
ATOM   302  N N   . LYS A 1 37  ? -23.78623 3.24950  -5.64671  1.000 45.30483 ? 37  LYS A N   1 
ATOM   303  C CA  . LYS A 1 37  ? -23.09650 2.89876  -4.40460  1.000 46.39428 ? 37  LYS A CA  1 
ATOM   304  C C   . LYS A 1 37  ? -21.84942 2.04920  -4.63735  1.000 50.66023 ? 37  LYS A C   1 
ATOM   305  O O   . LYS A 1 37  ? -21.07053 1.86071  -3.69814  1.000 49.80558 ? 37  LYS A O   1 
ATOM   306  C CB  . LYS A 1 37  ? -24.04182 2.16421  -3.44578  1.000 42.48434 ? 37  LYS A CB  1 
ATOM   307  C CG  . LYS A 1 37  ? -25.21610 2.99165  -2.95053  1.000 40.63846 ? 37  LYS A CG  1 
ATOM   308  C CD  . LYS A 1 37  ? -24.76463 4.28512  -2.27724  1.000 47.23199 ? 37  LYS A CD  1 
ATOM   309  C CE  . LYS A 1 37  ? -24.45335 4.10573  -0.79993  1.000 48.67273 ? 37  LYS A CE  1 
ATOM   310  N NZ  . LYS A 1 37  ? -24.29998 5.41922  -0.09887  1.000 43.85827 ? 37  LYS A NZ  1 
ATOM   311  N N   . ARG A 1 38  ? -21.63141 1.54400  -5.85012  1.000 54.03909 ? 38  ARG A N   1 
ATOM   312  C CA  . ARG A 1 38  ? -20.48326 0.69378  -6.14051  1.000 59.69144 ? 38  ARG A CA  1 
ATOM   313  C C   . ARG A 1 38  ? -19.25528 1.52078  -6.51659  1.000 65.09653 ? 38  ARG A C   1 
ATOM   314  O O   . ARG A 1 38  ? -19.34672 2.70207  -6.86095  1.000 67.43651 ? 38  ARG A O   1 
ATOM   315  C CB  . ARG A 1 38  ? -20.80463 -0.28752 -7.26834  1.000 62.73713 ? 38  ARG A CB  1 
ATOM   316  C CG  . ARG A 1 38  ? -21.79425 -1.36557 -6.88361  1.000 61.12777 ? 38  ARG A CG  1 
ATOM   317  C CD  . ARG A 1 38  ? -22.08186 -2.27831 -8.05291  1.000 52.18318 ? 38  ARG A CD  1 
ATOM   318  N NE  . ARG A 1 38  ? -20.98294 -3.19309 -8.33758  1.000 59.38251 ? 38  ARG A NE  1 
ATOM   319  C CZ  . ARG A 1 38  ? -20.83669 -4.38118 -7.76729  1.000 56.38332 ? 38  ARG A CZ  1 
ATOM   320  N NH1 . ARG A 1 38  ? -21.67531 -4.80752 -6.83656  1.000 57.33153 ? 38  ARG A NH1 1 
ATOM   321  N NH2 . ARG A 1 38  ? -19.82509 -5.16100 -8.14089  1.000 52.75973 ? 38  ARG A NH2 1 
ATOM   322  N N   . ASP A 1 39  ? -18.09450 0.87079  -6.45264  1.000 76.56139 ? 39  ASP A N   1 
ATOM   323  C CA  . ASP A 1 39  ? -16.82173 1.51180  -6.76982  1.000 79.00493 ? 39  ASP A CA  1 
ATOM   324  C C   . ASP A 1 39  ? -16.52085 1.43962  -8.26423  1.000 86.22439 ? 39  ASP A C   1 
ATOM   325  O O   . ASP A 1 39  ? -16.50348 0.35994  -8.85845  1.000 92.73600 ? 39  ASP A O   1 
ATOM   326  C CB  . ASP A 1 39  ? -15.68616 0.86397  -5.97391  1.000 78.42286 ? 39  ASP A CB  1 
ATOM   327  O OXT . ASP A 1 39  ? -16.28250 2.46039  -8.91182  1.000 89.74260 ? 39  ASP A OXT 1 
ATOM   328  N N   . ASN B 2 2   ? -53.10612 18.27256 30.70021  1.000 67.98614 ? 334 ASN B N   1 
ATOM   329  C CA  . ASN B 2 2   ? -52.84917 18.67232 29.32035  1.000 67.01214 ? 334 ASN B CA  1 
ATOM   330  C C   . ASN B 2 2   ? -52.55896 17.45013 28.44878  1.000 55.80289 ? 334 ASN B C   1 
ATOM   331  O O   . ASN B 2 2   ? -51.53765 16.78665 28.61656  1.000 55.11079 ? 334 ASN B O   1 
ATOM   332  C CB  . ASN B 2 2   ? -51.67935 19.66314 29.26098  1.000 71.12519 ? 334 ASN B CB  1 
ATOM   333  C CG  . ASN B 2 2   ? -51.05629 19.91976 30.63053  1.000 81.85470 ? 334 ASN B CG  1 
ATOM   334  O OD1 . ASN B 2 2   ? -50.10683 19.24729 31.03358  1.000 82.69178 ? 334 ASN B OD1 1 
ATOM   335  N ND2 . ASN B 2 2   ? -51.59201 20.89823 31.34926  1.000 83.34705 ? 334 ASN B ND2 1 
ATOM   336  N N   . LEU B 2 3   ? -53.46119 17.14430 27.52159  1.000 58.29287 ? 335 LEU B N   1 
ATOM   337  C CA  . LEU B 2 3   ? -53.28138 15.98213 26.66238  1.000 57.65496 ? 335 LEU B CA  1 
ATOM   338  C C   . LEU B 2 3   ? -52.28587 16.28709 25.55066  1.000 47.69874 ? 335 LEU B C   1 
ATOM   339  O O   . LEU B 2 3   ? -52.34502 17.34546 24.91977  1.000 50.35554 ? 335 LEU B O   1 
ATOM   340  C CB  . LEU B 2 3   ? -54.61331 15.54343 26.05846  1.000 54.07227 ? 335 LEU B CB  1 
ATOM   341  C CG  . LEU B 2 3   ? -54.80256 14.02771 26.09572  1.000 63.31912 ? 335 LEU B CG  1 
ATOM   342  C CD1 . LEU B 2 3   ? -55.04369 13.56380 27.53544  1.000 54.60089 ? 335 LEU B CD1 1 
ATOM   343  C CD2 . LEU B 2 3   ? -55.92565 13.57752 25.17183  1.000 65.61307 ? 335 LEU B CD2 1 
ATOM   344  N N   . CYS B 2 4   ? -51.36472 15.35431 25.32006  1.000 45.09780 ? 336 CYS B N   1 
ATOM   345  C CA  . CYS B 2 4   ? -50.35425 15.55476 24.28938  1.000 44.36573 ? 336 CYS B CA  1 
ATOM   346  C C   . CYS B 2 4   ? -51.00559 15.54700 22.90680  1.000 43.44327 ? 336 CYS B C   1 
ATOM   347  O O   . CYS B 2 4   ? -51.90175 14.73801 22.64494  1.000 45.92952 ? 336 CYS B O   1 
ATOM   348  C CB  . CYS B 2 4   ? -49.27464 14.47411 24.35970  1.000 48.48573 ? 336 CYS B CB  1 
ATOM   349  S SG  . CYS B 2 4   ? -48.25517 14.48678 25.85581  1.000 50.18616 ? 336 CYS B SG  1 
ATOM   350  N N   . PRO B 2 5   ? -50.57103 16.42255 22.00142  1.000 49.28565 ? 337 PRO B N   1 
ATOM   351  C CA  . PRO B 2 5   ? -51.21639 16.54913 20.68314  1.000 43.85573 ? 337 PRO B CA  1 
ATOM   352  C C   . PRO B 2 5   ? -50.71155 15.51706 19.67948  1.000 48.21858 ? 337 PRO B C   1 
ATOM   353  O O   . PRO B 2 5   ? -50.15024 15.85247 18.63340  1.000 49.95949 ? 337 PRO B O   1 
ATOM   354  C CB  . PRO B 2 5   ? -50.84522 17.98090 20.28246  1.000 41.63134 ? 337 PRO B CB  1 
ATOM   355  C CG  . PRO B 2 5   ? -49.48450 18.16068 20.86331  1.000 46.44905 ? 337 PRO B CG  1 
ATOM   356  C CD  . PRO B 2 5   ? -49.45947 17.37677 22.15724  1.000 46.24779 ? 337 PRO B CD  1 
ATOM   357  N N   . PHE B 2 6   ? -50.91289 14.23581 19.99817  1.000 43.01444 ? 338 PHE B N   1 
ATOM   358  C CA  . PHE B 2 6   ? -50.50804 13.17997 19.07225  1.000 46.52546 ? 338 PHE B CA  1 
ATOM   359  C C   . PHE B 2 6   ? -51.45671 13.07316 17.88725  1.000 53.03924 ? 338 PHE B C   1 
ATOM   360  O O   . PHE B 2 6   ? -51.02456 12.72616 16.78064  1.000 48.47241 ? 338 PHE B O   1 
ATOM   361  C CB  . PHE B 2 6   ? -50.41782 11.83865 19.79785  1.000 41.09718 ? 338 PHE B CB  1 
ATOM   362  C CG  . PHE B 2 6   ? -49.12513 11.63639 20.52870  1.000 46.85984 ? 338 PHE B CG  1 
ATOM   363  C CD1 . PHE B 2 6   ? -47.92241 11.98761 19.93814  1.000 55.89153 ? 338 PHE B CD1 1 
ATOM   364  C CD2 . PHE B 2 6   ? -49.10981 11.11839 21.81209  1.000 62.09519 ? 338 PHE B CD2 1 
ATOM   365  C CE1 . PHE B 2 6   ? -46.72141 11.81024 20.60330  1.000 48.84060 ? 338 PHE B CE1 1 
ATOM   366  C CE2 . PHE B 2 6   ? -47.91000 10.93872 22.48611  1.000 64.77857 ? 338 PHE B CE2 1 
ATOM   367  C CZ  . PHE B 2 6   ? -46.71485 11.28680 21.88276  1.000 55.97940 ? 338 PHE B CZ  1 
ATOM   368  N N   . ASP B 2 7   ? -52.74473 13.35569 18.09871  1.000 47.96338 ? 339 ASP B N   1 
ATOM   369  C CA  . ASP B 2 7   ? -53.69827 13.32796 16.99714  1.000 57.85834 ? 339 ASP B CA  1 
ATOM   370  C C   . ASP B 2 7   ? -53.28935 14.29885 15.90063  1.000 56.93392 ? 339 ASP B C   1 
ATOM   371  O O   . ASP B 2 7   ? -53.45564 14.01318 14.70924  1.000 58.94931 ? 339 ASP B O   1 
ATOM   372  C CB  . ASP B 2 7   ? -55.09997 13.65724 17.50719  1.000 62.27149 ? 339 ASP B CB  1 
ATOM   373  C CG  . ASP B 2 7   ? -56.15685 13.51929 16.42824  1.000 79.47717 ? 339 ASP B CG  1 
ATOM   374  O OD1 . ASP B 2 7   ? -56.50351 12.36884 16.08731  1.000 87.44454 ? 339 ASP B OD1 1 
ATOM   375  O OD2 . ASP B 2 7   ? -56.63442 14.55550 15.91431  1.000 83.71705 ? 339 ASP B OD2 1 
ATOM   376  N N   . GLU B 2 8   ? -52.74286 15.45087 16.28398  1.000 55.51005 ? 340 GLU B N   1 
ATOM   377  C CA  . GLU B 2 8   ? -52.28107 16.41893 15.30033  1.000 48.74210 ? 340 GLU B CA  1 
ATOM   378  C C   . GLU B 2 8   ? -51.06161 15.91968 14.53880  1.000 53.28667 ? 340 GLU B C   1 
ATOM   379  O O   . GLU B 2 8   ? -50.78263 16.42081 13.44303  1.000 56.62122 ? 340 GLU B O   1 
ATOM   380  C CB  . GLU B 2 8   ? -51.97572 17.75614 15.97947  1.000 55.66268 ? 340 GLU B CB  1 
ATOM   381  C CG  . GLU B 2 8   ? -53.21885 18.54458 16.39931  1.000 60.31864 ? 340 GLU B CG  1 
ATOM   382  C CD  . GLU B 2 8   ? -54.09824 17.80499 17.40527  1.000 79.97449 ? 340 GLU B CD  1 
ATOM   383  O OE1 . GLU B 2 8   ? -53.58188 17.36797 18.46082  1.000 63.61024 ? 340 GLU B OE1 1 
ATOM   384  O OE2 . GLU B 2 8   ? -55.30909 17.64785 17.13145  1.000 89.28965 ? 340 GLU B OE2 1 
ATOM   385  N N   . VAL B 2 9   ? -50.34213 14.93745 15.08051  1.000 46.47267 ? 341 VAL B N   1 
ATOM   386  C CA  . VAL B 2 9   ? -49.23098 14.34666 14.34590  1.000 46.21107 ? 341 VAL B CA  1 
ATOM   387  C C   . VAL B 2 9   ? -49.72215 13.22269 13.44202  1.000 50.49589 ? 341 VAL B C   1 
ATOM   388  O O   . VAL B 2 9   ? -49.43956 13.20876 12.24016  1.000 42.48402 ? 341 VAL B O   1 
ATOM   389  C CB  . VAL B 2 9   ? -48.14285 13.85370 15.31517  1.000 50.64409 ? 341 VAL B CB  1 
ATOM   390  C CG1 . VAL B 2 9   ? -46.97006 13.28802 14.53819  1.000 44.79951 ? 341 VAL B CG1 1 
ATOM   391  C CG2 . VAL B 2 9   ? -47.68894 14.98461 16.22580  1.000 51.30101 ? 341 VAL B CG2 1 
ATOM   392  N N   . PHE B 2 10  ? -50.47915 12.27498 14.00251  1.000 47.78923 ? 342 PHE B N   1 
ATOM   393  C CA  . PHE B 2 10  ? -50.85964 11.07395 13.26373  1.000 37.30130 ? 342 PHE B CA  1 
ATOM   394  C C   . PHE B 2 10  ? -51.99700 11.31208 12.27937  1.000 51.72494 ? 342 PHE B C   1 
ATOM   395  O O   . PHE B 2 10  ? -52.02722 10.67849 11.21628  1.000 45.24032 ? 342 PHE B O   1 
ATOM   396  C CB  . PHE B 2 10  ? -51.25195 9.96178  14.23691  1.000 36.78748 ? 342 PHE B CB  1 
ATOM   397  C CG  . PHE B 2 10  ? -50.08524 9.33374  14.93895  1.000 42.18456 ? 342 PHE B CG  1 
ATOM   398  C CD1 . PHE B 2 10  ? -49.55234 9.90665  16.08824  1.000 41.46661 ? 342 PHE B CD1 1 
ATOM   399  C CD2 . PHE B 2 10  ? -49.52408 8.16360  14.45871  1.000 35.00722 ? 342 PHE B CD2 1 
ATOM   400  C CE1 . PHE B 2 10  ? -48.47432 9.32687  16.73384  1.000 37.70059 ? 342 PHE B CE1 1 
ATOM   401  C CE2 . PHE B 2 10  ? -48.45100 7.58046  15.09333  1.000 34.24623 ? 342 PHE B CE2 1 
ATOM   402  C CZ  . PHE B 2 10  ? -47.92463 8.16275  16.24649  1.000 42.56682 ? 342 PHE B CZ  1 
ATOM   403  N N   . ASN B 2 11  ? -52.94062 12.19607 12.60299  1.000 48.67855 ? 343 ASN B N   1 
ATOM   404  C CA  . ASN B 2 11  ? -54.08932 12.44626 11.74051  1.000 56.68476 ? 343 ASN B CA  1 
ATOM   405  C C   . ASN B 2 11  ? -53.99474 13.78395 11.01362  1.000 51.28447 ? 343 ASN B C   1 
ATOM   406  O O   . ASN B 2 11  ? -55.01356 14.30495 10.54911  1.000 55.63076 ? 343 ASN B O   1 
ATOM   407  C CB  . ASN B 2 11  ? -55.38889 12.35812 12.54557  1.000 57.84322 ? 343 ASN B CB  1 
ATOM   408  C CG  . ASN B 2 11  ? -55.77478 10.92137 12.87291  1.000 66.09668 ? 343 ASN B CG  1 
ATOM   409  O OD1 . ASN B 2 11  ? -55.44270 9.99480  12.13013  1.000 68.46775 ? 343 ASN B OD1 1 
ATOM   410  N ND2 . ASN B 2 11  ? -56.47856 10.73027 13.98536  1.000 54.88938 ? 343 ASN B ND2 1 
ATOM   411  N N   . ALA B 2 12  ? -52.79084 14.34379 10.89642  1.000 51.29977 ? 344 ALA B N   1 
ATOM   412  C CA  . ALA B 2 12  ? -52.60553 15.56615 10.12765  1.000 48.03459 ? 344 ALA B CA  1 
ATOM   413  C C   . ALA B 2 12  ? -53.05007 15.35299 8.68542   1.000 51.67488 ? 344 ALA B C   1 
ATOM   414  O O   . ALA B 2 12  ? -52.96734 14.24783 8.14178   1.000 46.06338 ? 344 ALA B O   1 
ATOM   415  C CB  . ALA B 2 12  ? -51.14301 16.00769 10.16266  1.000 46.86329 ? 344 ALA B CB  1 
ATOM   416  N N   . THR B 2 13  ? -53.54452 16.42613 8.06960   1.000 57.34086 ? 345 THR B N   1 
ATOM   417  C CA  . THR B 2 13  ? -54.06964 16.31618 6.71192   1.000 54.13006 ? 345 THR B CA  1 
ATOM   418  C C   . THR B 2 13  ? -52.95491 16.03632 5.71049   1.000 54.12694 ? 345 THR B C   1 
ATOM   419  O O   . THR B 2 13  ? -53.04060 15.08815 4.92176   1.000 48.76500 ? 345 THR B O   1 
ATOM   420  C CB  . THR B 2 13  ? -54.82997 17.58899 6.33553   1.000 60.18594 ? 345 THR B CB  1 
ATOM   421  O OG1 . THR B 2 13  ? -55.93714 17.76881 7.22880   1.000 53.80272 ? 345 THR B OG1 1 
ATOM   422  C CG2 . THR B 2 13  ? -55.34991 17.49343 4.90707   1.000 57.73098 ? 345 THR B CG2 1 
ATOM   423  N N   . ARG B 2 14  ? -51.89901 16.84460 5.72980   1.000 56.62186 ? 346 ARG B N   1 
ATOM   424  C CA  . ARG B 2 14  ? -50.77481 16.68076 4.82012   1.000 57.04656 ? 346 ARG B CA  1 
ATOM   425  C C   . ARG B 2 14  ? -49.53244 16.27859 5.60389   1.000 52.88199 ? 346 ARG B C   1 
ATOM   426  O O   . ARG B 2 14  ? -49.29636 16.76897 6.71258   1.000 58.20893 ? 346 ARG B O   1 
ATOM   427  C CB  . ARG B 2 14  ? -50.51362 17.96870 4.01932   1.000 66.92159 ? 346 ARG B CB  1 
ATOM   428  C CG  . ARG B 2 14  ? -49.69333 19.03854 4.74485   1.000 67.32818 ? 346 ARG B CG  1 
ATOM   429  C CD  . ARG B 2 14  ? -50.07729 20.45602 4.32280   1.000 70.99671 ? 346 ARG B CD  1 
ATOM   430  N NE  . ARG B 2 14  ? -49.82054 20.73479 2.91302   1.000 80.34082 ? 346 ARG B NE  1 
ATOM   431  C CZ  . ARG B 2 14  ? -48.66599 21.18078 2.43323   1.000 81.43145 ? 346 ARG B CZ  1 
ATOM   432  N NH1 . ARG B 2 14  ? -47.61415 21.36043 3.21788   1.000 77.76125 ? 346 ARG B NH1 1 
ATOM   433  N NH2 . ARG B 2 14  ? -48.56445 21.45553 1.13400   1.000 66.10956 ? 346 ARG B NH2 1 
ATOM   434  N N   . PHE B 2 15  ? -48.76440 15.35652 5.03907   1.000 43.10146 ? 347 PHE B N   1 
ATOM   435  C CA  . PHE B 2 15  ? -47.48675 14.94384 5.59434   1.000 44.92391 ? 347 PHE B CA  1 
ATOM   436  C C   . PHE B 2 15  ? -46.35622 15.56098 4.78329   1.000 42.30546 ? 347 PHE B C   1 
ATOM   437  O O   . PHE B 2 15  ? -46.55616 16.02887 3.66042   1.000 38.20092 ? 347 PHE B O   1 
ATOM   438  C CB  . PHE B 2 15  ? -47.36998 13.41517 5.60526   1.000 37.76819 ? 347 PHE B CB  1 
ATOM   439  C CG  . PHE B 2 15  ? -47.86566 12.77489 6.87699   1.000 37.99437 ? 347 PHE B CG  1 
ATOM   440  C CD1 . PHE B 2 15  ? -49.08407 13.13755 7.42188   1.000 44.39191 ? 347 PHE B CD1 1 
ATOM   441  C CD2 . PHE B 2 15  ? -47.12062 11.79645 7.50966   1.000 37.60705 ? 347 PHE B CD2 1 
ATOM   442  C CE1 . PHE B 2 15  ? -49.55036 12.55078 8.59551   1.000 39.79277 ? 347 PHE B CE1 1 
ATOM   443  C CE2 . PHE B 2 15  ? -47.57294 11.20648 8.69768   1.000 39.10745 ? 347 PHE B CE2 1 
ATOM   444  C CZ  . PHE B 2 15  ? -48.79612 11.57899 9.22660   1.000 38.35853 ? 347 PHE B CZ  1 
ATOM   445  N N   . ALA B 2 16  ? -45.16313 15.55861 5.36890   1.000 38.34485 ? 348 ALA B N   1 
ATOM   446  C CA  . ALA B 2 16  ? -43.98303 16.08052 4.69495   1.000 36.34616 ? 348 ALA B CA  1 
ATOM   447  C C   . ALA B 2 16  ? -43.39433 15.04744 3.73823   1.000 37.57086 ? 348 ALA B C   1 
ATOM   448  O O   . ALA B 2 16  ? -43.61790 13.83848 3.87157   1.000 30.34361 ? 348 ALA B O   1 
ATOM   449  C CB  . ALA B 2 16  ? -42.92477 16.48829 5.72057   1.000 38.78568 ? 348 ALA B CB  1 
ATOM   450  N N   . SER B 2 17  ? -42.66800 15.53930 2.73094   1.000 38.81689 ? 349 SER B N   1 
ATOM   451  C CA  . SER B 2 17  ? -41.78427 14.66274 1.97447   1.000 30.89997 ? 349 SER B CA  1 
ATOM   452  C C   . SER B 2 17  ? -40.64328 14.19865 2.87510   1.000 34.47613 ? 349 SER B C   1 
ATOM   453  O O   . SER B 2 17  ? -40.17745 14.93287 3.74745   1.000 32.49026 ? 349 SER B O   1 
ATOM   454  C CB  . SER B 2 17  ? -41.22845 15.37590 0.74427   1.000 33.12920 ? 349 SER B CB  1 
ATOM   455  O OG  . SER B 2 17  ? -42.25771 15.60285 -0.20133  1.000 35.77471 ? 349 SER B OG  1 
ATOM   456  N N   . VAL B 2 18  ? -40.19431 12.96200 2.65375   1.000 31.35547 ? 350 VAL B N   1 
ATOM   457  C CA  . VAL B 2 18  ? -39.18115 12.36167 3.51318   1.000 29.95694 ? 350 VAL B CA  1 
ATOM   458  C C   . VAL B 2 18  ? -37.88690 13.17620 3.50902   1.000 31.31598 ? 350 VAL B C   1 
ATOM   459  O O   . VAL B 2 18  ? -37.25428 13.35028 4.55013   1.000 32.70614 ? 350 VAL B O   1 
ATOM   460  C CB  . VAL B 2 18  ? -38.95392 10.89159 3.10758   1.000 25.87870 ? 350 VAL B CB  1 
ATOM   461  C CG1 . VAL B 2 18  ? -38.47342 10.77927 1.65427   1.000 25.56265 ? 350 VAL B CG1 1 
ATOM   462  C CG2 . VAL B 2 18  ? -37.98651 10.21356 4.05100   1.000 31.69508 ? 350 VAL B CG2 1 
ATOM   463  N N   . TYR B 2 19  ? -37.47313 13.71798 2.35545   1.000 30.44266 ? 351 TYR B N   1 
ATOM   464  C CA  . TYR B 2 19  ? -36.20753 14.45076 2.37507   1.000 27.65412 ? 351 TYR B CA  1 
ATOM   465  C C   . TYR B 2 19  ? -36.31732 15.72616 3.20850   1.000 30.06637 ? 351 TYR B C   1 
ATOM   466  O O   . TYR B 2 19  ? -35.31990 16.18661 3.77049   1.000 36.81324 ? 351 TYR B O   1 
ATOM   467  C CB  . TYR B 2 19  ? -35.74472 14.76678 0.94386   1.000 31.69327 ? 351 TYR B CB  1 
ATOM   468  C CG  . TYR B 2 19  ? -36.29105 16.05526 0.38871   1.000 34.18167 ? 351 TYR B CG  1 
ATOM   469  C CD1 . TYR B 2 19  ? -37.55184 16.10301 -0.19547  1.000 35.08008 ? 351 TYR B CD1 1 
ATOM   470  C CD2 . TYR B 2 19  ? -35.54204 17.22581 0.43181   1.000 31.39592 ? 351 TYR B CD2 1 
ATOM   471  C CE1 . TYR B 2 19  ? -38.06400 17.28793 -0.71108  1.000 34.27921 ? 351 TYR B CE1 1 
ATOM   472  C CE2 . TYR B 2 19  ? -36.04684 18.41839 -0.07787  1.000 32.21849 ? 351 TYR B CE2 1 
ATOM   473  C CZ  . TYR B 2 19  ? -37.30638 18.44285 -0.64798  1.000 35.27548 ? 351 TYR B CZ  1 
ATOM   474  O OH  . TYR B 2 19  ? -37.81849 19.61861 -1.17058  1.000 38.06804 ? 351 TYR B OH  1 
ATOM   475  N N   . ALA B 2 20  ? -37.51330 16.29549 3.30970   1.000 31.99865 ? 352 ALA B N   1 
ATOM   476  C CA  . ALA B 2 20  ? -37.78182 17.47787 4.11627   1.000 36.69981 ? 352 ALA B CA  1 
ATOM   477  C C   . ALA B 2 20  ? -38.67379 17.11032 5.29582   1.000 32.16201 ? 352 ALA B C   1 
ATOM   478  O O   . ALA B 2 20  ? -39.68173 17.76656 5.56371   1.000 31.09950 ? 352 ALA B O   1 
ATOM   479  C CB  . ALA B 2 20  ? -38.42081 18.57800 3.27293   1.000 31.67861 ? 352 ALA B CB  1 
ATOM   480  N N   . TRP B 2 21  ? -38.32328 16.01679 5.96784   1.000 31.08968 ? 353 TRP B N   1 
ATOM   481  C CA  . TRP B 2 21  ? -39.16292 15.45042 7.01715   1.000 37.56248 ? 353 TRP B CA  1 
ATOM   482  C C   . TRP B 2 21  ? -39.44319 16.46953 8.11559   1.000 32.97529 ? 353 TRP B C   1 
ATOM   483  O O   . TRP B 2 21  ? -38.60089 17.31192 8.43128   1.000 34.27212 ? 353 TRP B O   1 
ATOM   484  C CB  . TRP B 2 21  ? -38.49379 14.20437 7.60444   1.000 31.61627 ? 353 TRP B CB  1 
ATOM   485  C CG  . TRP B 2 21  ? -37.04225 14.37401 8.01833   1.000 31.72882 ? 353 TRP B CG  1 
ATOM   486  C CD1 . TRP B 2 21  ? -35.94348 14.22885 7.22674   1.000 32.43389 ? 353 TRP B CD1 1 
ATOM   487  C CD2 . TRP B 2 21  ? -36.55039 14.67846 9.33222   1.000 32.61616 ? 353 TRP B CD2 1 
ATOM   488  N NE1 . TRP B 2 21  ? -34.79876 14.44414 7.94680   1.000 29.73065 ? 353 TRP B NE1 1 
ATOM   489  C CE2 . TRP B 2 21  ? -35.14047 14.70733 9.25195   1.000 31.18783 ? 353 TRP B CE2 1 
ATOM   490  C CE3 . TRP B 2 21  ? -37.16293 14.93051 10.56056  1.000 35.99071 ? 353 TRP B CE3 1 
ATOM   491  C CZ2 . TRP B 2 21  ? -34.33786 14.99072 10.34475  1.000 34.88034 ? 353 TRP B CZ2 1 
ATOM   492  C CZ3 . TRP B 2 21  ? -36.36285 15.19581 11.65609  1.000 32.02147 ? 353 TRP B CZ3 1 
ATOM   493  C CH2 . TRP B 2 21  ? -34.96347 15.22421 11.54346  1.000 33.29458 ? 353 TRP B CH2 1 
ATOM   494  N N   . ASN B 2 22  ? -40.65377 16.39888 8.66993   1.000 31.80911 ? 354 ASN B N   1 
ATOM   495  C CA  . ASN B 2 22  ? -41.12179 17.32118 9.69788   1.000 32.98767 ? 354 ASN B CA  1 
ATOM   496  C C   . ASN B 2 22  ? -40.81479 16.78395 11.09170  1.000 33.02945 ? 354 ASN B C   1 
ATOM   497  O O   . ASN B 2 22  ? -40.88234 15.57505 11.33378  1.000 30.07369 ? 354 ASN B O   1 
ATOM   498  C CB  . ASN B 2 22  ? -42.62844 17.54472 9.55762   1.000 33.25388 ? 354 ASN B CB  1 
ATOM   499  C CG  . ASN B 2 22  ? -43.17126 18.51503 10.58579  1.000 50.73066 ? 354 ASN B CG  1 
ATOM   500  O OD1 . ASN B 2 22  ? -43.77968 18.11263 11.58730  1.000 51.68332 ? 354 ASN B OD1 1 
ATOM   501  N ND2 . ASN B 2 22  ? -42.93773 19.80394 10.35803  1.000 49.49684 ? 354 ASN B ND2 1 
ATOM   502  N N   . ARG B 2 23  ? -40.47465 17.69045 12.00951  1.000 33.90727 ? 355 ARG B N   1 
ATOM   503  C CA  . ARG B 2 23  ? -40.28269 17.34402 13.41504  1.000 31.22507 ? 355 ARG B CA  1 
ATOM   504  C C   . ARG B 2 23  ? -41.17653 18.21907 14.27372  1.000 34.95189 ? 355 ARG B C   1 
ATOM   505  O O   . ARG B 2 23  ? -41.22353 19.43717 14.08271  1.000 34.55306 ? 355 ARG B O   1 
ATOM   506  C CB  . ARG B 2 23  ? -38.82936 17.51437 13.87321  1.000 27.50300 ? 355 ARG B CB  1 
ATOM   507  C CG  . ARG B 2 23  ? -38.66597 17.34808 15.40416  1.000 28.56549 ? 355 ARG B CG  1 
ATOM   508  C CD  . ARG B 2 23  ? -37.22875 17.15197 15.78044  1.000 28.90200 ? 355 ARG B CD  1 
ATOM   509  N NE  . ARG B 2 23  ? -36.78875 15.79105 15.51481  1.000 33.15249 ? 355 ARG B NE  1 
ATOM   510  C CZ  . ARG B 2 23  ? -35.59193 15.32845 15.84056  1.000 35.92051 ? 355 ARG B CZ  1 
ATOM   511  N NH1 . ARG B 2 23  ? -34.71289 16.07926 16.48966  1.000 38.30174 ? 355 ARG B NH1 1 
ATOM   512  N NH2 . ARG B 2 23  ? -35.27445 14.07733 15.53205  1.000 35.43363 ? 355 ARG B NH2 1 
ATOM   513  N N   . LYS B 2 24  ? -41.87684 17.59354 15.21536  1.000 33.66442 ? 356 LYS B N   1 
ATOM   514  C CA  . LYS B 2 24  ? -42.72853 18.28558 16.17122  1.000 37.24222 ? 356 LYS B CA  1 
ATOM   515  C C   . LYS B 2 24  ? -42.22672 17.94794 17.56429  1.000 32.75617 ? 356 LYS B C   1 
ATOM   516  O O   . LYS B 2 24  ? -42.01791 16.77290 17.88365  1.000 35.02587 ? 356 LYS B O   1 
