data_9ILR
# 
_entry.id   9ILR 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.403 
_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   9ILR         pdb_00009ilr 10.2210/pdb9ilr/pdb 
WWPDB D_1300049012 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-03-05 ? 
2 'Structure model' 1 1 2025-05-28 ? 
# 
_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_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
loop_
_pdbx_audit_revision_category.ordinal 
_pdbx_audit_revision_category.revision_ordinal 
_pdbx_audit_revision_category.data_content_type 
_pdbx_audit_revision_category.category 
1 2 'Structure model' citation        
2 2 'Structure model' citation_author 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.journal_volume'          
2 2 'Structure model' '_citation.page_first'              
3 2 'Structure model' '_citation.page_last'               
4 2 'Structure model' '_citation_author.identifier_ORCID' 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9ILR 
_pdbx_database_status.recvd_initial_deposition_date   2024-07-01 
_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                 2 
_pdbx_contact_author.email              xiewei6@mail.sysu.edu.cn 
_pdbx_contact_author.name_first         Wei 
_pdbx_contact_author.name_last          Xie 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0003-2410-2135 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Xie, W.'  1 ? 
'Chen, R.' 2 ? 
'Zhao, H.' 3 ? 
# 
_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                   NE 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Febs Lett.' 
_citation.journal_id_ASTM           FEBLAL 
_citation.journal_id_CSD            0165 
_citation.journal_id_ISSN           0014-5793 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            599 
_citation.language                  ? 
_citation.page_first                1246 
_citation.page_last                 1259 
_citation.title                     'Structural insights into the Shigella flexneri GmvAT toxin-antitoxin system.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1002/1873-3468.70015 
_citation.pdbx_database_id_PubMed   39973444 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Chen, R.'  1  ? 
primary 'Zhao, H.'  2  ? 
primary 'Zhou, J.'  3  ? 
primary 'Liu, A.'   4  ? 
primary 'Guo, Y.'   5  ? 
primary 'Wu, K.'    6  ? 
primary 'Xiang, Y.' 7  ? 
primary 'Lei, J.'   8  ? 
primary 'Jiang, S.' 9  ? 
primary 'Xie, W.'   10 ? 
# 
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     man N-acetyltransferase                 18870.719 1  ? Q100R ? ?                     
2 polymer     man 'DUF1778 domain-containing protein' 4973.642  1  ? ?     ? 'GenBank: UUR52005.1' 
3 non-polymer syn 'ACETYL COENZYME *A'                809.571   1  ? ?     ? ?                     
4 non-polymer syn 'PHOSPHATE ION'                     94.971    1  ? ?     ? ?                     
5 water       nat water                               18.015    45 ? ?     ? ?                     
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        GmvT 
# 
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 
;MEINVTAPALLTDEHILQPFDCGNEVLSNWLRGRAMKNQMLNASRTFVICLEDTLRIVGYYSLATGSVTHAELGRSLRHN
MPNPVPVVLLGRLAVDVCTRGHGFGKWLLSDAIHRVVNLADQVGIKAVMVHAIDDDARAFYERFGFVQSVVAPNTLFYKV
LEHHHHHH
;
;MEINVTAPALLTDEHILQPFDCGNEVLSNWLRGRAMKNQMLNASRTFVICLEDTLRIVGYYSLATGSVTHAELGRSLRHN
MPNPVPVVLLGRLAVDVCTRGHGFGKWLLSDAIHRVVNLADQVGIKAVMVHAIDDDARAFYERFGFVQSVVAPNTLFYKV
LEHHHHHH
;
A ? 
2 'polypeptide(L)' no no MASQRLFVLDNERYDSFITQLEAPVQNAEGRERLMAVKPEWK MASQRLFVLDNERYDSFITQLEAPVQNAEGRERLMAVKPEWK B ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 'ACETYL COENZYME *A' ACO 
4 'PHOSPHATE ION'      PO4 
5 water                HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   GLU n 
1 3   ILE n 
1 4   ASN n 
1 5   VAL n 
1 6   THR n 
1 7   ALA n 
1 8   PRO n 
1 9   ALA n 
1 10  LEU n 
1 11  LEU n 
1 12  THR n 
1 13  ASP n 
1 14  GLU n 
1 15  HIS n 
1 16  ILE n 
1 17  LEU n 
1 18  GLN n 
1 19  PRO n 
1 20  PHE n 
1 21  ASP n 
1 22  CYS n 
1 23  GLY n 
1 24  ASN n 
1 25  GLU n 
1 26  VAL n 
1 27  LEU n 
1 28  SER n 
1 29  ASN n 
1 30  TRP n 
1 31  LEU n 
1 32  ARG n 
1 33  GLY n 
1 34  ARG n 
1 35  ALA n 
1 36  MET n 
1 37  LYS n 
1 38  ASN n 
1 39  GLN n 
1 40  MET n 
1 41  LEU n 
1 42  ASN n 
1 43  ALA n 
1 44  SER n 
1 45  ARG n 
1 46  THR n 
1 47  PHE n 
1 48  VAL n 
1 49  ILE n 
1 50  CYS n 
1 51  LEU n 
1 52  GLU n 
1 53  ASP n 
1 54  THR n 
1 55  LEU n 
1 56  ARG n 
1 57  ILE n 
1 58  VAL n 
1 59  GLY n 
1 60  TYR n 
1 61  TYR n 
1 62  SER n 
1 63  LEU n 
1 64  ALA n 
1 65  THR n 
1 66  GLY n 
1 67  SER n 
1 68  VAL n 
1 69  THR n 
1 70  HIS n 
1 71  ALA n 
1 72  GLU n 
1 73  LEU n 
1 74  GLY n 
1 75  ARG n 
1 76  SER n 
1 77  LEU n 
1 78  ARG n 
1 79  HIS n 
1 80  ASN n 
1 81  MET n 
1 82  PRO n 
1 83  ASN n 
1 84  PRO n 
1 85  VAL n 
1 86  PRO n 
1 87  VAL n 
1 88  VAL n 
1 89  LEU n 
1 90  LEU n 
1 91  GLY n 
1 92  ARG n 
1 93  LEU n 
1 94  ALA n 
1 95  VAL n 
1 96  ASP n 
1 97  VAL n 
1 98  CYS n 
1 99  THR n 
1 100 ARG n 
1 101 GLY n 
1 102 HIS n 
1 103 GLY n 
1 104 PHE n 
1 105 GLY n 
1 106 LYS n 
1 107 TRP n 
1 108 LEU n 
1 109 LEU n 
1 110 SER n 
1 111 ASP n 
1 112 ALA n 
1 113 ILE n 
1 114 HIS n 
1 115 ARG n 
1 116 VAL n 
1 117 VAL n 
1 118 ASN n 
1 119 LEU n 
1 120 ALA n 
1 121 ASP n 
1 122 GLN n 
1 123 VAL n 
1 124 GLY n 
1 125 ILE n 
1 126 LYS n 
1 127 ALA n 
1 128 VAL n 
1 129 MET n 
1 130 VAL n 
1 131 HIS n 
1 132 ALA n 
1 133 ILE n 
1 134 ASP n 
1 135 ASP n 
1 136 ASP n 
1 137 ALA n 
1 138 ARG n 
1 139 ALA n 
1 140 PHE n 
1 141 TYR n 
1 142 GLU n 
1 143 ARG n 
1 144 PHE n 
1 145 GLY n 
1 146 PHE n 
1 147 VAL n 
1 148 GLN n 
1 149 SER n 
1 150 VAL n 
1 151 VAL n 
1 152 ALA n 
1 153 PRO n 
1 154 ASN n 
1 155 THR n 
1 156 LEU n 
1 157 PHE n 
1 158 TYR n 
1 159 LYS n 
1 160 VAL n 
1 161 LEU n 
1 162 GLU n 
1 163 HIS n 
1 164 HIS n 
1 165 HIS n 
1 166 HIS n 
1 167 HIS n 
1 168 HIS n 
2 1   MET n 
2 2   ALA n 
2 3   SER n 
2 4   GLN n 
2 5   ARG n 
2 6   LEU n 
2 7   PHE n 
2 8   VAL n 
2 9   LEU n 
2 10  ASP n 
2 11  ASN n 
2 12  GLU n 
2 13  ARG n 
2 14  TYR n 
2 15  ASP n 
2 16  SER n 
2 17  PHE n 
2 18  ILE n 
2 19  THR n 
2 20  GLN n 
2 21  LEU n 
2 22  GLU n 
2 23  ALA n 
2 24  PRO n 
2 25  VAL n 
2 26  GLN n 
2 27  ASN n 
2 28  ALA n 
2 29  GLU n 
2 30  GLY n 
2 31  ARG n 
2 32  GLU n 
2 33  ARG n 
2 34  LEU n 
2 35  MET n 
2 36  ALA n 
2 37  VAL n 
2 38  LYS n 
2 39  PRO n 
2 40  GLU n 
2 41  TRP n 
2 42  LYS n 
# 
loop_
_entity_src_gen.entity_id 
_entity_src_gen.pdbx_src_id 
_entity_src_gen.pdbx_alt_source_flag 
_entity_src_gen.pdbx_seq_type 
_entity_src_gen.pdbx_beg_seq_num 
_entity_src_gen.pdbx_end_seq_num 
_entity_src_gen.gene_src_common_name 
_entity_src_gen.gene_src_genus 
_entity_src_gen.pdbx_gene_src_gene 
_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 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 
_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 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 
_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 
1 1 sample 'Biological sequence' 1 168 ? ? CBL27_26410 ? ? ? ? ? ? 'Shigella sonnei' 624 ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? 
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
2 1 sample 'Biological sequence' 1 42  ? ? ?           ? ? ? ? ? ? 'Shigella sonnei' 624 ? ? ? ? ? ? ? ? 'Escherichia coli' 562 ? 
? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
# 
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 
ACO non-polymer         . 'ACETYL COENZYME *A' ? 'C23 H38 N7 O17 P3 S' 809.571 
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  
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 
PO4 non-polymer         . 'PHOSPHATE ION'      ? 'O4 P -3'             94.971  
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   MET 1   1   1   MET MET A . n 
A 1 2   GLU 2   2   2   GLU GLU A . n 
A 1 3   ILE 3   3   3   ILE ILE A . n 
A 1 4   ASN 4   4   4   ASN ASN A . n 
A 1 5   VAL 5   5   5   VAL VAL A . n 
A 1 6   THR 6   6   6   THR THR A . n 
A 1 7   ALA 7   7   7   ALA ALA A . n 
A 1 8   PRO 8   8   8   PRO PRO A . n 
A 1 9   ALA 9   9   9   ALA ALA A . n 
A 1 10  LEU 10  10  10  LEU LEU A . n 
A 1 11  LEU 11  11  11  LEU LEU A . n 
A 1 12  THR 12  12  12  THR THR A . n 
A 1 13  ASP 13  13  13  ASP ASP A . n 
A 1 14  GLU 14  14  14  GLU GLU A . n 
A 1 15  HIS 15  15  15  HIS HIS A . n 
A 1 16  ILE 16  16  16  ILE ILE A . n 
A 1 17  LEU 17  17  17  LEU LEU A . n 
A 1 18  GLN 18  18  18  GLN GLN A . n 
A 1 19  PRO 19  19  19  PRO PRO A . n 
A 1 20  PHE 20  20  20  PHE PHE A . n 
A 1 21  ASP 21  21  21  ASP ASP A . n 
A 1 22  CYS 22  22  22  CYS CYS A . n 
A 1 23  GLY 23  23  23  GLY GLY A . n 
A 1 24  ASN 24  24  24  ASN ASN A . n 
A 1 25  GLU 25  25  25  GLU GLU A . n 
A 1 26  VAL 26  26  26  VAL VAL A . n 
A 1 27  LEU 27  27  27  LEU LEU A . n 
A 1 28  SER 28  28  28  SER SER A . n 
A 1 29  ASN 29  29  29  ASN ASN A . n 
A 1 30  TRP 30  30  30  TRP TRP A . n 
A 1 31  LEU 31  31  31  LEU LEU A . n 
A 1 32  ARG 32  32  32  ARG ARG A . n 
A 1 33  GLY 33  33  33  GLY GLY A . n 
A 1 34  ARG 34  34  34  ARG ARG A . n 
A 1 35  ALA 35  35  35  ALA ALA 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  ASN 38  38  38  ASN ASN A . n 
A 1 39  GLN 39  39  39  GLN GLN A . n 
A 1 40  MET 40  40  40  MET MET A . n 
A 1 41  LEU 41  41  41  LEU LEU A . n 
A 1 42  ASN 42  42  42  ASN ASN A . n 
A 1 43  ALA 43  43  43  ALA ALA A . n 
A 1 44  SER 44  44  44  SER SER A . n 
A 1 45  ARG 45  45  45  ARG ARG A . n 
A 1 46  THR 46  46  46  THR THR A . n 
A 1 47  PHE 47  47  47  PHE PHE A . n 
A 1 48  VAL 48  48  48  VAL VAL A . n 
A 1 49  ILE 49  49  49  ILE ILE A . n 
A 1 50  CYS 50  50  50  CYS CYS A . n 
A 1 51  LEU 51  51  51  LEU LEU A . n 
A 1 52  GLU 52  52  52  GLU GLU A . n 
A 1 53  ASP 53  53  53  ASP ASP A . n 
A 1 54  THR 54  54  54  THR THR A . n 
A 1 55  LEU 55  55  55  LEU LEU A . n 
A 1 56  ARG 56  56  56  ARG ARG A . n 
A 1 57  ILE 57  57  57  ILE ILE A . n 
A 1 58  VAL 58  58  58  VAL VAL A . n 
A 1 59  GLY 59  59  59  GLY GLY A . n 
A 1 60  TYR 60  60  60  TYR TYR A . n 
A 1 61  TYR 61  61  61  TYR TYR A . n 
A 1 62  SER 62  62  62  SER SER A . n 
A 1 63  LEU 63  63  63  LEU LEU A . n 
A 1 64  ALA 64  64  64  ALA ALA A . n 
A 1 65  THR 65  65  65  THR THR A . n 
A 1 66  GLY 66  66  66  GLY GLY A . n 
A 1 67  SER 67  67  67  SER SER A . n 
A 1 68  VAL 68  68  68  VAL VAL A . n 
A 1 69  THR 69  69  69  THR THR A . n 
A 1 70  HIS 70  70  70  HIS HIS A . n 
A 1 71  ALA 71  71  71  ALA ALA A . n 
A 1 72  GLU 72  72  72  GLU GLU A . n 
A 1 73  LEU 73  73  73  LEU LEU A . n 
A 1 74  GLY 74  74  ?   ?   ?   A . n 
A 1 75  ARG 75  75  ?   ?   ?   A . n 
A 1 76  SER 76  76  ?   ?   ?   A . n 
A 1 77  LEU 77  77  ?   ?   ?   A . n 
A 1 78  ARG 78  78  ?   ?   ?   A . n 
A 1 79  HIS 79  79  ?   ?   ?   A . n 
A 1 80  ASN 80  80  ?   ?   ?   A . n 
A 1 81  MET 81  81  ?   ?   ?   A . n 
A 1 82  PRO 82  82  82  PRO PRO A . n 
A 1 83  ASN 83  83  83  ASN ASN A . n 
A 1 84  PRO 84  84  84  PRO PRO A . n 
A 1 85  VAL 85  85  85  VAL VAL A . n 
A 1 86  PRO 86  86  86  PRO PRO A . n 
A 1 87  VAL 87  87  87  VAL VAL A . n 
A 1 88  VAL 88  88  88  VAL VAL A . n 
A 1 89  LEU 89  89  89  LEU LEU A . n 
A 1 90  LEU 90  90  90  LEU LEU A . n 
A 1 91  GLY 91  91  91  GLY GLY A . n 
A 1 92  ARG 92  92  92  ARG ARG A . n 
A 1 93  LEU 93  93  93  LEU LEU A . n 
A 1 94  ALA 94  94  94  ALA ALA A . n 
A 1 95  VAL 95  95  95  VAL VAL A . n 
A 1 96  ASP 96  96  96  ASP ASP A . n 