ATOM   517  C CB  . LYS B 2 24  ? -44.19437 17.87312 15.99872  1.000 35.44422 ? 356 LYS B CB  1 
ATOM   518  C CG  . LYS B 2 24  ? -45.11133 18.26270 17.14313  1.000 50.03974 ? 356 LYS B CG  1 
ATOM   519  C CD  . LYS B 2 24  ? -45.61166 19.69236 17.02276  1.000 47.25784 ? 356 LYS B CD  1 
ATOM   520  C CE  . LYS B 2 24  ? -46.68372 19.97980 18.06976  1.000 54.02216 ? 356 LYS B CE  1 
ATOM   521  N NZ  . LYS B 2 24  ? -46.97645 21.43627 18.16292  1.000 52.65886 ? 356 LYS B NZ  1 
ATOM   522  N N   . ARG B 2 25  ? -41.98844 18.97379 18.37447  1.000 32.51374 ? 357 ARG B N   1 
ATOM   523  C CA  . ARG B 2 25  ? -41.58821 18.76684 19.75616  1.000 35.36535 ? 357 ARG B CA  1 
ATOM   524  C C   . ARG B 2 25  ? -42.83976 18.65753 20.61236  1.000 34.55763 ? 357 ARG B C   1 
ATOM   525  O O   . ARG B 2 25  ? -43.72021 19.52224 20.54789  1.000 33.67436 ? 357 ARG B O   1 
ATOM   526  C CB  . ARG B 2 25  ? -40.69289 19.90476 20.24918  1.000 35.14906 ? 357 ARG B CB  1 
ATOM   527  C CG  . ARG B 2 25  ? -40.29813 19.77365 21.72947  1.000 36.20769 ? 357 ARG B CG  1 
ATOM   528  C CD  . ARG B 2 25  ? -39.29415 20.84160 22.14193  1.000 33.34072 ? 357 ARG B CD  1 
ATOM   529  N NE  . ARG B 2 25  ? -39.78715 22.18729 21.87442  1.000 46.51077 ? 357 ARG B NE  1 
ATOM   530  C CZ  . ARG B 2 25  ? -40.69822 22.82413 22.60071  1.000 51.84606 ? 357 ARG B CZ  1 
ATOM   531  N NH1 . ARG B 2 25  ? -41.27520 22.25425 23.65036  1.000 48.70094 ? 357 ARG B NH1 1 
ATOM   532  N NH2 . ARG B 2 25  ? -41.04454 24.06269 22.26269  1.000 46.98578 ? 357 ARG B NH2 1 
ATOM   533  N N   . ILE B 2 26  ? -42.92867 17.57586 21.38220  1.000 34.98920 ? 358 ILE B N   1 
ATOM   534  C CA  . ILE B 2 26  ? -44.04365 17.32129 22.28585  1.000 34.21193 ? 358 ILE B CA  1 
ATOM   535  C C   . ILE B 2 26  ? -43.53553 17.54347 23.70460  1.000 31.14221 ? 358 ILE B C   1 
ATOM   536  O O   . ILE B 2 26  ? -42.50795 16.97472 24.09111  1.000 33.46120 ? 358 ILE B O   1 
ATOM   537  C CB  . ILE B 2 26  ? -44.59532 15.89252 22.11837  1.000 35.42070 ? 358 ILE B CB  1 
ATOM   538  C CG1 . ILE B 2 26  ? -45.07679 15.64821 20.68131  1.000 37.36334 ? 358 ILE B CG1 1 
ATOM   539  C CG2 . ILE B 2 26  ? -45.71438 15.62711 23.12717  1.000 44.14349 ? 358 ILE B CG2 1 
ATOM   540  C CD1 . ILE B 2 26  ? -46.31943 16.39631 20.34297  1.000 44.72191 ? 358 ILE B CD1 1 
ATOM   541  N N   . SER B 2 27  ? -44.23361 18.37796 24.47122  1.000 38.08744 ? 359 SER B N   1 
ATOM   542  C CA  . SER B 2 27  ? -43.75123 18.67197 25.81834  1.000 39.66368 ? 359 SER B CA  1 
ATOM   543  C C   . SER B 2 27  ? -44.89883 19.10524 26.72044  1.000 39.25890 ? 359 SER B C   1 
ATOM   544  O O   . SER B 2 27  ? -45.95873 19.53061 26.25572  1.000 41.87842 ? 359 SER B O   1 
ATOM   545  C CB  . SER B 2 27  ? -42.65872 19.74533 25.79471  1.000 44.93911 ? 359 SER B CB  1 
ATOM   546  O OG  . SER B 2 27  ? -43.19964 21.00837 25.46373  1.000 51.19093 ? 359 SER B OG  1 
ATOM   547  N N   . ASN B 2 28  ? -44.65719 18.99045 28.02915  1.000 41.83189 ? 360 ASN B N   1 
ATOM   548  C CA  . ASN B 2 28  ? -45.54595 19.50889 29.07142  1.000 51.91275 ? 360 ASN B CA  1 
ATOM   549  C C   . ASN B 2 28  ? -46.98234 19.01647 28.87381  1.000 38.05724 ? 360 ASN B C   1 
ATOM   550  O O   . ASN B 2 28  ? -47.91848 19.79517 28.68544  1.000 49.15634 ? 360 ASN B O   1 
ATOM   551  C CB  . ASN B 2 28  ? -45.48149 21.04092 29.10982  1.000 47.14378 ? 360 ASN B CB  1 
ATOM   552  C CG  . ASN B 2 28  ? -45.52428 21.59711 30.52599  1.000 69.91382 ? 360 ASN B CG  1 
ATOM   553  O OD1 . ASN B 2 28  ? -45.19300 20.90490 31.48862  1.000 66.62662 ? 360 ASN B OD1 1 
ATOM   554  N ND2 . ASN B 2 28  ? -45.93017 22.85710 30.65676  1.000 77.26368 ? 360 ASN B ND2 1 
ATOM   555  N N   . CYS B 2 29  ? -47.14567 17.69587 28.91969  1.000 39.35604 ? 361 CYS B N   1 
ATOM   556  C CA  . CYS B 2 29  ? -48.44050 17.09738 28.61719  1.000 39.98441 ? 361 CYS B CA  1 
ATOM   557  C C   . CYS B 2 29  ? -48.44427 15.63154 29.02929  1.000 39.92708 ? 361 CYS B C   1 
ATOM   558  O O   . CYS B 2 29  ? -47.39287 15.03311 29.28032  1.000 38.89651 ? 361 CYS B O   1 
ATOM   559  C CB  . CYS B 2 29  ? -48.77625 17.22480 27.12857  1.000 54.17109 ? 361 CYS B CB  1 
ATOM   560  S SG  . CYS B 2 29  ? -47.58476 16.40007 26.04321  1.000 44.60513 ? 361 CYS B SG  1 
ATOM   561  N N   . VAL B 2 30  ? -49.65036 15.05621 29.06766  1.000 40.13193 ? 362 VAL B N   1 
ATOM   562  C CA  . VAL B 2 30  ? -49.86653 13.64221 29.36827  1.000 38.19746 ? 362 VAL B CA  1 
ATOM   563  C C   . VAL B 2 30  ? -50.38628 12.94942 28.11566  1.000 42.67952 ? 362 VAL B C   1 
ATOM   564  O O   . VAL B 2 30  ? -51.28372 13.46481 27.44115  1.000 44.35403 ? 362 VAL B O   1 
ATOM   565  C CB  . VAL B 2 30  ? -50.85656 13.45410 30.53469  1.000 50.15168 ? 362 VAL B CB  1 
ATOM   566  C CG1 . VAL B 2 30  ? -51.20599 11.98154 30.70808  1.000 43.70234 ? 362 VAL B CG1 1 
ATOM   567  C CG2 . VAL B 2 30  ? -50.26884 14.01107 31.80861  1.000 44.98386 ? 362 VAL B CG2 1 
ATOM   568  N N   . ALA B 2 31  ? -49.84278 11.76921 27.82400  1.000 43.11153 ? 363 ALA B N   1 
ATOM   569  C CA  . ALA B 2 31  ? -50.19198 11.01968 26.62629  1.000 58.50287 ? 363 ALA B CA  1 
ATOM   570  C C   . ALA B 2 31  ? -50.59153 9.59394  26.97610  1.000 54.66419 ? 363 ALA B C   1 
ATOM   571  O O   . ALA B 2 31  ? -49.92081 8.93229  27.77161  1.000 51.10117 ? 363 ALA B O   1 
ATOM   572  C CB  . ALA B 2 31  ? -49.01981 10.98690 25.64510  1.000 53.34064 ? 363 ALA B CB  1 
ATOM   573  N N   . ASP B 2 32  ? -51.66730 9.11000  26.35252  1.000 62.82103 ? 364 ASP B N   1 
ATOM   574  C CA  . ASP B 2 32  ? -52.09437 7.71876  26.49861  1.000 69.52822 ? 364 ASP B CA  1 
ATOM   575  C C   . ASP B 2 32  ? -51.55912 6.94487  25.29715  1.000 63.50212 ? 364 ASP B C   1 
ATOM   576  O O   . ASP B 2 32  ? -52.10988 7.02205  24.19579  1.000 63.57643 ? 364 ASP B O   1 
ATOM   577  C CB  . ASP B 2 32  ? -53.61187 7.61252  26.61125  1.000 69.97634 ? 364 ASP B CB  1 
ATOM   578  C CG  . ASP B 2 32  ? -54.06635 6.26035  27.14453  1.000 68.17020 ? 364 ASP B CG  1 
ATOM   579  O OD1 . ASP B 2 32  ? -53.27918 5.29012  27.08766  1.000 66.18574 ? 364 ASP B OD1 1 
ATOM   580  O OD2 . ASP B 2 32  ? -55.21693 6.16643  27.62197  1.000 76.02794 ? 364 ASP B OD2 1 
ATOM   581  N N   . TYR B 2 33  ? -50.47963 6.19196  25.51820  1.000 56.00918 ? 365 TYR B N   1 
ATOM   582  C CA  . TYR B 2 33  ? -49.81789 5.49006  24.42603  1.000 63.12795 ? 365 TYR B CA  1 
ATOM   583  C C   . TYR B 2 33  ? -50.55604 4.22185  24.01638  1.000 77.33200 ? 365 TYR B C   1 
ATOM   584  O O   . TYR B 2 33  ? -50.40643 3.77139  22.87450  1.000 71.09070 ? 365 TYR B O   1 
ATOM   585  C CB  . TYR B 2 33  ? -48.37518 5.15437  24.80953  1.000 61.74081 ? 365 TYR B CB  1 
ATOM   586  C CG  . TYR B 2 33  ? -47.48351 6.36708  24.95320  1.000 62.84602 ? 365 TYR B CG  1 
ATOM   587  C CD1 . TYR B 2 33  ? -46.92374 6.97629  23.83814  1.000 55.93280 ? 365 TYR B CD1 1 
ATOM   588  C CD2 . TYR B 2 33  ? -47.20286 6.90300  26.20156  1.000 50.09446 ? 365 TYR B CD2 1 
ATOM   589  C CE1 . TYR B 2 33  ? -46.11215 8.08080  23.96204  1.000 51.14851 ? 365 TYR B CE1 1 
ATOM   590  C CE2 . TYR B 2 33  ? -46.39121 8.00649  26.33536  1.000 50.58264 ? 365 TYR B CE2 1 
ATOM   591  C CZ  . TYR B 2 33  ? -45.84751 8.59315  25.21214  1.000 55.63779 ? 365 TYR B CZ  1 
ATOM   592  O OH  . TYR B 2 33  ? -45.03720 9.69466  25.33793  1.000 52.85740 ? 365 TYR B OH  1 
ATOM   593  N N   . SER B 2 34  ? -51.34273 3.62613  24.91950  1.000 73.17255 ? 366 SER B N   1 
ATOM   594  C CA  . SER B 2 34  ? -52.14657 2.46991  24.53149  1.000 72.03072 ? 366 SER B CA  1 
ATOM   595  C C   . SER B 2 34  ? -53.16406 2.84010  23.45775  1.000 76.55185 ? 366 SER B C   1 
ATOM   596  O O   . SER B 2 34  ? -53.55071 1.98951  22.64583  1.000 72.78099 ? 366 SER B O   1 
ATOM   597  C CB  . SER B 2 34  ? -52.84578 1.87679  25.75557  1.000 77.93458 ? 366 SER B CB  1 
ATOM   598  O OG  . SER B 2 34  ? -53.78136 2.78997  26.30171  1.000 80.40838 ? 366 SER B OG  1 
ATOM   599  N N   . VAL B 2 35  ? -53.60004 4.10360  23.43409  1.000 69.18149 ? 367 VAL B N   1 
ATOM   600  C CA  . VAL B 2 35  ? -54.45488 4.59245  22.35561  1.000 65.32550 ? 367 VAL B CA  1 
ATOM   601  C C   . VAL B 2 35  ? -53.73316 4.52021  21.01439  1.000 72.06888 ? 367 VAL B C   1 
ATOM   602  O O   . VAL B 2 35  ? -54.35557 4.25503  19.97654  1.000 73.99820 ? 367 VAL B O   1 
ATOM   603  C CB  . VAL B 2 35  ? -54.92985 6.02209  22.68391  1.000 65.38346 ? 367 VAL B CB  1 
ATOM   604  C CG1 . VAL B 2 35  ? -55.50494 6.70426  21.46009  1.000 55.00939 ? 367 VAL B CG1 1 
ATOM   605  C CG2 . VAL B 2 35  ? -55.95924 5.98536  23.80840  1.000 68.46313 ? 367 VAL B CG2 1 
ATOM   606  N N   . LEU B 2 36  ? -52.41600 4.73981  21.00728  1.000 67.99956 ? 368 LEU B N   1 
ATOM   607  C CA  . LEU B 2 36  ? -51.64153 4.55964  19.78239  1.000 68.19459 ? 368 LEU B CA  1 
ATOM   608  C C   . LEU B 2 36  ? -51.57314 3.08812  19.39146  1.000 74.30081 ? 368 LEU B C   1 
ATOM   609  O O   . LEU B 2 36  ? -52.10169 2.68448  18.34803  1.000 75.96444 ? 368 LEU B O   1 
ATOM   610  C CB  . LEU B 2 36  ? -50.23053 5.13108  19.95018  1.000 62.12379 ? 368 LEU B CB  1 
ATOM   611  C CG  . LEU B 2 36  ? -50.02612 6.62386  19.70375  1.000 51.11701 ? 368 LEU B CG  1 
ATOM   612  C CD1 . LEU B 2 36  ? -48.54125 6.95203  19.71649  1.000 49.95850 ? 368 LEU B CD1 1 
ATOM   613  C CD2 . LEU B 2 36  ? -50.65968 7.03225  18.38855  1.000 53.27989 ? 368 LEU B CD2 1 
ATOM   614  N N   . TYR B 2 37  ? -50.93264 2.26679  20.23271  1.000 72.50109 ? 369 TYR B N   1 
ATOM   615  C CA  . TYR B 2 37  ? -50.69461 0.86367  19.90260  1.000 70.05823 ? 369 TYR B CA  1 
ATOM   616  C C   . TYR B 2 37  ? -51.97893 0.09895  19.60683  1.000 83.78999 ? 369 TYR B C   1 
ATOM   617  O O   . TYR B 2 37  ? -51.93302 -0.91110 18.89543  1.000 93.93967 ? 369 TYR B O   1 
ATOM   618  C CB  . TYR B 2 37  ? -49.93365 0.17819  21.04043  1.000 63.01658 ? 369 TYR B CB  1 
ATOM   619  N N   . ASN B 2 38  ? -53.11626 0.55287  20.12401  1.000 81.97065 ? 370 ASN B N   1 
ATOM   620  C CA  . ASN B 2 38  ? -54.38865 -0.11439 19.87369  1.000 83.06603 ? 370 ASN B CA  1 
ATOM   621  C C   . ASN B 2 38  ? -55.35376 0.80928  19.12984  1.000 80.88050 ? 370 ASN B C   1 
ATOM   622  O O   . ASN B 2 38  ? -56.17318 0.35719  18.32794  1.000 81.88942 ? 370 ASN B O   1 
ATOM   623  C CB  . ASN B 2 38  ? -55.01047 -0.58971 21.19153  1.000 64.31523 ? 370 ASN B CB  1 
ATOM   624  N N   . ALA B 2 40  ? -55.30181 3.01832  15.56958  1.000 72.04902 ? 372 ALA B N   1 
ATOM   625  C CA  . ALA B 2 40  ? -55.32828 2.90033  14.11407  1.000 72.71002 ? 372 ALA B CA  1 
ATOM   626  C C   . ALA B 2 40  ? -54.72139 1.55635  13.67004  1.000 76.88635 ? 372 ALA B C   1 
ATOM   627  O O   . ALA B 2 40  ? -54.04440 0.89252  14.45967  1.000 77.77350 ? 372 ALA B O   1 
ATOM   628  C CB  . ALA B 2 40  ? -54.58689 4.08100  13.47480  1.000 56.40210 ? 372 ALA B CB  1 
ATOM   629  N N   . PRO B 2 41  ? -54.99378 1.13424  12.43133  1.000 78.29748 ? 373 PRO B N   1 
ATOM   630  C CA  . PRO B 2 41  ? -54.33946 -0.07129 11.88939  1.000 67.47710 ? 373 PRO B CA  1 
ATOM   631  C C   . PRO B 2 41  ? -52.94729 0.26040  11.36717  1.000 57.51978 ? 373 PRO B C   1 
ATOM   632  O O   . PRO B 2 41  ? -52.79535 1.03106  10.41641  1.000 67.25276 ? 373 PRO B O   1 
ATOM   633  C CB  . PRO B 2 41  ? -55.27951 -0.50514 10.75789  1.000 72.45070 ? 373 PRO B CB  1 
ATOM   634  C CG  . PRO B 2 41  ? -55.92864 0.76728  10.31125  1.000 73.11425 ? 373 PRO B CG  1 
ATOM   635  C CD  . PRO B 2 41  ? -56.07479 1.61792  11.54956  1.000 77.13619 ? 373 PRO B CD  1 
ATOM   636  N N   . PHE B 2 42  ? -51.92844 -0.33635 11.98179  1.000 46.39723 ? 374 PHE B N   1 
ATOM   637  C CA  . PHE B 2 42  ? -50.53535 -0.00485 11.71458  1.000 44.80668 ? 374 PHE B CA  1 
ATOM   638  C C   . PHE B 2 42  ? -49.84340 -1.18094 11.04406  1.000 47.94329 ? 374 PHE B C   1 
ATOM   639  O O   . PHE B 2 42  ? -50.01346 -2.32888 11.46338  1.000 51.31264 ? 374 PHE B O   1 
ATOM   640  C CB  . PHE B 2 42  ? -49.80443 0.37219  13.01237  1.000 43.13522 ? 374 PHE B CB  1 
ATOM   641  C CG  . PHE B 2 42  ? -50.25562 1.67667  13.60137  1.000 40.26936 ? 374 PHE B CG  1 
ATOM   642  C CD1 . PHE B 2 42  ? -50.40939 2.79583  12.79983  1.000 48.79780 ? 374 PHE B CD1 1 
ATOM   643  C CD2 . PHE B 2 42  ? -50.54083 1.78250  14.95784  1.000 46.88455 ? 374 PHE B CD2 1 
ATOM   644  C CE1 . PHE B 2 42  ? -50.83012 4.00220  13.33195  1.000 44.97177 ? 374 PHE B CE1 1 
ATOM   645  C CE2 . PHE B 2 42  ? -50.96082 2.98408  15.49547  1.000 45.40271 ? 374 PHE B CE2 1 
ATOM   646  C CZ  . PHE B 2 42  ? -51.10699 4.09526  14.68501  1.000 59.70825 ? 374 PHE B CZ  1 
ATOM   647  N N   . SER B 2 43  ? -49.06346 -0.89095 10.00393  1.000 40.24451 ? 375 SER B N   1 
ATOM   648  C CA  . SER B 2 43  ? -48.28531 -1.91733 9.32893   1.000 34.07689 ? 375 SER B CA  1 
ATOM   649  C C   . SER B 2 43  ? -46.89508 -2.07524 9.91850   1.000 37.02902 ? 375 SER B C   1 
ATOM   650  O O   . SER B 2 43  ? -46.25734 -3.12055 9.71878   1.000 39.66729 ? 375 SER B O   1 
ATOM   651  C CB  . SER B 2 43  ? -48.18507 -1.59777 7.83036   1.000 39.10353 ? 375 SER B CB  1 
ATOM   652  O OG  . SER B 2 43  ? -47.60006 -0.32378 7.63417   1.000 42.91920 ? 375 SER B OG  1 
ATOM   653  N N   . ALA B 2 44  ? -46.41188 -1.06868 10.64547  1.000 39.64218 ? 376 ALA B N   1 
ATOM   654  C CA  . ALA B 2 44  ? -45.17691 -1.18089 11.39569  1.000 37.98534 ? 376 ALA B CA  1 
ATOM   655  C C   . ALA B 2 44  ? -45.38522 -0.51783 12.74486  1.000 32.80702 ? 376 ALA B C   1 
ATOM   656  O O   . ALA B 2 44  ? -46.08903 0.49247  12.85252  1.000 32.69561 ? 376 ALA B O   1 
ATOM   657  C CB  . ALA B 2 44  ? -43.99152 -0.53677 10.67795  1.000 40.03257 ? 376 ALA B CB  1 
ATOM   658  N N   . PHE B 2 45  ? -44.79757 -1.12675 13.76755  1.000 36.16313 ? 377 PHE B N   1 
ATOM   659  C CA  . PHE B 2 45  ? -44.80405 -0.59021 15.12315  1.000 37.08749 ? 377 PHE B CA  1 
ATOM   660  C C   . PHE B 2 45  ? -43.72026 -1.31280 15.90119  1.000 41.29652 ? 377 PHE B C   1 
ATOM   661  O O   . PHE B 2 45  ? -43.92589 -2.43069 16.38536  1.000 51.16377 ? 377 PHE B O   1 
ATOM   662  C CB  . PHE B 2 45  ? -46.16757 -0.76414 15.79274  1.000 43.31828 ? 377 PHE B CB  1 
ATOM   663  C CG  . PHE B 2 45  ? -46.44996 0.25526  16.86425  1.000 39.67311 ? 377 PHE B CG  1 
ATOM   664  C CD1 . PHE B 2 45  ? -45.60846 0.38778  17.95788  1.000 45.93979 ? 377 PHE B CD1 1 
ATOM   665  C CD2 . PHE B 2 45  ? -47.56033 1.07932  16.77963  1.000 41.14399 ? 377 PHE B CD2 1 
ATOM   666  C CE1 . PHE B 2 45  ? -45.86930 1.32923  18.95162  1.000 44.37184 ? 377 PHE B CE1 1 
ATOM   667  C CE2 . PHE B 2 45  ? -47.82702 2.01805  17.76860  1.000 49.95759 ? 377 PHE B CE2 1 
ATOM   668  C CZ  . PHE B 2 45  ? -46.97943 2.14211  18.85200  1.000 37.42896 ? 377 PHE B CZ  1 
ATOM   669  N N   . LYS B 2 46  ? -42.55047 -0.69718 15.99708  1.000 35.13574 ? 378 LYS B N   1 
ATOM   670  C CA  . LYS B 2 46  ? -41.39844 -1.32014 16.62708  1.000 36.55573 ? 378 LYS B CA  1 
ATOM   671  C C   . LYS B 2 46  ? -40.75104 -0.28268 17.52384  1.000 44.64513 ? 378 LYS B C   1 
ATOM   672  O O   . LYS B 2 46  ? -40.38024 0.79477  17.05161  1.000 37.08096 ? 378 LYS B O   1 
ATOM   673  C CB  . LYS B 2 46  ? -40.40212 -1.83714 15.58823  1.000 41.80374 ? 378 LYS B CB  1 
ATOM   674  C CG  . LYS B 2 46  ? -39.08950 -2.30869 16.18741  1.000 41.55802 ? 378 LYS B CG  1 
ATOM   675  C CD  . LYS B 2 46  ? -39.28914 -3.50363 17.10035  1.000 47.53999 ? 378 LYS B CD  1 
ATOM   676  C CE  . LYS B 2 46  ? -37.96064 -4.18863 17.39524  1.000 58.73809 ? 378 LYS B CE  1 
ATOM   677  N NZ  . LYS B 2 46  ? -37.28184 -4.61797 16.13235  1.000 57.84471 ? 378 LYS B NZ  1 
ATOM   678  N N   . CYS B 2 47  ? -40.65420 -0.58287 18.81414  1.000 35.63744 ? 379 CYS B N   1 
ATOM   679  C CA  . CYS B 2 47  ? -39.92431 0.27368  19.73340  1.000 33.40831 ? 379 CYS B CA  1 
ATOM   680  C C   . CYS B 2 47  ? -38.56634 -0.33752 20.03586  1.000 33.57090 ? 379 CYS B C   1 
ATOM   681  O O   . CYS B 2 47  ? -38.38982 -1.55722 20.00034  1.000 45.50269 ? 379 CYS B O   1 
ATOM   682  C CB  . CYS B 2 47  ? -40.71206 0.50239  21.02310  1.000 34.67076 ? 379 CYS B CB  1 
ATOM   683  S SG  . CYS B 2 47  ? -42.32377 1.23179  20.69576  1.000 46.86683 ? 379 CYS B SG  1 
ATOM   684  N N   . TYR B 2 48  ? -37.59888 0.52730  20.32746  1.000 38.88982 ? 380 TYR B N   1 
ATOM   685  C CA  . TYR B 2 48  ? -36.20466 0.10915  20.40865  1.000 44.34843 ? 380 TYR B CA  1 
ATOM   686  C C   . TYR B 2 48  ? -35.62267 0.26172  21.80661  1.000 55.67578 ? 380 TYR B C   1 
ATOM   687  O O   . TYR B 2 48  ? -35.16368 -0.73033 22.37903  1.000 62.35661 ? 380 TYR B O   1 
ATOM   688  C CB  . TYR B 2 48  ? -35.38641 0.88556  19.37521  1.000 45.38354 ? 380 TYR B CB  1 
ATOM   689  C CG  . TYR B 2 48  ? -35.64779 0.38967  17.97923  1.000 47.57623 ? 380 TYR B CG  1 
ATOM   690  C CD1 . TYR B 2 48  ? -34.91702 -0.66606 17.45469  1.000 43.88195 ? 380 TYR B CD1 1 
ATOM   691  C CD2 . TYR B 2 48  ? -36.65095 0.95005  17.19474  1.000 46.61989 ? 380 TYR B CD2 1 
ATOM   692  C CE1 . TYR B 2 48  ? -35.16069 -1.13819 16.17240  1.000 48.39548 ? 380 TYR B CE1 1 
ATOM   693  C CE2 . TYR B 2 48  ? -36.90016 0.48826  15.91452  1.000 42.29688 ? 380 TYR B CE2 1 
ATOM   694  C CZ  . TYR B 2 48  ? -36.15071 -0.55885 15.40770  1.000 47.62546 ? 380 TYR B CZ  1 
ATOM   695  O OH  . TYR B 2 48  ? -36.38667 -1.03180 14.14069  1.000 47.70344 ? 380 TYR B OH  1 
ATOM   696  N N   . GLY B 2 49  ? -35.60408 1.46521  22.36820  1.000 51.38573 ? 381 GLY B N   1 
ATOM   697  C CA  . GLY B 2 49  ? -35.15348 1.63876  23.73252  1.000 69.12043 ? 381 GLY B CA  1 
ATOM   698  C C   . GLY B 2 49  ? -36.23748 1.48022  24.77534  1.000 72.75012 ? 381 GLY B C   1 
ATOM   699  O O   . GLY B 2 49  ? -35.98648 1.71768  25.96263  1.000 74.51211 ? 381 GLY B O   1 
ATOM   700  N N   . VAL B 2 50  ? -37.43665 1.06899  24.36638  1.000 71.37444 ? 382 VAL B N   1 
ATOM   701  C CA  . VAL B 2 50  ? -38.61747 1.07920  25.22156  1.000 60.92294 ? 382 VAL B CA  1 
ATOM   702  C C   . VAL B 2 50  ? -39.55524 -0.04446 24.80206  1.000 68.16735 ? 382 VAL B C   1 
ATOM   703  O O   . VAL B 2 50  ? -39.21556 -0.85836 23.93528  1.000 66.60131 ? 382 VAL B O   1 
ATOM   704  C CB  . VAL B 2 50  ? -39.33447 2.43834  25.14139  1.000 70.81526 ? 382 VAL B CB  1 
ATOM   705  C CG1 . VAL B 2 50  ? -38.59993 3.49254  25.96016  1.000 70.06087 ? 382 VAL B CG1 1 
ATOM   706  C CG2 . VAL B 2 50  ? -39.46828 2.87724  23.67370  1.000 54.44164 ? 382 VAL B CG2 1 
ATOM   707  N N   . SER B 2 51  ? -40.74104 -0.08776 25.40558  1.000 60.43212 ? 383 SER B N   1 
ATOM   708  C CA  . SER B 2 51  ? -41.81936 -0.98695 25.02009  1.000 59.26148 ? 383 SER B CA  1 
ATOM   709  C C   . SER B 2 51  ? -43.14392 -0.25256 25.15640  1.000 57.61074 ? 383 SER B C   1 
ATOM   710  O O   . SER B 2 51  ? -43.29636 0.58925  26.04856  1.000 58.14859 ? 383 SER B O   1 
ATOM   711  C CB  . SER B 2 51  ? -41.84333 -2.25816 25.87986  1.000 61.18116 ? 383 SER B CB  1 
ATOM   712  O OG  . SER B 2 51  ? -43.04424 -2.97861 25.67313  1.000 64.16492 ? 383 SER B OG  1 
ATOM   713  N N   . PRO B 2 52  ? -44.11663 -0.54398 24.28517  1.000 58.80823 ? 384 PRO B N   1 
ATOM   714  C CA  . PRO B 2 52  ? -45.37829 0.22517  24.32043  1.000 56.69782 ? 384 PRO B CA  1 
ATOM   715  C C   . PRO B 2 52  ? -46.08282 0.20791  25.66875  1.000 64.16120 ? 384 PRO B C   1 
ATOM   716  O O   . PRO B 2 52  ? -46.44905 1.27303  26.18603  1.000 64.55639 ? 384 PRO B O   1 
ATOM   717  C CB  . PRO B 2 52  ? -46.21395 -0.44522 23.22252  1.000 56.96956 ? 384 PRO B CB  1 
ATOM   718  C CG  . PRO B 2 52  ? -45.20637 -0.98505 22.27504  1.000 56.65012 ? 384 PRO B CG  1 
ATOM   719  C CD  . PRO B 2 52  ? -44.05027 -1.44230 23.11992  1.000 53.63107 ? 384 PRO B CD  1 
ATOM   720  N N   . THR B 2 53  ? -46.29188 -0.97176 26.25824  1.000 60.56093 ? 385 THR B N   1 
ATOM   721  C CA  . THR B 2 53  ? -46.97743 -1.02682 27.54675  1.000 62.04436 ? 385 THR B CA  1 
ATOM   722  C C   . THR B 2 53  ? -46.19547 -0.27291 28.61484  1.000 58.69166 ? 385 THR B C   1 
ATOM   723  O O   . THR B 2 53  ? -46.78504 0.41265  29.45967  1.000 69.83474 ? 385 THR B O   1 
ATOM   724  C CB  . THR B 2 53  ? -47.20354 -2.48046 27.97028  1.000 70.10550 ? 385 THR B CB  1 
ATOM   725  O OG1 . THR B 2 53  ? -45.98970 -3.22811 27.80635  1.000 66.64000 ? 385 THR B OG1 1 
ATOM   726  C CG2 . THR B 2 53  ? -48.31222 -3.11724 27.14169  1.000 67.91712 ? 385 THR B CG2 1 
ATOM   727  N N   . LYS B 2 54  ? -44.86280 -0.37319 28.58094  1.000 55.74238 ? 386 LYS B N   1 
ATOM   728  C CA  . LYS B 2 54  ? -44.02837 0.33042  29.54684  1.000 52.73907 ? 386 LYS B CA  1 
ATOM   729  C C   . LYS B 2 54  ? -44.05095 1.83960  29.34667  1.000 54.50472 ? 386 LYS B C   1 
ATOM   730  O O   . LYS B 2 54  ? -43.71984 2.57609  30.28031  1.000 52.69864 ? 386 LYS B O   1 
ATOM   731  C CB  . LYS B 2 54  ? -42.58563 -0.16790 29.46361  1.000 52.39308 ? 386 LYS B CB  1 
ATOM   732  C CG  . LYS B 2 54  ? -42.42690 -1.68356 29.37284  1.000 62.07575 ? 386 LYS B CG  1 
ATOM   733  C CD  . LYS B 2 54  ? -42.54562 -2.36386 30.72881  1.000 68.88593 ? 386 LYS B CD  1 
ATOM   734  C CE  . LYS B 2 54  ? -42.05546 -3.80951 30.67724  1.000 60.89330 ? 386 LYS B CE  1 
ATOM   735  N NZ  . LYS B 2 54  ? -40.59378 -3.93311 30.97745  1.000 60.92792 ? 386 LYS B NZ  1 
ATOM   736  N N   . LEU B 2 55  ? -44.41868 2.31549  28.15211  1.000 62.12957 ? 387 LEU B N   1 
ATOM   737  C CA  . LEU B 2 55  ? -44.41148 3.75249  27.89176  1.000 53.92929 ? 387 LEU B CA  1 
ATOM   738  C C   . LEU B 2 55  ? -45.44460 4.47922  28.73832  1.000 53.80951 ? 387 LEU B C   1 
ATOM   739  O O   . LEU B 2 55  ? -45.19416 5.59600  29.20604  1.000 50.39275 ? 387 LEU B O   1 
ATOM   740  C CB  . LEU B 2 55  ? -44.66997 4.03260  26.41187  1.000 53.39640 ? 387 LEU B CB  1 
ATOM   741  C CG  . LEU B 2 55  ? -43.57361 3.72912  25.39416  1.000 56.52053 ? 387 LEU B CG  1 
ATOM   742  C CD1 . LEU B 2 55  ? -44.02047 4.18508  24.01316  1.000 54.89552 ? 387 LEU B CD1 1 
ATOM   743  C CD2 . LEU B 2 55  ? -42.26261 4.38897  25.78901  1.000 48.07831 ? 387 LEU B CD2 1 
ATOM   744  N N   . ASN B 2 56  ? -46.61121 3.86718  28.94483  1.000 57.29727 ? 388 ASN B N   1 
ATOM   745  C CA  . ASN B 2 56  ? -47.69636 4.54554  29.64091  1.000 52.87750 ? 388 ASN B CA  1 
ATOM   746  C C   . ASN B 2 56  ? -47.39756 4.80703  31.11643  1.000 57.52215 ? 388 ASN B C   1 
ATOM   747  O O   . ASN B 2 56  ? -48.21463 5.45273  31.77779  1.000 58.06594 ? 388 ASN B O   1 
ATOM   748  C CB  . ASN B 2 56  ? -48.99181 3.74304  29.50147  1.000 62.03296 ? 388 ASN B CB  1 
ATOM   749  C CG  . ASN B 2 56  ? -50.15601 4.59518  29.01950  1.000 63.27393 ? 388 ASN B CG  1 
ATOM   750  O OD1 . ASN B 2 56  ? -49.99381 5.45463  28.15486  1.000 55.38698 ? 388 ASN B OD1 1 
ATOM   751  N ND2 . ASN B 2 56  ? -51.33295 4.37022  29.59066  1.000 67.51023 ? 388 ASN B ND2 1 
ATOM   752  N N   . ASP B 2 57  ? -46.26549 4.34168  31.64841  1.000 49.87875 ? 389 ASP B N   1 
ATOM   753  C CA  . ASP B 2 57  ? -45.85320 4.69402  33.00080  1.000 54.33294 ? 389 ASP B CA  1 
ATOM   754  C C   . ASP B 2 57  ? -44.60758 5.55795  33.04962  1.000 62.29392 ? 389 ASP B C   1 
ATOM   755  O O   . ASP B 2 57  ? -44.18989 5.94687  34.14569  1.000 58.96733 ? 389 ASP B O   1 
ATOM   756  C CB  . ASP B 2 57  ? -45.57437 3.44475  33.83999  1.000 65.01754 ? 389 ASP B CB  1 
ATOM   757  C CG  . ASP B 2 57  ? -46.50038 2.31675  33.52748  1.000 66.22790 ? 389 ASP B CG  1 
ATOM   758  O OD1 . ASP B 2 57  ? -47.72096 2.53928  33.37075  1.000 73.06979 ? 389 ASP B OD1 1 
ATOM   759  O OD2 . ASP B 2 57  ? -45.98402 1.19688  33.44157  1.000 61.63244 ? 389 ASP B OD2 1 
ATOM   760  N N   . LEU B 2 58  ? -43.98821 5.84282  31.91402  1.000 48.07187 ? 390 LEU B N   1 
ATOM   761  C CA  . LEU B 2 58  ? -42.74958 6.59723  31.92211  1.000 43.29962 ? 390 LEU B CA  1 
ATOM   762  C C   . LEU B 2 58  ? -43.01948 8.07652  31.67771  1.000 44.65415 ? 390 LEU B C   1 
ATOM   763  O O   . LEU B 2 58  ? -44.04563 8.46670  31.11322  1.000 44.37970 ? 390 LEU B O   1 
ATOM   764  C CB  . LEU B 2 58  ? -41.78455 6.05113  30.87325  1.000 53.17136 ? 390 LEU B CB  1 
ATOM   765  C CG  . LEU B 2 58  ? -41.14424 4.71291  31.22976  1.000 50.54389 ? 390 LEU B CG  1 
ATOM   766  C CD1 . LEU B 2 58  ? -40.35706 4.16091  30.05587  1.000 48.70483 ? 390 LEU B CD1 1 
ATOM   767  C CD2 . LEU B 2 58  ? -40.24865 4.88455  32.44438  1.000 46.18859 ? 390 LEU B CD2 1 
ATOM   768  N N   . CYS B 2 59  ? -42.08154 8.90039  32.13579  1.000 42.99327 ? 391 CYS B N   1 
ATOM   769  C CA  . CYS B 2 59  ? -42.07017 10.33047 31.87164  1.000 40.42629 ? 391 CYS B CA  1 
ATOM   770  C C   . CYS B 2 59  ? -40.77090 10.68544 31.16537  1.000 34.95105 ? 391 CYS B C   1 
ATOM   771  O O   . CYS B 2 59  ? -39.71424 10.12097 31.46931  1.000 39.26564 ? 391 CYS B O   1 
ATOM   772  C CB  . CYS B 2 59  ? -42.20481 11.14588 33.16414  1.000 43.62507 ? 391 CYS B CB  1 
ATOM   773  S SG  . CYS B 2 59  ? -43.83119 11.01092 33.96221  1.000 44.96896 ? 391 CYS B SG  1 
ATOM   774  N N   . PHE B 2 60  ? -40.85006 11.60612 30.20941  1.000 32.68509 ? 392 PHE B N   1 
ATOM   775  C CA  . PHE B 2 60  ? -39.67688 12.01489 29.45471  1.000 33.25214 ? 392 PHE B CA  1 
ATOM   776  C C   . PHE B 2 60  ? -39.57817 13.53005 29.45487  1.000 28.68209 ? 392 PHE B C   1 
ATOM   777  O O   . PHE B 2 60  ? -40.56403 14.23687 29.67207  1.000 34.92546 ? 392 PHE B O   1 
ATOM   778  C CB  . PHE B 2 60  ? -39.71454 11.45665 28.00084  1.000 27.12519 ? 392 PHE B CB  1 
ATOM   779  C CG  . PHE B 2 60  ? -39.52951 9.96170  27.94319  1.000 29.19736 ? 392 PHE B CG  1 
ATOM   780  C CD1 . PHE B 2 60  ? -38.26158 9.41158  27.99954  1.000 28.59916 ? 392 PHE B CD1 1 
ATOM   781  C CD2 . PHE B 2 60  ? -40.62331 9.11172  27.90616  1.000 33.71787 ? 392 PHE B CD2 1 
ATOM   782  C CE1 . PHE B 2 60  ? -38.07718 8.03788  27.97613  1.000 31.68668 ? 392 PHE B CE1 1 
ATOM   783  C CE2 . PHE B 2 60  ? -40.45032 7.73464  27.89222  1.000 30.85784 ? 392 PHE B CE2 1 
ATOM   784  C CZ  . PHE B 2 60  ? -39.17339 7.19681  27.93156  1.000 27.73475 ? 392 PHE B CZ  1 
ATOM   785  N N   . THR B 2 61  ? -38.36454 14.01916 29.19253  1.000 33.01514 ? 393 THR B N   1 
ATOM   786  C CA  . THR B 2 61  ? -38.14343 15.46080 29.10065  1.000 37.38966 ? 393 THR B CA  1 
ATOM   787  C C   . THR B 2 61  ? -38.86352 16.05505 27.90176  1.000 39.78945 ? 393 THR B C   1 
ATOM   788  O O   . THR B 2 61  ? -39.60133 17.04223 28.02903  1.000 38.94068 ? 393 THR B O   1 
ATOM   789  C CB  . THR B 2 61  ? -36.65095 15.74587 29.01705  1.000 40.23868 ? 393 THR B CB  1 
ATOM   790  O OG1 . THR B 2 61  ? -35.97879 14.96160 30.00332  1.000 42.03162 ? 393 THR B OG1 1 
ATOM   791  C CG2 . THR B 2 61  ? -36.37558 17.22614 29.26693  1.000 47.38926 ? 393 THR B CG2 1 
ATOM   792  N N   . ASN B 2 62  ? -38.63918 15.47470 26.72123  1.000 37.90574 ? 394 ASN B N   1 
ATOM   793  C CA  . ASN B 2 62  ? -39.35265 15.81514 25.50354  1.000 44.77042 ? 394 ASN B CA  1 
ATOM   794  C C   . ASN B 2 62  ? -39.61320 14.53032 24.73840  1.000 31.14860 ? 394 ASN B C   1 
ATOM   795  O O   . ASN B 2 62  ? -38.92753 13.51941 24.93515  1.000 31.68776 ? 394 ASN B O   1 
ATOM   796  C CB  . ASN B 2 62  ? -38.57124 16.77441 24.58524  1.000 40.53429 ? 394 ASN B CB  1 
ATOM   797  C CG  . ASN B 2 62  ? -38.18445 18.05787 25.27096  1.000 48.09095 ? 394 ASN B CG  1 
ATOM   798  O OD1 . ASN B 2 62  ? -39.00681 18.95889 25.43051  1.000 51.42498 ? 394 ASN B OD1 1 
ATOM   799  N ND2 . ASN B 2 62  ? -36.92367 18.15694 25.66932  1.000 44.33829 ? 394 ASN B ND2 1 
ATOM   800  N N   . VAL B 2 63  ? -40.62288 14.59103 23.87545  1.000 35.42862 ? 395 VAL B N   1 
ATOM   801  C CA  . VAL B 2 63  ? -40.84457 13.61463 22.81893  1.000 27.62214 ? 395 VAL B CA  1 
ATOM   802  C C   . VAL B 2 63  ? -40.78707 14.36051 21.49311  1.000 32.22885 ? 395 VAL B C   1 
ATOM   803  O O   . VAL B 2 63  ? -41.42663 15.40972 21.33393  1.000 35.97340 ? 395 VAL B O   1 
ATOM   804  C CB  . VAL B 2 63  ? -42.19036 12.88652 22.98616  1.000 32.18567 ? 395 VAL B CB  1 
ATOM   805  C CG1 . VAL B 2 63  ? -42.42880 11.91058 21.84391  1.000 33.06077 ? 395 VAL B CG1 1 
ATOM   806  C CG2 . VAL B 2 63  ? -42.23511 12.15771 24.32065  1.000 40.24057 ? 395 VAL B CG2 1 
ATOM   807  N N   . TYR B 2 64  ? -40.02661 13.82234 20.54870  1.000 30.71925 ? 396 TYR B N   1 
ATOM   808  C CA  . TYR B 2 64  ? -39.95645 14.37903 19.20829  1.000 28.18399 ? 396 TYR B CA  1 
ATOM   809  C C   . TYR B 2 64  ? -40.65494 13.42530 18.25705  1.000 27.69550 ? 396 TYR B C   1 
ATOM   810  O O   . TYR B 2 64  ? -40.43164 12.21524 18.30852  1.000 34.79822 ? 396 TYR B O   1 
ATOM   811  C CB  . TYR B 2 64  ? -38.50488 14.61063 18.78597  1.000 29.34007 ? 396 TYR B CB  1 
ATOM   812  C CG  . TYR B 2 64  ? -37.81094 15.56457 19.71883  1.000 33.55934 ? 396 TYR B CG  1 
ATOM   813  C CD1 . TYR B 2 64  ? -37.96867 16.93509 19.58262  1.000 34.40507 ? 396 TYR B CD1 1 
ATOM   814  C CD2 . TYR B 2 64  ? -37.04301 15.09188 20.77175  1.000 45.91041 ? 396 TYR B CD2 1 
ATOM   815  C CE1 . TYR B 2 64  ? -37.34652 17.81633 20.45411  1.000 40.05003 ? 396 TYR B CE1 1 
ATOM   816  C CE2 . TYR B 2 64  ? -36.42365 15.95881 21.65008  1.000 47.73549 ? 396 TYR B CE2 1 
ATOM   817  C CZ  . TYR B 2 64  ? -36.58057 17.31576 21.49297  1.000 47.29931 ? 396 TYR B CZ  1 
ATOM   818  O OH  . TYR B 2 64  ? -35.95440 18.16803 22.38163  1.000 52.60325 ? 396 TYR B OH  1 
ATOM   819  N N   . ALA B 2 65  ? -41.52778 13.97265 17.42621  1.000 30.83128 ? 397 ALA B N   1 
ATOM   820  C CA  . ALA B 2 65  ? -42.31531 13.18060 16.49305  1.000 27.58010 ? 397 ALA B CA  1 
ATOM   821  C C   . ALA B 2 65  ? -41.90705 13.61592 15.09618  1.000 26.44130 ? 397 ALA B C   1 
ATOM   822  O O   . ALA B 2 65  ? -42.19784 14.74561 14.69306  1.000 31.43302 ? 397 ALA B O   1 
ATOM   823  C CB  . ALA B 2 65  ? -43.81022 13.37981 16.73345  1.000 33.57025 ? 397 ALA B CB  1 
ATOM   824  N N   . ASP B 2 66  ? -41.21261 12.73602 14.38177  1.000 28.18308 ? 398 ASP B N   1 
ATOM   825  C CA  . ASP B 2 66  ? -40.79974 12.99294 13.00479  1.000 26.96493 ? 398 ASP B CA  1 
ATOM   826  C C   . ASP B 2 66  ? -41.75554 12.25752 12.07901  1.000 31.99249 ? 398 ASP B C   1 
ATOM   827  O O   . ASP B 2 66  ? -42.11674 11.10698 12.34365  1.000 32.65126 ? 398 ASP B O   1 
ATOM   828  C CB  . ASP B 2 66  ? -39.35779 12.52440 12.76118  1.000 31.15676 ? 398 ASP B CB  1 
ATOM   829  C CG  . ASP B 2 66  ? -38.34454 13.19113 13.68640  1.000 31.69782 ? 398 ASP B CG  1 
ATOM   830  O OD1 . ASP B 2 66  ? -38.61166 14.30866 14.15362  1.000 30.78596 ? 398 ASP B OD1 1 
ATOM   831  O OD2 . ASP B 2 66  ? -37.26343 12.61525 13.92686  1.000 32.44344 ? 398 ASP B OD2 1 
ATOM   832  N N   . SER B 2 67  ? -42.16097 12.90727 10.98268  1.000 30.76351 ? 399 SER B N   1 
ATOM   833  C CA  . SER B 2 67  ? -43.17361 12.28428 10.14597  1.000 27.89685 ? 399 SER B CA  1 
ATOM   834  C C   . SER B 2 67  ? -42.93074 12.63267 8.68651   1.000 33.16561 ? 399 SER B C   1 
ATOM   835  O O   . SER B 2 67  ? -42.38727 13.69409 8.36128   1.000 33.10269 ? 399 SER B O   1 
ATOM   836  C CB  . SER B 2 67  ? -44.59602 12.68557 10.56141  1.000 28.04433 ? 399 SER B CB  1 
ATOM   837  O OG  . SER B 2 67  ? -44.75297 14.09170 10.56632  1.000 31.62386 ? 399 SER B OG  1 
ATOM   838  N N   . PHE B 2 68  ? -43.34055 11.71047 7.82031   1.000 26.59530 ? 400 PHE B N   1 
ATOM   839  C CA  . PHE B 2 68  ? -43.09989 11.80947 6.37594   1.000 27.58852 ? 400 PHE B CA  1 
ATOM   840  C C   . PHE B 2 68  ? -43.77249 10.65606 5.65181   1.000 29.47525 ? 400 PHE B C   1 
ATOM   841  O O   . PHE B 2 68  ? -44.37839 9.78440  6.28268   1.000 30.75253 ? 400 PHE B O   1 
ATOM   842  C CB  . PHE B 2 68  ? -41.59658 11.80981 6.06353   1.000 30.88476 ? 400 PHE B CB  1 
ATOM   843  C CG  . PHE B 2 68  ? -40.83345 10.70140 6.73616   1.000 33.24089 ? 400 PHE B CG  1 
ATOM   844  C CD1 . PHE B 2 68  ? -40.75351 9.44221  6.16366   1.000 27.74336 ? 400 PHE B CD1 1 
ATOM   845  C CD2 . PHE B 2 68  ? -40.22142 10.90851 7.96132   1.000 30.25069 ? 400 PHE B CD2 1 
ATOM   846  C CE1 . PHE B 2 68  ? -40.04718 8.42320  6.77423   1.000 28.20098 ? 400 PHE B CE1 1 
ATOM   847  C CE2 . PHE B 2 68  ? -39.52122 9.89900  8.57806   1.000 34.29846 ? 400 PHE B CE2 1 
ATOM   848  C CZ  . PHE B 2 68  ? -39.44240 8.65203  8.00374   1.000 31.77848 ? 400 PHE B CZ  1 
ATOM   849  N N   . VAL B 2 69  ? -43.65860 10.63248 4.32059   1.000 28.28888 ? 401 VAL B N   1 
ATOM   850  C CA  . VAL B 2 69  ? -44.24888 9.59518  3.48991   1.000 37.76063 ? 401 VAL B CA  1 
ATOM   851  C C   . VAL B 2 69  ? -43.13992 8.95753  2.65801   1.000 33.23679 ? 401 VAL B C   1 
ATOM   852  O O   . VAL B 2 69  ? -42.27710 9.66324  2.12208   1.000 29.53208 ? 401 VAL B O   1 
ATOM   853  C CB  . VAL B 2 69  ? -45.36119 10.17441 2.59608   1.000 33.46125 ? 401 VAL B CB  1 
ATOM   854  C CG1 . VAL B 2 69  ? -45.76078 9.18554  1.51013   1.000 35.70783 ? 401 VAL B CG1 1 
ATOM   855  C CG2 . VAL B 2 69  ? -46.56636 10.53640 3.44120   1.000 35.98934 ? 401 VAL B CG2 1 
ATOM   856  N N   . ILE B 2 70  ? -43.13171 7.62514  2.60073   1.000 30.29165 ? 402 ILE B N   1 
ATOM   857  C CA  . ILE B 2 70  ? -42.20368 6.85684  1.77609   1.000 33.75221 ? 402 ILE B CA  1 
ATOM   858  C C   . ILE B 2 70  ? -42.97354 5.70585  1.14515   1.000 32.49200 ? 402 ILE B C   1 
ATOM   859  O O   . ILE B 2 70  ? -44.16414 5.51414  1.40132   1.000 30.06576 ? 402 ILE B O   1 
ATOM   860  C CB  . ILE B 2 70  ? -40.99752 6.31065  2.57077   1.000 32.48598 ? 402 ILE B CB  1 
ATOM   861  C CG1 . ILE B 2 70  ? -41.46141 5.57916  3.83973   1.000 33.16780 ? 402 ILE B CG1 1 
ATOM   862  C CG2 . ILE B 2 70  ? -39.98376 7.42473  2.86065   1.000 26.04437 ? 402 ILE B CG2 1 
ATOM   863  C CD1 . ILE B 2 70  ? -40.33367 4.91335  4.61698   1.000 28.53895 ? 402 ILE B CD1 1 
ATOM   864  N N   . ARG B 2 71  ? -42.27798 4.94959  0.28784   1.000 36.44443 ? 403 ARG B N   1 
ATOM   865  C CA  . ARG B 2 71  ? -42.84640 3.73526  -0.28849  1.000 33.76392 ? 403 ARG B CA  1 
ATOM   866  C C   . ARG B 2 71  ? -42.91750 2.61857  0.74809   1.000 36.17948 ? 403 ARG B C   1 
ATOM   867  O O   . ARG B 2 71  ? -42.07833 2.52009  1.64420   1.000 33.73633 ? 403 ARG B O   1 
ATOM   868  C CB  . ARG B 2 71  ? -42.00492 3.24353  -1.45664  1.000 33.36124 ? 403 ARG B CB  1 
ATOM   869  C CG  . ARG B 2 71  ? -42.20397 3.99350  -2.73494  1.000 32.47268 ? 403 ARG B CG  1 
ATOM   870  C CD  . ARG B 2 71  ? -40.96781 3.86210  -3.58713  1.000 31.24975 ? 403 ARG B CD  1 
ATOM   871  N NE  . ARG B 2 71  ? -40.55175 2.48126  -3.82042  1.000 34.52320 ? 403 ARG B NE  1 
ATOM   872  C CZ  . ARG B 2 71  ? -39.56988 2.14465  -4.65140  1.000 36.77747 ? 403 ARG B CZ  1 
ATOM   873  N NH1 . ARG B 2 71  ? -38.88697 3.05918  -5.31292  1.000 31.27156 ? 403 ARG B NH1 1 
ATOM   874  N NH2 . ARG B 2 71  ? -39.25305 0.86144  -4.80563  1.000 34.43700 ? 403 ARG B NH2 1 
ATOM   875  N N   . GLY B 2 72  ? -43.89665 1.72654  0.56920   1.000 40.49983 ? 404 GLY B N   1 
ATOM   876  C CA  . GLY B 2 72  ? -44.02042 0.58311  1.46085   1.000 27.62844 ? 404 GLY B CA  1 
ATOM   877  C C   . GLY B 2 72  ? -42.74843 -0.23348 1.58081   1.000 31.69970 ? 404 GLY B C   1 
ATOM   878  O O   . GLY B 2 72  ? -42.36955 -0.65693 2.67696   1.000 33.04660 ? 404 GLY B O   1 
ATOM   879  N N   . ASN B 2 73  ? -42.06017 -0.46617 0.45821   1.000 30.02454 ? 405 ASN B N   1 
ATOM   880  C CA  . ASN B 2 73  ? -40.83613 -1.25948 0.53296   1.000 29.53428 ? 405 ASN B CA  1 
ATOM   881  C C   . ASN B 2 73  ? -39.71211 -0.54034 1.26839   1.000 30.51721 ? 405 ASN B C   1 
ATOM   882  O O   . ASN B 2 73  ? -38.74291 -1.19187 1.67918   1.000 34.60156 ? 405 ASN B O   1 
ATOM   883  C CB  . ASN B 2 73  ? -40.36585 -1.61833 -0.87005  1.000 37.19371 ? 405 ASN B CB  1 
ATOM   884  C CG  . ASN B 2 73  ? -39.83659 -0.41795 -1.60662  1.000 32.29113 ? 405 ASN B CG  1 
ATOM   885  O OD1 . ASN B 2 73  ? -40.59070 0.49289  -1.92905  1.000 36.82770 ? 405 ASN B OD1 1 
ATOM   886  N ND2 . ASN B 2 73  ? -38.53596 -0.39905 -1.86316  1.000 36.10477 ? 405 ASN B ND2 1 
ATOM   887  N N   . GLU B 2 74  ? -39.81588 0.78132  1.44398   1.000 33.18620 ? 406 GLU B N   1 
ATOM   888  C CA  . GLU B 2 74  ? -38.80007 1.57023  2.13031   1.000 28.76361 ? 406 GLU B CA  1 
ATOM   889  C C   . GLU B 2 74  ? -39.00682 1.65963  3.64078   1.000 28.69440 ? 406 GLU B C   1 
ATOM   890  O O   . GLU B 2 74  ? -38.09684 2.10974  4.33678   1.000 31.73299 ? 406 GLU B O   1 
ATOM   891  C CB  . GLU B 2 74  ? -38.75726 2.98565  1.54380   1.000 29.20989 ? 406 GLU B CB  1 
ATOM   892  C CG  . GLU B 2 74  ? -38.32540 2.95861  0.09071   1.000 29.86788 ? 406 GLU B CG  1 
ATOM   893  C CD  . GLU B 2 74  ? -38.50242 4.26206  -0.65298  1.000 31.81879 ? 406 GLU B CD  1 
ATOM   894  O OE1 . GLU B 2 74  ? -39.30575 5.12525  -0.23389  1.000 31.73816 ? 406 GLU B OE1 1 
ATOM   895  O OE2 . GLU B 2 74  ? -37.84634 4.41203  -1.71605  1.000 34.53168 ? 406 GLU B OE2 1 
ATOM   896  N N   . VAL B 2 75  ? -40.16170 1.23558  4.15578   1.000 30.16399 ? 407 VAL B N   1 
ATOM   897  C CA  . VAL B 2 75  ? -40.43380 1.37102  5.59244   1.000 29.63938 ? 407 VAL B CA  1 
ATOM   898  C C   . VAL B 2 75  ? -39.37607 0.64864  6.42473   1.000 35.20232 ? 407 VAL B C   1 
ATOM   899  O O   . VAL B 2 75  ? -38.99411 1.10727  7.51453   1.000 34.09513 ? 407 VAL B O   1 
ATOM   900  C CB  . VAL B 2 75  ? -41.85369 0.86549  5.91258   1.000 25.37960 ? 407 VAL B CB  1 
ATOM   901  C CG1 . VAL B 2 75  ? -42.08519 0.82912  7.43356   1.000 28.72094 ? 407 VAL B CG1 1 
ATOM   902  C CG2 . VAL B 2 75  ? -42.89705 1.73653  5.23964   1.000 26.23093 ? 407 VAL B CG2 1 
ATOM   903  N N   . SER B 2 76  ? -38.88275 -0.48520 5.92662   1.000 33.10303 ? 408 SER B N   1 
ATOM   904  C CA  . SER B 2 76  ? -37.87375 -1.26467 6.62909   1.000 34.37453 ? 408 SER B CA  1 
ATOM   905  C C   . SER B 2 76  ? -36.56550 -0.51160 6.81372   1.000 35.02096 ? 408 SER B C   1 
ATOM   906  O O   . SER B 2 76  ? -35.77948 -0.87182 7.69555   1.000 36.66379 ? 408 SER B O   1 
ATOM   907  C CB  . SER B 2 76  ? -37.61396 -2.56986 5.87915   1.000 43.07580 ? 408 SER B CB  1 
ATOM   908  O OG  . SER B 2 76  ? -37.25265 -2.31742 4.52793   1.000 39.59307 ? 408 SER B OG  1 
ATOM   909  N N   . GLN B 2 77  ? -36.31118 0.52520  6.01173   1.000 32.55928 ? 409 GLN B N   1 
ATOM   910  C CA  . GLN B 2 77  ? -35.10134 1.32065  6.18954   1.000 27.78521 ? 409 GLN B CA  1 
ATOM   911  C C   . GLN B 2 77  ? -35.17124 2.24514  7.40070   1.000 33.50608 ? 409 GLN B C   1 
ATOM   912  O O   . GLN B 2 77  ? -34.12713 2.71536  7.85537   1.000 35.94226 ? 409 GLN B O   1 
ATOM   913  C CB  . GLN B 2 77  ? -34.83018 2.16247  4.94866   1.000 31.05658 ? 409 GLN B CB  1 
ATOM   914  C CG  . GLN B 2 77  ? -34.61441 1.34975  3.70362   1.000 34.13231 ? 409 GLN B CG  1 
ATOM   915  C CD  . GLN B 2 77  ? -34.16726 2.21734  2.54421   1.000 33.93516 ? 409 GLN B CD  1 
ATOM   916  O OE1 . GLN B 2 77  ? -33.41695 3.18442  2.73030   1.000 32.42177 ? 409 GLN B OE1 1 
ATOM   917  N NE2 . GLN B 2 77  ? -34.63344 1.88937  1.34468   1.000 31.65836 ? 409 GLN B NE2 1 
ATOM   918  N N   . ILE B 2 78  ? -36.36832 2.55709  7.89584   1.000 35.21745 ? 410 ILE B N   1 
ATOM   919  C CA  . ILE B 2 78  ? -36.51632 3.42146  9.06611   1.000 31.86817 ? 410 ILE B CA  1 
ATOM   920  C C   . ILE B 2 78  ? -36.28642 2.57256  10.30847  1.000 35.54128 ? 410 ILE B C   1 
ATOM   921  O O   . ILE B 2 78  ? -37.21843 2.26023  11.05767  1.000 33.92191 ? 410 ILE B O   1 
ATOM   922  C CB  . ILE B 2 78  ? -37.88740 4.12691  9.07862   1.000 27.78320 ? 410 ILE B CB  1 
ATOM   923  C CG1 . ILE B 2 78  ? -38.20289 4.66546  7.67523   1.000 30.67747 ? 410 ILE B CG1 1 
ATOM   924  C CG2 . ILE B 2 78  ? -37.90366 5.29659  10.08535  1.000 26.02991 ? 410 ILE B CG2 1 
ATOM   925  C CD1 . ILE B 2 78  ? -37.16558 5.64097  7.15331   1.000 35.48966 ? 410 ILE B CD1 1 
ATOM   926  N N   . ALA B 2 79  ? -35.03504 2.18161  10.51171  1.000 34.28621 ? 411 ALA B N   1 
ATOM   927  C CA  . ALA B 2 79  ? -34.60499 1.36811  11.63825  1.000 35.23255 ? 411 ALA B CA  1 
ATOM   928  C C   . ALA B 2 79  ? -33.12889 1.62979  11.85085  1.000 38.75285 ? 411 ALA B C   1 
ATOM   929  O O   . ALA B 2 79  ? -32.41824 1.97349  10.89505  1.000 38.96727 ? 411 ALA B O   1 
ATOM   930  C CB  . ALA B 2 79  ? -34.84769 -0.12683 11.37677  1.000 37.05838 ? 411 ALA B CB  1 
ATOM   931  N N   . PRO B 2 80  ? -32.63145 1.49365  13.07942  1.000 40.03690 ? 412 PRO B N   1 
ATOM   932  C CA  . PRO B 2 80  ? -31.19086 1.62817  13.31084  1.000 33.15035 ? 412 PRO B CA  1 
ATOM   933  C C   . PRO B 2 80  ? -30.42806 0.58214  12.51929  1.000 35.99725 ? 412 PRO B C   1 
ATOM   934  O O   . PRO B 2 80  ? -30.89173 -0.54690 12.34787  1.000 43.62012 ? 412 PRO B O   1 
ATOM   935  C CB  . PRO B 2 80  ? -31.04235 1.40048  14.82657  1.000 37.81634 ? 412 PRO B CB  1 
ATOM   936  C CG  . PRO B 2 80  ? -32.41047 1.55394  15.39414  1.000 40.46708 ? 412 PRO B CG  1 
ATOM   937  C CD  . PRO B 2 80  ? -33.37109 1.16270  14.30703  1.000 43.20105 ? 412 PRO B CD  1 
ATOM   938  N N   . GLY B 2 81  ? -29.25804 0.97758  12.01323  1.000 43.24997 ? 413 GLY B N   1 
ATOM   939  C CA  . GLY B 2 81  ? -28.36795 0.08323  11.30259  1.000 38.96087 ? 413 GLY B CA  1 
ATOM   940  C C   . GLY B 2 81  ? -28.69208 -0.15508 9.84078   1.000 45.79969 ? 413 GLY B C   1 
ATOM   941  O O   . GLY B 2 81  ? -28.02225 -0.97917 9.20902   1.000 47.79107 ? 413 GLY B O   1 
ATOM   942  N N   . GLN B 2 82  ? -29.67763 0.54347  9.28205   1.000 38.35690 ? 414 GLN B N   1 
ATOM   943  C CA  . GLN B 2 82  ? -30.16471 0.30029  7.93310   1.000 39.22846 ? 414 GLN B CA  1 
ATOM   944  C C   . GLN B 2 82  ? -29.41196 1.14772  6.92178   1.000 41.92989 ? 414 GLN B C   1 
ATOM   945  O O   . GLN B 2 82  ? -28.91491 2.23026  7.23772   1.000 44.65783 ? 414 GLN B O   1 
ATOM   946  C CB  . GLN B 2 82  ? -31.66193 0.60697  7.83999   1.000 38.70677 ? 414 GLN B CB  1 
ATOM   947  C CG  . GLN B 2 82  ? -32.55407 -0.45379 8.46397   1.000 43.65770 ? 414 GLN B CG  1 
ATOM   948  C CD  . GLN B 2 82  ? -32.56310 -1.71896 7.63184   1.000 52.14236 ? 414 GLN B CD  1 