A 1 97  VAL 97  97  97  VAL VAL A . n 
A 1 98  CYS 98  98  98  CYS CYS A . n 
A 1 99  THR 99  99  99  THR THR A . n 
A 1 100 ARG 100 100 100 ARG ARG A . n 
A 1 101 GLY 101 101 101 GLY GLY A . n 
A 1 102 HIS 102 102 102 HIS HIS A . n 
A 1 103 GLY 103 103 103 GLY GLY A . n 
A 1 104 PHE 104 104 104 PHE PHE A . n 
A 1 105 GLY 105 105 105 GLY GLY A . n 
A 1 106 LYS 106 106 106 LYS LYS A . n 
A 1 107 TRP 107 107 107 TRP TRP A . n 
A 1 108 LEU 108 108 108 LEU LEU A . n 
A 1 109 LEU 109 109 109 LEU LEU A . n 
A 1 110 SER 110 110 110 SER SER A . n 
A 1 111 ASP 111 111 111 ASP ASP A . n 
A 1 112 ALA 112 112 112 ALA ALA A . n 
A 1 113 ILE 113 113 113 ILE ILE A . n 
A 1 114 HIS 114 114 114 HIS HIS A . n 
A 1 115 ARG 115 115 115 ARG ARG A . n 
A 1 116 VAL 116 116 116 VAL VAL A . n 
A 1 117 VAL 117 117 117 VAL VAL A . n 
A 1 118 ASN 118 118 118 ASN ASN A . n 
A 1 119 LEU 119 119 119 LEU LEU A . n 
A 1 120 ALA 120 120 120 ALA ALA A . n 
A 1 121 ASP 121 121 121 ASP ASP A . n 
A 1 122 GLN 122 122 122 GLN GLN A . n 
A 1 123 VAL 123 123 123 VAL VAL A . n 
A 1 124 GLY 124 124 124 GLY GLY A . n 
A 1 125 ILE 125 125 125 ILE ILE A . n 
A 1 126 LYS 126 126 126 LYS LYS A . n 
A 1 127 ALA 127 127 127 ALA ALA A . n 
A 1 128 VAL 128 128 128 VAL VAL A . n 
A 1 129 MET 129 129 129 MET MET A . n 
A 1 130 VAL 130 130 130 VAL VAL A . n 
A 1 131 HIS 131 131 131 HIS HIS A . n 
A 1 132 ALA 132 132 132 ALA ALA A . n 
A 1 133 ILE 133 133 133 ILE ILE A . n 
A 1 134 ASP 134 134 134 ASP ASP A . n 
A 1 135 ASP 135 135 135 ASP ASP A . n 
A 1 136 ASP 136 136 136 ASP ASP A . n 
A 1 137 ALA 137 137 137 ALA ALA A . n 
A 1 138 ARG 138 138 138 ARG ARG A . n 
A 1 139 ALA 139 139 139 ALA ALA A . n 
A 1 140 PHE 140 140 140 PHE PHE A . n 
A 1 141 TYR 141 141 141 TYR TYR A . n 
A 1 142 GLU 142 142 142 GLU GLU A . n 
A 1 143 ARG 143 143 143 ARG ARG A . n 
A 1 144 PHE 144 144 144 PHE PHE A . n 
A 1 145 GLY 145 145 145 GLY GLY A . n 
A 1 146 PHE 146 146 146 PHE PHE A . n 
A 1 147 VAL 147 147 147 VAL VAL A . n 
A 1 148 GLN 148 148 148 GLN GLN A . n 
A 1 149 SER 149 149 149 SER SER A . n 
A 1 150 VAL 150 150 150 VAL VAL A . n 
A 1 151 VAL 151 151 151 VAL VAL A . n 
A 1 152 ALA 152 152 152 ALA ALA A . n 
A 1 153 PRO 153 153 153 PRO PRO A . n 
A 1 154 ASN 154 154 154 ASN ASN A . n 
A 1 155 THR 155 155 155 THR THR A . n 
A 1 156 LEU 156 156 156 LEU LEU A . n 
A 1 157 PHE 157 157 157 PHE PHE A . n 
A 1 158 TYR 158 158 158 TYR TYR A . n 
A 1 159 LYS 159 159 159 LYS LYS A . n 
A 1 160 VAL 160 160 160 VAL VAL A . n 
A 1 161 LEU 161 161 161 LEU LEU A . n 
A 1 162 GLU 162 162 162 GLU GLU A . n 
A 1 163 HIS 163 163 163 HIS HIS A . n 
A 1 164 HIS 164 164 164 HIS HIS A . n 
A 1 165 HIS 165 165 ?   ?   ?   A . n 
A 1 166 HIS 166 166 ?   ?   ?   A . n 
A 1 167 HIS 167 167 ?   ?   ?   A . n 
A 1 168 HIS 168 168 ?   ?   ?   A . n 
B 2 1   MET 1   59  ?   ?   ?   B . n 
B 2 2   ALA 2   60  60  ALA ALA B . n 
B 2 3   SER 3   61  61  SER SER B . n 
B 2 4   GLN 4   62  62  GLN GLN B . n 
B 2 5   ARG 5   63  63  ARG ARG B . n 
B 2 6   LEU 6   64  64  LEU LEU B . n 
B 2 7   PHE 7   65  65  PHE PHE B . n 
B 2 8   VAL 8   66  66  VAL VAL B . n 
B 2 9   LEU 9   67  67  LEU LEU B . n 
B 2 10  ASP 10  68  68  ASP ASP B . n 
B 2 11  ASN 11  69  69  ASN ASN B . n 
B 2 12  GLU 12  70  70  GLU GLU B . n 
B 2 13  ARG 13  71  71  ARG ARG B . n 
B 2 14  TYR 14  72  72  TYR TYR B . n 
B 2 15  ASP 15  73  73  ASP ASP B . n 
B 2 16  SER 16  74  74  SER SER B . n 
B 2 17  PHE 17  75  75  PHE PHE B . n 
B 2 18  ILE 18  76  76  ILE ILE B . n 
B 2 19  THR 19  77  77  THR THR B . n 
B 2 20  GLN 20  78  78  GLN GLN B . n 
B 2 21  LEU 21  79  79  LEU LEU B . n 
B 2 22  GLU 22  80  80  GLU GLU B . n 
B 2 23  ALA 23  81  81  ALA ALA B . n 
B 2 24  PRO 24  82  82  PRO PRO B . n 
B 2 25  VAL 25  83  83  VAL VAL B . n 
B 2 26  GLN 26  84  84  GLN GLN B . n 
B 2 27  ASN 27  85  85  ASN ASN B . n 
B 2 28  ALA 28  86  86  ALA ALA B . n 
B 2 29  GLU 29  87  87  GLU GLU B . n 
B 2 30  GLY 30  88  88  GLY GLY B . n 
B 2 31  ARG 31  89  89  ARG ARG B . n 
B 2 32  GLU 32  90  90  GLU GLU B . n 
B 2 33  ARG 33  91  91  ARG ARG B . n 
B 2 34  LEU 34  92  92  LEU LEU B . n 
B 2 35  MET 35  93  93  MET MET B . n 
B 2 36  ALA 36  94  94  ALA ALA B . n 
B 2 37  VAL 37  95  95  VAL VAL B . n 
B 2 38  LYS 38  96  96  LYS LYS B . n 
B 2 39  PRO 39  97  97  PRO PRO B . n 
B 2 40  GLU 40  98  98  GLU GLU B . n 
B 2 41  TRP 41  99  99  TRP TRP B . n 
B 2 42  LYS 42  100 100 LYS LYS B . n 
# 
loop_
_pdbx_entity_instance_feature.ordinal 
_pdbx_entity_instance_feature.comp_id 
_pdbx_entity_instance_feature.asym_id 
_pdbx_entity_instance_feature.seq_num 
_pdbx_entity_instance_feature.auth_comp_id 
_pdbx_entity_instance_feature.auth_asym_id 
_pdbx_entity_instance_feature.auth_seq_num 
_pdbx_entity_instance_feature.feature_type 
_pdbx_entity_instance_feature.details 
1 ACO ? ? ACO ? ? 'SUBJECT OF INVESTIGATION' ? 
2 PO4 ? ? PO4 ? ? 'SUBJECT OF INVESTIGATION' ? 
# 
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 ACO 1  201 201 ACO ACO A . 
D 4 PO4 1  202 3   PO4 PO4 A . 
E 5 HOH 1  301 31  HOH HOH A . 
E 5 HOH 2  302 43  HOH HOH A . 
E 5 HOH 3  303 47  HOH HOH A . 
E 5 HOH 4  304 27  HOH HOH A . 
E 5 HOH 5  305 37  HOH HOH A . 
E 5 HOH 6  306 4   HOH HOH A . 
E 5 HOH 7  307 23  HOH HOH A . 
E 5 HOH 8  308 25  HOH HOH A . 
E 5 HOH 9  309 2   HOH HOH A . 
E 5 HOH 10 310 33  HOH HOH A . 
E 5 HOH 11 311 13  HOH HOH A . 
E 5 HOH 12 312 5   HOH HOH A . 
E 5 HOH 13 313 36  HOH HOH A . 
E 5 HOH 14 314 19  HOH HOH A . 
E 5 HOH 15 315 3   HOH HOH A . 
E 5 HOH 16 316 45  HOH HOH A . 
E 5 HOH 17 317 21  HOH HOH A . 
E 5 HOH 18 318 6   HOH HOH A . 
E 5 HOH 19 319 22  HOH HOH A . 
E 5 HOH 20 320 20  HOH HOH A . 
E 5 HOH 21 321 10  HOH HOH A . 
E 5 HOH 22 322 48  HOH HOH A . 
E 5 HOH 23 323 34  HOH HOH A . 
E 5 HOH 24 324 29  HOH HOH A . 
E 5 HOH 25 325 46  HOH HOH A . 
E 5 HOH 26 326 12  HOH HOH A . 
E 5 HOH 27 327 7   HOH HOH A . 
E 5 HOH 28 328 15  HOH HOH A . 
E 5 HOH 29 329 35  HOH HOH A . 
E 5 HOH 30 330 11  HOH HOH A . 
E 5 HOH 31 331 17  HOH HOH A . 
E 5 HOH 32 332 44  HOH HOH A . 
E 5 HOH 33 333 18  HOH HOH A . 
E 5 HOH 34 334 49  HOH HOH A . 
E 5 HOH 35 335 42  HOH HOH A . 
E 5 HOH 36 336 40  HOH HOH A . 
E 5 HOH 37 337 26  HOH HOH A . 
E 5 HOH 38 338 41  HOH HOH A . 
E 5 HOH 39 339 38  HOH HOH A . 
E 5 HOH 40 340 14  HOH HOH A . 
E 5 HOH 41 341 28  HOH HOH A . 
F 5 HOH 1  201 16  HOH HOH B . 
F 5 HOH 2  202 8   HOH HOH B . 
F 5 HOH 3  203 9   HOH HOH B . 
F 5 HOH 4  204 24  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 MET 1  ? CG ? A MET 1  CG 
2 1 Y 1 A MET 1  ? SD ? A MET 1  SD 
3 1 Y 1 A MET 1  ? CE ? A MET 1  CE 
4 1 Y 1 B LYS 96 ? CG ? B LYS 38 CG 
5 1 Y 1 B LYS 96 ? CD ? B LYS 38 CD 
6 1 Y 1 B LYS 96 ? CE ? B LYS 38 CE 
7 1 Y 1 B LYS 96 ? NZ ? B LYS 38 NZ 
# 
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'   ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? .           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                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9ILR 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     67.220 
_cell.length_a_esd                 ? 
_cell.length_b                     67.220 
_cell.length_b_esd                 ? 
_cell.length_c                     185.030 
_cell.length_c_esd                 ? 
_cell.volume                       836063.310 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_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                         9ILR 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                96 
_symmetry.space_group_name_Hall            'P 4nw 2abw' 
_symmetry.space_group_name_H-M             'P 43 21 2' 
_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                   9ILR 
_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             4.38 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          71.94 
_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    '1.4-1.9 M KH2PO4 and 0.1 M HEPES pH 7.0.' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            298 
# 
_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         2020-03-27 
_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   0.97918 
_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                        'SSRF BEAMLINE BL19U1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.97918 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   BL19U1 
_diffrn_source.pdbx_synchrotron_site       SSRF 
# 
_reflns.B_iso_Wilson_estimate                          53.81 
_reflns.entry_id                                       9ILR 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.25 
_reflns.d_resolution_low                               37.65 
_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                                     21054 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           99.9 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                24.6 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          15.7 
_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                                   0.998 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.166 
_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                                    2.25 
_reflns_shell.d_res_low                                     2.31 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           2.4 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             1532 
_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                               22.0 
_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                                  0.767 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          99.9 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  2.0 
_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                               62.62 
_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                                 9ILR 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            2.25 
_refine.ls_d_res_low                             33.15 
_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                     20969 
_refine.ls_number_reflns_R_free                  1021 
_refine.ls_number_reflns_R_work                  19948 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.86 
_refine.ls_percent_reflns_R_free                 4.87 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.2090 
_refine.ls_R_factor_R_free                       0.2269 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2082 
_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                          1.36 
_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                      7AK8 
_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                 24.6805 
_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                            0.2379 
_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                       2.25 
_refine_hist.d_res_low                        33.15 
_refine_hist.number_atoms_solvent             45 
_refine_hist.number_atoms_total               1654 
_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        1553 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         56 
_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' ? 0.0092  ? 1654 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 1.2880  ? 2256 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 0.0581  ? 253  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.0152  ? 285  ? f_plane_restr      ? ? 