ATOM   949  O OE1 . GLN B 2 82  ? -32.70330 -1.66948 6.40836   1.000 50.54986 ? 414 GLN B OE1 1 
ATOM   950  N NE2 . GLN B 2 82  ? -32.39824 -2.85302 8.28335   1.000 47.81896 ? 414 GLN B NE2 1 
ATOM   951  N N   . THR B 2 83  ? -29.32920 0.63536  5.69426   1.000 41.14513 ? 415 THR B N   1 
ATOM   952  C CA  . THR B 2 83  ? -28.79666 1.36667  4.55608   1.000 43.19688 ? 415 THR B CA  1 
ATOM   953  C C   . THR B 2 83  ? -29.80260 1.29072  3.41483   1.000 36.02470 ? 415 THR B C   1 
ATOM   954  O O   . THR B 2 83  ? -30.72127 0.46551  3.41338   1.000 39.88107 ? 415 THR B O   1 
ATOM   955  C CB  . THR B 2 83  ? -27.43984 0.81374  4.10028   1.000 48.19603 ? 415 THR B CB  1 
ATOM   956  O OG1 . THR B 2 83  ? -27.63423 -0.45946 3.47511   1.000 50.63655 ? 415 THR B OG1 1 
ATOM   957  C CG2 . THR B 2 83  ? -26.50251 0.64411  5.28105   1.000 49.82482 ? 415 THR B CG2 1 
ATOM   958  N N   . GLY B 2 84  ? -29.62930 2.16487  2.43436   1.000 36.93092 ? 416 GLY B N   1 
ATOM   959  C CA  . GLY B 2 84  ? -30.59239 2.24063  1.35306   1.000 33.06735 ? 416 GLY B CA  1 
ATOM   960  C C   . GLY B 2 84  ? -30.84260 3.66886  0.93176   1.000 33.26733 ? 416 GLY B C   1 
ATOM   961  O O   . GLY B 2 84  ? -30.27339 4.58856  1.52057   1.000 35.69962 ? 416 GLY B O   1 
ATOM   962  N N   . ASN B 2 85  ? -31.68212 3.87657  -0.08588  1.000 31.95639 ? 417 ASN B N   1 
ATOM   963  C CA  . ASN B 2 85  ? -31.85340 5.22502  -0.61900  1.000 32.23340 ? 417 ASN B CA  1 
ATOM   964  C C   . ASN B 2 85  ? -32.46295 6.16107  0.41886   1.000 32.43752 ? 417 ASN B C   1 
ATOM   965  O O   . ASN B 2 85  ? -32.14070 7.35420  0.43900   1.000 31.14176 ? 417 ASN B O   1 
ATOM   966  C CB  . ASN B 2 85  ? -32.71276 5.20579  -1.88696  1.000 31.49590 ? 417 ASN B CB  1 
ATOM   967  C CG  . ASN B 2 85  ? -34.13540 4.75820  -1.62276  1.000 33.05977 ? 417 ASN B CG  1 
ATOM   968  O OD1 . ASN B 2 85  ? -34.36707 3.71763  -0.99635  1.000 36.52089 ? 417 ASN B OD1 1 
ATOM   969  N ND2 . ASN B 2 85  ? -35.09896 5.54080  -2.09203  1.000 38.00135 ? 417 ASN B ND2 1 
ATOM   970  N N   . ILE B 2 86  ? -33.32973 5.64540  1.29074   1.000 32.75147 ? 418 ILE B N   1 
ATOM   971  C CA  . ILE B 2 86  ? -33.97172 6.50710  2.27625   1.000 30.00767 ? 418 ILE B CA  1 
ATOM   972  C C   . ILE B 2 86  ? -33.06935 6.70462  3.48545   1.000 36.66533 ? 418 ILE B C   1 
ATOM   973  O O   . ILE B 2 86  ? -32.85892 7.83531  3.93347   1.000 31.17718 ? 418 ILE B O   1 
ATOM   974  C CB  . ILE B 2 86  ? -35.35196 5.94697  2.67780   1.000 30.17253 ? 418 ILE B CB  1 
ATOM   975  C CG1 . ILE B 2 86  ? -36.29897 5.91409  1.46484   1.000 33.49917 ? 418 ILE B CG1 1 
ATOM   976  C CG2 . ILE B 2 86  ? -35.94853 6.74149  3.84772   1.000 31.47728 ? 418 ILE B CG2 1 
ATOM   977  C CD1 . ILE B 2 86  ? -36.33438 7.22741  0.63778   1.000 33.31598 ? 418 ILE B CD1 1 
ATOM   978  N N   . ALA B 2 87  ? -32.49173 5.62206  4.01163   1.000 36.37779 ? 419 ALA B N   1 
ATOM   979  C CA  . ALA B 2 87  ? -31.62762 5.75969  5.18570   1.000 33.92825 ? 419 ALA B CA  1 
ATOM   980  C C   . ALA B 2 87  ? -30.35895 6.55009  4.86759   1.000 30.39325 ? 419 ALA B C   1 
ATOM   981  O O   . ALA B 2 87  ? -29.89812 7.33510  5.70940   1.000 35.80219 ? 419 ALA B O   1 
ATOM   982  C CB  . ALA B 2 87  ? -31.27332 4.38391  5.75187   1.000 33.73764 ? 419 ALA B CB  1 
ATOM   983  N N   . ASP B 2 88  ? -29.80464 6.39037  3.65748   1.000 34.78041 ? 420 ASP B N   1 
ATOM   984  C CA  . ASP B 2 88  ? -28.56921 7.08127  3.29593   1.000 36.29994 ? 420 ASP B CA  1 
ATOM   985  C C   . ASP B 2 88  ? -28.80773 8.55916  3.01322   1.000 34.06363 ? 420 ASP B C   1 
ATOM   986  O O   . ASP B 2 88  ? -28.02017 9.40925  3.43754   1.000 36.94143 ? 420 ASP B O   1 
ATOM   987  C CB  . ASP B 2 88  ? -27.92964 6.44862  2.05374   1.000 37.81016 ? 420 ASP B CB  1 
ATOM   988  C CG  . ASP B 2 88  ? -27.33937 5.07784  2.31562   1.000 47.50528 ? 420 ASP B CG  1 
ATOM   989  O OD1 . ASP B 2 88  ? -27.45783 4.56513  3.45014   1.000 41.73465 ? 420 ASP B OD1 1 
ATOM   990  O OD2 . ASP B 2 88  ? -26.74654 4.51441  1.37108   1.000 44.30969 ? 420 ASP B OD2 1 
ATOM   991  N N   . TYR B 2 89  ? -29.85496 8.88103  2.24329   1.000 34.75966 ? 421 TYR B N   1 
ATOM   992  C CA  . TYR B 2 89  ? -29.97424 10.19266 1.61392   1.000 26.27580 ? 421 TYR B CA  1 
ATOM   993  C C   . TYR B 2 89  ? -31.16116 11.02177 2.07944   1.000 32.75027 ? 421 TYR B C   1 
ATOM   994  O O   . TYR B 2 89  ? -31.26771 12.18393 1.66059   1.000 34.00507 ? 421 TYR B O   1 
ATOM   995  C CB  . TYR B 2 89  ? -30.07270 10.05184 0.07535   1.000 29.11701 ? 421 TYR B CB  1 
ATOM   996  C CG  . TYR B 2 89  ? -28.89754 9.37607  -0.59900  1.000 35.75055 ? 421 TYR B CG  1 
ATOM   997  C CD1 . TYR B 2 89  ? -27.66131 9.28852  0.02149   1.000 34.35431 ? 421 TYR B CD1 1 
ATOM   998  C CD2 . TYR B 2 89  ? -29.02812 8.83224  -1.88627  1.000 37.42323 ? 421 TYR B CD2 1 
ATOM   999  C CE1 . TYR B 2 89  ? -26.58533 8.66422  -0.59692  1.000 41.44909 ? 421 TYR B CE1 1 
ATOM   1000 C CE2 . TYR B 2 89  ? -27.95935 8.21277  -2.51381  1.000 35.17624 ? 421 TYR B CE2 1 
ATOM   1001 C CZ  . TYR B 2 89  ? -26.73989 8.13333  -1.86902  1.000 38.24780 ? 421 TYR B CZ  1 
ATOM   1002 O OH  . TYR B 2 89  ? -25.67757 7.51169  -2.48476  1.000 42.00096 ? 421 TYR B OH  1 
ATOM   1003 N N   . ASN B 2 90  ? -32.05210 10.48027 2.92531   1.000 31.16271 ? 422 ASN B N   1 
ATOM   1004 C CA  . ASN B 2 90  ? -33.29521 11.17106 3.26271   1.000 21.95871 ? 422 ASN B CA  1 
ATOM   1005 C C   . ASN B 2 90  ? -33.53670 11.26119 4.76667   1.000 25.99333 ? 422 ASN B C   1 
ATOM   1006 O O   . ASN B 2 90  ? -33.71924 12.36060 5.29584   1.000 30.21429 ? 422 ASN B O   1 
ATOM   1007 C CB  . ASN B 2 90  ? -34.47027 10.47740 2.60278   1.000 25.60327 ? 422 ASN B CB  1 
ATOM   1008 C CG  . ASN B 2 90  ? -34.44040 10.65520 1.10542   1.000 26.17123 ? 422 ASN B CG  1 
ATOM   1009 O OD1 . ASN B 2 90  ? -35.04716 11.58239 0.58051   1.000 27.78818 ? 422 ASN B OD1 1 
ATOM   1010 N ND2 . ASN B 2 90  ? -33.68928 9.80083  0.41711   1.000 34.19740 ? 422 ASN B ND2 1 
ATOM   1011 N N   . TYR B 2 91  ? -33.57540 10.12538 5.45357   1.000 28.67639 ? 423 TYR B N   1 
ATOM   1012 C CA  . TYR B 2 91  ? -33.86326 10.13224 6.89218   1.000 22.98342 ? 423 TYR B CA  1 
ATOM   1013 C C   . TYR B 2 91  ? -33.10967 8.99705  7.56345   1.000 29.65208 ? 423 TYR B C   1 
ATOM   1014 O O   . TYR B 2 91  ? -33.34143 7.82853  7.23727   1.000 31.95859 ? 423 TYR B O   1 
ATOM   1015 C CB  . TYR B 2 91  ? -35.37472 10.01412 7.13659   1.000 23.56895 ? 423 TYR B CB  1 
ATOM   1016 C CG  . TYR B 2 91  ? -35.73124 10.08246 8.61186   1.000 27.37697 ? 423 TYR B CG  1 
ATOM   1017 C CD1 . TYR B 2 91  ? -35.79594 8.92743  9.36850   1.000 24.16789 ? 423 TYR B CD1 1 
ATOM   1018 C CD2 . TYR B 2 91  ? -36.01823 11.29587 9.22762   1.000 30.12403 ? 423 TYR B CD2 1 
ATOM   1019 C CE1 . TYR B 2 91  ? -36.11504 8.97293  10.73776  1.000 29.08156 ? 423 TYR B CE1 1 
ATOM   1020 C CE2 . TYR B 2 91  ? -36.34619 11.34968 10.60706  1.000 29.94360 ? 423 TYR B CE2 1 
ATOM   1021 C CZ  . TYR B 2 91  ? -36.39754 10.18210 11.32976  1.000 31.89335 ? 423 TYR B CZ  1 
ATOM   1022 O OH  . TYR B 2 91  ? -36.71661 10.19869 12.66969  1.000 27.82921 ? 423 TYR B OH  1 
ATOM   1023 N N   . LYS B 2 92  ? -32.24270 9.33523  8.52888   1.000 30.25571 ? 424 LYS B N   1 
ATOM   1024 C CA  . LYS B 2 92  ? -31.28566 8.39025  9.09522   1.000 28.27092 ? 424 LYS B CA  1 
ATOM   1025 C C   . LYS B 2 92  ? -31.48762 8.28551  10.59989  1.000 32.21005 ? 424 LYS B C   1 
ATOM   1026 O O   . LYS B 2 92  ? -31.36596 9.28799  11.31390  1.000 34.05992 ? 424 LYS B O   1 
ATOM   1027 C CB  . LYS B 2 92  ? -29.84986 8.81623  8.78847   1.000 31.60891 ? 424 LYS B CB  1 
ATOM   1028 C CG  . LYS B 2 92  ? -28.77181 7.91565  9.39435   1.000 35.36036 ? 424 LYS B CG  1 
ATOM   1029 C CD  . LYS B 2 92  ? -28.95095 6.46170  8.95495   1.000 37.56986 ? 424 LYS B CD  1 
ATOM   1030 C CE  . LYS B 2 92  ? -27.76091 5.59699  9.34229   1.000 40.24592 ? 424 LYS B CE  1 
ATOM   1031 N NZ  . LYS B 2 92  ? -27.97453 4.16647  8.97435   1.000 41.13492 ? 424 LYS B NZ  1 
ATOM   1032 N N   . LEU B 2 93  ? -31.79663 7.02617  11.09835  1.000 32.25579 ? 425 LEU B N   1 
ATOM   1033 C CA  . LEU B 2 93  ? -31.81675 6.86425  12.55100  1.000 34.27911 ? 425 LEU B CA  1 
ATOM   1034 C C   . LEU B 2 93  ? -30.43982 6.45841  13.06440  1.000 36.56049 ? 425 LEU B C   1 
ATOM   1035 O O   . LEU B 2 93  ? -29.67841 5.78526  12.35918  1.000 37.29784 ? 425 LEU B O   1 
ATOM   1036 C CB  . LEU B 2 93  ? -32.83557 5.80088  12.96422  1.000 33.00694 ? 425 LEU B CB  1 
ATOM   1037 C CG  . LEU B 2 93  ? -34.31656 6.11550  12.82929  1.000 32.62140 ? 425 LEU B CG  1 
ATOM   1038 C CD1 . LEU B 2 93  ? -35.13653 4.89206  13.21546  1.000 34.78098 ? 425 LEU B CD1 1 
ATOM   1039 C CD2 . LEU B 2 93  ? -34.71084 7.33719  13.65852  1.000 34.03027 ? 425 LEU B CD2 1 
ATOM   1040 N N   . PRO B 2 94  ? -30.11799 6.83101  14.30084  1.000 43.33748 ? 426 PRO B N   1 
ATOM   1041 C CA  . PRO B 2 94  ? -28.83384 6.43824  14.88868  1.000 46.74774 ? 426 PRO B CA  1 
ATOM   1042 C C   . PRO B 2 94  ? -28.82579 4.99334  15.36386  1.000 45.90798 ? 426 PRO B C   1 
ATOM   1043 O O   . PRO B 2 94  ? -29.86621 4.40075  15.66446  1.000 41.93628 ? 426 PRO B O   1 
ATOM   1044 C CB  . PRO B 2 94  ? -28.68732 7.39790  16.07279  1.000 48.47370 ? 426 PRO B CB  1 
ATOM   1045 C CG  . PRO B 2 94  ? -30.11188 7.68995  16.47497  1.000 42.34168 ? 426 PRO B CG  1 
ATOM   1046 C CD  . PRO B 2 94  ? -30.89619 7.71682  15.18707  1.000 37.64379 ? 426 PRO B CD  1 
ATOM   1047 N N   . ASP B 2 95  ? -27.61134 4.43567  15.44467  1.000 45.41963 ? 427 ASP B N   1 
ATOM   1048 C CA  . ASP B 2 95  ? -27.45095 3.05478  15.88786  1.000 48.48373 ? 427 ASP B CA  1 
ATOM   1049 C C   . ASP B 2 95  ? -28.03052 2.83792  17.28050  1.000 52.81778 ? 427 ASP B C   1 
ATOM   1050 O O   . ASP B 2 95  ? -28.44796 1.72284  17.61013  1.000 53.75245 ? 427 ASP B O   1 
ATOM   1051 C CB  . ASP B 2 95  ? -25.97256 2.65733  15.86802  1.000 47.07358 ? 427 ASP B CB  1 
ATOM   1052 C CG  . ASP B 2 95  ? -25.43584 2.45501  14.46120  1.000 66.34516 ? 427 ASP B CG  1 
ATOM   1053 O OD1 . ASP B 2 95  ? -26.21063 2.59429  13.49330  1.000 57.50349 ? 427 ASP B OD1 1 
ATOM   1054 O OD2 . ASP B 2 95  ? -24.23168 2.15037  14.32188  1.000 76.94143 ? 427 ASP B OD2 1 
ATOM   1055 N N   . ASP B 2 96  ? -28.08698 3.88908  18.09832  1.000 50.59367 ? 428 ASP B N   1 
ATOM   1056 C CA  . ASP B 2 96  ? -28.53305 3.79972  19.48358  1.000 53.60186 ? 428 ASP B CA  1 
ATOM   1057 C C   . ASP B 2 96  ? -29.90704 4.43063  19.69418  1.000 57.22076 ? 428 ASP B C   1 
ATOM   1058 O O   . ASP B 2 96  ? -30.19264 4.95830  20.77173  1.000 61.26542 ? 428 ASP B O   1 
ATOM   1059 C CB  . ASP B 2 96  ? -27.50873 4.45499  20.40741  1.000 52.18098 ? 428 ASP B CB  1 
ATOM   1060 C CG  . ASP B 2 96  ? -27.39834 5.95420  20.18545  1.000 64.97986 ? 428 ASP B CG  1 
ATOM   1061 O OD1 . ASP B 2 96  ? -27.76225 6.42650  19.08592  1.000 62.70921 ? 428 ASP B OD1 1 
ATOM   1062 O OD2 . ASP B 2 96  ? -26.94651 6.66155  21.10910  1.000 64.47513 ? 428 ASP B OD2 1 
ATOM   1063 N N   . PHE B 2 97  ? -30.76425 4.37037  18.67670  1.000 52.18649 ? 429 PHE B N   1 
ATOM   1064 C CA  . PHE B 2 97  ? -32.06947 5.01980  18.72512  1.000 45.54582 ? 429 PHE B CA  1 
ATOM   1065 C C   . PHE B 2 97  ? -32.89381 4.54506  19.91967  1.000 50.65805 ? 429 PHE B C   1 
ATOM   1066 O O   . PHE B 2 97  ? -32.94808 3.35025  20.22496  1.000 51.36290 ? 429 PHE B O   1 
ATOM   1067 C CB  . PHE B 2 97  ? -32.80892 4.74425  17.41205  1.000 38.33154 ? 429 PHE B CB  1 
ATOM   1068 C CG  . PHE B 2 97  ? -34.23500 5.20467  17.39287  1.000 33.69883 ? 429 PHE B CG  1 
ATOM   1069 C CD1 . PHE B 2 97  ? -34.55022 6.54517  17.51417  1.000 31.02825 ? 429 PHE B CD1 1 
ATOM   1070 C CD2 . PHE B 2 97  ? -35.25633 4.29321  17.20692  1.000 34.49917 ? 429 PHE B CD2 1 
ATOM   1071 C CE1 . PHE B 2 97  ? -35.86091 6.96418  17.48009  1.000 32.22125 ? 429 PHE B CE1 1 
ATOM   1072 C CE2 . PHE B 2 97  ? -36.57028 4.69802  17.17640  1.000 33.08690 ? 429 PHE B CE2 1 
ATOM   1073 C CZ  . PHE B 2 97  ? -36.87801 6.03505  17.31346  1.000 29.64071 ? 429 PHE B CZ  1 
ATOM   1074 N N   . THR B 2 98  ? -33.53389 5.49729  20.60093  1.000 46.21392 ? 430 THR B N   1 
ATOM   1075 C CA  . THR B 2 98  ? -34.46652 5.20933  21.69078  1.000 51.16617 ? 430 THR B CA  1 
ATOM   1076 C C   . THR B 2 98  ? -35.82427 5.80675  21.32967  1.000 51.59721 ? 430 THR B C   1 
ATOM   1077 O O   . THR B 2 98  ? -36.04013 7.02062  21.44953  1.000 40.01865 ? 430 THR B O   1 
ATOM   1078 C CB  . THR B 2 98  ? -33.94521 5.74224  23.02533  1.000 53.17946 ? 430 THR B CB  1 
ATOM   1079 O OG1 . THR B 2 98  ? -32.81815 4.95827  23.42670  1.000 53.22231 ? 430 THR B OG1 1 
ATOM   1080 C CG2 . THR B 2 98  ? -35.02300 5.66320  24.10444  1.000 52.57190 ? 430 THR B CG2 1 
ATOM   1081 N N   . GLY B 2 99  ? -36.72729 4.94759  20.87179  1.000 41.53522 ? 431 GLY B N   1 
ATOM   1082 C CA  . GLY B 2 99  ? -38.07368 5.36636  20.54128  1.000 40.10781 ? 431 GLY B CA  1 
ATOM   1083 C C   . GLY B 2 99  ? -38.76208 4.30372  19.69923  1.000 34.15206 ? 431 GLY B C   1 
ATOM   1084 O O   . GLY B 2 99  ? -38.33325 3.15067  19.66316  1.000 39.22812 ? 431 GLY B O   1 
ATOM   1085 N N   . CYS B 2 100 ? -39.83154 4.72305  19.02528  1.000 34.57243 ? 432 CYS B N   1 
ATOM   1086 C CA  . CYS B 2 100 ? -40.63566 3.80884  18.22772  1.000 28.97030 ? 432 CYS B CA  1 
ATOM   1087 C C   . CYS B 2 100 ? -40.75809 4.31001  16.80528  1.000 28.59416 ? 432 CYS B C   1 
ATOM   1088 O O   . CYS B 2 100 ? -40.81072 5.51813  16.55329  1.000 31.39109 ? 432 CYS B O   1 
ATOM   1089 C CB  . CYS B 2 100 ? -42.04175 3.63244  18.75048  1.000 27.84785 ? 432 CYS B CB  1 
ATOM   1090 S SG  . CYS B 2 100 ? -42.06856 3.26702  20.52360  1.000 41.10693 ? 432 CYS B SG  1 
ATOM   1091 N N   . VAL B 2 101 ? -40.87069 3.34971  15.89868  1.000 29.17566 ? 433 VAL B N   1 
ATOM   1092 C CA  . VAL B 2 101 ? -41.13003 3.60403  14.48267  1.000 30.27542 ? 433 VAL B CA  1 
ATOM   1093 C C   . VAL B 2 101 ? -42.50778 3.03569  14.17045  1.000 32.27962 ? 433 VAL B C   1 
ATOM   1094 O O   . VAL B 2 101 ? -42.74912 1.84109  14.38482  1.000 33.84977 ? 433 VAL B O   1 
ATOM   1095 C CB  . VAL B 2 101 ? -40.05317 2.97335  13.58963  1.000 27.04905 ? 433 VAL B CB  1 
ATOM   1096 C CG1 . VAL B 2 101 ? -40.36361 3.19837  12.08328  1.000 28.06035 ? 433 VAL B CG1 1 
ATOM   1097 C CG2 . VAL B 2 101 ? -38.69171 3.53163  13.94207  1.000 33.74473 ? 433 VAL B CG2 1 
ATOM   1098 N N   . ILE B 2 102 ? -43.40832 3.89246  13.68782  1.000 29.09500 ? 434 ILE B N   1 
ATOM   1099 C CA  . ILE B 2 102 ? -44.80711 3.55972  13.41701  1.000 32.40053 ? 434 ILE B CA  1 
ATOM   1100 C C   . ILE B 2 102 ? -45.12894 3.93018  11.96921  1.000 35.72890 ? 434 ILE B C   1 
ATOM   1101 O O   . ILE B 2 102 ? -44.81525 5.04382  11.53104  1.000 32.80874 ? 434 ILE B O   1 
ATOM   1102 C CB  . ILE B 2 102 ? -45.75229 4.30493  14.37798  1.000 30.21007 ? 434 ILE B CB  1 
ATOM   1103 C CG1 . ILE B 2 102 ? -45.39394 3.98040  15.83522  1.000 36.44419 ? 434 ILE B CG1 1 
ATOM   1104 C CG2 . ILE B 2 102 ? -47.20279 3.97090  14.08487  1.000 32.12704 ? 434 ILE B CG2 1 
ATOM   1105 C CD1 . ILE B 2 102 ? -45.97923 4.94635  16.82978  1.000 37.09711 ? 434 ILE B CD1 1 
ATOM   1106 N N   . ALA B 2 103 ? -45.78608 3.02175  11.23815  1.000 30.89640 ? 435 ALA B N   1 
ATOM   1107 C CA  . ALA B 2 103 ? -46.12843 3.28509  9.83965   1.000 34.71799 ? 435 ALA B CA  1 
ATOM   1108 C C   . ALA B 2 103 ? -47.50129 2.71156  9.50378   1.000 39.57154 ? 435 ALA B C   1 
ATOM   1109 O O   . ALA B 2 103 ? -47.98094 1.78480  10.16121  1.000 40.13009 ? 435 ALA B O   1 
ATOM   1110 C CB  . ALA B 2 103 ? -45.07527 2.70564  8.89368   1.000 36.02994 ? 435 ALA B CB  1 
ATOM   1111 N N   . TRP B 2 104 ? -48.13682 3.27661  8.47109   1.000 35.29322 ? 436 TRP B N   1 
ATOM   1112 C CA  . TRP B 2 104 ? -49.39618 2.73740  7.96923   1.000 34.40768 ? 436 TRP B CA  1 
ATOM   1113 C C   . TRP B 2 104 ? -49.59603 3.11197  6.50181   1.000 38.44272 ? 436 TRP B C   1 
ATOM   1114 O O   . TRP B 2 104 ? -49.05576 4.10796  6.00849   1.000 32.45791 ? 436 TRP B O   1 
ATOM   1115 C CB  . TRP B 2 104 ? -50.60775 3.19614  8.80419   1.000 35.21926 ? 436 TRP B CB  1 
ATOM   1116 C CG  . TRP B 2 104 ? -50.84962 4.67479  8.83791   1.000 35.91986 ? 436 TRP B CG  1 
ATOM   1117 C CD1 . TRP B 2 104 ? -51.79650 5.36344  8.15901   1.000 36.94815 ? 436 TRP B CD1 1 
ATOM   1118 C CD2 . TRP B 2 104 ? -50.15090 5.63838  9.63968   1.000 38.99606 ? 436 TRP B CD2 1 
ATOM   1119 N NE1 . TRP B 2 104 ? -51.72481 6.70450  8.46153   1.000 38.95352 ? 436 TRP B NE1 1 
ATOM   1120 C CE2 . TRP B 2 104 ? -50.71897 6.89770  9.36702   1.000 39.99404 ? 436 TRP B CE2 1 
ATOM   1121 C CE3 . TRP B 2 104 ? -49.09717 5.55640  10.55238  1.000 37.72701 ? 436 TRP B CE3 1 
ATOM   1122 C CZ2 . TRP B 2 104 ? -50.27176 8.06460  9.97390   1.000 41.88535 ? 436 TRP B CZ2 1 
ATOM   1123 C CZ3 . TRP B 2 104 ? -48.64873 6.71270  11.13899  1.000 34.62529 ? 436 TRP B CZ3 1 
ATOM   1124 C CH2 . TRP B 2 104 ? -49.23757 7.95045  10.85099  1.000 33.52308 ? 436 TRP B CH2 1 
ATOM   1125 N N   . ASN B 2 105 ? -50.38784 2.29225  5.81622   1.000 32.58048 ? 437 ASN B N   1 
ATOM   1126 C CA  . ASN B 2 105 ? -50.65432 2.48748  4.39790   1.000 32.63643 ? 437 ASN B CA  1 
ATOM   1127 C C   . ASN B 2 105 ? -51.56772 3.69110  4.21116   1.000 38.32939 ? 437 ASN B C   1 
ATOM   1128 O O   . ASN B 2 105 ? -52.64543 3.75976  4.80942   1.000 39.78424 ? 437 ASN B O   1 
ATOM   1129 C CB  . ASN B 2 105 ? -51.30814 1.23151  3.83770   1.000 36.55870 ? 437 ASN B CB  1 
ATOM   1130 C CG  . ASN B 2 105 ? -51.52537 1.30162  2.34774   1.000 34.99725 ? 437 ASN B CG  1 
ATOM   1131 O OD1 . ASN B 2 105 ? -52.31954 2.10830  1.85261   1.000 37.33136 ? 437 ASN B OD1 1 
ATOM   1132 N ND2 . ASN B 2 105 ? -50.83939 0.43431  1.62478   1.000 36.50397 ? 437 ASN B ND2 1 
ATOM   1133 N N   . SER B 2 106 ? -51.14428 4.64631  3.38778   1.000 32.74226 ? 438 SER B N   1 
ATOM   1134 C CA  . SER B 2 106 ? -51.91768 5.86160  3.16960   1.000 33.39809 ? 438 SER B CA  1 
ATOM   1135 C C   . SER B 2 106 ? -52.34270 6.00770  1.71053   1.000 38.40477 ? 438 SER B C   1 
ATOM   1136 O O   . SER B 2 106 ? -52.55536 7.12367  1.23618   1.000 35.50156 ? 438 SER B O   1 
ATOM   1137 C CB  . SER B 2 106 ? -51.12947 7.08749  3.62353   1.000 39.78537 ? 438 SER B CB  1 
ATOM   1138 O OG  . SER B 2 106 ? -49.93267 7.23061  2.87267   1.000 36.98574 ? 438 SER B OG  1 
ATOM   1139 N N   . ASN B 2 107 ? -52.48450 4.87564  1.01228   1.000 40.08556 ? 439 ASN B N   1 
ATOM   1140 C CA  . ASN B 2 107 ? -52.87318 4.86889  -0.40269  1.000 43.41641 ? 439 ASN B CA  1 
ATOM   1141 C C   . ASN B 2 107 ? -54.15401 5.65535  -0.64728  1.000 41.78968 ? 439 ASN B C   1 
ATOM   1142 O O   . ASN B 2 107 ? -54.25436 6.40824  -1.62243  1.000 43.76819 ? 439 ASN B O   1 
ATOM   1143 C CB  . ASN B 2 107 ? -53.04979 3.42872  -0.87036  1.000 35.42971 ? 439 ASN B CB  1 
ATOM   1144 C CG  . ASN B 2 107 ? -53.11216 3.30822  -2.38419  1.000 45.63966 ? 439 ASN B CG  1 
ATOM   1145 O OD1 . ASN B 2 107 ? -52.37976 3.98978  -3.10003  1.000 38.27016 ? 439 ASN B OD1 1 
ATOM   1146 N ND2 . ASN B 2 107 ? -53.99019 2.44557  -2.87518  1.000 48.27248 ? 439 ASN B ND2 1 
ATOM   1147 N N   . LYS B 2 108 ? -55.14436 5.50145  0.23713   1.000 42.96473 ? 440 LYS B N   1 
ATOM   1148 C CA  . LYS B 2 108 ? -56.40488 6.21770  0.06873   1.000 40.95987 ? 440 LYS B CA  1 
ATOM   1149 C C   . LYS B 2 108 ? -56.21796 7.72516  0.14866   1.000 44.32934 ? 440 LYS B C   1 
ATOM   1150 O O   . LYS B 2 108 ? -56.96040 8.47417  -0.49311  1.000 54.10702 ? 440 LYS B O   1 
ATOM   1151 C CB  . LYS B 2 108 ? -57.41595 5.75082  1.11526   1.000 54.79902 ? 440 LYS B CB  1 
ATOM   1152 C CG  . LYS B 2 108 ? -57.78501 4.28412  0.97832   1.000 62.80680 ? 440 LYS B CG  1 
ATOM   1153 C CD  . LYS B 2 108 ? -58.88082 3.87623  1.94660   1.000 66.23711 ? 440 LYS B CD  1 
ATOM   1154 C CE  . LYS B 2 108 ? -59.33948 2.45346  1.66422   1.000 66.99477 ? 440 LYS B CE  1 
ATOM   1155 N NZ  . LYS B 2 108 ? -59.79314 2.29714  0.25080   1.000 70.29737 ? 440 LYS B NZ  1 
ATOM   1156 N N   . LEU B 2 109 ? -55.22631 8.18879  0.90615   1.000 48.84990 ? 441 LEU B N   1 
ATOM   1157 C CA  . LEU B 2 109 ? -55.03185 9.61721  1.12254   1.000 45.19033 ? 441 LEU B CA  1 
ATOM   1158 C C   . LEU B 2 109 ? -54.00979 10.23033 0.17801   1.000 43.53796 ? 441 LEU B C   1 
ATOM   1159 O O   . LEU B 2 109 ? -54.17018 11.38165 -0.24439  1.000 47.23249 ? 441 LEU B O   1 
ATOM   1160 C CB  . LEU B 2 109 ? -54.58497 9.87387  2.56335   1.000 41.23372 ? 441 LEU B CB  1 
ATOM   1161 C CG  . LEU B 2 109 ? -55.61506 9.53591  3.62926   1.000 46.92984 ? 441 LEU B CG  1 
ATOM   1162 C CD1 . LEU B 2 109 ? -55.08055 9.89770  5.00658   1.000 49.21735 ? 441 LEU B CD1 1 
ATOM   1163 C CD2 . LEU B 2 109 ? -56.89978 10.27613 3.31868   1.000 55.57270 ? 441 LEU B CD2 1 