'X-RAY DIFFRACTION' ? 10.5888 ? 225  ? 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' 2.25 2.37  . . 148 2774 99.90  . . . . 0.2830 . . . . . . . . . . . 0.2908 
'X-RAY DIFFRACTION' 2.37 2.52  . . 159 2763 99.80  . . . . 0.2697 . . . . . . . . . . . 0.2788 
'X-RAY DIFFRACTION' 2.52 2.71  . . 140 2804 99.83  . . . . 0.2651 . . . . . . . . . . . 0.3251 
'X-RAY DIFFRACTION' 2.71 2.98  . . 138 2816 99.90  . . . . 0.2428 . . . . . . . . . . . 0.2792 
'X-RAY DIFFRACTION' 2.98 3.41  . . 149 2846 100.00 . . . . 0.2307 . . . . . . . . . . . 0.2623 
'X-RAY DIFFRACTION' 3.42 4.30  . . 144 2877 100.00 . . . . 0.1861 . . . . . . . . . . . 0.2014 
'X-RAY DIFFRACTION' 4.30 33.15 . . 143 3068 99.60  . . . . 0.1852 . . . . . . . . . . . 0.1894 
# 
_struct.entry_id                     9ILR 
_struct.title                        'The structure of the GmvT-GmvA-AcCoA ternary complex' 
_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        9ILR 
_struct_keywords.text            'Toxin-antitoxin system, GNAT-RHH, acetylation, AcCoA, GmvAT, TOXIN' 
_struct_keywords.pdbx_keywords   TOXIN 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 4 ? 
E N N 5 ? 
F N N 5 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 UNP A0A200L144_SHISO A0A200L144 ? 1 
;MEINVTAPALLTDEHILQPFDCGNEVLSNWLRGRAMKNQMLNASRTFVICLEDTLRIVGYYSLATGSVTHAELGRSLRHN
MPNPVPVVLLGRLAVDVCTQGHGFGKWLLSDAIHRVVNLADQVGIKAVMVHAIDDDARAFYERFGFVQSVVAPNTLFYKV

;
1 
2 PDB 9ILR             9ILR       ? 2 ? 1 
# 
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 9ILR A 1 ? 160 ? A0A200L144 1  ? 160 ? 1  160 
2 2 9ILR B 1 ? 42  ? 9ILR       59 ? 100 ? 59 100 
# 
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 
1 9ILR ARG A 100 ? UNP A0A200L144 GLN 100 'engineered mutation' 100 1 
1 9ILR LEU A 161 ? UNP A0A200L144 ?   ?   'expression tag'      161 2 
1 9ILR GLU A 162 ? UNP A0A200L144 ?   ?   'expression tag'      162 3 
1 9ILR HIS A 163 ? UNP A0A200L144 ?   ?   'expression tag'      163 4 
1 9ILR HIS A 164 ? UNP A0A200L144 ?   ?   'expression tag'      164 5 
1 9ILR HIS A 165 ? UNP A0A200L144 ?   ?   'expression tag'      165 6 
1 9ILR HIS A 166 ? UNP A0A200L144 ?   ?   'expression tag'      166 7 
1 9ILR HIS A 167 ? UNP A0A200L144 ?   ?   'expression tag'      167 8 
1 9ILR HIS A 168 ? UNP A0A200L144 ?   ?   'expression tag'      168 9 
# 
_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)' 4970  ? 
1 MORE         -27   ? 
1 'SSA (A^2)'  10070 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D,E,F 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 ASN A 24  ? ARG A 34  ? ASN A 24  ARG A 34  1 ? 11 
HELX_P HELX_P2 AA2 ARG A 34  ? LEU A 41  ? ARG A 34  LEU A 41  1 ? 8  
HELX_P HELX_P3 AA3 VAL A 97  ? ARG A 100 ? VAL A 97  ARG A 100 5 ? 4  
HELX_P HELX_P4 AA4 GLY A 103 ? ALA A 120 ? GLY A 103 ALA A 120 1 ? 18 
HELX_P HELX_P5 AA5 ASP A 134 ? PHE A 144 ? ASP A 134 PHE A 144 1 ? 11 
HELX_P HELX_P6 AA6 ASP B 10  ? ALA B 23  ? ASP B 68  ALA B 81  1 ? 14 
HELX_P HELX_P7 AA7 ASN B 27  ? VAL B 37  ? ASN B 85  VAL B 95  1 ? 11 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 7 ? 
AA2 ? 4 ? 
# 
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 ? parallel      
AA1 5 6 ? anti-parallel 
AA1 6 7 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? anti-parallel 
AA2 3 4 ? 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 ALA A 9   ? LEU A 10  ? ALA A 9   LEU A 10  
AA1 2 ARG A 45  ? CYS A 50  ? ARG A 45  CYS A 50  
AA1 3 ILE A 57  ? HIS A 70  ? ILE A 57  HIS A 70  
AA1 4 VAL A 85  ? VAL A 95  ? VAL A 85  VAL A 95  
AA1 5 ALA A 127 ? HIS A 131 ? ALA A 127 HIS A 131 
AA1 6 THR A 155 ? LYS A 159 ? THR A 155 LYS A 159 
AA1 7 VAL A 147 ? GLN A 148 ? VAL A 147 GLN A 148 
AA2 1 ALA A 9   ? LEU A 10  ? ALA A 9   LEU A 10  
AA2 2 ARG A 45  ? CYS A 50  ? ARG A 45  CYS A 50  
AA2 3 ILE A 57  ? HIS A 70  ? ILE A 57  HIS A 70  
AA2 4 LEU B 6   ? LEU B 9   ? LEU B 64  LEU B 67  
# 
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 ALA A 9   ? N ALA A 9   O VAL A 48  ? O VAL A 48  
AA1 2 3 N PHE A 47  ? N PHE A 47  O TYR A 61  ? O TYR A 61  
AA1 3 4 N ALA A 64  ? N ALA A 64  O LEU A 89  ? O LEU A 89  
AA1 4 5 N LEU A 90  ? N LEU A 90  O MET A 129 ? O MET A 129 
AA1 5 6 N VAL A 130 ? N VAL A 130 O LEU A 156 ? O LEU A 156 
AA1 6 7 O PHE A 157 ? O PHE A 157 N VAL A 147 ? N VAL A 147 
AA2 1 2 N ALA A 9   ? N ALA A 9   O VAL A 48  ? O VAL A 48  
AA2 2 3 N PHE A 47  ? N PHE A 47  O TYR A 61  ? O TYR A 61  
AA2 3 4 N SER A 67  ? N SER A 67  O PHE B 7   ? O PHE B 65  
# 
_pdbx_entry_details.entry_id                   9ILR 
_pdbx_entry_details.has_ligand_of_interest     Y 
_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   N 
# 
_pdbx_validate_close_contact.id               1 
_pdbx_validate_close_contact.PDB_model_num    1 
_pdbx_validate_close_contact.auth_atom_id_1   OG 
_pdbx_validate_close_contact.auth_asym_id_1   A 
_pdbx_validate_close_contact.auth_comp_id_1   SER 
_pdbx_validate_close_contact.auth_seq_id_1    28 
_pdbx_validate_close_contact.PDB_ins_code_1   ? 
_pdbx_validate_close_contact.label_alt_id_1   ? 
_pdbx_validate_close_contact.auth_atom_id_2   O 
_pdbx_validate_close_contact.auth_asym_id_2   A 
_pdbx_validate_close_contact.auth_comp_id_2   HOH 
_pdbx_validate_close_contact.auth_seq_id_2    301 
_pdbx_validate_close_contact.PDB_ins_code_2   ? 
_pdbx_validate_close_contact.label_alt_id_2   ? 
_pdbx_validate_close_contact.dist             2.19 
# 
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 163 ? ? -56.06 105.96 
2 1 SER B 61  ? ? 53.69  101.78 
# 
_pdbx_validate_planes.id              1 
_pdbx_validate_planes.PDB_model_num   1 
_pdbx_validate_planes.auth_comp_id    ARG 
_pdbx_validate_planes.auth_asym_id    A 
_pdbx_validate_planes.auth_seq_id     45 
_pdbx_validate_planes.PDB_ins_code    ? 
_pdbx_validate_planes.label_alt_id    ? 
_pdbx_validate_planes.rmsd            0.073 
_pdbx_validate_planes.type            'SIDE CHAIN' 
# 
loop_
_space_group_symop.id 
_space_group_symop.operation_xyz 
1 x,y,z               
2 -y+1/2,x+1/2,z+3/4  
3 y+1/2,-x+1/2,z+1/4  
4 x+1/2,-y+1/2,-z+1/4 
5 -x+1/2,y+1/2,-z+3/4 
6 -x,-y,z+1/2         
7 y,x,-z              
8 -y,-x,-z+1/2        
# 
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 A GLY 74  ? A GLY 74  
2  1 Y 1 A ARG 75  ? A ARG 75  
3  1 Y 1 A SER 76  ? A SER 76  
4  1 Y 1 A LEU 77  ? A LEU 77  
5  1 Y 1 A ARG 78  ? A ARG 78  
6  1 Y 1 A HIS 79  ? A HIS 79  
7  1 Y 1 A ASN 80  ? A ASN 80  
8  1 Y 1 A MET 81  ? A MET 81  
9  1 Y 1 A HIS 165 ? A HIS 165 
10 1 Y 1 A HIS 166 ? A HIS 166 
11 1 Y 1 A HIS 167 ? A HIS 167 
12 1 Y 1 A HIS 168 ? A HIS 168 
13 1 Y 1 B MET 59  ? B MET 1   
# 
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 
ACO N1A  N Y N 1   
ACO C2A  C Y N 2   
ACO N3A  N Y N 3   
ACO C4A  C Y N 4   
ACO C5A  C Y N 5   
ACO C6A  C Y N 6   
ACO N6A  N N N 7   
ACO N7A  N Y N 8   
ACO C8A  C Y N 9   
ACO N9A  N Y N 10  
ACO C1B  C N R 11  
ACO C2B  C N R 12  
ACO O2B  O N N 13  
ACO C3B  C N S 14  
ACO O3B  O N N 15  
ACO P3B  P N N 16  
ACO O7A  O N N 17  
ACO O8A  O N N 18  
ACO O9A  O N N 19  
ACO C4B  C N R 20  
ACO O4B  O N N 21  
ACO C5B  C N N 22  
ACO O5B  O N N 23  
ACO P1A  P N S 24  
ACO O1A  O N N 25  
ACO O2A  O N N 26  
ACO O3A  O N N 27  
ACO P2A  P N S 28  
ACO O4A  O N N 29  
ACO O5A  O N N 30  
ACO O6A  O N N 31  
ACO CBP  C N N 32  
ACO CCP  C N N 33  
ACO CDP  C N N 34  
ACO CEP  C N N 35  
ACO CAP  C N R 36  
ACO OAP  O N N 37  
ACO C9P  C N N 38  
ACO O9P  O N N 39  
ACO N8P  N N N 40  
ACO C7P  C N N 41  
ACO C6P  C N N 42  
ACO C5P  C N N 43  
ACO O5P  O N N 44  
ACO N4P  N N N 45  
ACO C3P  C N N 46  
ACO C2P  C N N 47  
ACO S1P  S N N 48  
ACO C    C N N 49  
ACO O    O N N 50  
ACO CH3  C N N 51  
ACO H2A  H N N 52  
ACO H61A H N N 53  
ACO H62A H N N 54  
ACO H8A  H N N 55  
ACO H1B  H N N 56  
ACO H2B  H N N 57  
ACO HO2A H N N 58  
ACO H3B  H N N 59  
ACO HOA8 H N N 60  
ACO HOA9 H N N 61  
ACO H4B  H N N 62  
ACO H51A H N N 63  
ACO H52A H N N 64  
ACO HOA2 H N N 65  
ACO HOA5 H N N 66  
ACO H121 H N N 67  
ACO H122 H N N 68  
ACO H131 H N N 69  
ACO H132 H N N 70  
ACO H133 H N N 71  
ACO H141 H N N 72  
ACO H142 H N N 73  
ACO H143 H N N 74  
ACO H10  H N N 75  
ACO HO1  H N N 76  
ACO HN8  H N N 77  
ACO H71  H N N 78  
ACO H72  H N N 79  
ACO H61  H N N 80  
ACO H62  H N N 81  
ACO HN4  H N N 82  
ACO H31  H N N 83  
ACO H32  H N N 84  
ACO H21  H N N 85  
ACO H22  H N N 86  
ACO HH31 H N N 87  
ACO HH32 H N N 88  
ACO HH33 H N N 89  
ALA N    N N N 90  
ALA CA   C N S 91  
ALA C    C N N 92  
ALA O    O N N 93  
ALA CB   C N N 94  
ALA OXT  O N N 95  
ALA H    H N N 96  
ALA H2   H N N 97  
ALA HA   H N N 98  
ALA HB1  H N N 99  
ALA HB2  H N N 100 
ALA HB3  H N N 101 
ALA HXT  H N N 102 
ARG N    N N N 103 
ARG CA   C N S 104 
ARG C    C N N 105 
ARG O    O N N 106 
ARG CB   C N N 107 
ARG CG   C N N 108 
ARG CD   C N N 109 
ARG NE   N N N 110 
ARG CZ   C N N 111 
ARG NH1  N N N 112 
ARG NH2  N N N 113 
ARG OXT  O N N 114 
ARG H    H N N 115 
ARG H2   H N N 116 
ARG HA   H N N 117 
ARG HB2  H N N 118 
ARG HB3  H N N 119 
ARG HG2  H N N 120 
ARG HG3  H N N 121 
ARG HD2  H N N 122 
ARG HD3  H N N 123 
ARG HE   H N N 124 
ARG HH11 H N N 125 
ARG HH12 H N N 126 
ARG HH21 H N N 127 
ARG HH22 H N N 128 
ARG HXT  H N N 129 
ASN N    N N N 130 
ASN CA   C N S 131 
ASN C    C N N 132 
ASN O    O N N 133 
ASN CB   C N N 134 
ASN CG   C N N 135 
ASN OD1  O N N 136 
ASN ND2  N N N 137 
ASN OXT  O N N 138 
ASN H    H N N 139 
ASN H2   H N N 140 
ASN HA   H N N 141 
ASN HB2  H N N 142 
ASN HB3  H N N 143 
ASN HD21 H N N 144 
ASN HD22 H N N 145 
ASN HXT  H N N 146 
ASP N    N N N 147 
ASP CA   C N S 148 
ASP C    C N N 149 
ASP O    O N N 150 
ASP CB   C N N 151 
ASP CG   C N N 152 
ASP OD1  O N N 153 
ASP OD2  O N N 154 
ASP OXT  O N N 155 
ASP H    H N N 156 
ASP H2   H N N 157 
ASP HA   H N N 158 
ASP HB2  H N N 159 
ASP HB3  H N N 160 
ASP HD2  H N N 161 
ASP HXT  H N N 162 
CYS N    N N N 163 
CYS CA   C N R 164 
CYS C    C N N 165 
CYS O    O N N 166 
CYS CB   C N N 167 
CYS SG   S N N 168 
CYS OXT  O N N 169 
CYS H    H N N 170 
CYS H2   H N N 171 
CYS HA   H N N 172 
CYS HB2  H N N 173 
CYS HB3  H N N 174 
CYS HG   H N N 175 
CYS HXT  H N N 176 
GLN N    N N N 177 
GLN CA   C N S 178 
GLN C    C N N 179 
GLN O    O N N 180 
GLN CB   C N N 181 
GLN CG   C N N 182 
GLN CD   C N N 183 
GLN OE1  O N N 184 
GLN NE2  N N N 185 
GLN OXT  O N N 186 
GLN H    H N N 187 
GLN H2   H N N 188 
GLN HA   H N N 189 
GLN HB2  H N N 190 
GLN HB3  H N N 191 
GLN HG2  H N N 192 
GLN HG3  H N N 193 
GLN HE21 H N N 194 
GLN HE22 H N N 195 
GLN HXT  H N N 196 
GLU N    N N N 197 
GLU CA   C N S 198 
GLU C    C N N 199 
GLU O    O N N 200 
GLU CB   C N N 201 
GLU CG   C N N 202 
GLU CD   C N N 203 
GLU OE1  O N N 204 
GLU OE2  O N N 205 
GLU OXT  O N N 206 
GLU H    H N N 207 
GLU H2   H N N 208 
GLU HA   H N N 209 
GLU HB2  H N N 210 
GLU HB3  H N N 211 
GLU HG2  H N N 212 
GLU HG3  H N N 213 
GLU HE2  H N N 214 
GLU HXT  H N N 215 
GLY N    N N N 216 
GLY CA   C N N 217 
GLY C    C N N 218 
GLY O    O N N 219 
GLY OXT  O N N 220 
GLY H    H N N 221 
GLY H2   H N N 222 
GLY HA2  H N N 223 
GLY HA3  H N N 224 
GLY HXT  H N N 225 
HIS N    N N N 226 
HIS CA   C N S 227 
HIS C    C N N 228 
HIS O    O N N 229 
HIS CB   C N N 230 
HIS CG   C Y N 231 
HIS ND1  N Y N 232 
HIS CD2  C Y N 233 
HIS CE1  C Y N 234 
HIS NE2  N Y N 235 
HIS OXT  O N N 236 
HIS H    H N N 237 
HIS H2   H N N 238 
HIS HA   H N N 239 
HIS HB2  H N N 240 
HIS HB3  H N N 241 
HIS HD1  H N N 242 
HIS HD2  H N N 243 
HIS HE1  H N N 244 
HIS HE2  H N N 245 
HIS HXT  H N N 246 
HOH O    O N N 247 
HOH H1   H N N 248 
HOH H2   H N N 249 
ILE N    N N N 250 
ILE CA   C N S 251 
ILE C    C N N 252 
ILE O    O N N 253 
ILE CB   C N S 254 
ILE CG1  C N N 255 
ILE CG2  C N N 256 
ILE CD1  C N N 257 
ILE OXT  O N N 258 
ILE H    H N N 259 
ILE H2   H N N 260 
ILE HA   H N N 261 
ILE HB   H N N 262 
ILE HG12 H N N 263 
ILE HG13 H N N 264 
ILE HG21 H N N 265 
ILE HG22 H N N 266 
ILE HG23 H N N 267 
ILE HD11 H N N 268 
ILE HD12 H N N 269 
ILE HD13 H N N 270 
ILE HXT  H N N 271 
LEU N    N N N 272 
LEU CA   C N S 273 
LEU C    C N N 274 
LEU O    O N N 275 
LEU CB   C N N 276 
LEU CG   C N N 277 
LEU CD1  C N N 278 
LEU CD2  C N N 279 
LEU OXT  O N N 280 
LEU H    H N N 281 
LEU H2   H N N 282 
LEU HA   H N N 283 
LEU HB2  H N N 284 
LEU HB3  H N N 285 
LEU HG   H N N 286 
LEU HD11 H N N 287 
LEU HD12 H N N 288 
LEU HD13 H N N 289 
LEU HD21 H N N 290 
LEU HD22 H N N 291 
LEU HD23 H N N 292 
LEU HXT  H N N 293 
LYS N    N N N 294 
LYS CA   C N S 295 
LYS C    C N N 296 
LYS O    O N N 297 
LYS CB   C N N 298 
LYS CG   C N N 299 
LYS CD   C N N 300 
LYS CE   C N N 301 
LYS NZ   N N N 302 
LYS OXT  O N N 303 
LYS H    H N N 304 
LYS H2   H N N 305 
LYS HA   H N N 306 
LYS HB2  H N N 307 
LYS HB3  H N N 308 
LYS HG2  H N N 309 
LYS HG3  H N N 310 
LYS HD2  H N N 311 
LYS HD3  H N N 312 
LYS HE2  H N N 313 
LYS HE3  H N N 314 
LYS HZ1  H N N 315 
LYS HZ2  H N N 316 
LYS HZ3  H N N 317 
LYS HXT  H N N 318 
MET N    N N N 319 
MET CA   C N S 320 
MET C    C N N 321 
MET O    O N N 322 
MET CB   C N N 323 
MET CG   C N N 324 
MET SD   S N N 325 
MET CE   C N N 326 
MET OXT  O N N 327 
MET H    H N N 328 
MET H2   H N N 329 
MET HA   H N N 330 
MET HB2  H N N 331 
MET HB3  H N N 332 
MET HG2  H N N 333 
MET HG3  H N N 334 
MET HE1  H N N 335 
MET HE2  H N N 336 
MET HE3  H N N 337 
MET HXT  H N N 338 
PHE N    N N N 339 
PHE CA   C N S 340 
PHE C    C N N 341 
PHE O    O N N 342 
PHE CB   C N N 343 
PHE CG   C Y N 344 
PHE CD1  C Y N 345 
PHE CD2  C Y N 346 
PHE CE1  C Y N 347 
PHE CE2  C Y N 348 
PHE CZ   C Y N 349 
PHE OXT  O N N 350 
PHE H    H N N 351 
PHE H2   H N N 352 
PHE HA   H N N 353 
PHE HB2  H N N 354 
PHE HB3  H N N 355 
PHE HD1  H N N 356 
PHE HD2  H N N 357 
PHE HE1  H N N 358 
PHE HE2  H N N 359 
PHE HZ   H N N 360 
PHE HXT  H N N 361 
PO4 P    P N N 362 
PO4 O1   O N N 363 
PO4 O2   O N N 364 
PO4 O3   O N N 365 
PO4 O4   O N N 366 
PRO N    N N N 367 
PRO CA   C N S 368 
PRO C    C N N 369 
PRO O    O N N 370 
PRO CB   C N N 371 
PRO CG   C N N 372 
PRO CD   C N N 373 
PRO OXT  O N N 374 
PRO H    H N N 375 
PRO HA   H N N 376 
PRO HB2  H N N 377 
PRO HB3  H N N 378 
PRO HG2  H N N 379 
PRO HG3  H N N 380 
PRO HD2  H N N 381 
PRO HD3  H N N 382 
PRO HXT  H N N 383 
SER N    N N N 384 
SER CA   C N S 385 
SER C    C N N 386 
SER O    O N N 387 
SER CB   C N N 388 
SER OG   O N N 389 
SER OXT  O N N 390 
SER H    H N N 391 
SER H2   H N N 392 
SER HA   H N N 393 
SER HB2  H N N 394 
SER HB3  H N N 395 
SER HG   H N N 396 
SER HXT  H N N 397 
THR N    N N N 398 
THR CA   C N S 399 
THR C    C N N 400 
THR O    O N N 401 
THR CB   C N R 402 
THR OG1  O N N 403 
THR CG2  C N N 404 
THR OXT  O N N 405 
THR H    H N N 406 
THR H2   H N N 407 
THR HA   H N N 408 
THR HB   H N N 409 
THR HG1  H N N 410 
THR HG21 H N N 411 
THR HG22 H N N 412 
THR HG23 H N N 413 
THR HXT  H N N 414 
TRP N    N N N 415 
TRP CA   C N S 416 
TRP C    C N N 417 
TRP O    O N N 418 
TRP CB   C N N 419 
TRP CG   C Y N 420 
TRP CD1  C Y N 421 
TRP CD2  C Y N 422 
TRP NE1  N Y N 423 
TRP CE2  C Y N 424 
TRP CE3  C Y N 425 
TRP CZ2  C Y N 426 
TRP CZ3  C Y N 427 
TRP CH2  C Y N 428 
TRP OXT  O N N 429 
TRP H    H N N 430 
TRP H2   H N N 431 
TRP HA   H N N 432 
TRP HB2  H N N 433 
TRP HB3  H N N 434 
TRP HD1  H N N 435 
TRP HE1  H N N 436 
TRP HE3  H N N 437 
TRP HZ2  H N N 438 
TRP HZ3  H N N 439 
TRP HH2  H N N 440 
TRP HXT  H N N 441 
TYR N    N N N 442 
TYR CA   C N S 443 
TYR C    C N N 444 
TYR O    O N N 445 
TYR CB   C N N 446 
TYR CG   C Y N 447 
TYR CD1  C Y N 448 
TYR CD2  C Y N 449 
TYR CE1  C Y N 450 
TYR CE2  C Y N 451 
TYR CZ   C Y N 452 
TYR OH   O N N 453 
TYR OXT  O N N 454 
TYR H    H N N 455 
TYR H2   H N N 456 
TYR HA   H N N 457 
TYR HB2  H N N 458 
TYR HB3  H N N 459 
TYR HD1  H N N 460 
TYR HD2  H N N 461 
TYR HE1  H N N 462 
TYR HE2  H N N 463 
TYR HH   H N N 464 
TYR HXT  H N N 465 
VAL N    N N N 466 
VAL CA   C N S 467 
VAL C    C N N 468 
VAL O    O N N 469 
VAL CB   C N N 470 
VAL CG1  C N N 471 
VAL CG2  C N N 472 
VAL OXT  O N N 473 
VAL H    H N N 474 
VAL H2   H N N 475 
VAL HA   H N N 476 
VAL HB   H N N 477 
VAL HG11 H N N 478 
VAL HG12 H N N 479 
VAL HG13 H N N 480 
VAL HG21 H N N 481 
VAL HG22 H N N 482 
VAL HG23 H N N 483 
VAL HXT  H N N 484 
# 
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 
ACO N1A C2A  sing Y N 1   
ACO N1A C6A  doub Y N 2   
ACO C2A N3A  doub Y N 3   
ACO C2A H2A  sing N N 4   
ACO N3A C4A  sing Y N 5   
ACO C4A C5A  doub Y N 6   
ACO C4A N9A  sing Y N 7   
ACO C5A C6A  sing Y N 8   
ACO C5A N7A  sing Y N 9   
ACO C6A N6A  sing N N 10  
ACO N6A H61A sing N N 11  
ACO N6A H62A sing N N 12  
ACO N7A C8A  doub Y N 13  
ACO C8A N9A  sing Y N 14  
ACO C8A H8A  sing N N 15  
ACO N9A C1B  sing N N 16  
ACO C1B C2B  sing N N 17  
ACO C1B O4B  sing N N 18  
ACO C1B H1B  sing N N 19  
ACO C2B O2B  sing N N 20  
ACO C2B C3B  sing N N 21  
ACO C2B H2B  sing N N 22  
ACO O2B HO2A sing N N 23  
ACO C3B O3B  sing N N 24  
ACO C3B C4B  sing N N 25  
ACO C3B H3B  sing N N 26  
ACO O3B P3B  sing N N 27  
ACO P3B O7A  doub N N 28  
ACO P3B O8A  sing N N 29  
ACO P3B O9A  sing N N 30  
ACO O8A HOA8 sing N N 31  
ACO O9A HOA9 sing N N 32  
ACO C4B O4B  sing N N 33  
ACO C4B C5B  sing N N 34  
ACO C4B H4B  sing N N 35  
ACO C5B O5B  sing N N 36  
ACO C5B H51A sing N N 37  
ACO C5B H52A sing N N 38  
ACO O5B P1A  sing N N 39  
ACO P1A O1A  doub N N 40  
ACO P1A O2A  sing N N 41  
ACO P1A O3A  sing N N 42  
ACO O2A HOA2 sing N N 43  
ACO O3A P2A  sing N N 44  
ACO P2A O4A  doub N N 45  
ACO P2A O5A  sing N N 46  
ACO P2A O6A  sing N N 47  
ACO O5A HOA5 sing N N 48  
ACO O6A CCP  sing N N 49  
ACO CBP CCP  sing N N 50  
ACO CBP CDP  sing N N 51  
ACO CBP CEP  sing N N 52  
ACO CBP CAP  sing N N 53  
ACO CCP H121 sing N N 54  
ACO CCP H122 sing N N 55  
ACO CDP H131 sing N N 56  
ACO CDP H132 sing N N 57  
ACO CDP H133 sing N N 58  
ACO CEP H141 sing N N 59  
ACO CEP H142 sing N N 60  
ACO CEP H143 sing N N 61  
ACO CAP OAP  sing N N 62  
ACO CAP C9P  sing N N 63  
ACO CAP H10  sing N N 64  
ACO OAP HO1  sing N N 65  
ACO C9P O9P  doub N N 66  
ACO C9P N8P  sing N N 67  
ACO N8P C7P  sing N N 68  
ACO N8P HN8  sing N N 69  
ACO C7P C6P  sing N N 70  
ACO C7P H71  sing N N 71  
ACO C7P H72  sing N N 72  
ACO C6P C5P  sing N N 73  
ACO C6P H61  sing N N 74  
ACO C6P H62  sing N N 75  
ACO C5P O5P  doub N N 76  
ACO C5P N4P  sing N N 77  
ACO N4P C3P  sing N N 78  
ACO N4P HN4  sing N N 79  
ACO C3P C2P  sing N N 80  
ACO C3P H31  sing N N 81  
ACO C3P H32  sing N N 82  
ACO C2P S1P  sing N N 83  
ACO C2P H21  sing N N 84  
ACO C2P H22  sing N N 85  
ACO S1P C    sing N N 86  
ACO C   O    doub N N 87  
ACO C   CH3  sing N N 88  
ACO CH3 HH31 sing N N 89  
ACO CH3 HH32 sing N N 90  
ACO CH3 HH33 sing N N 91  
ALA N   CA   sing N N 92  
ALA N   H    sing N N 93  
ALA N   H2   sing N N 94  
ALA CA  C    sing N N 95  
ALA CA  CB   sing N N 96  
ALA CA  HA   sing N N 97  
ALA C   O    doub N N 98  
ALA C   OXT  sing N N 99  
ALA CB  HB1  sing N N 100 
ALA CB  HB2  sing N N 101 
ALA CB  HB3  sing N N 102 
ALA OXT HXT  sing N N 103 
ARG N   CA   sing N N 104 
ARG N   H    sing N N 105 
ARG N   H2   sing N N 106 
ARG CA  C    sing N N 107 
ARG CA  CB   sing N N 108 
ARG CA  HA   sing N N 109 
ARG C   O    doub N N 110 
ARG C   OXT  sing N N 111 
ARG CB  CG   sing N N 112 
ARG CB  HB2  sing N N 113 
ARG CB  HB3  sing N N 114 
ARG CG  CD   sing N N 115 
ARG CG  HG2  sing N N 116 
ARG CG  HG3  sing N N 117 
ARG CD  NE   sing N N 118 