ATOM   1164 N N   . ASP B 2 110 ? -52.95047 9.49251  -0.14414  1.000 40.94315 ? 442 ASP B N   1 
ATOM   1165 C CA  . ASP B 2 110 ? -51.78569 10.07153 -0.78924  1.000 36.53417 ? 442 ASP B CA  1 
ATOM   1166 C C   . ASP B 2 110 ? -51.57791 9.61743  -2.22933  1.000 38.03939 ? 442 ASP B C   1 
ATOM   1167 O O   . ASP B 2 110 ? -50.67549 10.13801 -2.88925  1.000 41.93667 ? 442 ASP B O   1 
ATOM   1168 C CB  . ASP B 2 110 ? -50.52828 9.76604  0.03782   1.000 34.10893 ? 442 ASP B CB  1 
ATOM   1169 C CG  . ASP B 2 110 ? -50.55815 10.43936 1.41173   1.000 37.71791 ? 442 ASP B CG  1 
ATOM   1170 O OD1 . ASP B 2 110 ? -51.04194 11.59055 1.50707   1.000 39.72889 ? 442 ASP B OD1 1 
ATOM   1171 O OD2 . ASP B 2 110 ? -50.09123 9.81914  2.38203   1.000 39.75786 ? 442 ASP B OD2 1 
ATOM   1172 N N   . SER B 2 111 ? -52.36850 8.67378  -2.73016  1.000 41.07727 ? 443 SER B N   1 
ATOM   1173 C CA  . SER B 2 111 ? -52.33683 8.30139  -4.14087  1.000 37.77370 ? 443 SER B CA  1 
ATOM   1174 C C   . SER B 2 111 ? -53.41162 9.06057  -4.89992  1.000 47.64982 ? 443 SER B C   1 
ATOM   1175 O O   . SER B 2 111 ? -54.50091 9.30915  -4.37754  1.000 48.36653 ? 443 SER B O   1 
ATOM   1176 C CB  . SER B 2 111 ? -52.55806 6.80061  -4.33040  1.000 39.44908 ? 443 SER B CB  1 
ATOM   1177 O OG  . SER B 2 111 ? -51.55359 6.04219  -3.67618  1.000 48.00162 ? 443 SER B OG  1 
ATOM   1178 N N   . LYS B 2 112 ? -53.10889 9.39693  -6.15635  1.000 51.27371 ? 444 LYS B N   1 
ATOM   1179 C CA  . LYS B 2 112 ? -54.03609 10.12077 -7.01297  1.000 44.59057 ? 444 LYS B CA  1 
ATOM   1180 C C   . LYS B 2 112 ? -54.01242 9.50932  -8.40342  1.000 49.02135 ? 444 LYS B C   1 
ATOM   1181 O O   . LYS B 2 112 ? -52.95512 9.09489  -8.88795  1.000 44.33659 ? 444 LYS B O   1 
ATOM   1182 C CB  . LYS B 2 112 ? -53.68456 11.61602 -7.09744  1.000 42.21526 ? 444 LYS B CB  1 
ATOM   1183 C CG  . LYS B 2 112 ? -53.52801 12.31944 -5.74267  1.000 58.84911 ? 444 LYS B CG  1 
ATOM   1184 C CD  . LYS B 2 112 ? -54.84503 12.42104 -4.98820  1.000 64.51739 ? 444 LYS B CD  1 
ATOM   1185 C CE  . LYS B 2 112 ? -54.63891 13.02428 -3.60239  1.000 65.76094 ? 444 LYS B CE  1 
ATOM   1186 N NZ  . LYS B 2 112 ? -55.90791 13.10284 -2.82380  1.000 61.72392 ? 444 LYS B NZ  1 
ATOM   1187 N N   . VAL B 2 113 ? -55.18744 9.43773  -9.03208  1.000 50.62857 ? 445 VAL B N   1 
ATOM   1188 C CA  . VAL B 2 113 ? -55.26022 8.99192  -10.41812 1.000 45.55623 ? 445 VAL B CA  1 
ATOM   1189 C C   . VAL B 2 113 ? -54.36387 9.87509  -11.26398 1.000 44.43759 ? 445 VAL B C   1 
ATOM   1190 O O   . VAL B 2 113 ? -54.48047 11.10440 -11.23934 1.000 53.50151 ? 445 VAL B O   1 
ATOM   1191 C CB  . VAL B 2 113 ? -56.71631 9.02003  -10.91457 1.000 47.34344 ? 445 VAL B CB  1 
ATOM   1192 C CG1 . VAL B 2 113 ? -56.75970 9.08384  -12.44282 1.000 53.42812 ? 445 VAL B CG1 1 
ATOM   1193 C CG2 . VAL B 2 113 ? -57.46150 7.80148  -10.41452 1.000 54.78253 ? 445 VAL B CG2 1 
ATOM   1194 N N   . GLY B 2 114 ? -53.44815 9.25478  -12.00098 1.000 48.16321 ? 446 GLY B N   1 
ATOM   1195 C CA  . GLY B 2 114 ? -52.48372 10.00975 -12.76758 1.000 47.65542 ? 446 GLY B CA  1 
ATOM   1196 C C   . GLY B 2 114 ? -51.24384 10.42091 -12.00839 1.000 56.09804 ? 446 GLY B C   1 
ATOM   1197 O O   . GLY B 2 114 ? -50.37199 11.07504 -12.59241 1.000 46.46225 ? 446 GLY B O   1 
ATOM   1198 N N   . GLY B 2 115 ? -51.13984 10.08047 -10.72238 1.000 45.23200 ? 447 GLY B N   1 
ATOM   1199 C CA  . GLY B 2 115 ? -49.89039 10.27336 -10.01304 1.000 42.62885 ? 447 GLY B CA  1 
ATOM   1200 C C   . GLY B 2 115 ? -49.83797 11.48724 -9.11389  1.000 43.37101 ? 447 GLY B C   1 
ATOM   1201 O O   . GLY B 2 115 ? -50.13151 12.60765 -9.53848  1.000 47.98182 ? 447 GLY B O   1 
ATOM   1202 N N   . ASN B 2 116 ? -49.46552 11.27124 -7.85477  1.000 41.28343 ? 448 ASN B N   1 
ATOM   1203 C CA  . ASN B 2 116 ? -49.25646 12.35013 -6.89885  1.000 41.92799 ? 448 ASN B CA  1 
ATOM   1204 C C   . ASN B 2 116 ? -47.76705 12.67416 -6.85592  1.000 41.44584 ? 448 ASN B C   1 
ATOM   1205 O O   . ASN B 2 116 ? -46.97467 11.91286 -6.28887  1.000 47.91383 ? 448 ASN B O   1 
ATOM   1206 C CB  . ASN B 2 116 ? -49.77436 11.94889 -5.51882  1.000 37.50128 ? 448 ASN B CB  1 
ATOM   1207 C CG  . ASN B 2 116 ? -49.61527 13.04779 -4.49210  1.000 46.36205 ? 448 ASN B CG  1 
ATOM   1208 O OD1 . ASN B 2 116 ? -49.09172 14.12393 -4.78833  1.000 42.30817 ? 448 ASN B OD1 1 
ATOM   1209 N ND2 . ASN B 2 116 ? -50.08093 12.78581 -3.26675  1.000 43.83205 ? 448 ASN B ND2 1 
ATOM   1210 N N   . TYR B 2 117 ? -47.39554 13.82104 -7.41938  1.000 38.94794 ? 449 TYR B N   1 
ATOM   1211 C CA  . TYR B 2 117 ? -46.00509 14.24552 -7.49234  1.000 38.12329 ? 449 TYR B CA  1 
ATOM   1212 C C   . TYR B 2 117 ? -45.64507 15.23243 -6.38474  1.000 39.22946 ? 449 TYR B C   1 
ATOM   1213 O O   . TYR B 2 117 ? -44.56274 15.82484 -6.41348  1.000 38.94115 ? 449 TYR B O   1 
ATOM   1214 C CB  . TYR B 2 117 ? -45.71893 14.81231 -8.89128  1.000 42.24629 ? 449 TYR B CB  1 
ATOM   1215 C CG  . TYR B 2 117 ? -45.77429 13.71099 -9.94423  1.000 45.12398 ? 449 TYR B CG  1 
ATOM   1216 C CD1 . TYR B 2 117 ? -46.98233 13.30458 -10.49753 1.000 48.10689 ? 449 TYR B CD1 1 
ATOM   1217 C CD2 . TYR B 2 117 ? -44.62203 13.03802 -10.33472 1.000 48.66337 ? 449 TYR B CD2 1 
ATOM   1218 C CE1 . TYR B 2 117 ? -47.03333 12.28148 -11.42678 1.000 48.46053 ? 449 TYR B CE1 1 
ATOM   1219 C CE2 . TYR B 2 117 ? -44.66124 12.01715 -11.25371 1.000 43.50813 ? 449 TYR B CE2 1 
ATOM   1220 C CZ  . TYR B 2 117 ? -45.86639 11.64338 -11.79951 1.000 52.45074 ? 449 TYR B CZ  1 
ATOM   1221 O OH  . TYR B 2 117 ? -45.89751 10.62466 -12.71704 1.000 51.80700 ? 449 TYR B OH  1 
ATOM   1222 N N   . ASN B 2 118 ? -46.51151 15.37172 -5.37939  1.000 44.06961 ? 450 ASN B N   1 
ATOM   1223 C CA  . ASN B 2 118 ? -46.25370 16.28049 -4.26686  1.000 44.60803 ? 450 ASN B CA  1 
ATOM   1224 C C   . ASN B 2 118 ? -45.25218 15.71587 -3.26753  1.000 39.31869 ? 450 ASN B C   1 
ATOM   1225 O O   . ASN B 2 118 ? -44.61472 16.48691 -2.54018  1.000 37.66795 ? 450 ASN B O   1 
ATOM   1226 C CB  . ASN B 2 118 ? -47.56019 16.61337 -3.55108  1.000 41.78491 ? 450 ASN B CB  1 
ATOM   1227 C CG  . ASN B 2 118 ? -48.47238 17.47358 -4.38708  1.000 50.02912 ? 450 ASN B CG  1 
ATOM   1228 O OD1 . ASN B 2 118 ? -48.03849 18.46001 -4.97976  1.000 49.27378 ? 450 ASN B OD1 1 
ATOM   1229 N ND2 . ASN B 2 118 ? -49.74746 17.10748 -4.44025  1.000 53.32461 ? 450 ASN B ND2 1 
ATOM   1230 N N   . TYR B 2 119 ? -45.11074 14.39461 -3.20055  1.000 37.19362 ? 451 TYR B N   1 
ATOM   1231 C CA  . TYR B 2 119 ? -44.16266 13.75132 -2.30133  1.000 34.99599 ? 451 TYR B CA  1 
ATOM   1232 C C   . TYR B 2 119 ? -42.87957 13.42818 -3.05501  1.000 37.41199 ? 451 TYR B C   1 
ATOM   1233 O O   . TYR B 2 119 ? -42.92051 12.78452 -4.10918  1.000 37.43741 ? 451 TYR B O   1 
ATOM   1234 C CB  . TYR B 2 119 ? -44.76589 12.48076 -1.70569  1.000 31.48040 ? 451 TYR B CB  1 
ATOM   1235 C CG  . TYR B 2 119 ? -45.86895 12.73951 -0.70863  1.000 32.99296 ? 451 TYR B CG  1 
ATOM   1236 C CD1 . TYR B 2 119 ? -45.57357 13.12161 0.58888   1.000 39.86629 ? 451 TYR B CD1 1 
ATOM   1237 C CD2 . TYR B 2 119 ? -47.20535 12.58337 -1.05760  1.000 34.69504 ? 451 TYR B CD2 1 
ATOM   1238 C CE1 . TYR B 2 119 ? -46.56947 13.35041 1.49857   1.000 32.76069 ? 451 TYR B CE1 1 
ATOM   1239 C CE2 . TYR B 2 119 ? -48.22020 12.81494 -0.14515  1.000 31.19189 ? 451 TYR B CE2 1 
ATOM   1240 C CZ  . TYR B 2 119 ? -47.88581 13.18954 1.14162   1.000 37.78242 ? 451 TYR B CZ  1 
ATOM   1241 O OH  . TYR B 2 119 ? -48.86883 13.42507 2.07468   1.000 43.99062 ? 451 TYR B OH  1 
ATOM   1242 N N   . LEU B 2 120 ? -41.75261 13.87846 -2.51273  1.000 33.93591 ? 452 LEU B N   1 
ATOM   1243 C CA  . LEU B 2 120 ? -40.43921 13.74331 -3.12186  1.000 31.56024 ? 452 LEU B CA  1 
ATOM   1244 C C   . LEU B 2 120 ? -39.51096 12.92506 -2.23754  1.000 37.83925 ? 452 LEU B C   1 
ATOM   1245 O O   . LEU B 2 120 ? -39.72784 12.79309 -1.02605  1.000 32.91377 ? 452 LEU B O   1 
ATOM   1246 C CB  . LEU B 2 120 ? -39.80234 15.12098 -3.36519  1.000 35.30178 ? 452 LEU B CB  1 
ATOM   1247 C CG  . LEU B 2 120 ? -40.67780 16.20330 -4.00667  1.000 35.50358 ? 452 LEU B CG  1 
ATOM   1248 C CD1 . LEU B 2 120 ? -39.90385 17.49697 -4.16867  1.000 42.72405 ? 452 LEU B CD1 1 
ATOM   1249 C CD2 . LEU B 2 120 ? -41.15727 15.73809 -5.35815  1.000 39.62964 ? 452 LEU B CD2 1 
ATOM   1250 N N   . TYR B 2 121 ? -38.45477 12.39413 -2.85512  1.000 31.11688 ? 453 TYR B N   1 
ATOM   1251 C CA  . TYR B 2 121 ? -37.31221 11.82640 -2.14681  1.000 32.69243 ? 453 TYR B CA  1 
ATOM   1252 C C   . TYR B 2 121 ? -36.04114 12.25315 -2.86787  1.000 34.83110 ? 453 TYR B C   1 
ATOM   1253 O O   . TYR B 2 121 ? -36.06762 12.63233 -4.04446  1.000 32.83737 ? 453 TYR B O   1 
ATOM   1254 C CB  . TYR B 2 121 ? -37.37976 10.28340 -2.04869  1.000 29.79256 ? 453 TYR B CB  1 
ATOM   1255 C CG  . TYR B 2 121 ? -37.35427 9.62134  -3.41296  1.000 30.55379 ? 453 TYR B CG  1 
ATOM   1256 C CD1 . TYR B 2 121 ? -38.50981 9.53892  -4.16844  1.000 25.63799 ? 453 TYR B CD1 1 
ATOM   1257 C CD2 . TYR B 2 121 ? -36.18925 9.07991  -3.92865  1.000 29.87811 ? 453 TYR B CD2 1 
ATOM   1258 C CE1 . TYR B 2 121 ? -38.51561 8.94795  -5.45896  1.000 24.68639 ? 453 TYR B CE1 1 
ATOM   1259 C CE2 . TYR B 2 121 ? -36.17420 8.49165  -5.22745  1.000 29.04327 ? 453 TYR B CE2 1 
ATOM   1260 C CZ  . TYR B 2 121 ? -37.34221 8.41657  -5.95875  1.000 31.59564 ? 453 TYR B CZ  1 
ATOM   1261 O OH  . TYR B 2 121 ? -37.34473 7.84957  -7.23938  1.000 33.04985 ? 453 TYR B OH  1 
ATOM   1262 N N   . ARG B 2 122 ? -34.91947 12.16650 -2.15988  1.000 33.21532 ? 454 ARG B N   1 
ATOM   1263 C CA  . ARG B 2 122 ? -33.61130 12.50412 -2.71332  1.000 27.86372 ? 454 ARG B CA  1 
ATOM   1264 C C   . ARG B 2 122 ? -32.93394 11.24703 -3.24458  1.000 28.74985 ? 454 ARG B C   1 
ATOM   1265 O O   . ARG B 2 122 ? -32.70868 10.29484 -2.49407  1.000 33.45817 ? 454 ARG B O   1 
ATOM   1266 C CB  . ARG B 2 122 ? -32.73768 13.18432 -1.65775  1.000 33.08448 ? 454 ARG B CB  1 
ATOM   1267 C CG  . ARG B 2 122 ? -31.33847 13.53468 -2.15212  1.000 32.86349 ? 454 ARG B CG  1 
ATOM   1268 C CD  . ARG B 2 122 ? -30.49727 14.25822 -1.07772  1.000 33.93952 ? 454 ARG B CD  1 
ATOM   1269 N NE  . ARG B 2 122 ? -31.16833 15.43859 -0.54204  1.000 33.38040 ? 454 ARG B NE  1 
ATOM   1270 C CZ  . ARG B 2 122 ? -31.24801 16.61962 -1.14413  1.000 35.65710 ? 454 ARG B CZ  1 
ATOM   1271 N NH1 . ARG B 2 122 ? -30.68735 16.84204 -2.33037  1.000 34.98162 ? 454 ARG B NH1 1 
ATOM   1272 N NH2 . ARG B 2 122 ? -31.93541 17.59625 -0.56194  1.000 32.93362 ? 454 ARG B NH2 1 
ATOM   1273 N N   . LEU B 2 123 ? -32.63838 11.23530 -4.55455  1.000 25.11720 ? 455 LEU B N   1 
ATOM   1274 C CA  . LEU B 2 123 ? -31.98617 10.08744 -5.17217  1.000 28.64229 ? 455 LEU B CA  1 
ATOM   1275 C C   . LEU B 2 123 ? -30.46031 10.18040 -5.19069  1.000 32.28266 ? 455 LEU B C   1 
ATOM   1276 O O   . LEU B 2 123 ? -29.78454 9.14047  -5.21015  1.000 31.30138 ? 455 LEU B O   1 
ATOM   1277 C CB  . LEU B 2 123 ? -32.51260 9.92245  -6.59847  1.000 28.32898 ? 455 LEU B CB  1 
ATOM   1278 C CG  . LEU B 2 123 ? -31.97700 8.74286  -7.40871  1.000 28.87923 ? 455 LEU B CG  1 
ATOM   1279 C CD1 . LEU B 2 123 ? -32.10405 7.41930  -6.68449  1.000 31.72733 ? 455 LEU B CD1 1 
ATOM   1280 C CD2 . LEU B 2 123 ? -32.68387 8.68594  -8.75297  1.000 30.64718 ? 455 LEU B CD2 1 
ATOM   1281 N N   . PHE B 2 124 ? -29.89112 11.38206 -5.17656  1.000 32.53401 ? 456 PHE B N   1 
ATOM   1282 C CA  . PHE B 2 124 ? -28.45231 11.56078 -5.32060  1.000 32.40790 ? 456 PHE B CA  1 
ATOM   1283 C C   . PHE B 2 124 ? -27.91269 12.36327 -4.14788  1.000 34.42678 ? 456 PHE B C   1 
ATOM   1284 O O   . PHE B 2 124 ? -28.54648 13.32444 -3.70974  1.000 34.83875 ? 456 PHE B O   1 
ATOM   1285 C CB  . PHE B 2 124 ? -28.09634 12.29656 -6.63304  1.000 32.86275 ? 456 PHE B CB  1 
ATOM   1286 C CG  . PHE B 2 124 ? -28.68673 11.67811 -7.88699  1.000 33.81883 ? 456 PHE B CG  1 
ATOM   1287 C CD1 . PHE B 2 124 ? -27.99177 10.71254 -8.59647  1.000 30.59092 ? 456 PHE B CD1 1 
ATOM   1288 C CD2 . PHE B 2 124 ? -29.91651 12.09949 -8.37127  1.000 31.43715 ? 456 PHE B CD2 1 
ATOM   1289 C CE1 . PHE B 2 124 ? -28.52544 10.16114 -9.78768  1.000 27.79522 ? 456 PHE B CE1 1 
ATOM   1290 C CE2 . PHE B 2 124 ? -30.45778 11.55194 -9.54900  1.000 34.56968 ? 456 PHE B CE2 1 
ATOM   1291 C CZ  . PHE B 2 124 ? -29.76178 10.58357 -10.24232 1.000 35.30358 ? 456 PHE B CZ  1 
ATOM   1292 N N   . ARG B 2 125 ? -26.72766 11.98753 -3.67010  1.000 33.11016 ? 457 ARG B N   1 
ATOM   1293 C CA  . ARG B 2 125 ? -26.03770 12.72583 -2.61746  1.000 34.53968 ? 457 ARG B CA  1 
ATOM   1294 C C   . ARG B 2 125 ? -24.59685 12.23822 -2.54377  1.000 35.58669 ? 457 ARG B C   1 
ATOM   1295 O O   . ARG B 2 125 ? -24.33872 11.04200 -2.69917  1.000 40.14805 ? 457 ARG B O   1 
ATOM   1296 C CB  . ARG B 2 125 ? -26.73807 12.55397 -1.25879  1.000 32.46658 ? 457 ARG B CB  1 
ATOM   1297 C CG  . ARG B 2 125 ? -26.40106 13.65820 -0.26493  1.000 32.18253 ? 457 ARG B CG  1 
ATOM   1298 C CD  . ARG B 2 125 ? -27.21405 13.53615 1.01632   1.000 35.53956 ? 457 ARG B CD  1 
ATOM   1299 N NE  . ARG B 2 125 ? -27.08518 14.73490 1.83982   1.000 38.31240 ? 457 ARG B NE  1 
ATOM   1300 C CZ  . ARG B 2 125 ? -26.16647 14.90130 2.77992   1.000 38.10620 ? 457 ARG B CZ  1 
ATOM   1301 N NH1 . ARG B 2 125 ? -25.28332 13.95639 3.05902   1.000 36.58125 ? 457 ARG B NH1 1 
ATOM   1302 N NH2 . ARG B 2 125 ? -26.14036 16.04101 3.46528   1.000 40.74352 ? 457 ARG B NH2 1 
ATOM   1303 N N   . LYS B 2 126 ? -23.66515 13.16579 -2.29239  1.000 33.96627 ? 458 LYS B N   1 
ATOM   1304 C CA  . LYS B 2 126 ? -22.24893 12.80153 -2.27036  1.000 41.74849 ? 458 LYS B CA  1 
ATOM   1305 C C   . LYS B 2 126 ? -21.90837 11.87726 -1.10503  1.000 46.90072 ? 458 LYS B C   1 
ATOM   1306 O O   . LYS B 2 126 ? -21.02319 11.02345 -1.22991  1.000 44.40119 ? 458 LYS B O   1 
ATOM   1307 C CB  . LYS B 2 126 ? -21.38306 14.06087 -2.20778  1.000 55.34661 ? 458 LYS B CB  1 
ATOM   1308 C CG  . LYS B 2 126 ? -21.61414 15.03712 -3.35414  1.000 64.56254 ? 458 LYS B CG  1 
ATOM   1309 C CD  . LYS B 2 126 ? -20.60515 16.18664 -3.33527  1.000 68.59748 ? 458 LYS B CD  1 
ATOM   1310 C CE  . LYS B 2 126 ? -20.98347 17.26468 -2.32729  1.000 67.46136 ? 458 LYS B CE  1 
ATOM   1311 N NZ  . LYS B 2 126 ? -22.25575 17.95789 -2.69043  1.000 68.40671 ? 458 LYS B NZ  1 
ATOM   1312 N N   . SER B 2 127 ? -22.58692 12.02795 0.02909   1.000 42.44941 ? 459 SER B N   1 
ATOM   1313 C CA  . SER B 2 127 ? -22.29387 11.23805 1.21815   1.000 47.87955 ? 459 SER B CA  1 
ATOM   1314 C C   . SER B 2 127 ? -23.58546 10.94887 1.97010   1.000 37.34353 ? 459 SER B C   1 
ATOM   1315 O O   . SER B 2 127 ? -24.61817 11.58611 1.74243   1.000 38.17652 ? 459 SER B O   1 
ATOM   1316 C CB  . SER B 2 127 ? -21.30576 11.95489 2.15285   1.000 43.03292 ? 459 SER B CB  1 
ATOM   1317 O OG  . SER B 2 127 ? -21.87483 13.15756 2.63226   1.000 45.11798 ? 459 SER B OG  1 
ATOM   1318 N N   . ASN B 2 128 ? -23.50731 9.98498  2.88364   1.000 39.14667 ? 460 ASN B N   1 
ATOM   1319 C CA  . ASN B 2 128 ? -24.66423 9.60971  3.68997   1.000 42.81443 ? 460 ASN B CA  1 
ATOM   1320 C C   . ASN B 2 128 ? -24.97217 10.65506 4.75374   1.000 35.67423 ? 460 ASN B C   1 
ATOM   1321 O O   . ASN B 2 128 ? -24.08916 11.36058 5.24714   1.000 42.60726 ? 460 ASN B O   1 
ATOM   1322 C CB  . ASN B 2 128 ? -24.44189 8.25996  4.37084   1.000 39.96535 ? 460 ASN B CB  1 
ATOM   1323 C CG  . ASN B 2 128 ? -24.27584 7.12396  3.37881   1.000 46.71370 ? 460 ASN B CG  1 
ATOM   1324 O OD1 . ASN B 2 128 ? -24.54352 7.28095  2.18510   1.000 44.20338 ? 460 ASN B OD1 1 
ATOM   1325 N ND2 . ASN B 2 128 ? -23.82851 5.97123  3.86981   1.000 50.49164 ? 460 ASN B ND2 1 
ATOM   1326 N N   . LEU B 2 129 ? -26.24947 10.74402 5.10125   1.000 35.11111 ? 461 LEU B N   1 
ATOM   1327 C CA  . LEU B 2 129 ? -26.67590 11.62553 6.17735   1.000 36.54619 ? 461 LEU B CA  1 
ATOM   1328 C C   . LEU B 2 129 ? -26.14157 11.14604 7.51556   1.000 35.14408 ? 461 LEU B C   1 
ATOM   1329 O O   . LEU B 2 129 ? -25.98431 9.94595  7.76114   1.000 34.39563 ? 461 LEU B O   1 
ATOM   1330 C CB  . LEU B 2 129 ? -28.19623 11.68347 6.25078   1.000 32.46403 ? 461 LEU B CB  1 
ATOM   1331 C CG  . LEU B 2 129 ? -28.90671 12.34097 5.08059   1.000 34.46117 ? 461 LEU B CG  1 
ATOM   1332 C CD1 . LEU B 2 129 ? -30.38202 12.15388 5.26241   1.000 35.40687 ? 461 LEU B CD1 1 
ATOM   1333 C CD2 . LEU B 2 129 ? -28.56871 13.81198 5.02643   1.000 38.82976 ? 461 LEU B CD2 1 
ATOM   1334 N N   . LYS B 2 130 ? -25.87403 12.10010 8.39085   1.000 36.60696 ? 462 LYS B N   1 
ATOM   1335 C CA  . LYS B 2 130 ? -25.71299 11.77011 9.79291   1.000 33.07884 ? 462 LYS B CA  1 
ATOM   1336 C C   . LYS B 2 130 ? -27.08329 11.50420 10.40756  1.000 37.02116 ? 462 LYS B C   1 
ATOM   1337 O O   . LYS B 2 130 ? -28.10304 11.93802 9.86817   1.000 36.52873 ? 462 LYS B O   1 
ATOM   1338 C CB  . LYS B 2 130 ? -25.02484 12.91612 10.52481  1.000 41.58393 ? 462 LYS B CB  1 
ATOM   1339 C CG  . LYS B 2 130 ? -23.64182 13.25828 10.01469  1.000 43.94331 ? 462 LYS B CG  1 
ATOM   1340 C CD  . LYS B 2 130 ? -23.21670 14.61894 10.55134  1.000 55.11544 ? 462 LYS B CD  1 
ATOM   1341 C CE  . LYS B 2 130 ? -24.24980 15.68812 10.20105  1.000 53.78909 ? 462 LYS B CE  1 
ATOM   1342 N NZ  . LYS B 2 130 ? -23.91823 17.02747 10.76565  1.000 58.13211 ? 462 LYS B NZ  1 
ATOM   1343 N N   . PRO B 2 131 ? -27.14167 10.81502 11.54999  1.000 40.52263 ? 463 PRO B N   1 
ATOM   1344 C CA  . PRO B 2 131 ? -28.44196 10.59007 12.19282  1.000 36.12443 ? 463 PRO B CA  1 
ATOM   1345 C C   . PRO B 2 131 ? -29.17843 11.89771 12.44495  1.000 37.32823 ? 463 PRO B C   1 
ATOM   1346 O O   . PRO B 2 131 ? -28.62481 12.84626 13.01503  1.000 34.33298 ? 463 PRO B O   1 
ATOM   1347 C CB  . PRO B 2 131 ? -28.07429 9.89003  13.50406  1.000 37.72753 ? 463 PRO B CB  1 
ATOM   1348 C CG  . PRO B 2 131 ? -26.81004 9.17944  13.21230  1.000 42.58082 ? 463 PRO B CG  1 
ATOM   1349 C CD  . PRO B 2 131 ? -26.07196 10.01552 12.17564  1.000 45.82826 ? 463 PRO B CD  1 
ATOM   1350 N N   . PHE B 2 132 ? -30.44020 11.94059 12.01127  1.000 28.28008 ? 464 PHE B N   1 
ATOM   1351 C CA  . PHE B 2 132 ? -31.34853 13.06366 12.22083  1.000 30.90770 ? 464 PHE B CA  1 
ATOM   1352 C C   . PHE B 2 132 ? -30.90446 14.32017 11.47682  1.000 38.60146 ? 464 PHE B C   1 
ATOM   1353 O O   . PHE B 2 132 ? -31.42933 15.41245 11.73532  1.000 37.16056 ? 464 PHE B O   1 
ATOM   1354 C CB  . PHE B 2 132 ? -31.53189 13.36057 13.72134  1.000 37.10046 ? 464 PHE B CB  1 
ATOM   1355 C CG  . PHE B 2 132 ? -32.24081 12.26050 14.48152  1.000 36.58310 ? 464 PHE B CG  1 
ATOM   1356 C CD1 . PHE B 2 132 ? -33.46701 11.77389 14.04979  1.000 35.29601 ? 464 PHE B CD1 1 
ATOM   1357 C CD2 . PHE B 2 132 ? -31.68134 11.71910 15.63419  1.000 35.42116 ? 464 PHE B CD2 1 
ATOM   1358 C CE1 . PHE B 2 132 ? -34.11662 10.77082 14.74757  1.000 40.04208 ? 464 PHE B CE1 1 
ATOM   1359 C CE2 . PHE B 2 132 ? -32.32538 10.71217 16.33277  1.000 39.82486 ? 464 PHE B CE2 1 
ATOM   1360 C CZ  . PHE B 2 132 ? -33.54630 10.24191 15.90117  1.000 39.66231 ? 464 PHE B CZ  1 
ATOM   1361 N N   . GLU B 2 133 ? -29.96591 14.19842 10.54374  1.000 43.86154 ? 465 GLU B N   1 
ATOM   1362 C CA  . GLU B 2 133 ? -29.64518 15.30085 9.64846   1.000 43.14574 ? 465 GLU B CA  1 
ATOM   1363 C C   . GLU B 2 133 ? -30.76037 15.49025 8.62345   1.000 39.82685 ? 465 GLU B C   1 
ATOM   1364 O O   . GLU B 2 133 ? -31.45206 14.54048 8.24448   1.000 33.77160 ? 465 GLU B O   1 
ATOM   1365 C CB  . GLU B 2 133 ? -28.31263 15.03879 8.94818   1.000 42.49168 ? 465 GLU B CB  1 
ATOM   1366 C CG  . GLU B 2 133 ? -27.91389 16.08693 7.90993   1.000 37.93762 ? 465 GLU B CG  1 
ATOM   1367 C CD  . GLU B 2 133 ? -26.48516 15.91870 7.43587   1.000 39.14880 ? 465 GLU B CD  1 
ATOM   1368 O OE1 . GLU B 2 133 ? -25.93316 14.80521 7.59854   1.000 35.56513 ? 465 GLU B OE1 1 
ATOM   1369 O OE2 . GLU B 2 133 ? -25.91107 16.90132 6.90719   1.000 48.92638 ? 465 GLU B OE2 1 
ATOM   1370 N N   . ARG B 2 134 ? -30.94336 16.73725 8.18631   1.000 33.40114 ? 466 ARG B N   1 
ATOM   1371 C CA  . ARG B 2 134 ? -31.99757 17.10593 7.24763   1.000 33.51812 ? 466 ARG B CA  1 
ATOM   1372 C C   . ARG B 2 134 ? -31.37946 17.92948 6.12944   1.000 36.70426 ? 466 ARG B C   1 
ATOM   1373 O O   . ARG B 2 134 ? -30.82373 19.00166 6.38291   1.000 43.44959 ? 466 ARG B O   1 
ATOM   1374 C CB  . ARG B 2 134 ? -33.09406 17.89711 7.95801   1.000 41.51811 ? 466 ARG B CB  1 
ATOM   1375 C CG  . ARG B 2 134 ? -34.34762 18.13992 7.16678   1.000 36.74993 ? 466 ARG B CG  1 
ATOM   1376 C CD  . ARG B 2 134 ? -35.48110 18.45407 8.12699   1.000 45.80925 ? 466 ARG B CD  1 
ATOM   1377 N NE  . ARG B 2 134 ? -36.60891 19.09852 7.46925   1.000 49.79586 ? 466 ARG B NE  1 
ATOM   1378 C CZ  . ARG B 2 134 ? -36.60569 20.35825 7.05465   1.000 52.67457 ? 466 ARG B CZ  1 
ATOM   1379 N NH1 . ARG B 2 134 ? -35.52905 21.11927 7.16726   1.000 47.98456 ? 466 ARG B NH1 1 