ARG CD  HD2  sing N N 119 
ARG CD  HD3  sing N N 120 
ARG NE  CZ   sing N N 121 
ARG NE  HE   sing N N 122 
ARG CZ  NH1  sing N N 123 
ARG CZ  NH2  doub N N 124 
ARG NH1 HH11 sing N N 125 
ARG NH1 HH12 sing N N 126 
ARG NH2 HH21 sing N N 127 
ARG NH2 HH22 sing N N 128 
ARG OXT HXT  sing N N 129 
ASN N   CA   sing N N 130 
ASN N   H    sing N N 131 
ASN N   H2   sing N N 132 
ASN CA  C    sing N N 133 
ASN CA  CB   sing N N 134 
ASN CA  HA   sing N N 135 
ASN C   O    doub N N 136 
ASN C   OXT  sing N N 137 
ASN CB  CG   sing N N 138 
ASN CB  HB2  sing N N 139 
ASN CB  HB3  sing N N 140 
ASN CG  OD1  doub N N 141 
ASN CG  ND2  sing N N 142 
ASN ND2 HD21 sing N N 143 
ASN ND2 HD22 sing N N 144 
ASN OXT HXT  sing N N 145 
ASP N   CA   sing N N 146 
ASP N   H    sing N N 147 
ASP N   H2   sing N N 148 
ASP CA  C    sing N N 149 
ASP CA  CB   sing N N 150 
ASP CA  HA   sing N N 151 
ASP C   O    doub N N 152 
ASP C   OXT  sing N N 153 
ASP CB  CG   sing N N 154 
ASP CB  HB2  sing N N 155 
ASP CB  HB3  sing N N 156 
ASP CG  OD1  doub N N 157 
ASP CG  OD2  sing N N 158 
ASP OD2 HD2  sing N N 159 
ASP OXT HXT  sing N N 160 
CYS N   CA   sing N N 161 
CYS N   H    sing N N 162 
CYS N   H2   sing N N 163 
CYS CA  C    sing N N 164 
CYS CA  CB   sing N N 165 
CYS CA  HA   sing N N 166 
CYS C   O    doub N N 167 
CYS C   OXT  sing N N 168 
CYS CB  SG   sing N N 169 
CYS CB  HB2  sing N N 170 
CYS CB  HB3  sing N N 171 
CYS SG  HG   sing N N 172 
CYS OXT HXT  sing N N 173 
GLN N   CA   sing N N 174 
GLN N   H    sing N N 175 
GLN N   H2   sing N N 176 
GLN CA  C    sing N N 177 
GLN CA  CB   sing N N 178 
GLN CA  HA   sing N N 179 
GLN C   O    doub N N 180 
GLN C   OXT  sing N N 181 
GLN CB  CG   sing N N 182 
GLN CB  HB2  sing N N 183 
GLN CB  HB3  sing N N 184 
GLN CG  CD   sing N N 185 
GLN CG  HG2  sing N N 186 
GLN CG  HG3  sing N N 187 
GLN CD  OE1  doub N N 188 
GLN CD  NE2  sing N N 189 
GLN NE2 HE21 sing N N 190 
GLN NE2 HE22 sing N N 191 
GLN OXT HXT  sing N N 192 
GLU N   CA   sing N N 193 
GLU N   H    sing N N 194 
GLU N   H2   sing N N 195 
GLU CA  C    sing N N 196 
GLU CA  CB   sing N N 197 
GLU CA  HA   sing N N 198 
GLU C   O    doub N N 199 
GLU C   OXT  sing N N 200 
GLU CB  CG   sing N N 201 
GLU CB  HB2  sing N N 202 
GLU CB  HB3  sing N N 203 
GLU CG  CD   sing N N 204 
GLU CG  HG2  sing N N 205 
GLU CG  HG3  sing N N 206 
GLU CD  OE1  doub N N 207 
GLU CD  OE2  sing N N 208 
GLU OE2 HE2  sing N N 209 
GLU OXT HXT  sing N N 210 
GLY N   CA   sing N N 211 
GLY N   H    sing N N 212 
GLY N   H2   sing N N 213 
GLY CA  C    sing N N 214 
GLY CA  HA2  sing N N 215 
GLY CA  HA3  sing N N 216 
GLY C   O    doub N N 217 
GLY C   OXT  sing N N 218 
GLY OXT HXT  sing N N 219 
HIS N   CA   sing N N 220 
HIS N   H    sing N N 221 
HIS N   H2   sing N N 222 
HIS CA  C    sing N N 223 
HIS CA  CB   sing N N 224 
HIS CA  HA   sing N N 225 
HIS C   O    doub N N 226 
HIS C   OXT  sing N N 227 
HIS CB  CG   sing N N 228 
HIS CB  HB2  sing N N 229 
HIS CB  HB3  sing N N 230 
HIS CG  ND1  sing Y N 231 
HIS CG  CD2  doub Y N 232 
HIS ND1 CE1  doub Y N 233 
HIS ND1 HD1  sing N N 234 
HIS CD2 NE2  sing Y N 235 
HIS CD2 HD2  sing N N 236 
HIS CE1 NE2  sing Y N 237 
HIS CE1 HE1  sing N N 238 
HIS NE2 HE2  sing N N 239 
HIS OXT HXT  sing N N 240 
HOH O   H1   sing N N 241 
HOH O   H2   sing N N 242 
ILE N   CA   sing N N 243 
ILE N   H    sing N N 244 
ILE N   H2   sing N N 245 
ILE CA  C    sing N N 246 
ILE CA  CB   sing N N 247 
ILE CA  HA   sing N N 248 
ILE C   O    doub N N 249 
ILE C   OXT  sing N N 250 
ILE CB  CG1  sing N N 251 
ILE CB  CG2  sing N N 252 
ILE CB  HB   sing N N 253 
ILE CG1 CD1  sing N N 254 
ILE CG1 HG12 sing N N 255 
ILE CG1 HG13 sing N N 256 
ILE CG2 HG21 sing N N 257 
ILE CG2 HG22 sing N N 258 
ILE CG2 HG23 sing N N 259 
ILE CD1 HD11 sing N N 260 
ILE CD1 HD12 sing N N 261 
ILE CD1 HD13 sing N N 262 
ILE OXT HXT  sing N N 263 
LEU N   CA   sing N N 264 
LEU N   H    sing N N 265 
LEU N   H2   sing N N 266 
LEU CA  C    sing N N 267 
LEU CA  CB   sing N N 268 
LEU CA  HA   sing N N 269 
LEU C   O    doub N N 270 
LEU C   OXT  sing N N 271 
LEU CB  CG   sing N N 272 
LEU CB  HB2  sing N N 273 
LEU CB  HB3  sing N N 274 
LEU CG  CD1  sing N N 275 
LEU CG  CD2  sing N N 276 
LEU CG  HG   sing N N 277 
LEU CD1 HD11 sing N N 278 
LEU CD1 HD12 sing N N 279 
LEU CD1 HD13 sing N N 280 
LEU CD2 HD21 sing N N 281 
LEU CD2 HD22 sing N N 282 
LEU CD2 HD23 sing N N 283 
LEU OXT HXT  sing N N 284 
LYS N   CA   sing N N 285 
LYS N   H    sing N N 286 
LYS N   H2   sing N N 287 
LYS CA  C    sing N N 288 
LYS CA  CB   sing N N 289 
LYS CA  HA   sing N N 290 
LYS C   O    doub N N 291 
LYS C   OXT  sing N N 292 
LYS CB  CG   sing N N 293 
LYS CB  HB2  sing N N 294 
LYS CB  HB3  sing N N 295 
LYS CG  CD   sing N N 296 
LYS CG  HG2  sing N N 297 
LYS CG  HG3  sing N N 298 
LYS CD  CE   sing N N 299 
LYS CD  HD2  sing N N 300 
LYS CD  HD3  sing N N 301 
LYS CE  NZ   sing N N 302 
LYS CE  HE2  sing N N 303 
LYS CE  HE3  sing N N 304 
LYS NZ  HZ1  sing N N 305 
LYS NZ  HZ2  sing N N 306 
LYS NZ  HZ3  sing N N 307 
LYS OXT HXT  sing N N 308 
MET N   CA   sing N N 309 
MET N   H    sing N N 310 
MET N   H2   sing N N 311 
MET CA  C    sing N N 312 
MET CA  CB   sing N N 313 
MET CA  HA   sing N N 314 
MET C   O    doub N N 315 
MET C   OXT  sing N N 316 
MET CB  CG   sing N N 317 
MET CB  HB2  sing N N 318 
MET CB  HB3  sing N N 319 
MET CG  SD   sing N N 320 
MET CG  HG2  sing N N 321 
MET CG  HG3  sing N N 322 
MET SD  CE   sing N N 323 
MET CE  HE1  sing N N 324 
MET CE  HE2  sing N N 325 
MET CE  HE3  sing N N 326 
MET OXT HXT  sing N N 327 
PHE N   CA   sing N N 328 
PHE N   H    sing N N 329 
PHE N   H2   sing N N 330 
PHE CA  C    sing N N 331 
PHE CA  CB   sing N N 332 
PHE CA  HA   sing N N 333 
PHE C   O    doub N N 334 
PHE C   OXT  sing N N 335 
PHE CB  CG   sing N N 336 
PHE CB  HB2  sing N N 337 
PHE CB  HB3  sing N N 338 
PHE CG  CD1  doub Y N 339 
PHE CG  CD2  sing Y N 340 
PHE CD1 CE1  sing Y N 341 
PHE CD1 HD1  sing N N 342 
PHE CD2 CE2  doub Y N 343 
PHE CD2 HD2  sing N N 344 
PHE CE1 CZ   doub Y N 345 
PHE CE1 HE1  sing N N 346 
PHE CE2 CZ   sing Y N 347 
PHE CE2 HE2  sing N N 348 
PHE CZ  HZ   sing N N 349 
PHE OXT HXT  sing N N 350 
PO4 P   O1   doub N N 351 
PO4 P   O2   sing N N 352 
PO4 P   O3   sing N N 353 
PO4 P   O4   sing N N 354 
PRO N   CA   sing N N 355 
PRO N   CD   sing N N 356 
PRO N   H    sing N N 357 
PRO CA  C    sing N N 358 
PRO CA  CB   sing N N 359 
PRO CA  HA   sing N N 360 
PRO C   O    doub N N 361 
PRO C   OXT  sing N N 362 
PRO CB  CG   sing N N 363 
PRO CB  HB2  sing N N 364 
PRO CB  HB3  sing N N 365 
PRO CG  CD   sing N N 366 
PRO CG  HG2  sing N N 367 
PRO CG  HG3  sing N N 368 
PRO CD  HD2  sing N N 369 
PRO CD  HD3  sing N N 370 
PRO OXT HXT  sing N N 371 
SER N   CA   sing N N 372 
SER N   H    sing N N 373 
SER N   H2   sing N N 374 
SER CA  C    sing N N 375 
SER CA  CB   sing N N 376 
SER CA  HA   sing N N 377 
SER C   O    doub N N 378 
SER C   OXT  sing N N 379 
SER CB  OG   sing N N 380 
SER CB  HB2  sing N N 381 
SER CB  HB3  sing N N 382 
SER OG  HG   sing N N 383 
SER OXT HXT  sing N N 384 
THR N   CA   sing N N 385 
THR N   H    sing N N 386 
THR N   H2   sing N N 387 
THR CA  C    sing N N 388 
THR CA  CB   sing N N 389 
THR CA  HA   sing N N 390 
THR C   O    doub N N 391 
THR C   OXT  sing N N 392 
THR CB  OG1  sing N N 393 
THR CB  CG2  sing N N 394 
THR CB  HB   sing N N 395 
THR OG1 HG1  sing N N 396 
THR CG2 HG21 sing N N 397 
THR CG2 HG22 sing N N 398 
THR CG2 HG23 sing N N 399 
THR OXT HXT  sing N N 400 
TRP N   CA   sing N N 401 
TRP N   H    sing N N 402 
TRP N   H2   sing N N 403 
TRP CA  C    sing N N 404 
TRP CA  CB   sing N N 405 
TRP CA  HA   sing N N 406 
TRP C   O    doub N N 407 
TRP C   OXT  sing N N 408 
TRP CB  CG   sing N N 409 
TRP CB  HB2  sing N N 410 
TRP CB  HB3  sing N N 411 
TRP CG  CD1  doub Y N 412 
TRP CG  CD2  sing Y N 413 
TRP CD1 NE1  sing Y N 414 
TRP CD1 HD1  sing N N 415 
TRP CD2 CE2  doub Y N 416 
TRP CD2 CE3  sing Y N 417 
TRP NE1 CE2  sing Y N 418 
TRP NE1 HE1  sing N N 419 
TRP CE2 CZ2  sing Y N 420 
TRP CE3 CZ3  doub Y N 421 
TRP CE3 HE3  sing N N 422 
TRP CZ2 CH2  doub Y N 423 
TRP CZ2 HZ2  sing N N 424 
TRP CZ3 CH2  sing Y N 425 
TRP CZ3 HZ3  sing N N 426 
TRP CH2 HH2  sing N N 427 
TRP OXT HXT  sing N N 428 
TYR N   CA   sing N N 429 
TYR N   H    sing N N 430 
TYR N   H2   sing N N 431 
TYR CA  C    sing N N 432 
TYR CA  CB   sing N N 433 
TYR CA  HA   sing N N 434 
TYR C   O    doub N N 435 
TYR C   OXT  sing N N 436 
TYR CB  CG   sing N N 437 
TYR CB  HB2  sing N N 438 
TYR CB  HB3  sing N N 439 
TYR CG  CD1  doub Y N 440 
TYR CG  CD2  sing Y N 441 
TYR CD1 CE1  sing Y N 442 
TYR CD1 HD1  sing N N 443 
TYR CD2 CE2  doub Y N 444 
TYR CD2 HD2  sing N N 445 
TYR CE1 CZ   doub Y N 446 
TYR CE1 HE1  sing N N 447 
TYR CE2 CZ   sing Y N 448 
TYR CE2 HE2  sing N N 449 
TYR CZ  OH   sing N N 450 
TYR OH  HH   sing N N 451 
TYR OXT HXT  sing N N 452 
VAL N   CA   sing N N 453 
VAL N   H    sing N N 454 
VAL N   H2   sing N N 455 
VAL CA  C    sing N N 456 
VAL CA  CB   sing N N 457 
VAL CA  HA   sing N N 458 
VAL C   O    doub N N 459 
VAL C   OXT  sing N N 460 
VAL CB  CG1  sing N N 461 
VAL CB  CG2  sing N N 462 
VAL CB  HB   sing N N 463 
VAL CG1 HG11 sing N N 464 
VAL CG1 HG12 sing N N 465 
VAL CG1 HG13 sing N N 466 
VAL CG2 HG21 sing N N 467 
VAL CG2 HG22 sing N N 468 
VAL CG2 HG23 sing N N 469 
VAL OXT HXT  sing N N 470 
# 
_pdbx_audit_support.funding_organization   'National Natural Science Foundation of China (NSFC)' 
_pdbx_audit_support.country                China 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_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   7AK8 
_pdbx_initial_refinement_model.details          ? 
# 
_space_group.name_H-M_alt     'P 43 21 2' 
_space_group.name_Hall        'P 4nw 2abw' 
_space_group.IT_number        96 
_space_group.crystal_system   tetragonal 
_space_group.id               1 
# 
_atom_sites.entry_id                    9ILR 
_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]   0.014877 
_atom_sites.fract_transf_matrix[1][2]   0.000000 
_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]   0.014877 
_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]   0.005405 
_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.
;
? 
P ? ? 9.51135 5.44231 ? ? 1.42069  35.72801 ? ? 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   . MET A 1 1   ? -9.52011  -6.61914  13.65585 1.000 114.12484 ? 1   MET A N   1 
ATOM   2    C CA  . MET A 1 1   ? -10.63968 -6.23302  14.50672 1.000 110.38455 ? 1   MET A CA  1 
ATOM   3    C C   . MET A 1 1   ? -10.11606 -5.55589  15.76745 1.000 109.36966 ? 1   MET A C   1 
ATOM   4    O O   . MET A 1 1   ? -9.02029  -5.87570  16.22855 1.000 105.35567 ? 1   MET A O   1 
ATOM   5    C CB  . MET A 1 1   ? -11.49450 -7.45427  14.86555 1.000 87.54601  ? 1   MET A CB  1 
ATOM   6    N N   . GLU A 1 2   ? -10.88615 -4.60936  16.31129 1.000 119.18239 ? 2   GLU A N   1 
ATOM   7    C CA  . GLU A 1 2   ? -10.55319 -4.01244  17.60215 1.000 109.56785 ? 2   GLU A CA  1 
ATOM   8    C C   . GLU A 1 2   ? -10.82828 -5.02773  18.70489 1.000 107.18011 ? 2   GLU A C   1 
ATOM   9    O O   . GLU A 1 2   ? -11.97470 -5.44751  18.90877 1.000 97.69092  ? 2   GLU A O   1 
ATOM   10   C CB  . GLU A 1 2   ? -11.35558 -2.73278  17.83568 1.000 103.78833 ? 2   GLU A CB  1 
ATOM   11   C CG  . GLU A 1 2   ? -11.50835 -2.31706  19.30314 1.000 114.71239 ? 2   GLU A CG  1 
ATOM   12   C CD  . GLU A 1 2   ? -10.29020 -1.58078  19.84714 1.000 118.46948 ? 2   GLU A CD  1 
ATOM   13   O OE1 . GLU A 1 2   ? -9.37158  -2.24139  20.37523 1.000 114.37342 ? 2   GLU A OE1 1 
ATOM   14   O OE2 . GLU A 1 2   ? -10.25577 -0.33489  19.75535 1.000 120.48016 ? 2   GLU A OE2 1 
ATOM   15   N N   . ILE A 1 3   ? -9.76856  -5.44076  19.39319 1.000 92.90966  ? 3   ILE A N   1 
ATOM   16   C CA  . ILE A 1 3   ? -9.84017  -6.41126  20.47658 1.000 79.02389  ? 3   ILE A CA  1 
ATOM   17   C C   . ILE A 1 3   ? -9.48546  -5.68148  21.76349 1.000 71.97457  ? 3   ILE A C   1 
ATOM   18   O O   . ILE A 1 3   ? -8.47564  -4.97065  21.81799 1.000 70.82612  ? 3   ILE A O   1 
ATOM   19   C CB  . ILE A 1 3   ? -8.90272  -7.60444  20.21288 1.000 76.96970  ? 3   ILE A CB  1 
ATOM   20   C CG1 . ILE A 1 3   ? -9.50486  -8.53796  19.15713 1.000 82.84194  ? 3   ILE A CG1 1 
ATOM   21   C CG2 . ILE A 1 3   ? -8.64599  -8.37968  21.47422 1.000 66.93040  ? 3   ILE A CG2 1 
ATOM   22   C CD1 . ILE A 1 3   ? -8.48724  -9.45925  18.48620 1.000 73.43742  ? 3   ILE A CD1 1 
ATOM   23   N N   . ASN A 1 4   ? -10.33530 -5.81581  22.77842 1.000 59.54090  ? 4   ASN A N   1 
ATOM   24   C CA  . ASN A 1 4   ? -10.12003 -5.18111  24.07248 1.000 66.39612  ? 4   ASN A CA  1 
ATOM   25   C C   . ASN A 1 4   ? -9.83250  -6.23419  25.12713 1.000 58.40915  ? 4   ASN A C   1 
ATOM   26   O O   . ASN A 1 4   ? -10.44083 -7.31153  25.12146 1.000 56.88612  ? 4   ASN A O   1 
ATOM   27   C CB  . ASN A 1 4   ? -11.33204 -4.36454  24.49244 1.000 80.19533  ? 4   ASN A CB  1 
ATOM   28   C CG  . ASN A 1 4   ? -11.50914 -3.13528  23.65226 1.000 84.26349  ? 4   ASN A CG  1 
ATOM   29   O OD1 . ASN A 1 4   ? -10.56506 -2.38130  23.43341 1.000 80.74612  ? 4   ASN A OD1 1 
ATOM   30   N ND2 . ASN A 1 4   ? -12.72547 -2.91684  23.18020 1.000 71.49660  ? 4   ASN A ND2 1 
ATOM   31   N N   . VAL A 1 5   ? -8.91376  -5.91496  26.04180 1.000 56.99516  ? 5   VAL A N   1 
ATOM   32   C CA  . VAL A 1 5   ? -8.46678  -6.86321  27.05407 1.000 57.08612  ? 5   VAL A CA  1 
ATOM   33   C C   . VAL A 1 5   ? -8.47786  -6.20753  28.42385 1.000 50.78397  ? 5   VAL A C   1 
ATOM   34   O O   . VAL A 1 5   ? -8.24581  -5.00191  28.57281 1.000 55.51612  ? 5   VAL A O   1 
ATOM   35   C CB  . VAL A 1 5   ? -7.05714  -7.43327  26.76633 1.000 56.22517  ? 5   VAL A CB  1 
ATOM   36   C CG1 . VAL A 1 5   ? -7.07569  -8.33586  25.56143 1.000 55.13612  ? 5   VAL A CG1 1 
ATOM   37   C CG2 . VAL A 1 5   ? -6.05036  -6.30658  26.58554 1.000 61.37615  ? 5   VAL A CG2 1 
ATOM   38   N N   . THR A 1 6   ? -8.71013  -7.03644  29.43095 1.000 47.45336  ? 6   THR A N   1 
ATOM   39   C CA  . THR A 1 6   ? -8.75013  -6.61319  30.82016 1.000 58.48641  ? 6   THR A CA  1 
ATOM   40   C C   . THR A 1 6   ? -7.34312  -6.46495  31.37111 1.000 55.27827  ? 6   THR A C   1 
ATOM   41   O O   . THR A 1 6   ? -6.39310  -7.07568  30.87929 1.000 55.12612  ? 6   THR A O   1 
ATOM   42   C CB  . THR A 1 6   ? -9.51180  -7.62718  31.66219 1.000 61.25612  ? 6   THR A CB  1 
ATOM   43   O OG1 . THR A 1 6   ? -8.91190  -8.92332  31.48961 1.000 56.14612  ? 6   THR A OG1 1 
ATOM   44   C CG2 . THR A 1 6   ? -10.96334 -7.67082  31.21852 1.000 47.06612  ? 6   THR A CG2 1 
ATOM   45   N N   . ALA A 1 7   ? -7.22664  -5.66031  32.42872 1.000 60.70049  ? 7   ALA A N   1 
ATOM   46   C CA  . ALA A 1 7   ? -5.92982  -5.42407  33.04537 1.000 58.34045  ? 7   ALA A CA  1 
ATOM   47   C C   . ALA A 1 7   ? -5.36655  -6.71819  33.63175 1.000 55.28612  ? 7   ALA A C   1 
ATOM   48   O O   . ALA A 1 7   ? -6.12105  -7.61220  34.03249 1.000 54.71612  ? 7   ALA A O   1 
ATOM   49   C CB  . ALA A 1 7   ? -6.03071  -4.35949  34.12953 1.000 45.79612  ? 7   ALA A CB  1 
ATOM   50   N N   . PRO A 1 8   ? -4.03888  -6.85116  33.64999 1.000 49.09462  ? 8   PRO A N   1 
ATOM   51   C CA  . PRO A 1 8   ? -3.40425  -8.06036  34.20020 1.000 59.82612  ? 8   PRO A CA  1 
ATOM   52   C C   . PRO A 1 8   ? -3.81795  -8.31398  35.64203 1.000 54.35556  ? 8   PRO A C   1 
ATOM   53   O O   . PRO A 1 8   ? -3.75726  -7.42693  36.49157 1.000 62.26612  ? 8   PRO A O   1 
ATOM   54   C CB  . PRO A 1 8   ? -1.91123  -7.74847  34.09882 1.000 46.48612  ? 8   PRO A CB  1 
ATOM   55   C CG  . PRO A 1 8   ? -1.82891  -6.77667  32.97519 1.000 51.80846  ? 8   PRO A CG  1 
ATOM   56   C CD  . PRO A 1 8   ? -3.05200  -5.91980  33.08733 1.000 48.19194  ? 8   PRO A CD  1 
ATOM   57   N N   . ALA A 1 9   ? -4.22361  -9.54921  35.90173 1.000 44.62612  ? 9   ALA A N   1 
ATOM   58   C CA  . ALA A 1 9   ? -4.81834  -9.94977  37.15431 1.000 48.28612  ? 9   ALA A CA  1 
ATOM   59   C C   . ALA A 1 9   ? -4.30139  -11.33856 37.46215 1.000 54.02382  ? 9   ALA A C   1 
ATOM   60   O O   . ALA A 1 9   ? -3.94713  -12.09444 36.55449 1.000 47.81612  ? 9   ALA A O   1 
ATOM   61   C CB  . ALA A 1 9   ? -6.35245  -9.94973  37.08188 1.000 50.17612  ? 9   ALA A CB  1 
ATOM   62   N N   . LEU A 1 10  ? -4.24634  -11.66247 38.75236 1.000 39.95612  ? 10  LEU A N   1 
ATOM   63   C CA  . LEU A 1 10  ? -3.74614  -12.95882 39.15778 1.000 40.53612  ? 10  LEU A CA  1 
ATOM   64   C C   . LEU A 1 10  ? -4.65631  -14.03979 38.61685 1.000 46.94612  ? 10  LEU A C   1 
ATOM   65   O O   . LEU A 1 10  ? -5.87847  -13.90806 38.62854 1.000 47.78612  ? 10  LEU A O   1 
ATOM   66   C CB  . LEU A 1 10  ? -3.64805  -13.06727 40.68900 1.000 44.09612  ? 10  LEU A CB  1 
ATOM   67   C CG  . LEU A 1 10  ? -2.40060  -12.47805 41.35548 1.000 47.54612  ? 10  LEU A CG  1 
ATOM   68   C CD1 . LEU A 1 10  ? -2.43575  -12.64819 42.85926 1.000 57.58807  ? 10  LEU A CD1 1 
ATOM   69   C CD2 . LEU A 1 10  ? -1.14194  -13.10446 40.80708 1.000 39.11023  ? 10  LEU A CD2 1 
ATOM   70   N N   . LEU A 1 11  ? -4.04378  -15.10335 38.12520 1.000 38.11612  ? 11  LEU A N   1 
ATOM   71   C CA  . LEU A 1 11  ? -4.78389  -16.25420 37.64118 1.000 43.51612  ? 11  LEU A CA  1 
ATOM   72   C C   . LEU A 1 11  ? -5.53642  -16.89817 38.79454 1.000 57.79612  ? 11  LEU A C   1 
ATOM   73   O O   . LEU A 1 11  ? -4.97055  -17.12892 39.86650 1.000 50.06222  ? 11  LEU A O   1 
ATOM   74   C CB  . LEU A 1 11  ? -3.81645  -17.25201 37.01227 1.000 44.31612  ? 11  LEU A CB  1 
ATOM   75   C CG  . LEU A 1 11  ? -4.37456  -18.58682 36.54389 1.000 50.18612  ? 11  LEU A CG  1 
ATOM   76   C CD1 . LEU A 1 11  ? -5.24114  -18.39203 35.31283 1.000 48.69612  ? 11  LEU A CD1 1 
ATOM   77   C CD2 . LEU A 1 11  ? -3.24793  -19.57299 36.28086 1.000 42.79612  ? 11  LEU A CD2 1 
ATOM   78   N N   . THR A 1 12  ? -6.81494  -17.18310 38.58028 1.000 51.50612  ? 12  THR A N   1 
ATOM   79   C CA  . THR A 1 12  ? -7.62269  -17.92609 39.54778 1.000 51.78481  ? 12  THR A CA  1 
ATOM   80   C C   . THR A 1 12  ? -8.16969  -19.18682 38.89164 1.000 55.99928  ? 12  THR A C   1 
ATOM   81   O O   . THR A 1 12  ? -7.91371  -19.47065 37.71727 1.000 57.59699  ? 12  THR A O   1 
ATOM   82   C CB  . THR A 1 12  ? -8.78582  -17.09353 40.09865 1.000 58.94612  ? 12  THR A CB  1 
ATOM   83   O OG1 . THR A 1 12  ? -9.92101  -17.25077 39.24095 1.000 72.45612  ? 12  THR A OG1 1 