ATOM   1380 N NH2 . ARG B 2 134 ? -37.70897 20.86691 6.50889   1.000 54.17812 ? 466 ARG B NH2 1 
ATOM   1381 N N   . ASP B 2 135 ? -31.45903 17.42519 4.90291   1.000 30.64700 ? 467 ASP B N   1 
ATOM   1382 C CA  . ASP B 2 135 ? -30.86749 18.08301 3.73757   1.000 32.70891 ? 467 ASP B CA  1 
ATOM   1383 C C   . ASP B 2 135 ? -32.00451 18.46171 2.79911   1.000 37.34183 ? 467 ASP B C   1 
ATOM   1384 O O   . ASP B 2 135 ? -32.65731 17.58433 2.22381   1.000 37.97573 ? 467 ASP B O   1 
ATOM   1385 C CB  . ASP B 2 135 ? -29.85228 17.16042 3.05664   1.000 37.33236 ? 467 ASP B CB  1 
ATOM   1386 C CG  . ASP B 2 135 ? -29.17527 17.79729 1.82719   1.000 38.98073 ? 467 ASP B CG  1 
ATOM   1387 O OD1 . ASP B 2 135 ? -29.52560 18.93108 1.42588   1.000 36.14489 ? 467 ASP B OD1 1 
ATOM   1388 O OD2 . ASP B 2 135 ? -28.26389 17.14588 1.27607   1.000 38.47578 ? 467 ASP B OD2 1 
ATOM   1389 N N   . ILE B 2 136 ? -32.25062 19.76439 2.64977   1.000 37.35568 ? 468 ILE B N   1 
ATOM   1390 C CA  . ILE B 2 136 ? -33.30208 20.26131 1.77420   1.000 37.55375 ? 468 ILE B CA  1 
ATOM   1391 C C   . ILE B 2 136 ? -32.73074 21.01440 0.57953   1.000 38.64765 ? 468 ILE B C   1 
ATOM   1392 O O   . ILE B 2 136 ? -33.47944 21.68008 -0.14237  1.000 35.04317 ? 468 ILE B O   1 
ATOM   1393 C CB  . ILE B 2 136 ? -34.31206 21.13227 2.54372   1.000 42.67608 ? 468 ILE B CB  1 
ATOM   1394 C CG1 . ILE B 2 136 ? -33.60799 22.30366 3.22645   1.000 46.68657 ? 468 ILE B CG1 1 
ATOM   1395 C CG2 . ILE B 2 136 ? -35.08842 20.29594 3.56620   1.000 37.27097 ? 468 ILE B CG2 1 
ATOM   1396 C CD1 . ILE B 2 136 ? -34.56536 23.33182 3.77415   1.000 41.48587 ? 468 ILE B CD1 1 
ATOM   1397 N N   . SER B 2 137 ? -31.41952 20.92771 0.35895   1.000 31.92106 ? 469 SER B N   1 
ATOM   1398 C CA  . SER B 2 137 ? -30.79590 21.57586 -0.78837  1.000 36.89246 ? 469 SER B CA  1 
ATOM   1399 C C   . SER B 2 137 ? -31.29531 20.96362 -2.08884  1.000 37.85272 ? 469 SER B C   1 
ATOM   1400 O O   . SER B 2 137 ? -31.73351 19.81302 -2.13335  1.000 36.00830 ? 469 SER B O   1 
ATOM   1401 C CB  . SER B 2 137 ? -29.27800 21.44568 -0.71483  1.000 38.73659 ? 469 SER B CB  1 
ATOM   1402 O OG  . SER B 2 137 ? -28.87728 20.09211 -0.86889  1.000 40.67509 ? 469 SER B OG  1 
ATOM   1403 N N   . THR B 2 138 ? -31.22267 21.74801 -3.16047  1.000 36.45032 ? 470 THR B N   1 
ATOM   1404 C CA  . THR B 2 138 ? -31.60907 21.29215 -4.48784  1.000 33.49653 ? 470 THR B CA  1 
ATOM   1405 C C   . THR B 2 138 ? -30.53221 21.64018 -5.50180  1.000 42.84486 ? 470 THR B C   1 
ATOM   1406 O O   . THR B 2 138 ? -30.81522 22.09471 -6.61129  1.000 42.41527 ? 470 THR B O   1 
ATOM   1407 C CB  . THR B 2 138 ? -32.95477 21.87474 -4.90821  1.000 41.47762 ? 470 THR B CB  1 
ATOM   1408 O OG1 . THR B 2 138 ? -32.91342 23.30507 -4.80996  1.000 44.90629 ? 470 THR B OG1 1 
ATOM   1409 C CG2 . THR B 2 138 ? -34.06918 21.32272 -4.03410  1.000 39.34833 ? 470 THR B CG2 1 
ATOM   1410 N N   . GLU B 2 139 ? -29.27746 21.41846 -5.13653  1.000 39.18086 ? 471 GLU B N   1 
ATOM   1411 C CA  . GLU B 2 139 ? -28.17585 21.64853 -6.04847  1.000 38.74478 ? 471 GLU B CA  1 
ATOM   1412 C C   . GLU B 2 139 ? -28.11552 20.53780 -7.08776  1.000 41.52062 ? 471 GLU B C   1 
ATOM   1413 O O   . GLU B 2 139 ? -28.40038 19.37698 -6.79865  1.000 36.75656 ? 471 GLU B O   1 
ATOM   1414 C CB  . GLU B 2 139 ? -26.86142 21.71458 -5.28036  1.000 40.32534 ? 471 GLU B CB  1 
ATOM   1415 C CG  . GLU B 2 139 ? -26.71444 22.96919 -4.43507  1.000 49.31530 ? 471 GLU B CG  1 
ATOM   1416 C CD  . GLU B 2 139 ? -25.89114 24.04208 -5.12406  1.000 69.56047 ? 471 GLU B CD  1 
ATOM   1417 O OE1 . GLU B 2 139 ? -24.64560 23.98461 -5.02600  1.000 75.77001 ? 471 GLU B OE1 1 
ATOM   1418 O OE2 . GLU B 2 139 ? -26.48405 24.93279 -5.77651  1.000 65.27703 ? 471 GLU B OE2 1 
ATOM   1419 N N   . ILE B 2 140 ? -27.73516 20.89985 -8.31085  1.000 38.27103 ? 472 ILE B N   1 
ATOM   1420 C CA  . ILE B 2 140 ? -27.57785 19.88889 -9.34798  1.000 35.91731 ? 472 ILE B CA  1 
ATOM   1421 C C   . ILE B 2 140 ? -26.45452 18.94370 -8.95204  1.000 35.72528 ? 472 ILE B C   1 
ATOM   1422 O O   . ILE B 2 140 ? -25.36466 19.37798 -8.55269  1.000 41.56181 ? 472 ILE B O   1 
ATOM   1423 C CB  . ILE B 2 140 ? -27.30308 20.54726 -10.70484 1.000 33.12864 ? 472 ILE B CB  1 
ATOM   1424 C CG1 . ILE B 2 140 ? -28.34800 21.62511 -10.98280 1.000 36.37725 ? 472 ILE B CG1 1 
ATOM   1425 C CG2 . ILE B 2 140 ? -27.28248 19.49247 -11.81592 1.000 38.44198 ? 472 ILE B CG2 1 
ATOM   1426 C CD1 . ILE B 2 140 ? -29.75670 21.11227 -11.07907 1.000 37.17854 ? 472 ILE B CD1 1 
ATOM   1427 N N   . TYR B 2 141 ? -26.71569 17.64133 -9.03871  1.000 34.41601 ? 473 TYR B N   1 
ATOM   1428 C CA  . TYR B 2 141 ? -25.73779 16.65835 -8.59523  1.000 37.91745 ? 473 TYR B CA  1 
ATOM   1429 C C   . TYR B 2 141 ? -24.76555 16.34891 -9.72003  1.000 41.69641 ? 473 TYR B C   1 
ATOM   1430 O O   . TYR B 2 141 ? -25.17708 15.95359 -10.81727 1.000 39.73122 ? 473 TYR B O   1 
ATOM   1431 C CB  . TYR B 2 141 ? -26.41021 15.37330 -8.11924  1.000 34.56263 ? 473 TYR B CB  1 
ATOM   1432 C CG  . TYR B 2 141 ? -25.42676 14.36238 -7.57587  1.000 37.94706 ? 473 TYR B CG  1 
ATOM   1433 C CD1 . TYR B 2 141 ? -24.99337 14.42590 -6.25785  1.000 36.48059 ? 473 TYR B CD1 1 
ATOM   1434 C CD2 . TYR B 2 141 ? -24.94194 13.33617 -8.37269  1.000 38.48920 ? 473 TYR B CD2 1 
ATOM   1435 C CE1 . TYR B 2 141 ? -24.09454 13.50410 -5.75951  1.000 40.60179 ? 473 TYR B CE1 1 
ATOM   1436 C CE2 . TYR B 2 141 ? -24.04337 12.40859 -7.87967  1.000 37.45401 ? 473 TYR B CE2 1 
ATOM   1437 C CZ  . TYR B 2 141 ? -23.62651 12.49776 -6.57086  1.000 44.84031 ? 473 TYR B CZ  1 
ATOM   1438 O OH  . TYR B 2 141 ? -22.73219 11.57150 -6.08783  1.000 49.09682 ? 473 TYR B OH  1 
ATOM   1439 N N   . GLN B 2 142 ? -23.47704 16.51435 -9.43953  1.000 41.10255 ? 474 GLN B N   1 
ATOM   1440 C CA  . GLN B 2 142 ? -22.43790 16.26103 -10.43088 1.000 42.65004 ? 474 GLN B CA  1 
ATOM   1441 C C   . GLN B 2 142 ? -22.06220 14.78750 -10.36520 1.000 43.13189 ? 474 GLN B C   1 
ATOM   1442 O O   . GLN B 2 142 ? -21.29326 14.36661 -9.49974  1.000 39.55983 ? 474 GLN B O   1 
ATOM   1443 C CB  . GLN B 2 142 ? -21.23475 17.16487 -10.19505 1.000 44.63295 ? 474 GLN B CB  1 
ATOM   1444 C CG  . GLN B 2 142 ? -20.15227 17.06634 -11.26108 1.000 44.11850 ? 474 GLN B CG  1 
ATOM   1445 C CD  . GLN B 2 142 ? -18.88292 17.79585 -10.86124 1.000 49.57420 ? 474 GLN B CD  1 
ATOM   1446 O OE1 . GLN B 2 142 ? -18.93453 18.88475 -10.28315 1.000 45.72241 ? 474 GLN B OE1 1 
ATOM   1447 N NE2 . GLN B 2 142 ? -17.73429 17.18963 -11.14904 1.000 56.04414 ? 474 GLN B NE2 1 
ATOM   1448 N N   . ALA B 2 143 ? -22.59445 13.99671 -11.30023 1.000 36.37621 ? 475 ALA B N   1 
ATOM   1449 C CA  . ALA B 2 143 ? -22.28474 12.57545 -11.32456 1.000 41.60652 ? 475 ALA B CA  1 
ATOM   1450 C C   . ALA B 2 143 ? -21.01822 12.25529 -12.10245 1.000 45.28273 ? 475 ALA B C   1 
ATOM   1451 O O   . ALA B 2 143 ? -20.40195 11.21369 -11.85270 1.000 46.87602 ? 475 ALA B O   1 
ATOM   1452 C CB  . ALA B 2 143 ? -23.45619 11.78563 -11.91598 1.000 38.42153 ? 475 ALA B CB  1 
ATOM   1453 N N   . GLY B 2 144 ? -20.61366 13.12286 -13.03072 1.000 49.15597 ? 476 GLY B N   1 
ATOM   1454 C CA  . GLY B 2 144 ? -19.47263 12.88677 -13.87270 1.000 53.09551 ? 476 GLY B CA  1 
ATOM   1455 C C   . GLY B 2 144 ? -18.30734 13.80200 -13.56547 1.000 57.57751 ? 476 GLY B C   1 
ATOM   1456 O O   . GLY B 2 144 ? -18.21410 14.40243 -12.48286 1.000 43.82573 ? 476 GLY B O   1 
ATOM   1457 N N   . ASN B 2 145 ? -17.40063 13.92379 -14.54211 1.000 52.01969 ? 477 ASN B N   1 
ATOM   1458 C CA  . ASN B 2 145 ? -16.19013 14.72101 -14.37753 1.000 55.38757 ? 477 ASN B CA  1 
ATOM   1459 C C   . ASN B 2 145 ? -16.40481 16.20476 -14.64913 1.000 51.85129 ? 477 ASN B C   1 
ATOM   1460 O O   . ASN B 2 145 ? -15.57962 17.02128 -14.22823 1.000 62.72475 ? 477 ASN B O   1 
ATOM   1461 C CB  . ASN B 2 145 ? -15.08062 14.20227 -15.29858 1.000 69.65781 ? 477 ASN B CB  1 
ATOM   1462 C CG  . ASN B 2 145 ? -14.43794 12.92909 -14.78530 1.000 75.73640 ? 477 ASN B CG  1 
ATOM   1463 O OD1 . ASN B 2 145 ? -15.08803 12.10550 -14.14533 1.000 77.64395 ? 477 ASN B OD1 1 
ATOM   1464 N ND2 . ASN B 2 145 ? -13.14599 12.76721 -15.05926 1.000 80.27542 ? 477 ASN B ND2 1 
ATOM   1465 N N   . LYS B 2 146 ? -17.47765 16.57308 -15.33398 1.000 56.71936 ? 478 LYS B N   1 
ATOM   1466 C CA  . LYS B 2 146 ? -17.53853 18.00139 -15.61469 1.000 59.41452 ? 478 LYS B CA  1 
ATOM   1467 C C   . LYS B 2 146 ? -18.45070 18.71769 -14.62581 1.000 50.39349 ? 478 LYS B C   1 
ATOM   1468 O O   . LYS B 2 146 ? -19.54960 18.22996 -14.32593 1.000 44.46667 ? 478 LYS B O   1 
ATOM   1469 C CB  . LYS B 2 146 ? -18.04281 18.25846 -17.03514 1.000 54.24720 ? 478 LYS B CB  1 
ATOM   1470 C CG  . LYS B 2 146 ? -17.15479 17.68857 -18.12823 1.000 50.43005 ? 478 LYS B CG  1 
ATOM   1471 C CD  . LYS B 2 146 ? -17.48748 18.30786 -19.47840 1.000 61.57127 ? 478 LYS B CD  1 
ATOM   1472 C CE  . LYS B 2 146 ? -17.14266 19.79831 -19.51566 1.000 65.99997 ? 478 LYS B CE  1 
ATOM   1473 N NZ  . LYS B 2 146 ? -16.06375 20.09847 -20.50390 1.000 66.51684 ? 478 LYS B NZ  1 
ATOM   1474 N N   . PRO B 2 147 ? -18.00079 19.86630 -14.11833 1.000 50.03041 ? 479 PRO B N   1 
ATOM   1475 C CA  . PRO B 2 147 ? -18.86761 20.68588 -13.26471 1.000 49.10489 ? 479 PRO B CA  1 
ATOM   1476 C C   . PRO B 2 147 ? -20.17777 21.01470 -13.96208 1.000 49.43111 ? 479 PRO B C   1 
ATOM   1477 O O   . PRO B 2 147 ? -20.22370 21.25209 -15.17137 1.000 51.05454 ? 479 PRO B O   1 
ATOM   1478 C CB  . PRO B 2 147 ? -18.02805 21.94368 -13.01247 1.000 51.00850 ? 479 PRO B CB  1 
ATOM   1479 C CG  . PRO B 2 147 ? -16.60582 21.47517 -13.16346 1.000 51.40888 ? 479 PRO B CG  1 
ATOM   1480 C CD  . PRO B 2 147 ? -16.63695 20.41759 -14.22694 1.000 47.72252 ? 479 PRO B CD  1 
ATOM   1481 N N   . CYS B 2 148 ? -21.25109 21.02507 -13.18396 1.000 36.44086 ? 480 CYS B N   1 
ATOM   1482 C CA  . CYS B 2 148 ? -22.58589 21.18631 -13.73461 1.000 42.71100 ? 480 CYS B CA  1 
ATOM   1483 C C   . CYS B 2 148 ? -23.00461 22.63943 -13.89513 1.000 39.50500 ? 480 CYS B C   1 
ATOM   1484 O O   . CYS B 2 148 ? -23.90714 22.91974 -14.69044 1.000 46.34443 ? 480 CYS B O   1 
ATOM   1485 C CB  . CYS B 2 148 ? -23.59510 20.43505 -12.85817 1.000 48.62679 ? 480 CYS B CB  1 
ATOM   1486 S SG  . CYS B 2 148 ? -23.28031 18.64647 -12.83458 1.000 70.82941 ? 480 CYS B SG  1 
ATOM   1487 N N   . ASN B 2 149 ? -22.38085 23.56145 -13.16069 1.000 47.25614 ? 481 ASN B N   1 
ATOM   1488 C CA  . ASN B 2 149 ? -22.66486 24.99289 -13.28329 1.000 36.52246 ? 481 ASN B CA  1 
ATOM   1489 C C   . ASN B 2 149 ? -24.15708 25.29598 -13.14356 1.000 49.11150 ? 481 ASN B C   1 
ATOM   1490 O O   . ASN B 2 149 ? -24.70076 26.18330 -13.80367 1.000 45.36363 ? 481 ASN B O   1 
ATOM   1491 C CB  . ASN B 2 149 ? -22.10681 25.53496 -14.60239 1.000 49.31066 ? 481 ASN B CB  1 
ATOM   1492 C CG  . ASN B 2 149 ? -20.60131 25.40308 -14.67697 1.000 53.17190 ? 481 ASN B CG  1 
ATOM   1493 O OD1 . ASN B 2 149 ? -19.90416 25.68710 -13.70635 1.000 49.28218 ? 481 ASN B OD1 1 
ATOM   1494 N ND2 . ASN B 2 149 ? -20.09302 24.94913 -15.81558 1.000 46.10037 ? 481 ASN B ND2 1 
ATOM   1495 N N   . GLY B 2 150 ? -24.83074 24.55359 -12.26517 1.000 46.24424 ? 482 GLY B N   1 
ATOM   1496 C CA  . GLY B 2 150 ? -26.22309 24.82901 -11.97752 1.000 34.92818 ? 482 GLY B CA  1 
ATOM   1497 C C   . GLY B 2 150 ? -27.22058 24.42553 -13.03424 1.000 50.48841 ? 482 GLY B C   1 
ATOM   1498 O O   . GLY B 2 150 ? -28.39563 24.79205 -12.92130 1.000 51.65800 ? 482 GLY B O   1 
ATOM   1499 N N   . VAL B 2 151 ? -26.80372 23.68705 -14.05689 1.000 48.64918 ? 483 VAL B N   1 
ATOM   1500 C CA  . VAL B 2 151 ? -27.68467 23.27800 -15.14290 1.000 54.95845 ? 483 VAL B CA  1 
ATOM   1501 C C   . VAL B 2 151 ? -27.70437 21.76026 -15.19358 1.000 46.32523 ? 483 VAL B C   1 
ATOM   1502 O O   . VAL B 2 151 ? -26.64412 21.12202 -15.18971 1.000 42.92677 ? 483 VAL B O   1 
ATOM   1503 C CB  . VAL B 2 151 ? -27.23051 23.85738 -16.49500 1.000 47.89960 ? 483 VAL B CB  1 
ATOM   1504 C CG1 . VAL B 2 151 ? -28.23589 23.51380 -17.59184 1.000 47.12793 ? 483 VAL B CG1 1 
ATOM   1505 C CG2 . VAL B 2 151 ? -27.03056 25.35913 -16.38951 1.000 54.26765 ? 483 VAL B CG2 1 
ATOM   1506 N N   . ALA B 2 152 ? -28.90515 21.18814 -15.24022 1.000 47.12898 ? 484 ALA B N   1 
ATOM   1507 C CA  . ALA B 2 152 ? -29.03669 19.74916 -15.40513 1.000 45.31966 ? 484 ALA B CA  1 
ATOM   1508 C C   . ALA B 2 152 ? -28.61860 19.34581 -16.81290 1.000 41.78676 ? 484 ALA B C   1 
ATOM   1509 O O   . ALA B 2 152 ? -28.83357 20.07876 -17.78219 1.000 47.79297 ? 484 ALA B O   1 
ATOM   1510 C CB  . ALA B 2 152 ? -30.47348 19.30198 -15.14260 1.000 39.79621 ? 484 ALA B CB  1 
ATOM   1511 N N   . GLY B 2 153 ? -28.00787 18.17015 -16.92242 1.000 41.08656 ? 485 GLY B N   1 
ATOM   1512 C CA  . GLY B 2 153 ? -27.60105 17.69506 -18.23560 1.000 40.02038 ? 485 GLY B CA  1 
ATOM   1513 C C   . GLY B 2 153 ? -26.96054 16.32454 -18.20857 1.000 50.60992 ? 485 GLY B C   1 
ATOM   1514 O O   . GLY B 2 153 ? -27.28686 15.49732 -17.35275 1.000 39.13373 ? 485 GLY B O   1 
ATOM   1515 N N   . PHE B 2 154 ? -26.05575 16.06465 -19.15112 1.000 40.64605 ? 486 PHE B N   1 
ATOM   1516 C CA  . PHE B 2 154 ? -25.31336 14.80922 -19.15461 1.000 47.91890 ? 486 PHE B CA  1 
ATOM   1517 C C   . PHE B 2 154 ? -24.57841 14.61685 -17.83141 1.000 41.86297 ? 486 PHE B C   1 
ATOM   1518 O O   . PHE B 2 154 ? -23.68049 15.39501 -17.50056 1.000 43.21344 ? 486 PHE B O   1 
ATOM   1519 C CB  . PHE B 2 154 ? -24.32858 14.77804 -20.32917 1.000 45.35130 ? 486 PHE B CB  1 
ATOM   1520 C CG  . PHE B 2 154 ? -23.95068 13.38870 -20.76984 1.000 61.57549 ? 486 PHE B CG  1 
ATOM   1521 C CD1 . PHE B 2 154 ? -23.00785 12.65494 -20.06452 1.000 49.74947 ? 486 PHE B CD1 1 
ATOM   1522 C CD2 . PHE B 2 154 ? -24.52971 12.81969 -21.89883 1.000 64.83223 ? 486 PHE B CD2 1 
ATOM   1523 C CE1 . PHE B 2 154 ? -22.65622 11.37526 -20.46406 1.000 42.76612 ? 486 PHE B CE1 1 
ATOM   1524 C CE2 . PHE B 2 154 ? -24.17951 11.54224 -22.30311 1.000 59.29985 ? 486 PHE B CE2 1 
ATOM   1525 C CZ  . PHE B 2 154 ? -23.24389 10.81924 -21.57900 1.000 49.30659 ? 486 PHE B CZ  1 
ATOM   1526 N N   . ASN B 2 155 ? -24.95514 13.58252 -17.07132 1.000 37.91706 ? 487 ASN B N   1 
ATOM   1527 C CA  . ASN B 2 155 ? -24.35806 13.27539 -15.76773 1.000 41.70428 ? 487 ASN B CA  1 
ATOM   1528 C C   . ASN B 2 155 ? -24.49594 14.43868 -14.79032 1.000 34.08164 ? 487 ASN B C   1 
ATOM   1529 O O   . ASN B 2 155 ? -23.67131 14.59269 -13.88927 1.000 32.66824 ? 487 ASN B O   1 
ATOM   1530 C CB  . ASN B 2 155 ? -22.87850 12.87627 -15.87204 1.000 41.24161 ? 487 ASN B CB  1 
ATOM   1531 C CG  . ASN B 2 155 ? -22.66619 11.56904 -16.60985 1.000 52.88418 ? 487 ASN B CG  1 
ATOM   1532 O OD1 . ASN B 2 155 ? -21.68526 11.41519 -17.33430 1.000 52.76936 ? 487 ASN B OD1 1 
ATOM   1533 N ND2 . ASN B 2 155 ? -23.57849 10.61732 -16.42483 1.000 44.00604 ? 487 ASN B ND2 1 
ATOM   1534 N N   . CYS B 2 156 ? -25.52260 15.26831 -14.97172 1.000 36.38319 ? 488 CYS B N   1 
ATOM   1535 C CA  . CYS B 2 156 ? -25.79267 16.41411 -14.09942 1.000 38.48197 ? 488 CYS B CA  1 
ATOM   1536 C C   . CYS B 2 156 ? -27.27758 16.39008 -13.76774 1.000 34.04255 ? 488 CYS B C   1 
ATOM   1537 O O   . CYS B 2 156 ? -28.09710 16.84741 -14.56176 1.000 35.07467 ? 488 CYS B O   1 
ATOM   1538 C CB  . CYS B 2 156 ? -25.39182 17.72793 -14.77061 1.000 34.55727 ? 488 CYS B CB  1 
ATOM   1539 S SG  . CYS B 2 156 ? -23.62542 18.01711 -14.76098 1.000 40.56539 ? 488 CYS B SG  1 
ATOM   1540 N N   . TYR B 2 157 ? -27.62903 15.89879 -12.57803 1.000 36.38180 ? 489 TYR B N   1 
ATOM   1541 C CA  . TYR B 2 157 ? -28.99907 15.50582 -12.27509 1.000 33.30486 ? 489 TYR B CA  1 
ATOM   1542 C C   . TYR B 2 157 ? -29.58485 16.37205 -11.17174 1.000 30.66439 ? 489 TYR B C   1 
ATOM   1543 O O   . TYR B 2 157 ? -28.95218 16.56546 -10.12913 1.000 33.74060 ? 489 TYR B O   1 
ATOM   1544 C CB  . TYR B 2 157 ? -29.04718 14.03676 -11.84853 1.000 33.01353 ? 489 TYR B CB  1 
ATOM   1545 C CG  . TYR B 2 157 ? -28.41986 13.13175 -12.87012 1.000 33.63946 ? 489 TYR B CG  1 
ATOM   1546 C CD1 . TYR B 2 157 ? -28.81904 13.18880 -14.19548 1.000 33.61131 ? 489 TYR B CD1 1 
ATOM   1547 C CD2 . TYR B 2 157 ? -27.40803 12.25235 -12.52255 1.000 34.65193 ? 489 TYR B CD2 1 
ATOM   1548 C CE1 . TYR B 2 157 ? -28.24063 12.37439 -15.14957 1.000 35.19673 ? 489 TYR B CE1 1 
ATOM   1549 C CE2 . TYR B 2 157 ? -26.81945 11.43042 -13.47164 1.000 40.31632 ? 489 TYR B CE2 1 
ATOM   1550 C CZ  . TYR B 2 157 ? -27.24624 11.49740 -14.78256 1.000 39.23232 ? 489 TYR B CZ  1 
ATOM   1551 O OH  . TYR B 2 157 ? -26.67787 10.68803 -15.73458 1.000 39.84900 ? 489 TYR B OH  1 
ATOM   1552 N N   . PHE B 2 158 ? -30.78032 16.89330 -11.40784 1.000 34.89606 ? 490 PHE B N   1 
ATOM   1553 C CA  . PHE B 2 158 ? -31.56131 17.42181 -10.30318 1.000 37.21686 ? 490 PHE B CA  1 
ATOM   1554 C C   . PHE B 2 158 ? -31.68035 16.33695 -9.23602  1.000 35.96961 ? 490 PHE B C   1 
ATOM   1555 O O   . PHE B 2 158 ? -31.93833 15.17627 -9.56603  1.000 32.89413 ? 490 PHE B O   1 
ATOM   1556 C CB  . PHE B 2 158 ? -32.94707 17.86337 -10.78320 1.000 38.28253 ? 490 PHE B CB  1 
ATOM   1557 C CG  . PHE B 2 158 ? -33.70908 18.65184 -9.75563  1.000 42.37457 ? 490 PHE B CG  1 
ATOM   1558 C CD1 . PHE B 2 158 ? -33.53979 20.02200 -9.65821  1.000 33.85546 ? 490 PHE B CD1 1 
ATOM   1559 C CD2 . PHE B 2 158 ? -34.57459 18.02143 -8.87061  1.000 40.86647 ? 490 PHE B CD2 1 
ATOM   1560 C CE1 . PHE B 2 158 ? -34.22298 20.75397 -8.70681  1.000 52.47117 ? 490 PHE B CE1 1 
ATOM   1561 C CE2 . PHE B 2 158 ? -35.26196 18.75232 -7.91777  1.000 43.96321 ? 490 PHE B CE2 1 
ATOM   1562 C CZ  . PHE B 2 158 ? -35.08321 20.11735 -7.83352  1.000 36.99414 ? 490 PHE B CZ  1 
ATOM   1563 N N   . PRO B 2 159 ? -31.47831 16.66430 -7.95620  1.000 33.45119 ? 491 PRO B N   1 
ATOM   1564 C CA  . PRO B 2 159 ? -31.26140 15.61667 -6.94721  1.000 34.39761 ? 491 PRO B CA  1 
ATOM   1565 C C   . PRO B 2 159 ? -32.51556 14.94830 -6.40009  1.000 31.07559 ? 491 PRO B C   1 
ATOM   1566 O O   . PRO B 2 159 ? -32.39269 13.86397 -5.82152  1.000 31.18981 ? 491 PRO B O   1 
ATOM   1567 C CB  . PRO B 2 159 ? -30.52103 16.37663 -5.82831  1.000 34.61081 ? 491 PRO B CB  1 
ATOM   1568 C CG  . PRO B 2 159 ? -31.05678 17.78307 -5.93314  1.000 35.32418 ? 491 PRO B CG  1 
ATOM   1569 C CD  . PRO B 2 159 ? -31.22644 18.01778 -7.43353  1.000 33.68712 ? 491 PRO B CD  1 
ATOM   1570 N N   . LEU B 2 160 ? -33.69666 15.52638 -6.58871  1.000 34.02378 ? 492 LEU B N   1 
ATOM   1571 C CA  . LEU B 2 160 ? -34.93091 14.98690 -6.04124  1.000 36.43755 ? 492 LEU B CA  1 
ATOM   1572 C C   . LEU B 2 160 ? -35.79513 14.36506 -7.13031  1.000 40.68860 ? 492 LEU B C   1 
ATOM   1573 O O   . LEU B 2 160 ? -35.78272 14.79642 -8.29134  1.000 37.52295 ? 492 LEU B O   1 
ATOM   1574 C CB  . LEU B 2 160 ? -35.73307 16.07646 -5.33695  1.000 29.33750 ? 492 LEU B CB  1 
ATOM   1575 C CG  . LEU B 2 160 ? -34.92974 16.94524 -4.36747  1.000 32.02075 ? 492 LEU B CG  1 
ATOM   1576 C CD1 . LEU B 2 160 ? -35.81122 18.07547 -3.87376  1.000 34.05926 ? 492 LEU B CD1 1 
ATOM   1577 C CD2 . LEU B 2 160 ? -34.39370 16.11703 -3.21051  1.000 34.04468 ? 492 LEU B CD2 1 
ATOM   1578 N N   . ARG B 2 161 ? -36.54510 13.33993 -6.73883  1.000 34.48152 ? 493 ARG B N   1 
ATOM   1579 C CA  . ARG B 2 161 ? -37.55144 12.70775 -7.57928  1.000 33.36937 ? 493 ARG B CA  1 
ATOM   1580 C C   . ARG B 2 161 ? -38.89555 12.72101 -6.86335  1.000 37.06462 ? 493 ARG B C   1 
ATOM   1581 O O   . ARG B 2 161 ? -38.96289 12.67246 -5.62590  1.000 36.80895 ? 493 ARG B O   1 
ATOM   1582 C CB  . ARG B 2 161 ? -37.18566 11.25756 -7.91193  1.000 35.32513 ? 493 ARG B CB  1 
ATOM   1583 C CG  . ARG B 2 161 ? -35.86431 11.05015 -8.64549  1.000 37.31857 ? 493 ARG B CG  1 
ATOM   1584 C CD  . ARG B 2 161 ? -35.88583 11.64871 -10.03928 1.000 35.77932 ? 493 ARG B CD  1 
ATOM   1585 N NE  . ARG B 2 161 ? -36.90190 11.06569 -10.90747 1.000 38.10211 ? 493 ARG B NE  1 
ATOM   1586 C CZ  . ARG B 2 161 ? -37.26580 11.59905 -12.06458 1.000 41.94834 ? 493 ARG B CZ  1 
ATOM   1587 N NH1 . ARG B 2 161 ? -36.70322 12.70695 -12.51846 1.000 41.68068 ? 493 ARG B NH1 1 
ATOM   1588 N NH2 . ARG B 2 161 ? -38.22754 11.01781 -12.77634 1.000 41.37538 ? 493 ARG B NH2 1 
ATOM   1589 N N   . SER B 2 162 ? -39.96822 12.76616 -7.64693  1.000 36.45503 ? 494 SER B N   1 
ATOM   1590 C CA  . SER B 2 162 ? -41.30912 12.57657 -7.11671  1.000 35.65263 ? 494 SER B CA  1 
ATOM   1591 C C   . SER B 2 162 ? -41.67177 11.10017 -7.14439  1.000 36.91279 ? 494 SER B C   1 
ATOM   1592 O O   . SER B 2 162 ? -41.30843 10.37145 -8.07368  1.000 36.09309 ? 494 SER B O   1 
ATOM   1593 C CB  . SER B 2 162 ? -42.35385 13.36429 -7.90872  1.000 38.74720 ? 494 SER B CB  1 
ATOM   1594 O OG  . SER B 2 162 ? -41.99297 14.72231 -8.08572  1.000 52.37110 ? 494 SER B OG  1 