ATOM   84   C CG2 . THR A 1 12  ? -8.42580  -15.62279 40.21068 1.000 59.22612  ? 12  THR A CG2 1 
ATOM   85   N N   . ASP A 1 13  ? -8.96253  -19.93216 39.66044 1.000 57.14212  ? 13  ASP A N   1 
ATOM   86   C CA  . ASP A 1 13  ? -9.60968  -21.13424 39.14746 1.000 64.68311  ? 13  ASP A CA  1 
ATOM   87   C C   . ASP A 1 13  ? -10.78413 -20.83956 38.21618 1.000 61.71364  ? 13  ASP A C   1 
ATOM   88   O O   . ASP A 1 13  ? -11.21834 -21.74261 37.49394 1.000 58.96612  ? 13  ASP A O   1 
ATOM   89   C CB  . ASP A 1 13  ? -10.07284 -22.00534 40.30976 1.000 66.57603  ? 13  ASP A CB  1 
ATOM   90   C CG  . ASP A 1 13  ? -9.18527  -23.22239 40.50748 1.000 99.78695  ? 13  ASP A CG  1 
ATOM   91   O OD1 . ASP A 1 13  ? -8.77492  -23.82950 39.49097 1.000 97.42638  ? 13  ASP A OD1 1 
ATOM   92   O OD2 . ASP A 1 13  ? -8.89187  -23.56777 41.67732 1.000 109.49593 ? 13  ASP A OD2 1 
ATOM   93   N N   . GLU A 1 14  ? -11.28825 -19.60594 38.19246 1.000 62.82612  ? 14  GLU A N   1 
ATOM   94   C CA  . GLU A 1 14  ? -12.42333 -19.27056 37.33807 1.000 73.99839  ? 14  GLU A CA  1 
ATOM   95   C C   . GLU A 1 14  ? -12.01929 -18.92688 35.90324 1.000 70.31612  ? 14  GLU A C   1 
ATOM   96   O O   . GLU A 1 14  ? -12.88142 -18.89292 35.02266 1.000 66.38331  ? 14  GLU A O   1 
ATOM   97   C CB  . GLU A 1 14  ? -13.19063 -18.09680 37.94862 1.000 74.34066  ? 14  GLU A CB  1 
ATOM   98   C CG  . GLU A 1 14  ? -14.47508 -18.49899 38.65753 1.000 102.41317 ? 14  GLU A CG  1 
ATOM   99   C CD  . GLU A 1 14  ? -15.47376 -17.35553 38.75431 1.000 118.21787 ? 14  GLU A CD  1 
ATOM   100  O OE1 . GLU A 1 14  ? -16.65845 -17.57182 38.40983 1.000 123.37751 ? 14  GLU A OE1 1 
ATOM   101  O OE2 . GLU A 1 14  ? -15.07032 -16.24098 39.15941 1.000 112.81338 ? 14  GLU A OE2 1 
ATOM   102  N N   . HIS A 1 15  ? -10.74138 -18.65747 35.65378 1.000 57.55612  ? 15  HIS A N   1 
ATOM   103  C CA  . HIS A 1 15  ? -10.27443 -18.30770 34.32082 1.000 55.75966  ? 15  HIS A CA  1 
ATOM   104  C C   . HIS A 1 15  ? -10.31486 -19.52361 33.40484 1.000 45.96077  ? 15  HIS A C   1 
ATOM   105  O O   . HIS A 1 15  ? -10.14532 -20.66914 33.84059 1.000 58.58612  ? 15  HIS A O   1 
ATOM   106  C CB  . HIS A 1 15  ? -8.85790  -17.74850 34.38904 1.000 43.02883  ? 15  HIS A CB  1 
ATOM   107  C CG  . HIS A 1 15  ? -8.79190  -16.33238 34.85187 1.000 50.39497  ? 15  HIS A CG  1 
ATOM   108  N ND1 . HIS A 1 15  ? -8.30546  -15.97550 36.09240 1.000 43.06612  ? 15  HIS A ND1 1 
ATOM   109  C CD2 . HIS A 1 15  ? -9.17196  -15.18349 34.25156 1.000 45.19820  ? 15  HIS A CD2 1 
ATOM   110  C CE1 . HIS A 1 15  ? -8.37437  -14.66299 36.22689 1.000 41.82086  ? 15  HIS A CE1 1 
ATOM   111  N NE2 . HIS A 1 15  ? -8.89799  -14.15803 35.12594 1.000 46.81612  ? 15  HIS A NE2 1 
ATOM   112  N N   . ILE A 1 16  ? -10.55099 -19.26602 32.12513 1.000 46.51601  ? 16  ILE A N   1 
ATOM   113  C CA  . ILE A 1 16  ? -10.68668 -20.31899 31.12679 1.000 59.81612  ? 16  ILE A CA  1 
ATOM   114  C C   . ILE A 1 16  ? -9.37785  -20.41239 30.34750 1.000 47.61612  ? 16  ILE A C   1 
ATOM   115  O O   . ILE A 1 16  ? -8.94624  -19.44182 29.71060 1.000 49.44612  ? 16  ILE A O   1 
ATOM   116  C CB  . ILE A 1 16  ? -11.88933 -20.05532 30.20982 1.000 58.37589  ? 16  ILE A CB  1 
ATOM   117  C CG1 . ILE A 1 16  ? -13.19114 -20.30477 30.97279 1.000 60.05612  ? 16  ILE A CG1 1 
ATOM   118  C CG2 . ILE A 1 16  ? -11.83542 -20.90494 28.96057 1.000 46.74612  ? 16  ILE A CG2 1 
ATOM   119  C CD1 . ILE A 1 16  ? -14.00634 -19.07773 31.10411 1.000 55.76612  ? 16  ILE A CD1 1 
ATOM   120  N N   . LEU A 1 17  ? -8.74853  -21.58576 30.41164 1.000 52.57612  ? 17  LEU A N   1 
ATOM   121  C CA  . LEU A 1 17  ? -7.37102  -21.76723 29.98084 1.000 52.14404  ? 17  LEU A CA  1 
ATOM   122  C C   . LEU A 1 17  ? -7.24421  -22.56701 28.70787 1.000 56.97817  ? 17  LEU A C   1 
ATOM   123  O O   . LEU A 1 17  ? -6.24442  -22.40417 28.00014 1.000 49.65081  ? 17  LEU A O   1 
ATOM   124  C CB  . LEU A 1 17  ? -6.55562  -22.50318 31.04298 1.000 51.18594  ? 17  LEU A CB  1 
ATOM   125  C CG  . LEU A 1 17  ? -6.60146  -22.05818 32.49713 1.000 57.69027  ? 17  LEU A CG  1 
ATOM   126  C CD1 . LEU A 1 17  ? -5.56187  -22.80573 33.29215 1.000 56.85104  ? 17  LEU A CD1 1 
ATOM   127  C CD2 . LEU A 1 17  ? -6.32731  -20.62326 32.56123 1.000 63.45612  ? 17  LEU A CD2 1 
ATOM   128  N N   . GLN A 1 18  ? -8.20888  -23.45497 28.42834 1.000 53.77612  ? 18  GLN A N   1 
ATOM   129  C CA  . GLN A 1 18  ? -8.08818  -24.35575 27.28183 1.000 64.18494  ? 18  GLN A CA  1 
ATOM   130  C C   . GLN A 1 18  ? -7.96711  -23.62972 25.95231 1.000 58.23612  ? 18  GLN A C   1 
ATOM   131  O O   . GLN A 1 18  ? -7.12490  -24.03611 25.13392 1.000 63.62612  ? 18  GLN A O   1 
ATOM   132  C CB  . GLN A 1 18  ? -9.26028  -25.34058 27.25390 1.000 68.25612  ? 18  GLN A CB  1 
ATOM   133  C CG  . GLN A 1 18  ? -9.00463  -26.66764 27.96680 1.000 84.05171  ? 18  GLN A CG  1 
ATOM   134  C CD  . GLN A 1 18  ? -7.59149  -27.22073 27.79592 1.000 104.65058 ? 18  GLN A CD  1 
ATOM   135  O OE1 . GLN A 1 18  ? -6.93354  -27.00368 26.76975 1.000 106.24232 ? 18  GLN A OE1 1 
ATOM   136  N NE2 . GLN A 1 18  ? -7.10623  -27.91723 28.82412 1.000 105.49612 ? 18  GLN A NE2 1 
ATOM   137  N N   . PRO A 1 19  ? -8.74421  -22.58555 25.65604 1.000 47.59612  ? 19  PRO A N   1 
ATOM   138  C CA  . PRO A 1 19  ? -8.60079  -21.94928 24.33896 1.000 54.82002  ? 19  PRO A CA  1 
ATOM   139  C C   . PRO A 1 19  ? -7.20756  -21.39848 24.06742 1.000 60.71755  ? 19  PRO A C   1 
ATOM   140  O O   . PRO A 1 19  ? -6.84459  -21.28545 22.89331 1.000 50.34612  ? 19  PRO A O   1 
ATOM   141  C CB  . PRO A 1 19  ? -9.65546  -20.83020 24.37307 1.000 45.37827  ? 19  PRO A CB  1 
ATOM   142  C CG  . PRO A 1 19  ? -10.67658 -21.32587 25.34345 1.000 50.42514  ? 19  PRO A CG  1 
ATOM   143  C CD  . PRO A 1 19  ? -9.87834  -22.01339 26.39961 1.000 55.36612  ? 19  PRO A CD  1 
ATOM   144  N N   . PHE A 1 20  ? -6.41436  -21.07823 25.09933 1.000 54.56612  ? 20  PHE A N   1 
ATOM   145  C CA  . PHE A 1 20  ? -5.17315  -20.32556 24.90453 1.000 54.06293  ? 20  PHE A CA  1 
ATOM   146  C C   . PHE A 1 20  ? -4.20049  -21.08028 24.00424 1.000 51.82612  ? 20  PHE A C   1 
ATOM   147  O O   . PHE A 1 20  ? -3.97056  -22.28150 24.17442 1.000 47.92612  ? 20  PHE A O   1 
ATOM   148  C CB  . PHE A 1 20  ? -4.50474  -19.99721 26.25033 1.000 50.60612  ? 20  PHE A CB  1 
ATOM   149  C CG  . PHE A 1 20  ? -3.26407  -19.15496 26.11561 1.000 46.23612  ? 20  PHE A CG  1 
ATOM   150  C CD1 . PHE A 1 20  ? -3.35515  -17.79129 25.84878 1.000 39.28612  ? 20  PHE A CD1 1 
ATOM   151  C CD2 . PHE A 1 20  ? -2.01039  -19.72556 26.22918 1.000 46.72612  ? 20  PHE A CD2 1 
ATOM   152  C CE1 . PHE A 1 20  ? -2.21577  -17.01399 25.69478 1.000 42.53612  ? 20  PHE A CE1 1 
ATOM   153  C CE2 . PHE A 1 20  ? -0.86654  -18.95955 26.08659 1.000 44.09654  ? 20  PHE A CE2 1 
ATOM   154  C CZ  . PHE A 1 20  ? -0.96872  -17.59837 25.81656 1.000 46.73612  ? 20  PHE A CZ  1 
ATOM   155  N N   . ASP A 1 21  ? -3.63899  -20.35965 23.03715 1.000 45.36612  ? 21  ASP A N   1 
ATOM   156  C CA  . ASP A 1 21  ? -2.65797  -20.92957 22.11919 1.000 59.00612  ? 21  ASP A CA  1 
ATOM   157  C C   . ASP A 1 21  ? -1.73086  -19.81970 21.65736 1.000 51.33454  ? 21  ASP A C   1 
ATOM   158  O O   . ASP A 1 21  ? -2.17409  -18.86586 21.00022 1.000 52.73612  ? 21  ASP A O   1 
ATOM   159  C CB  . ASP A 1 21  ? -3.33253  -21.58597 20.91887 1.000 62.90612  ? 21  ASP A CB  1 
ATOM   160  C CG  . ASP A 1 21  ? -2.33598  -21.99491 19.83664 1.000 84.86358  ? 21  ASP A CG  1 
ATOM   161  O OD1 . ASP A 1 21  ? -1.22182  -22.45215 20.18417 1.000 84.44413  ? 21  ASP A OD1 1 
ATOM   162  O OD2 . ASP A 1 21  ? -2.66218  -21.84847 18.63916 1.000 98.29226  ? 21  ASP A OD2 1 
ATOM   163  N N   . CYS A 1 22  ? -0.44736  -19.94519 21.99282 1.000 52.69612  ? 22  CYS A N   1 
ATOM   164  C CA  . CYS A 1 22  ? 0.53931   -18.96021 21.58156 1.000 59.35978  ? 22  CYS A CA  1 
ATOM   165  C C   . CYS A 1 22  ? 1.46860   -19.47070 20.49077 1.000 62.12612  ? 22  CYS A C   1 
ATOM   166  O O   . CYS A 1 22  ? 2.38541   -18.74512 20.09641 1.000 66.20940  ? 22  CYS A O   1 
ATOM   167  C CB  . CYS A 1 22  ? 1.36896   -18.49736 22.77839 1.000 51.89612  ? 22  CYS A CB  1 
ATOM   168  S SG  . CYS A 1 22  ? 2.15850   -19.85948 23.63605 1.000 59.66612  ? 22  CYS A SG  1 
ATOM   169  N N   . GLY A 1 23  ? 1.25488   -20.68522 19.98968 1.000 63.75612  ? 23  GLY A N   1 
ATOM   170  C CA  . GLY A 1 23  ? 2.12210   -21.28097 18.99480 1.000 66.55223  ? 23  GLY A CA  1 
ATOM   171  C C   . GLY A 1 23  ? 3.32561   -22.01026 19.55324 1.000 70.99220  ? 23  GLY A C   1 
ATOM   172  O O   . GLY A 1 23  ? 4.15748   -22.49444 18.77255 1.000 84.10397  ? 23  GLY A O   1 
ATOM   173  N N   . ASN A 1 24  ? 3.44131   -22.10925 20.87542 1.000 70.42784  ? 24  ASN A N   1 