ATOM   1595 N N   . TYR B 2 163 ? -42.41162 10.67098 -6.12547  1.000 34.95442 ? 495 TYR B N   1 
ATOM   1596 C CA  . TYR B 2 163 ? -42.88762 9.29460  -6.06378  1.000 31.02544 ? 495 TYR B CA  1 
ATOM   1597 C C   . TYR B 2 163 ? -43.97798 9.03426  -7.09637  1.000 33.41898 ? 495 TYR B C   1 
ATOM   1598 O O   . TYR B 2 163 ? -44.08936 7.92090  -7.62256  1.000 37.46391 ? 495 TYR B O   1 
ATOM   1599 C CB  . TYR B 2 163 ? -43.42133 8.99909  -4.66394  1.000 32.70172 ? 495 TYR B CB  1 
ATOM   1600 C CG  . TYR B 2 163 ? -42.37773 8.69335  -3.62380  1.000 27.44321 ? 495 TYR B CG  1 
ATOM   1601 C CD1 . TYR B 2 163 ? -41.60447 7.55036  -3.70677  1.000 27.81799 ? 495 TYR B CD1 1 
ATOM   1602 C CD2 . TYR B 2 163 ? -42.21282 9.51292  -2.50427  1.000 30.88189 ? 495 TYR B CD2 1 
ATOM   1603 C CE1 . TYR B 2 163 ? -40.66748 7.24362  -2.74077  1.000 32.05256 ? 495 TYR B CE1 1 
ATOM   1604 C CE2 . TYR B 2 163 ? -41.27401 9.20991  -1.52802  1.000 32.47392 ? 495 TYR B CE2 1 
ATOM   1605 C CZ  . TYR B 2 163 ? -40.50956 8.07327  -1.64467  1.000 33.07633 ? 495 TYR B CZ  1 
ATOM   1606 O OH  . TYR B 2 163 ? -39.57162 7.74331  -0.70753  1.000 32.11562 ? 495 TYR B OH  1 
ATOM   1607 N N   . GLY B 2 164 ? -44.81596 10.02910 -7.36872  1.000 38.39305 ? 496 GLY B N   1 
ATOM   1608 C CA  . GLY B 2 164 ? -45.89237 9.84356  -8.33462  1.000 43.14763 ? 496 GLY B CA  1 
ATOM   1609 C C   . GLY B 2 164 ? -46.90772 8.78803  -7.94707  1.000 47.23788 ? 496 GLY B C   1 
ATOM   1610 O O   . GLY B 2 164 ? -47.39545 8.05361  -8.81574  1.000 37.93833 ? 496 GLY B O   1 
ATOM   1611 N N   . PHE B 2 165 ? -47.25495 8.70980  -6.65679  1.000 35.13769 ? 497 PHE B N   1 
ATOM   1612 C CA  . PHE B 2 165 ? -48.10009 7.63200  -6.16160  1.000 40.63087 ? 497 PHE B CA  1 
ATOM   1613 C C   . PHE B 2 165 ? -49.44009 7.58145  -6.88524  1.000 34.89155 ? 497 PHE B C   1 
ATOM   1614 O O   . PHE B 2 165 ? -50.16457 8.58030  -6.94247  1.000 40.65134 ? 497 PHE B O   1 
ATOM   1615 C CB  . PHE B 2 165 ? -48.35862 7.80967  -4.66572  1.000 29.43235 ? 497 PHE B CB  1 
ATOM   1616 C CG  . PHE B 2 165 ? -47.13605 7.65156  -3.79123  1.000 32.22874 ? 497 PHE B CG  1 
ATOM   1617 C CD1 . PHE B 2 165 ? -46.45245 6.44929  -3.73510  1.000 31.70362 ? 497 PHE B CD1 1 
ATOM   1618 C CD2 . PHE B 2 165 ? -46.71510 8.69480  -2.97336  1.000 37.19290 ? 497 PHE B CD2 1 
ATOM   1619 C CE1 . PHE B 2 165 ? -45.34261 6.29132  -2.90768  1.000 33.82984 ? 497 PHE B CE1 1 
ATOM   1620 C CE2 . PHE B 2 165 ? -45.61105 8.54750  -2.13398  1.000 35.57726 ? 497 PHE B CE2 1 
ATOM   1621 C CZ  . PHE B 2 165 ? -44.92464 7.33847  -2.09624  1.000 34.10637 ? 497 PHE B CZ  1 
ATOM   1622 N N   . ARG B 2 166 ? -49.79029 6.39586  -7.38929  1.000 38.86527 ? 498 ARG B N   1 
ATOM   1623 C CA  . ARG B 2 166 ? -51.07310 6.10484  -8.01861  1.000 37.90253 ? 498 ARG B CA  1 
ATOM   1624 C C   . ARG B 2 166 ? -51.75046 4.93410  -7.31389  1.000 37.00425 ? 498 ARG B C   1 
ATOM   1625 O O   . ARG B 2 166 ? -51.07008 4.00659  -6.85983  1.000 38.21780 ? 498 ARG B O   1 
ATOM   1626 C CB  . ARG B 2 166 ? -50.91175 5.76053  -9.50907  1.000 36.99460 ? 498 ARG B CB  1 
ATOM   1627 C CG  . ARG B 2 166 ? -50.22442 6.81487  -10.33450 1.000 40.39457 ? 498 ARG B CG  1 
ATOM   1628 C CD  . ARG B 2 166 ? -50.39464 6.53031  -11.81677 1.000 44.94933 ? 498 ARG B CD  1 
ATOM   1629 N NE  . ARG B 2 166 ? -49.52360 7.34584  -12.65347 1.000 45.80807 ? 498 ARG B NE  1 
ATOM   1630 C CZ  . ARG B 2 166 ? -49.80583 7.69112  -13.90369 1.000 64.98675 ? 498 ARG B CZ  1 
ATOM   1631 N NH1 . ARG B 2 166 ? -50.96406 7.37535  -14.46373 1.000 55.26142 ? 498 ARG B NH1 1 
ATOM   1632 N NH2 . ARG B 2 166 ? -48.90807 8.37690  -14.60726 1.000 59.67853 ? 498 ARG B NH2 1 
ATOM   1633 N N   . PRO B 2 167 ? -53.08826 4.92125  -7.24619  1.000 40.60070 ? 499 PRO B N   1 
ATOM   1634 C CA  . PRO B 2 167 ? -53.76835 3.87522  -6.46258  1.000 50.43037 ? 499 PRO B CA  1 
ATOM   1635 C C   . PRO B 2 167 ? -53.59873 2.48251  -7.03477  1.000 51.74633 ? 499 PRO B C   1 
ATOM   1636 O O   . PRO B 2 167 ? -53.76488 1.50548  -6.29275  1.000 52.55866 ? 499 PRO B O   1 
ATOM   1637 C CB  . PRO B 2 167 ? -55.24497 4.30517  -6.48699  1.000 52.90672 ? 499 PRO B CB  1 
ATOM   1638 C CG  . PRO B 2 167 ? -55.29619 5.62265  -7.24487  1.000 48.21908 ? 499 PRO B CG  1 
ATOM   1639 C CD  . PRO B 2 167 ? -54.03964 5.71201  -8.04541  1.000 50.16711 ? 499 PRO B CD  1 
ATOM   1640 N N   . THR B 2 168 ? -53.27155 2.36157  -8.32068  1.000 45.78579 ? 500 THR B N   1 
ATOM   1641 C CA  . THR B 2 168 ? -53.09071 1.07179  -8.97038  1.000 55.54220 ? 500 THR B CA  1 
ATOM   1642 C C   . THR B 2 168 ? -51.71937 0.46538  -8.71290  1.000 50.12001 ? 500 THR B C   1 
ATOM   1643 O O   . THR B 2 168 ? -51.46311 -0.65754 -9.16257  1.000 50.19003 ? 500 THR B O   1 
ATOM   1644 C CB  . THR B 2 168 ? -53.31345 1.20869  -10.48248 1.000 40.97544 ? 500 THR B CB  1 
ATOM   1645 O OG1 . THR B 2 168 ? -52.13035 1.72766  -11.10547 1.000 55.04642 ? 500 THR B OG1 1 
ATOM   1646 C CG2 . THR B 2 168 ? -54.46111 2.16064  -10.76246 1.000 52.77116 ? 500 THR B CG2 1 
ATOM   1647 N N   . TYR B 2 169 ? -50.83513 1.17637  -8.01488  1.000 40.00544 ? 501 TYR B N   1 
ATOM   1648 C CA  . TYR B 2 169 ? -49.52746 0.62791  -7.69182  1.000 41.34439 ? 501 TYR B CA  1 
ATOM   1649 C C   . TYR B 2 169 ? -49.66913 -0.59529 -6.79949  1.000 35.07420 ? 501 TYR B C   1 
ATOM   1650 O O   . TYR B 2 169 ? -50.63951 -0.74253 -6.05111  1.000 43.62839 ? 501 TYR B O   1 
ATOM   1651 C CB  . TYR B 2 169 ? -48.65281 1.68173  -7.00014  1.000 38.87464 ? 501 TYR B CB  1 
ATOM   1652 C CG  . TYR B 2 169 ? -48.12926 2.72766  -7.95512  1.000 46.48868 ? 501 TYR B CG  1 
ATOM   1653 C CD1 . TYR B 2 169 ? -48.56414 2.75474  -9.27645  1.000 48.70837 ? 501 TYR B CD1 1 
ATOM   1654 C CD2 . TYR B 2 169 ? -47.18675 3.66987  -7.55487  1.000 45.20197 ? 501 TYR B CD2 1 
ATOM   1655 C CE1 . TYR B 2 169 ? -48.09587 3.69017  -10.17181 1.000 49.38363 ? 501 TYR B CE1 1 
ATOM   1656 C CE2 . TYR B 2 169 ? -46.70242 4.62507  -8.46209  1.000 39.75543 ? 501 TYR B CE2 1 
ATOM   1657 C CZ  . TYR B 2 169 ? -47.17013 4.62283  -9.76436  1.000 44.23145 ? 501 TYR B CZ  1 
ATOM   1658 O OH  . TYR B 2 169 ? -46.72789 5.54478  -10.69267 1.000 46.66578 ? 501 TYR B OH  1 
ATOM   1659 N N   . GLY B 2 170 ? -48.69676 -1.49155 -6.89969  1.000 37.45765 ? 502 GLY B N   1 
ATOM   1660 C CA  . GLY B 2 170 ? -48.59045 -2.56666 -5.94461  1.000 32.14841 ? 502 GLY B CA  1 
ATOM   1661 C C   . GLY B 2 170 ? -48.37250 -1.99529 -4.56008  1.000 38.33356 ? 502 GLY B C   1 
ATOM   1662 O O   . GLY B 2 170 ? -48.01745 -0.83079 -4.39108  1.000 37.17442 ? 502 GLY B O   1 
ATOM   1663 N N   . VAL B 2 171 ? -48.61336 -2.83135 -3.55181  1.000 36.73748 ? 503 VAL B N   1 
ATOM   1664 C CA  . VAL B 2 171 ? -48.61184 -2.32376 -2.18013  1.000 37.61045 ? 503 VAL B CA  1 
ATOM   1665 C C   . VAL B 2 171 ? -47.20876 -1.90593 -1.75492  1.000 40.06090 ? 503 VAL B C   1 
ATOM   1666 O O   . VAL B 2 171 ? -47.04722 -0.95501 -0.98054  1.000 41.32299 ? 503 VAL B O   1 
ATOM   1667 C CB  . VAL B 2 171 ? -49.23397 -3.36294 -1.22531  1.000 36.93537 ? 503 VAL B CB  1 
ATOM   1668 C CG1 . VAL B 2 171 ? -48.30080 -4.54697 -1.01094  1.000 51.11098 ? 503 VAL B CG1 1 
ATOM   1669 C CG2 . VAL B 2 171 ? -49.58835 -2.72025 0.10099   1.000 50.31393 ? 503 VAL B CG2 1 
ATOM   1670 N N   . GLY B 2 172 ? -46.17430 -2.58262 -2.25678  1.000 38.73040 ? 504 GLY B N   1 
ATOM   1671 C CA  . GLY B 2 172 ? -44.80697 -2.17642 -1.97868  1.000 39.27914 ? 504 GLY B CA  1 
ATOM   1672 C C   . GLY B 2 172 ? -44.42192 -0.83447 -2.57423  1.000 38.70633 ? 504 GLY B C   1 
ATOM   1673 O O   . GLY B 2 172 ? -43.45007 -0.22224 -2.11863  1.000 39.69591 ? 504 GLY B O   1 
ATOM   1674 N N   . HIS B 2 173 ? -45.15647 -0.36173 -3.57820  1.000 36.70501 ? 505 HIS B N   1 
ATOM   1675 C CA  . HIS B 2 173 ? -44.91275 0.94250  -4.17834  1.000 29.99255 ? 505 HIS B CA  1 
ATOM   1676 C C   . HIS B 2 173 ? -45.90165 1.99722  -3.70428  1.000 33.72509 ? 505 HIS B C   1 
ATOM   1677 O O   . HIS B 2 173 ? -45.80717 3.14987  -4.13192  1.000 35.68146 ? 505 HIS B O   1 
ATOM   1678 C CB  . HIS B 2 173 ? -44.94718 0.83361  -5.72181  1.000 29.74675 ? 505 HIS B CB  1 
ATOM   1679 C CG  . HIS B 2 173 ? -43.79681 0.05736  -6.28342  1.000 41.54489 ? 505 HIS B CG  1 
ATOM   1680 N ND1 . HIS B 2 173 ? -43.94829 -0.91625 -7.24753  1.000 37.13205 ? 505 HIS B ND1 1 
ATOM   1681 C CD2 . HIS B 2 173 ? -42.47460 0.09242  -5.99041  1.000 49.68162 ? 505 HIS B CD2 1 
ATOM   1682 C CE1 . HIS B 2 173 ? -42.76658 -1.43112 -7.54100  1.000 45.03532 ? 505 HIS B CE1 1 
ATOM   1683 N NE2 . HIS B 2 173 ? -41.85545 -0.83952 -6.78885  1.000 50.29163 ? 505 HIS B NE2 1 
ATOM   1684 N N   . GLN B 2 174 ? -46.83614 1.63538  -2.81971  1.000 32.52068 ? 506 GLN B N   1 
ATOM   1685 C CA  . GLN B 2 174 ? -47.86574 2.54971  -2.35833  1.000 37.77272 ? 506 GLN B CA  1 
ATOM   1686 C C   . GLN B 2 174 ? -47.32147 3.42611  -1.23338  1.000 33.53276 ? 506 GLN B C   1 
ATOM   1687 O O   . GLN B 2 174 ? -46.34686 3.05999  -0.58113  1.000 29.94052 ? 506 GLN B O   1 
ATOM   1688 C CB  . GLN B 2 174 ? -49.07879 1.76638  -1.86189  1.000 39.55928 ? 506 GLN B CB  1 
ATOM   1689 C CG  . GLN B 2 174 ? -49.95358 1.22295  -2.97491  1.000 42.04133 ? 506 GLN B CG  1 
ATOM   1690 C CD  . GLN B 2 174 ? -51.10038 0.38379  -2.45801  1.000 50.08570 ? 506 GLN B CD  1 
ATOM   1691 O OE1 . GLN B 2 174 ? -51.53211 0.53816  -1.31640  1.000 40.13596 ? 506 GLN B OE1 1 
ATOM   1692 N NE2 . GLN B 2 174 ? -51.60376 -0.51385 -3.30088  1.000 44.46834 ? 506 GLN B NE2 1 
ATOM   1693 N N   . PRO B 2 175 ? -47.91680 4.59834  -1.01060  1.000 33.93278 ? 507 PRO B N   1 
ATOM   1694 C CA  . PRO B 2 175 ? -47.40194 5.49846  0.02726   1.000 28.78677 ? 507 PRO B CA  1 
ATOM   1695 C C   . PRO B 2 175 ? -47.73427 4.99572  1.41923   1.000 33.90688 ? 507 PRO B C   1 
ATOM   1696 O O   . PRO B 2 175 ? -48.82348 4.47260  1.67443   1.000 32.02633 ? 507 PRO B O   1 
ATOM   1697 C CB  . PRO B 2 175 ? -48.13204 6.81454  -0.25530  1.000 34.44641 ? 507 PRO B CB  1 
ATOM   1698 C CG  . PRO B 2 175 ? -49.44122 6.36730  -0.82415  1.000 37.69296 ? 507 PRO B CG  1 
ATOM   1699 C CD  . PRO B 2 175 ? -49.07612 5.18740  -1.70660  1.000 41.91692 ? 507 PRO B CD  1 
ATOM   1700 N N   . TYR B 2 176 ? -46.77021 5.15897  2.31266   1.000 26.81138 ? 508 TYR B N   1 
ATOM   1701 C CA  . TYR B 2 176 ? -46.94302 4.87955  3.73245   1.000 30.86661 ? 508 TYR B CA  1 
ATOM   1702 C C   . TYR B 2 176 ? -46.60539 6.13236  4.51849   1.000 35.46935 ? 508 TYR B C   1 
ATOM   1703 O O   . TYR B 2 176 ? -45.60852 6.81285  4.23738   1.000 30.95984 ? 508 TYR B O   1 
ATOM   1704 C CB  . TYR B 2 176 ? -46.07335 3.69939  4.18669   1.000 30.35984 ? 508 TYR B CB  1 
ATOM   1705 C CG  . TYR B 2 176 ? -46.71509 2.37411  3.84454   1.000 35.46643 ? 508 TYR B CG  1 
ATOM   1706 C CD1 . TYR B 2 176 ? -46.90158 1.98909  2.51707   1.000 35.20379 ? 508 TYR B CD1 1 
ATOM   1707 C CD2 . TYR B 2 176 ? -47.15430 1.51482  4.84448   1.000 31.04898 ? 508 TYR B CD2 1 
ATOM   1708 C CE1 . TYR B 2 176 ? -47.49903 0.80014  2.20985   1.000 36.20142 ? 508 TYR B CE1 1 
ATOM   1709 C CE2 . TYR B 2 176 ? -47.75109 0.32171  4.54364   1.000 34.99722 ? 508 TYR B CE2 1 
ATOM   1710 C CZ  . TYR B 2 176 ? -47.92802 -0.03103 3.22065   1.000 33.00519 ? 508 TYR B CZ  1 
ATOM   1711 O OH  . TYR B 2 176 ? -48.52796 -1.22720 2.90859   1.000 43.23624 ? 508 TYR B OH  1 
ATOM   1712 N N   . ARG B 2 177 ? -47.44964 6.43859  5.50005   1.000 37.38332 ? 509 ARG B N   1 
ATOM   1713 C CA  . ARG B 2 177 ? -47.17023 7.50747  6.44478   1.000 40.81642 ? 509 ARG B CA  1 
ATOM   1714 C C   . ARG B 2 177 ? -46.37830 6.92308  7.59800   1.000 34.00446 ? 509 ARG B C   1 
ATOM   1715 O O   . ARG B 2 177 ? -46.67713 5.82136  8.06624   1.000 31.69021 ? 509 ARG B O   1 
ATOM   1716 C CB  . ARG B 2 177 ? -48.46410 8.15675  6.92655   1.000 31.56279 ? 509 ARG B CB  1 
ATOM   1717 C CG  . ARG B 2 177 ? -48.94954 9.18919  5.95282   1.000 37.11762 ? 509 ARG B CG  1 
ATOM   1718 C CD  . ARG B 2 177 ? -50.35554 9.67686  6.24708   1.000 40.15512 ? 509 ARG B CD  1 
ATOM   1719 N NE  . ARG B 2 177 ? -50.82319 10.54356 5.17017   1.000 37.95748 ? 509 ARG B NE  1 
ATOM   1720 C CZ  . ARG B 2 177 ? -51.70498 11.52400 5.31703   1.000 42.39748 ? 509 ARG B CZ  1 
ATOM   1721 N NH1 . ARG B 2 177 ? -52.25250 11.79708 6.49768   1.000 41.14130 ? 509 ARG B NH1 1 
ATOM   1722 N NH2 . ARG B 2 177 ? -52.03140 12.26347 4.26284   1.000 42.43305 ? 509 ARG B NH2 1 
ATOM   1723 N N   . VAL B 2 178 ? -45.32121 7.62008  7.99950   1.000 30.50160 ? 510 VAL B N   1 
ATOM   1724 C CA  . VAL B 2 178 ? -44.40685 7.13656  9.02239   1.000 29.76047 ? 510 VAL B CA  1 
ATOM   1725 C C   . VAL B 2 178 ? -44.32775 8.19227  10.11211  1.000 29.98759 ? 510 VAL B C   1 
ATOM   1726 O O   . VAL B 2 178 ? -44.24700 9.39054  9.81265   1.000 28.81649 ? 510 VAL B O   1 
ATOM   1727 C CB  . VAL B 2 178 ? -43.01118 6.83762  8.44622   1.000 34.88804 ? 510 VAL B CB  1 
ATOM   1728 C CG1 . VAL B 2 178 ? -42.09967 6.28775  9.51819   1.000 26.41145 ? 510 VAL B CG1 1 
ATOM   1729 C CG2 . VAL B 2 178 ? -43.11661 5.86517  7.25968   1.000 32.92309 ? 510 VAL B CG2 1 
ATOM   1730 N N   . VAL B 2 179 ? -44.39293 7.74778  11.36596  1.000 25.66082 ? 511 VAL B N   1 
ATOM   1731 C CA  . VAL B 2 179 ? -44.13365 8.59073  12.53708  1.000 31.62709 ? 511 VAL B CA  1 
ATOM   1732 C C   . VAL B 2 179 ? -43.01909 7.93923  13.34724  1.000 29.81555 ? 511 VAL B C   1 
ATOM   1733 O O   . VAL B 2 179 ? -43.11585 6.75931  13.72162  1.000 31.82634 ? 511 VAL B O   1 
ATOM   1734 C CB  . VAL B 2 179 ? -45.38835 8.80563  13.39878  1.000 28.34343 ? 511 VAL B CB  1 
ATOM   1735 C CG1 . VAL B 2 179 ? -45.03840 9.62171  14.65674  1.000 31.87892 ? 511 VAL B CG1 1 
ATOM   1736 C CG2 . VAL B 2 179 ? -46.48063 9.52163  12.61141  1.000 34.87523 ? 511 VAL B CG2 1 
ATOM   1737 N N   . VAL B 2 180 ? -41.94632 8.69186  13.59203  1.000 30.52023 ? 512 VAL B N   1 
ATOM   1738 C CA  . VAL B 2 180 ? -40.83660 8.24825  14.42688  1.000 29.64369 ? 512 VAL B CA  1 
ATOM   1739 C C   . VAL B 2 180 ? -40.92802 9.02405  15.73206  1.000 27.29899 ? 512 VAL B C   1 
ATOM   1740 O O   . VAL B 2 180 ? -40.91445 10.26007 15.72790  1.000 28.16049 ? 512 VAL B O   1 
ATOM   1741 C CB  . VAL B 2 180 ? -39.47433 8.46279  13.74746  1.000 30.04302 ? 512 VAL B CB  1 
ATOM   1742 C CG1 . VAL B 2 180 ? -38.33577 7.99197  14.66993  1.000 30.37702 ? 512 VAL B CG1 1 
ATOM   1743 C CG2 . VAL B 2 180 ? -39.42791 7.76089  12.35289  1.000 29.92666 ? 512 VAL B CG2 1 
ATOM   1744 N N   . LEU B 2 181 ? -41.05298 8.30530  16.84303  1.000 28.92249 ? 513 LEU B N   1 
ATOM   1745 C CA  . LEU B 2 181 ? -41.11587 8.91649  18.16452  1.000 32.92618 ? 513 LEU B CA  1 
ATOM   1746 C C   . LEU B 2 181 ? -39.75487 8.79158  18.82203  1.000 26.30754 ? 513 LEU B C   1 
ATOM   1747 O O   . LEU B 2 181 ? -39.23247 7.68353  18.96823  1.000 31.42049 ? 513 LEU B O   1 
ATOM   1748 C CB  . LEU B 2 181 ? -42.18888 8.25148  19.02078  1.000 29.62930 ? 513 LEU B CB  1 
ATOM   1749 C CG  . LEU B 2 181 ? -43.62876 8.39478  18.52424  1.000 37.00476 ? 513 LEU B CG  1 
ATOM   1750 C CD1 . LEU B 2 181 ? -44.59516 7.73025  19.47806  1.000 37.62024 ? 513 LEU B CD1 1 
ATOM   1751 C CD2 . LEU B 2 181 ? -44.02668 9.84939  18.23989  1.000 33.29312 ? 513 LEU B CD2 1 
ATOM   1752 N N   . SER B 2 182 ? -39.17325 9.92878  19.19657  1.000 33.30266 ? 514 SER B N   1 
ATOM   1753 C CA  . SER B 2 182 ? -37.94815 9.97525  19.97911  1.000 36.94189 ? 514 SER B CA  1 
ATOM   1754 C C   . SER B 2 182 ? -38.31362 10.33392 21.41004  1.000 30.90796 ? 514 SER B C   1 
ATOM   1755 O O   . SER B 2 182 ? -39.03323 11.31110 21.62892  1.000 31.08438 ? 514 SER B O   1 
ATOM   1756 C CB  . SER B 2 182 ? -36.98096 11.01935 19.42192  1.000 41.33516 ? 514 SER B CB  1 
ATOM   1757 O OG  . SER B 2 182 ? -36.27183 10.52873 18.31242  1.000 37.97115 ? 514 SER B OG  1 
ATOM   1758 N N   . PHE B 2 183 ? -37.84207 9.54164  22.37015  1.000 29.63118 ? 515 PHE B N   1 
ATOM   1759 C CA  . PHE B 2 183 ? -38.12782 9.76908  23.79072  1.000 29.26069 ? 515 PHE B CA  1 
ATOM   1760 C C   . PHE B 2 183 ? -36.85386 10.25331 24.46778  1.000 35.73130 ? 515 PHE B C   1 
ATOM   1761 O O   . PHE B 2 183 ? -35.90643 9.48072  24.64860  1.000 39.31174 ? 515 PHE B O   1 
ATOM   1762 C CB  . PHE B 2 183 ? -38.65809 8.49838  24.45197  1.000 33.46105 ? 515 PHE B CB  1 
ATOM   1763 C CG  . PHE B 2 183 ? -39.95567 8.02251  23.87599  1.000 37.19356 ? 515 PHE B CG  1 
ATOM   1764 C CD1 . PHE B 2 183 ? -41.15041 8.60739  24.24603  1.000 49.26004 ? 515 PHE B CD1 1 
ATOM   1765 C CD2 . PHE B 2 183 ? -39.97878 7.01268  22.92851  1.000 40.21021 ? 515 PHE B CD2 1 
ATOM   1766 C CE1 . PHE B 2 183 ? -42.34821 8.18132  23.69590  1.000 47.96426 ? 515 PHE B CE1 1 
ATOM   1767 C CE2 . PHE B 2 183 ? -41.16970 6.58017  22.39258  1.000 36.14836 ? 515 PHE B CE2 1 
ATOM   1768 C CZ  . PHE B 2 183 ? -42.35644 7.17080  22.76019  1.000 34.99545 ? 515 PHE B CZ  1 
ATOM   1769 N N   . GLU B 2 184 ? -36.84180 11.52424 24.85345  1.000 38.00394 ? 516 GLU B N   1 
ATOM   1770 C CA  . GLU B 2 184 ? -35.63727 12.19155 25.31873  1.000 27.31590 ? 516 GLU B CA  1 
ATOM   1771 C C   . GLU B 2 184 ? -35.67684 12.29116 26.83258  1.000 33.55187 ? 516 GLU B C   1 
ATOM   1772 O O   . GLU B 2 184 ? -36.67518 12.74636 27.39834  1.000 32.27862 ? 516 GLU B O   1 
ATOM   1773 C CB  . GLU B 2 184 ? -35.51574 13.58855 24.70841  1.000 39.59993 ? 516 GLU B CB  1 
ATOM   1774 C CG  . GLU B 2 184 ? -34.14079 14.20777 24.82421  1.000 44.86850 ? 516 GLU B CG  1 
ATOM   1775 C CD  . GLU B 2 184 ? -34.10647 15.64548 24.33421  1.000 38.47926 ? 516 GLU B CD  1 
ATOM   1776 O OE1 . GLU B 2 184 ? -35.10856 16.37028 24.51354  1.000 50.20494 ? 516 GLU B OE1 1 
ATOM   1777 O OE2 . GLU B 2 184 ? -33.07162 16.04984 23.77200  1.000 47.79058 ? 516 GLU B OE2 1 
ATOM   1778 N N   . LEU B 2 185 ? -34.59664 11.87561 27.47532  1.000 32.06161 ? 517 LEU B N   1 
ATOM   1779 C CA  . LEU B 2 185 ? -34.47694 11.97914 28.93191  1.000 30.79877 ? 517 LEU B CA  1 
ATOM   1780 C C   . LEU B 2 185 ? -33.17437 12.70075 29.26772  1.000 35.74375 ? 517 LEU B C   1 
ATOM   1781 O O   . LEU B 2 185 ? -32.10963 12.08178 29.33116  1.000 44.26014 ? 517 LEU B O   1 
ATOM   1782 C CB  . LEU B 2 185 ? -34.53329 10.60004 29.57888  1.000 35.07387 ? 517 LEU B CB  1 
ATOM   1783 C CG  . LEU B 2 185 ? -34.58523 10.64928 31.10994  1.000 48.13999 ? 517 LEU B CG  1 
ATOM   1784 C CD1 . LEU B 2 185 ? -35.94318 11.16518 31.57213  1.000 42.46698 ? 517 LEU B CD1 1 
ATOM   1785 C CD2 . LEU B 2 185 ? -34.26315 9.29641  31.73519  1.000 55.95934 ? 517 LEU B CD2 1 
ATOM   1786 N N   . LEU B 2 186 ? -33.26219 14.00510 29.49272  1.000 33.50938 ? 518 LEU B N   1 
ATOM   1787 C CA  . LEU B 2 186 ? -32.12485 14.81167 29.89741  1.000 33.99475 ? 518 LEU B CA  1 
ATOM   1788 C C   . LEU B 2 186 ? -32.04773 14.85638 31.42684  1.000 39.19604 ? 518 LEU B C   1 
ATOM   1789 O O   . LEU B 2 186 ? -32.88285 14.28375 32.12399  1.000 37.70764 ? 518 LEU B O   1 
ATOM   1790 C CB  . LEU B 2 186 ? -32.25391 16.21183 29.30900  1.000 31.88295 ? 518 LEU B CB  1 
ATOM   1791 C CG  . LEU B 2 186 ? -32.53468 16.18284 27.79447  1.000 33.66524 ? 518 LEU B CG  1 
ATOM   1792 C CD1 . LEU B 2 186 ? -32.68729 17.58669 27.23472  1.000 34.21376 ? 518 LEU B CD1 1 
ATOM   1793 C CD2 . LEU B 2 186 ? -31.41650 15.43989 27.10482  1.000 38.57173 ? 518 LEU B CD2 1 
ATOM   1794 N N   . HIS B 2 187 ? -31.02294 15.53087 31.95501  1.000 35.28088 ? 519 HIS B N   1 
ATOM   1795 C CA  . HIS B 2 187 ? -30.94182 15.84542 33.39028  1.000 34.71410 ? 519 HIS B CA  1 
ATOM   1796 C C   . HIS B 2 187 ? -31.81150 17.07001 33.65758  1.000 31.40505 ? 519 HIS B C   1 
ATOM   1797 O O   . HIS B 2 187 ? -31.33368 18.18540 33.86735  1.000 40.64723 ? 519 HIS B O   1 
ATOM   1798 C CB  . HIS B 2 187 ? -29.49761 16.08302 33.80196  1.000 35.12365 ? 519 HIS B CB  1 
ATOM   1799 C CG  . HIS B 2 187 ? -28.60921 14.90480 33.56709  1.000 38.66837 ? 519 HIS B CG  1 
ATOM   1800 N ND1 . HIS B 2 187 ? -29.04463 13.60594 33.71713  1.000 47.81868 ? 519 HIS B ND1 1 
ATOM   1801 C CD2 . HIS B 2 187 ? -27.31843 14.82408 33.16833  1.000 48.68932 ? 519 HIS B CD2 1 
ATOM   1802 C CE1 . HIS B 2 187 ? -28.05638 12.77519 33.43796  1.000 45.18727 ? 519 HIS B CE1 1 
ATOM   1803 N NE2 . HIS B 2 187 ? -26.99734 13.48882 33.10152  1.000 54.12020 ? 519 HIS B NE2 1 
ATOM   1804 N N   . ALA B 2 188 ? -33.12176 16.84343 33.62814  1.000 33.07117 ? 520 ALA B N   1 
ATOM   1805 C CA  . ALA B 2 188 ? -34.10245 17.92163 33.62979  1.000 35.57878 ? 520 ALA B CA  1 
ATOM   1806 C C   . ALA B 2 188 ? -35.45223 17.33146 34.02184  1.000 42.09110 ? 520 ALA B C   1 
ATOM   1807 O O   . ALA B 2 188 ? -35.62844 16.10612 33.99740  1.000 42.70390 ? 520 ALA B O   1 
ATOM   1808 C CB  . ALA B 2 188 ? -34.17430 18.60573 32.25118  1.000 36.71383 ? 520 ALA B CB  1 
ATOM   1809 N N   . PRO B 2 189 ? -36.42490 18.17115 34.39098  1.000 36.07916 ? 521 PRO B N   1 
ATOM   1810 C CA  . PRO B 2 189 ? -37.76440 17.65296 34.71100  1.000 35.43045 ? 521 PRO B CA  1 
ATOM   1811 C C   . PRO B 2 189 ? -38.36471 16.88916 33.53806  1.000 47.26689 ? 521 PRO B C   1 
ATOM   1812 O O   . PRO B 2 189 ? -38.33211 17.34929 32.39191  1.000 39.64427 ? 521 PRO B O   1 
ATOM   1813 C CB  . PRO B 2 189 ? -38.57578 18.91763 35.01354  1.000 36.28480 ? 521 PRO B CB  1 
ATOM   1814 C CG  . PRO B 2 189 ? -37.58328 19.97142 35.29848  1.000 40.69071 ? 521 PRO B CG  1 
ATOM   1815 C CD  . PRO B 2 189 ? -36.35563 19.63726 34.52963  1.000 42.06503 ? 521 PRO B CD  1 
ATOM   1816 N N   . ALA B 2 190 ? -38.93809 15.72217 33.83556  1.000 43.36382 ? 522 ALA B N   1 
ATOM   1817 C CA  . ALA B 2 190 ? -39.56664 14.87549 32.81458  1.000 40.28138 ? 522 ALA B CA  1 
ATOM   1818 C C   . ALA B 2 190 ? -41.06168 15.18045 32.79340  1.000 38.49674 ? 522 ALA B C   1 
ATOM   1819 O O   . ALA B 2 190 ? -41.83170 14.64197 33.59137  1.000 47.18106 ? 522 ALA B O   1 
ATOM   1820 C CB  . ALA B 2 190 ? -39.29394 13.40389 33.09465  1.000 34.65852 ? 522 ALA B CB  1 
ATOM   1821 N N   . THR B 2 191 ? -41.47333 16.03428 31.85422  1.000 38.02623 ? 523 THR B N   1 
ATOM   1822 C CA  . THR B 2 191 ? -42.81499 16.60750 31.81123  1.000 47.42501 ? 523 THR B CA  1 
ATOM   1823 C C   . THR B 2 191 ? -43.73792 16.00251 30.75237  1.000 46.29837 ? 523 THR B C   1 
ATOM   1824 O O   . THR B 2 191 ? -44.88849 16.44120 30.64494  1.000 44.57884 ? 523 THR B O   1 
ATOM   1825 C CB  . THR B 2 191 ? -42.73484 18.12083 31.57772  1.000 47.78021 ? 523 THR B CB  1 
ATOM   1826 O OG1 . THR B 2 191 ? -42.47278 18.38371 30.18904  1.000 63.51361 ? 523 THR B OG1 1 
ATOM   1827 C CG2 . THR B 2 191 ? -41.63888 18.73034 32.42830  1.000 57.68323 ? 523 THR B CG2 1 
ATOM   1828 N N   . VAL B 2 192 ? -43.27965 15.04517 29.95003  1.000 40.18289 ? 524 VAL B N   1 
ATOM   1829 C CA  . VAL B 2 192 ? -44.16677 14.30403 29.05707  1.000 34.46959 ? 524 VAL B CA  1 
ATOM   1830 C C   . VAL B 2 192 ? -44.36146 12.92438 29.66098  1.000 36.93787 ? 524 VAL B C   1 
ATOM   1831 O O   . VAL B 2 192 ? -43.42718 12.11757 29.70290  1.000 37.13593 ? 524 VAL B O   1 
ATOM   1832 C CB  . VAL B 2 192 ? -43.61606 14.20072 27.63173  1.000 37.47017 ? 524 VAL B CB  1 
ATOM   1833 C CG1 . VAL B 2 192 ? -44.63015 13.47915 26.75906  1.000 39.61237 ? 524 VAL B CG1 1 
ATOM   1834 C CG2 . VAL B 2 192 ? -43.33230 15.55886 27.08672  1.000 40.96180 ? 524 VAL B CG2 1 
ATOM   1835 N N   . CYS B 2 193 ? -45.57177 12.64668 30.13373  1.000 44.33544 ? 525 CYS B N   1 
ATOM   1836 C CA  . CYS B 2 193 ? -45.81429 11.50755 31.00720  1.000 44.94273 ? 525 CYS B CA  1 
ATOM   1837 C C   . CYS B 2 193 ? -46.88183 10.59001 30.44082  1.000 35.61578 ? 525 CYS B C   1 
ATOM   1838 O O   . CYS B 2 193 ? -47.94167 11.05470 30.01381  1.000 42.97969 ? 525 CYS B O   1 
ATOM   1839 C CB  . CYS B 2 193 ? -46.23459 11.98178 32.39414  1.000 40.88338 ? 525 CYS B CB  1 
ATOM   1840 S SG  . CYS B 2 193 ? -44.87569 12.65722 33.34103  1.000 49.37837 ? 525 CYS B SG  1 
ATOM   1841 N N   . GLY B 2 194 ? -46.60739 9.28789  30.47591  1.000 44.92966 ? 526 GLY B N   1 
ATOM   1842 C CA  . GLY B 2 194 ? -47.60943 8.28530  30.17846  1.000 51.85687 ? 526 GLY B CA  1 
ATOM   1843 C C   . GLY B 2 194 ? -48.85786 8.41873  31.03308  1.000 58.96719 ? 526 GLY B C   1 
ATOM   1844 O O   . GLY B 2 194 ? -48.81394 8.97947  32.13451  1.000 50.95116 ? 526 GLY B O   1 
ATOM   1845 N N   . SER B 2 195 ? -49.97790 7.88794  30.53476  1.000 55.14854 ? 527 SER B N   1 
ATOM   1846 C CA  . SER B 2 195 ? -51.27979 8.12517  31.14794  1.000 54.25687 ? 527 SER B CA  1 
ATOM   1847 C C   . SER B 2 195 ? -51.44745 7.40117  32.47814  1.000 63.47226 ? 527 SER B C   1 
ATOM   1848 O O   . SER B 2 195 ? -52.34871 7.74984  33.24867  1.000 57.85371 ? 527 SER B O   1 
ATOM   1849 C CB  . SER B 2 195 ? -52.38616 7.70731  30.17975  1.000 58.29609 ? 527 SER B CB  1 
ATOM   1850 O OG  . SER B 2 195 ? -53.59101 8.39555  30.45662  1.000 65.97366 ? 527 SER B OG  1 
ATOM   1851 N N   . ASN B 2 196 ? -50.61120 6.40370  32.76263  1.000 61.23085 ? 528 ASN B N   1 
ATOM   1852 C CA  . ASN B 2 196 ? -50.60239 5.72658  34.05143  1.000 60.26967 ? 528 ASN B CA  1 
ATOM   1853 C C   . ASN B 2 196 ? -49.37112 6.10519  34.86881  1.000 64.62765 ? 528 ASN B C   1 
ATOM   1854 O O   . ASN B 2 196 ? -48.88129 5.30659  35.67114  1.000 69.39986 ? 528 ASN B O   1 
ATOM   1855 C CB  . ASN B 2 196 ? -50.67881 4.21130  33.86467  1.000 62.46063 ? 528 ASN B CB  1 
ATOM   1856 N N   . SER B 2 197 ? -48.86008 7.31943  34.66769  1.000 58.48586 ? 529 SER B N   1 
ATOM   1857 C CA  . SER B 2 197 ? -47.68293 7.77110  35.39662  1.000 64.56705 ? 529 SER B CA  1 
ATOM   1858 C C   . SER B 2 197 ? -48.02229 8.01306  36.86410  1.000 67.41044 ? 529 SER B C   1 
ATOM   1859 O O   . SER B 2 197 ? -49.10642 8.50343  37.19583  1.000 65.61048 ? 529 SER B O   1 
ATOM   1860 C CB  . SER B 2 197 ? -47.12140 9.04665  34.76481  1.000 51.54594 ? 529 SER B CB  1 
ATOM   1861 N N   . GLU B 2 198 ? -47.08204 7.66364  37.74042  1.000 60.96332 ? 530 GLU B N   1 
ATOM   1862 C CA  . GLU B 2 198 ? -47.26734 7.76516  39.18645  1.000 68.31829 ? 530 GLU B CA  1 
ATOM   1863 C C   . GLU B 2 198 ? -47.64978 9.17716  39.61935  1.000 70.84545 ? 530 GLU B C   1 
ATOM   1864 O O   . GLU B 2 198 ? -48.69277 9.38286  40.24236  1.000 77.37616 ? 530 GLU B O   1 
ATOM   1865 C CB  . GLU B 2 198 ? -45.99406 7.32375  39.91493  1.000 62.65284 ? 530 GLU B CB  1 
HETATM 1866 C C1  . GOL C 3 .   ? -41.57920 7.81393  -10.55013 1.000 50.09099 ? 601 GOL B C1  1 
HETATM 1867 O O1  . GOL C 3 .   ? -42.66509 8.33103  -11.25424 1.000 54.25560 ? 601 GOL B O1  1 
HETATM 1868 C C2  . GOL C 3 .   ? -40.41780 8.83514  -10.65635 1.000 48.06940 ? 601 GOL B C2  1 
HETATM 1869 O O2  . GOL C 3 .   ? -39.85199 8.85775  -11.92143 1.000 48.58582 ? 601 GOL B O2  1 
HETATM 1870 C C3  . GOL C 3 .   ? -39.41383 8.37100  -9.59074  1.000 44.11304 ? 601 GOL B C3  1 
HETATM 1871 O O3  . GOL C 3 .   ? -38.21524 9.02336  -9.80886  1.000 49.12910 ? 601 GOL B O3  1 
HETATM 1872 O O   . HOH D 4 .   ? -26.74777 0.63285  0.35669   1.000 48.95337 ? 101 HOH A O   1 
HETATM 1873 O O   . HOH D 4 .   ? -31.95120 16.08980 -14.07243 1.000 36.77125 ? 102 HOH A O   1 
HETATM 1874 O O   . HOH D 4 .   ? -27.99201 10.21781 -23.93871 1.000 56.54180 ? 103 HOH A O   1 
HETATM 1875 O O   . HOH D 4 .   ? -48.79115 0.50162  -12.16432 1.000 45.99549 ? 104 HOH A O   1 
HETATM 1876 O O   . HOH D 4 .   ? -36.84863 2.06275  -2.85417  1.000 32.25573 ? 105 HOH A O   1 
HETATM 1877 O O   . HOH D 4 .   ? -35.52514 4.96979  -5.41850  1.000 33.62126 ? 106 HOH A O   1 
HETATM 1878 O O   . HOH D 4 .   ? -33.85775 13.99910 -11.34163 1.000 39.74657 ? 107 HOH A O   1 
HETATM 1879 O O   . HOH D 4 .   ? -32.12429 5.32503  -22.11278 1.000 42.95753 ? 108 HOH A O   1 
HETATM 1880 O O   . HOH D 4 .   ? -44.39278 3.22322  -23.46308 1.000 39.20451 ? 109 HOH A O   1 
HETATM 1881 O O   . HOH D 4 .   ? -26.19849 5.80822  -4.67204  1.000 37.33343 ? 110 HOH A O   1 
HETATM 1882 O O   . HOH D 4 .   ? -30.48307 13.90821 -18.69155 1.000 41.77278 ? 111 HOH A O   1 
HETATM 1883 O O   . HOH D 4 .   ? -39.88616 12.50479 -14.74776 1.000 52.19460 ? 112 HOH A O   1 
HETATM 1884 O O   . HOH D 4 .   ? -44.742   -0.228   -18.556   1.000 39.40437 ? 113 HOH A O   1 
HETATM 1885 O O   . HOH D 4 .   ? -48.86939 -3.03639 -9.86981  1.000 44.47238 ? 114 HOH A O   1 
HETATM 1886 O O   . HOH D 4 .   ? -34.62032 -2.33371 -9.03482  1.000 43.25528 ? 115 HOH A O   1 
HETATM 1887 O O   . HOH D 4 .   ? -47.11138 2.22951  -13.53017 1.000 48.26243 ? 116 HOH A O   1 
HETATM 1888 O O   . HOH D 4 .   ? -32.09121 -0.19689 -4.28719  1.000 47.39980 ? 117 HOH A O   1 
HETATM 1889 O O   . HOH D 4 .   ? -34.99097 15.16060 -16.10826 1.000 54.27032 ? 118 HOH A O   1 
HETATM 1890 O O   . HOH D 4 .   ? -47.01437 -0.00000 -16.62667 0.50  41.09828 ? 119 HOH A O   1 
HETATM 1891 O O   . HOH D 4 .   ? -30.11896 -1.66491 -3.34278  1.000 49.57132 ? 120 HOH A O   1 
HETATM 1892 O O   . HOH D 4 .   ? -35.14912 5.91617  -22.90832 1.000 49.91468 ? 121 HOH A O   1 
HETATM 1893 O O   . HOH D 4 .   ? -34.84037 -1.62627 -3.07537  1.000 57.91552 ? 122 HOH A O   1 
HETATM 1894 O O   . HOH D 4 .   ? -32.13789 -3.24817 -9.24822  1.000 50.62342 ? 123 HOH A O   1 
HETATM 1895 O O   . HOH D 4 .   ? -34.01251 18.14262 -14.62418 1.000 49.90854 ? 124 HOH A O   1 
HETATM 1896 O O   . HOH E 4 .   ? -20.58103 20.42006 -10.24274 1.000 44.05620 ? 701 HOH B O   1 
HETATM 1897 O O   . HOH E 4 .   ? -24.35814 8.41117  8.55189   1.000 56.39529 ? 702 HOH B O   1 
HETATM 1898 O O   . HOH E 4 .   ? -38.62289 -3.31340 2.83215   1.000 38.31243 ? 703 HOH B O   1 
HETATM 1899 O O   . HOH E 4 .   ? -33.14659 21.35152 7.72210   1.000 54.94101 ? 704 HOH B O   1 
HETATM 1900 O O   . HOH E 4 .   ? -23.35760 20.81110 -8.54030  1.000 50.13901 ? 705 HOH B O   1 
HETATM 1901 O O   . HOH E 4 .   ? -21.58509 10.28819 -7.91948  1.000 58.78276 ? 706 HOH B O   1 
HETATM 1902 O O   . HOH E 4 .   ? -39.276   21.135   26.706    1.000 47.14667 ? 707 HOH B O   1 
HETATM 1903 O O   . HOH E 4 .   ? -23.30735 8.73916  -2.43409  1.000 45.55444 ? 708 HOH B O   1 
HETATM 1904 O O   . HOH E 4 .   ? -28.14176 3.55860  12.15042  1.000 47.90930 ? 709 HOH B O   1 
HETATM 1905 O O   . HOH E 4 .   ? -44.40657 6.61795  -9.78878  1.000 42.81916 ? 710 HOH B O   1 
HETATM 1906 O O   . HOH E 4 .   ? -44.05171 15.50332 12.59118  1.000 32.45802 ? 711 HOH B O   1 
HETATM 1907 O O   . HOH E 4 .   ? -32.40785 14.49325 1.76894   1.000 35.23946 ? 712 HOH B O   1 
HETATM 1908 O O   . HOH E 4 .   ? -34.66782 -2.41769 4.60009   1.000 49.38818 ? 713 HOH B O   1 
HETATM 1909 O O   . HOH E 4 .   ? -28.73532 19.35782 -3.35112  1.000 38.37705 ? 714 HOH B O   1 
HETATM 1910 O O   . HOH E 4 .   ? -46.31883 8.49080  -14.70814 1.000 55.95343 ? 715 HOH B O   1 
HETATM 1911 O O   . HOH E 4 .   ? -35.92872 -2.88391 9.32677   1.000 39.59725 ? 716 HOH B O   1 
HETATM 1912 O O   . HOH E 4 .   ? -47.53269 14.63594 11.08262  1.000 39.71901 ? 717 HOH B O   1 
HETATM 1913 O O   . HOH E 4 .   ? -47.18176 8.22092  -11.77319 1.000 44.18376 ? 718 HOH B O   1 
HETATM 1914 O O   . HOH E 4 .   ? -36.13622 15.21716 -10.88580 1.000 49.05159 ? 719 HOH B O   1 
HETATM 1915 O O   . HOH E 4 .   ? -54.05442 2.16247  6.39929   1.000 43.74775 ? 720 HOH B O   1 
HETATM 1916 O O   . HOH E 4 .   ? -24.76556 3.15494  2.52612   1.000 54.87009 ? 721 HOH B O   1 
HETATM 1917 O O   . HOH E 4 .   ? -26.07656 2.37377  9.61489   1.000 45.88198 ? 722 HOH B O   1 
HETATM 1918 O O   . HOH E 4 .   ? -37.91910 11.35008 16.35271  1.000 32.50383 ? 723 HOH B O   1 
HETATM 1919 O O   . HOH E 4 .   ? -36.10318 21.96909 -0.65781  1.000 40.70575 ? 724 HOH B O   1 
HETATM 1920 O O   . HOH E 4 .   ? -27.00103 17.39512 -1.08834  1.000 37.68725 ? 725 HOH B O   1 
HETATM 1921 O O   . HOH E 4 .   ? -38.530   19.775   31.225    1.000 45.48095 ? 726 HOH B O   1 
HETATM 1922 O O   . HOH E 4 .   ? -31.84392 -1.80430 2.47668   1.000 60.67492 ? 727 HOH B O   1 
HETATM 1923 O O   . HOH E 4 .   ? -30.77453 3.99275  10.17085  1.000 42.01375 ? 728 HOH B O   1 
HETATM 1924 O O   . HOH E 4 .   ? -18.257   22.178   -16.779   1.000 52.21073 ? 729 HOH B O   1 
HETATM 1925 O O   . HOH E 4 .   ? -27.97940 15.94549 -3.25863  1.000 34.73317 ? 730 HOH B O   1 
HETATM 1926 O O   . HOH E 4 .   ? -27.05782 4.88852  6.13374   1.000 38.13387 ? 731 HOH B O   1 
HETATM 1927 O O   . HOH E 4 .   ? -56.31271 9.01085  16.10536  1.000 60.05634 ? 732 HOH B O   1 
HETATM 1928 O O   . HOH E 4 .   ? -53.64901 -0.76337 -0.16787  1.000 47.51512 ? 733 HOH B O   1 
HETATM 1929 O O   . HOH E 4 .   ? -21.72527 17.17299 -18.21706 1.000 48.28227 ? 734 HOH B O   1 
HETATM 1930 O O   . HOH E 4 .   ? -27.03667 17.70128 -5.11334  1.000 36.09747 ? 735 HOH B O   1 
HETATM 1931 O O   . HOH E 4 .   ? -32.98461 14.92627 4.47550   1.000 34.11583 ? 736 HOH B O   1 
HETATM 1932 O O   . HOH E 4 .   ? -42.08008 11.86758 0.48798   1.000 31.06621 ? 737 HOH B O   1 
HETATM 1933 O O   . HOH E 4 .   ? -32.42848 12.17649 9.29888   1.000 36.94891 ? 738 HOH B O   1 
HETATM 1934 O O   . HOH E 4 .   ? -23.89411 14.53427 5.74512   1.000 42.66476 ? 739 HOH B O   1 
HETATM 1935 O O   . HOH E 4 .   ? -21.04339 14.85122 -6.77773  1.000 46.97164 ? 740 HOH B O   1 
HETATM 1936 O O   . HOH E 4 .   ? -20.99215 23.24482 -10.77359 1.000 43.81095 ? 741 HOH B O   1 
HETATM 1937 O O   . HOH E 4 .   ? -38.53949 20.82139 -3.57575  1.000 38.71700 ? 742 HOH B O   1 
HETATM 1938 O O   . HOH E 4 .   ? -27.62087 7.77377  -6.31120  1.000 37.31993 ? 743 HOH B O   1 
HETATM 1939 O O   . HOH E 4 .   ? -45.39322 15.44576 8.21453   1.000 36.31542 ? 744 HOH B O   1 
HETATM 1940 O O   . HOH E 4 .   ? -38.37136 0.17001  12.50349  1.000 41.70078 ? 745 HOH B O   1 
HETATM 1941 O O   . HOH E 4 .   ? -27.20456 7.67916  6.37013   1.000 37.84615 ? 746 HOH B O   1 
HETATM 1942 O O   . HOH E 4 .   ? -36.05741 -0.69766 1.07589   1.000 37.64892 ? 747 HOH B O   1 
HETATM 1943 O O   . HOH E 4 .   ? -37.96774 5.69704  -4.20037  1.000 30.57611 ? 748 HOH B O   1 
HETATM 1944 O O   . HOH E 4 .   ? -22.45811 17.44498 -7.00282  1.000 48.43772 ? 749 HOH B O   1 
HETATM 1945 O O   . HOH E 4 .   ? -42.11381 21.62713 17.48290  1.000 44.02863 ? 750 HOH B O   1 
HETATM 1946 O O   . HOH E 4 .   ? -52.44443 -2.85884 -6.46839  1.000 59.33628 ? 751 HOH B O   1 
HETATM 1947 O O   . HOH E 4 .   ? -56.30069 6.08818  -3.54383  1.000 51.50727 ? 752 HOH B O   1 
HETATM 1948 O O   . HOH E 4 .   ? -39.64564 20.21673 11.04393  1.000 49.44653 ? 753 HOH B O   1 
HETATM 1949 O O   . HOH E 4 .   ? -44.16049 22.00011 19.24761  1.000 50.80932 ? 754 HOH B O   1 
HETATM 1950 O O   . HOH E 4 .   ? -29.72618 18.79531 9.72627   1.000 42.85100 ? 755 HOH B O   1 
HETATM 1951 O O   . HOH E 4 .   ? -39.12100 15.15082 36.62728  1.000 42.84857 ? 756 HOH B O   1 
HETATM 1952 O O   . HOH E 4 .   ? -30.17852 -2.41138 5.29311   1.000 52.52260 ? 757 HOH B O   1 
HETATM 1953 O O   . HOH E 4 .   ? -53.13428 10.05338 8.62445   1.000 46.98037 ? 758 HOH B O   1 
HETATM 1954 O O   . HOH E 4 .   ? -25.20574 6.10303  17.78364  1.000 59.28405 ? 759 HOH B O   1 
HETATM 1955 O O   . HOH E 4 .   ? -50.08210 -5.19688 -4.32808  1.000 42.18135 ? 760 HOH B O   1 
HETATM 1956 O O   . HOH E 4 .   ? -20.94380 15.70118 -14.47226 1.000 39.69617 ? 761 HOH B O   1 
HETATM 1957 O O   . HOH E 4 .   ? -52.36937 13.97532 0.54351   1.000 52.13182 ? 762 HOH B O   1 
HETATM 1958 O O   . HOH E 4 .   ? -24.60578 12.44196 31.84498  1.000 54.90775 ? 763 HOH B O   1 
HETATM 1959 O O   . HOH E 4 .   ? -33.18097 5.34019  8.72810   1.000 34.73760 ? 764 HOH B O   1 
HETATM 1960 O O   . HOH E 4 .   ? -32.55424 1.34745  -1.22228  1.000 37.19986 ? 765 HOH B O   1 
HETATM 1961 O O   . HOH E 4 .   ? -32.47279 10.51300 26.02617  1.000 49.09330 ? 766 HOH B O   1 
HETATM 1962 O O   . HOH E 4 .   ? -58.67982 8.93736  14.65109  1.000 68.78244 ? 767 HOH B O   1 
HETATM 1963 O O   . HOH E 4 .   ? -40.44378 -2.33553 4.11095   1.000 34.18917 ? 768 HOH B O   1 
HETATM 1964 O O   . HOH E 4 .   ? -30.46562 21.86396 3.67510   1.000 41.33927 ? 769 HOH B O   1 
HETATM 1965 O O   . HOH E 4 .   ? -51.61467 -0.06970 7.08004   1.000 41.59903 ? 770 HOH B O   1 
HETATM 1966 O O   . HOH E 4 .   ? -39.73531 13.57545 -10.47649 1.000 42.42149 ? 771 HOH B O   1 
HETATM 1967 O O   . HOH E 4 .   ? -38.08152 23.75907 6.02740   1.000 56.56702 ? 772 HOH B O   1 
HETATM 1968 O O   . HOH E 4 .   ? -45.24447 19.61576 3.54538   1.000 52.56351 ? 773 HOH B O   1 
HETATM 1969 O O   . HOH E 4 .   ? -31.37764 1.31467  18.71294  1.000 58.42905 ? 774 HOH B O   1 
HETATM 1970 O O   . HOH E 4 .   ? -27.04264 23.99930 -8.56625  1.000 40.82652 ? 775 HOH B O   1 
HETATM 1971 O O   . HOH E 4 .   ? -44.97065 -1.42078 6.70189   1.000 46.78950 ? 776 HOH B O   1 
HETATM 1972 O O   . HOH E 4 .   ? -25.68493 9.73589  -5.35978  1.000 36.28730 ? 777 HOH B O   1 
HETATM 1973 O O   . HOH E 4 .   ? -30.30302 15.85418 -16.35624 1.000 39.39156 ? 778 HOH B O   1 
HETATM 1974 O O   . HOH E 4 .   ? -24.64106 16.17477 -2.17558  1.000 49.14315 ? 779 HOH B O   1 
HETATM 1975 O O   . HOH E 4 .   ? -39.41797 -0.87263 9.76904   1.000 54.73966 ? 780 HOH B O   1 
HETATM 1976 O O   . HOH E 4 .   ? -54.96189 3.39769  2.60618   1.000 50.56545 ? 781 HOH B O   1 
HETATM 1977 O O   . HOH E 4 .   ? -40.71311 -1.72000 -4.11190  1.000 54.96300 ? 782 HOH B O   1 
HETATM 1978 O O   . HOH E 4 .   ? -37.52866 14.36338 -14.93369 1.000 52.82634 ? 783 HOH B O   1 
HETATM 1979 O O   . HOH E 4 .   ? -24.40583 17.76195 -4.84695  1.000 38.46616 ? 784 HOH B O   1 
HETATM 1980 O O   . HOH E 4 .   ? -34.84000 18.89769 17.68948  1.000 50.39218 ? 785 HOH B O   1 
HETATM 1981 O O   . HOH E 4 .   ? -42.05175 -3.24779 19.52141  1.000 47.35645 ? 786 HOH B O   1 
HETATM 1982 O O   . HOH E 4 .   ? -18.51275 12.95077 -9.76738  1.000 57.22147 ? 787 HOH B O   1 
HETATM 1983 O O   . HOH E 4 .   ? -20.86986 8.40133  3.23509   1.000 42.86023 ? 788 HOH B O   1 
HETATM 1984 O O   . HOH E 4 .   ? -37.20503 19.01266 10.62143  1.000 56.05666 ? 789 HOH B O   1 
HETATM 1985 O O   . HOH E 4 .   ? -53.62299 6.16968  -12.34305 1.000 53.29557 ? 790 HOH B O   1 
HETATM 1986 O O   . HOH E 4 .   ? -49.67212 15.79023 -8.22180  1.000 50.89265 ? 791 HOH B O   1 
HETATM 1987 O O   . HOH E 4 .   ? -54.00832 13.03279 20.94532  1.000 50.83058 ? 792 HOH B O   1 
HETATM 1988 O O   . HOH E 4 .   ? -25.81228 20.12707 -1.52301  1.000 58.34074 ? 793 HOH B O   1 
HETATM 1989 O O   . HOH E 4 .   ? -25.02088 6.05469  14.71744  1.000 60.78957 ? 794 HOH B O   1 
HETATM 1990 O O   . HOH E 4 .   ? -29.88961 24.52843 -2.56218  1.000 44.73338 ? 795 HOH B O   1 
HETATM 1991 O O   . HOH E 4 .   ? -44.74662 -1.98443 4.32192   1.000 49.08610 ? 796 HOH B O   1 
HETATM 1992 O O   . HOH E 4 .   ? -57.53446 16.32352 18.99145  1.000 69.52226 ? 797 HOH B O   1 
HETATM 1993 O O   . HOH E 4 .   ? -23.69547 6.16472  7.05759   1.000 54.28212 ? 798 HOH B O   1 
HETATM 1994 O O   . HOH E 4 .   ? -25.07220 18.74742 -20.59437 1.000 50.59154 ? 799 HOH B O   1 
HETATM 1995 O O   . HOH E 4 .   ? -35.02103 0.22275  -1.36136  1.000 37.83341 ? 800 HOH B O   1 
HETATM 1996 O O   . HOH E 4 .   ? -36.505   20.954   27.200    1.000 44.05270 ? 801 HOH B O   1 
HETATM 1997 O O   . HOH E 4 .   ? -46.97432 19.50551 23.17960  1.000 48.24009 ? 802 HOH B O   1 
HETATM 1998 O O   . HOH E 4 .   ? -36.80472 -3.04199 -1.17100  1.000 44.46966 ? 803 HOH B O   1 
HETATM 1999 O O   . HOH E 4 .   ? -23.29987 8.57360  -4.98968  1.000 57.58614 ? 804 HOH B O   1 
HETATM 2000 O O   . HOH E 4 .   ? -33.07073 19.34391 23.68751  1.000 61.47479 ? 805 HOH B O   1 
HETATM 2001 O O   . HOH E 4 .   ? -45.50619 22.09478 23.30600  1.000 62.95809 ? 806 HOH B O   1 
HETATM 2002 O O   . HOH E 4 .   ? -48.79836 20.16985 24.61116  1.000 61.19027 ? 807 HOH B O   1 
HETATM 2003 O O   . HOH E 4 .   ? -44.92356 -3.50167 -5.25763  1.000 43.44148 ? 808 HOH B O   1 
HETATM 2004 O O   . HOH E 4 .   ? -51.70992 3.80915  -13.78407 1.000 50.24802 ? 809 HOH B O   1 
HETATM 2005 O O   . HOH E 4 .   ? -54.70416 15.00827 -0.20174  1.000 55.32505 ? 810 HOH B O   1 
HETATM 2006 O O   . HOH E 4 .   ? -53.44390 7.17331  12.17498  1.000 61.03046 ? 811 HOH B O   1 
HETATM 2007 O O   . HOH E 4 .   ? -36.87254 -4.07373 1.26387   1.000 42.45560 ? 812 HOH B O   1 
HETATM 2008 O O   . HOH E 4 .   ? -45.67936 -3.15440 2.43291   1.000 64.53508 ? 813 HOH B O   1 
HETATM 2009 O O   . HOH E 4 .   ? -54.05240 -2.95047 -3.97521  1.000 60.07659 ? 814 HOH B O   1 
HETATM 2010 O O   . HOH E 4 .   ? -39.00583 -5.36800 4.09806   1.000 51.11321 ? 815 HOH B O   1 
HETATM 2011 O O   . HOH E 4 .   ? -53.21334 -1.96649 2.78150   1.000 51.14872 ? 816 HOH B O   1 
HETATM 2012 O O   . HOH E 4 .   ? -55.89449 1.11571  -0.10163  1.000 63.65793 ? 817 HOH B O   1 
HETATM 2013 O O   . HOH E 4 .   ? -35.10047 -5.38212 8.20419   1.000 58.62267 ? 818 HOH B O   1 
HETATM 2014 O O   . HOH E 4 .   ? -46.51883 19.19170 6.12527   1.000 61.36450 ? 819 HOH B O   1 
HETATM 2015 O O   . HOH E 4 .   ? -25.76407 16.04142 -22.95772 1.000 60.02467 ? 820 HOH B O   1 
HETATM 2016 O O   . HOH E 4 .   ? -40.51794 -4.56913 1.53173   1.000 45.79258 ? 821 HOH B O   1 
HETATM 2017 O O   . HOH E 4 .   ? -39.14915 17.27624 -8.24441  1.000 54.99189 ? 822 HOH B O   1 
HETATM 2018 O O   . HOH E 4 .   ? -34.22956 -2.32796 1.88264   1.000 50.29369 ? 823 HOH B O   1 
HETATM 2019 O O   . HOH E 4 .   ? -43.26554 -4.31484 0.53420   1.000 52.79904 ? 824 HOH B O   1 
HETATM 2020 O O   . HOH E 4 .   ? -34.67898 -3.75670 11.52503  1.000 48.72337 ? 825 HOH B O   1 
HETATM 2021 O O   . HOH E 4 .   ? -41.87981 -3.23755 6.28166   1.000 46.05826 ? 826 HOH B O   1 
HETATM 2022 O O   . HOH E 4 .   ? -40.34643 -2.89330 8.91530   1.000 46.56237 ? 827 HOH B O   1 
HETATM 2023 O O   . HOH E 4 .   ? -31.20296 -1.41796 18.19434  1.000 59.75909 ? 828 HOH B O   1 
HETATM 2024 O O   . HOH E 4 .   ? -37.46403 20.11115 17.66894  1.000 46.06514 ? 829 HOH B O   1 
HETATM 2025 O O   . HOH E 4 .   ? -41.082   18.776   37.496    1.000 51.52122 ? 830 HOH B O   1 
# 