ATOM   174  C CA  . ASN A 1 24  ? 4.56703   -22.74827 21.55026 1.000 61.44735  ? 24  ASN A CA  1 
ATOM   175  C C   . ASN A 1 24  ? 3.98347   -23.65582 22.62910 1.000 68.92563  ? 24  ASN A C   1 
ATOM   176  O O   . ASN A 1 24  ? 3.47934   -23.17051 23.64789 1.000 69.67612  ? 24  ASN A O   1 
ATOM   177  C CB  . ASN A 1 24  ? 5.50783   -21.69231 22.14286 1.000 65.15860  ? 24  ASN A CB  1 
ATOM   178  C CG  . ASN A 1 24  ? 6.74058   -22.28987 22.79066 1.000 76.30841  ? 24  ASN A CG  1 
ATOM   179  O OD1 . ASN A 1 24  ? 6.65090   -23.19599 23.61807 1.000 73.34184  ? 24  ASN A OD1 1 
ATOM   180  N ND2 . ASN A 1 24  ? 7.90420   -21.76253 22.43459 1.000 85.30146  ? 24  ASN A ND2 1 
ATOM   181  N N   . GLU A 1 25  ? 4.07273   -24.97070 22.41344 1.000 65.47612  ? 25  GLU A N   1 
ATOM   182  C CA  . GLU A 1 25  ? 3.36585   -25.93318 23.25662 1.000 70.61918  ? 25  GLU A CA  1 
ATOM   183  C C   . GLU A 1 25  ? 3.84353   -25.91390 24.70817 1.000 70.19388  ? 25  GLU A C   1 
ATOM   184  O O   . GLU A 1 25  ? 3.05652   -26.20683 25.61784 1.000 66.00496  ? 25  GLU A O   1 
ATOM   185  C CB  . GLU A 1 25  ? 3.51536   -27.34109 22.67447 1.000 72.35154  ? 25  GLU A CB  1 
ATOM   186  C CG  . GLU A 1 25  ? 4.89559   -27.62139 22.07815 1.000 92.00875  ? 25  GLU A CG  1 
ATOM   187  C CD  . GLU A 1 25  ? 4.97912   -27.34691 20.57560 1.000 118.56596 ? 25  GLU A CD  1 
ATOM   188  O OE1 . GLU A 1 25  ? 4.46419   -26.29950 20.11585 1.000 111.19291 ? 25  GLU A OE1 1 
ATOM   189  O OE2 . GLU A 1 25  ? 5.57054   -28.18039 19.85474 1.000 111.38196 ? 25  GLU A OE2 1 
ATOM   190  N N   . VAL A 1 26  ? 5.11790   -25.59791 24.95627 1.000 61.52843  ? 26  VAL A N   1 
ATOM   191  C CA  . VAL A 1 26  ? 5.58671   -25.64367 26.33935 1.000 81.00199  ? 26  VAL A CA  1 
ATOM   192  C C   . VAL A 1 26  ? 4.99498   -24.48160 27.13963 1.000 66.19400  ? 26  VAL A C   1 
ATOM   193  O O   . VAL A 1 26  ? 4.70343   -24.63561 28.32979 1.000 64.36759  ? 26  VAL A O   1 
ATOM   194  C CB  . VAL A 1 26  ? 7.13208   -25.68353 26.40484 1.000 81.46958  ? 26  VAL A CB  1 
ATOM   195  C CG1 . VAL A 1 26  ? 7.68999   -26.65426 25.35495 1.000 68.82722  ? 26  VAL A CG1 1 
ATOM   196  C CG2 . VAL A 1 26  ? 7.75993   -24.30263 26.27352 1.000 72.97612  ? 26  VAL A CG2 1 
ATOM   197  N N   . LEU A 1 27  ? 4.74938   -23.33098 26.48916 1.000 60.37612  ? 27  LEU A N   1 
ATOM   198  C CA  . LEU A 1 27  ? 4.16377   -22.16893 27.15585 1.000 65.09002  ? 27  LEU A CA  1 
ATOM   199  C C   . LEU A 1 27  ? 2.65814   -22.33169 27.38181 1.000 69.75143  ? 27  LEU A C   1 
ATOM   200  O O   . LEU A 1 27  ? 2.14799   -21.93998 28.43824 1.000 68.89612  ? 27  LEU A O   1 
ATOM   201  C CB  . LEU A 1 27  ? 4.42794   -20.89905 26.34169 1.000 53.37575  ? 27  LEU A CB  1 
ATOM   202  C CG  . LEU A 1 27  ? 5.86836   -20.40452 26.27917 1.000 63.34426  ? 27  LEU A CG  1 
ATOM   203  C CD1 . LEU A 1 27  ? 5.97391   -19.18444 25.39254 1.000 56.63140  ? 27  LEU A CD1 1 
ATOM   204  C CD2 . LEU A 1 27  ? 6.40181   -20.12447 27.66817 1.000 63.31625  ? 27  LEU A CD2 1 
ATOM   205  N N   . SER A 1 28  ? 1.92778   -22.87755 26.39798 1.000 61.81612  ? 28  SER A N   1 
ATOM   206  C CA  . SER A 1 28  ? 0.50893   -23.16313 26.59210 1.000 57.45330  ? 28  SER A CA  1 
ATOM   207  C C   . SER A 1 28  ? 0.31110   -24.26858 27.61581 1.000 62.18864  ? 28  SER A C   1 
ATOM   208  O O   . SER A 1 28  ? -0.58357  -24.17720 28.46445 1.000 68.95612  ? 28  SER A O   1 
ATOM   209  C CB  . SER A 1 28  ? -0.16416  -23.56590 25.27160 1.000 60.24706  ? 28  SER A CB  1 
ATOM   210  O OG  . SER A 1 28  ? 0.35353   -22.87867 24.15275 1.000 75.54612  ? 28  SER A OG  1 
ATOM   211  N N   . ASN A 1 29  ? 1.12591   -25.33211 27.54374 1.000 60.77689  ? 29  ASN A N   1 
ATOM   212  C CA  . ASN A 1 29  ? 1.00531   -26.41497 28.51781 1.000 60.43586  ? 29  ASN A CA  1 
ATOM   213  C C   . ASN A 1 29  ? 1.35515   -25.93526 29.91993 1.000 72.03022  ? 29  ASN A C   1 
ATOM   214  O O   . ASN A 1 29  ? 0.73699   -26.36650 30.90277 1.000 61.80421  ? 29  ASN A O   1 
ATOM   215  C CB  . ASN A 1 29  ? 1.89639   -27.59283 28.13393 1.000 70.56750  ? 29  ASN A CB  1 
ATOM   216  C CG  . ASN A 1 29  ? 1.23257   -28.52920 27.14242 1.000 86.95754  ? 29  ASN A CG  1 
ATOM   217  O OD1 . ASN A 1 29  ? 0.09726   -28.30788 26.71723 1.000 83.77895  ? 29  ASN A OD1 1 
ATOM   218  N ND2 . ASN A 1 29  ? 1.93328   -29.59497 26.78360 1.000 93.86531  ? 29  ASN A ND2 1 
ATOM   219  N N   . TRP A 1 30  ? 2.34411   -25.04638 30.04046 1.000 55.72206  ? 30  TRP A N   1 
ATOM   220  C CA  . TRP A 1 30  ? 2.67519   -24.55050 31.36714 1.000 63.50924  ? 30  TRP A CA  1 
ATOM   221  C C   . TRP A 1 30  ? 1.48358   -23.82821 31.98020 1.000 56.78783  ? 30  TRP A C   1 
ATOM   222  O O   . TRP A 1 30  ? 1.13248   -24.07686 33.13815 1.000 60.08612  ? 30  TRP A O   1 
ATOM   223  C CB  . TRP A 1 30  ? 3.90275   -23.64624 31.32483 1.000 44.31612  ? 30  TRP A CB  1 
ATOM   224  C CG  . TRP A 1 30  ? 4.36420   -23.33723 32.69449 1.000 61.70612  ? 30  TRP A CG  1 
ATOM   225  C CD1 . TRP A 1 30  ? 5.21421   -24.07722 33.44310 1.000 55.45743  ? 30  TRP A CD1 1 
ATOM   226  C CD2 . TRP A 1 30  ? 3.98680   -22.21381 33.50202 1.000 46.87612  ? 30  TRP A CD2 1 
ATOM   227  N NE1 . TRP A 1 30  ? 5.40443   -23.48880 34.65754 1.000 55.63329  ? 30  TRP A NE1 1 
ATOM   228  C CE2 . TRP A 1 30  ? 4.66192   -22.34087 34.72454 1.000 62.04383  ? 30  TRP A CE2 1 
ATOM   229  C CE3 . TRP A 1 30  ? 3.15904   -21.10993 33.30112 1.000 47.99690  ? 30  TRP A CE3 1 
ATOM   230  C CZ2 . TRP A 1 30  ? 4.52812   -21.40829 35.75993 1.000 55.40612  ? 30  TRP A CZ2 1 
ATOM   231  C CZ3 . TRP A 1 30  ? 3.03203   -20.18189 34.31563 1.000 47.40612  ? 30  TRP A CZ3 1 
ATOM   232  C CH2 . TRP A 1 30  ? 3.70817   -20.34356 35.53892 1.000 57.83612  ? 30  TRP A CH2 1 
ATOM   233  N N   . LEU A 1 31  ? 0.81878   -22.97485 31.19651 1.000 48.60612  ? 31  LEU A N   1 
ATOM   234  C CA  . LEU A 1 31  ? -0.36430  -22.27651 31.68245 1.000 58.98612  ? 31  LEU A CA  1 
ATOM   235  C C   . LEU A 1 31  ? -1.41030  -23.25285 32.20418 1.000 53.28612  ? 31  LEU A C   1 
ATOM   236  O O   . LEU A 1 31  ? -1.99539  -23.03706 33.26880 1.000 55.64612  ? 31  LEU A O   1 
ATOM   237  C CB  . LEU A 1 31  ? -0.94526  -21.40978 30.57015 1.000 53.22612  ? 31  LEU A CB  1 
ATOM   238  C CG  . LEU A 1 31  ? -2.22922  -20.63895 30.85200 1.000 63.36612  ? 31  LEU A CG  1 
ATOM   239  C CD1 . LEU A 1 31  ? -2.02322  -19.75395 32.03595 1.000 47.99920  ? 31  LEU A CD1 1 
ATOM   240  C CD2 . LEU A 1 31  ? -2.57943  -19.79463 29.65558 1.000 46.38801  ? 31  LEU A CD2 1 
ATOM   241  N N   . ARG A 1 32  ? -1.63204  -24.34929 31.49471 1.000 57.49881  ? 32  ARG A N   1 
ATOM   242  C CA  . ARG A 1 32  ? -2.69510  -25.26369 31.87834 1.000 60.12946  ? 32  ARG A CA  1 
ATOM   243  C C   . ARG A 1 32  ? -2.27739  -26.25216 32.94860 1.000 62.36612  ? 32  ARG A C   1 
ATOM   244  O O   . ARG A 1 32  ? -3.11054  -26.64500 33.77311 1.000 64.38536  ? 32  ARG A O   1 
ATOM   245  C CB  . ARG A 1 32  ? -3.18684  -26.02389 30.64755 1.000 66.43612  ? 32  ARG A CB  1 
ATOM   246  C CG  . ARG A 1 32  ? -3.60655  -25.09552 29.53446 1.000 67.46408  ? 32  ARG A CG  1 
ATOM   247  C CD  . ARG A 1 32  ? -4.39483  -25.80973 28.44956 1.000 82.18857  ? 32  ARG A CD  1 
ATOM   248  N NE  . ARG A 1 32  ? -3.66352  -26.02123 27.20154 1.000 72.18490  ? 32  ARG A NE  1 
ATOM   249  C CZ  . ARG A 1 32  ? -3.76673  -25.24019 26.13041 1.000 89.26868  ? 32  ARG A CZ  1 
ATOM   250  N NH1 . ARG A 1 32  ? -4.40744  -24.07681 26.17607 1.000 78.33612  ? 32  ARG A NH1 1 
ATOM   251  N NH2 . ARG A 1 32  ? -3.21015  -25.63087 24.98457 1.000 90.33221  ? 32  ARG A NH2 1 
ATOM   252  N N   . GLY A 1 33  ? -1.01406  -26.66086 32.96096 1.000 59.53612  ? 33  GLY A N   1 
ATOM   253  C CA  . GLY A 1 33  ? -0.60956  -27.74715 33.82742 1.000 70.72186  ? 33  GLY A CA  1 
ATOM   254  C C   . GLY A 1 33  ? 0.11116   -27.34969 35.09700 1.000 68.17357  ? 33  GLY A C   1 
ATOM   255  O O   . GLY A 1 33  ? 0.04174   -28.07805 36.08611 1.000 69.96645  ? 33  GLY A O   1 
ATOM   256  N N   . ARG A 1 34  ? 0.82719   -26.22187 35.08350 1.000 74.65020  ? 34  ARG A N   1 
ATOM   257  C CA  . ARG A 1 34  ? 1.66455   -25.83580 36.20985 1.000 70.57977  ? 34  ARG A CA  1 
ATOM   258  C C   . ARG A 1 34  ? 1.32810   -24.47729 36.80789 1.000 71.34689  ? 34  ARG A C   1 
ATOM   259  O O   . ARG A 1 34  ? 1.63451   -24.26228 37.98024 1.000 65.61612  ? 34  ARG A O   1 
ATOM   260  C CB  . ARG A 1 34  ? 3.15870   -25.85394 35.81739 1.000 71.59612  ? 34  ARG A CB  1 
ATOM   261  C CG  . ARG A 1 34  ? 4.13981   -26.24920 36.96516 1.000 91.38424  ? 34  ARG A CG  1 
ATOM   262  C CD  . ARG A 1 34  ? 5.64103   -26.13407 36.56077 1.000 97.40401  ? 34  ARG A CD  1 
ATOM   263  N NE  . ARG A 1 34  ? 6.40883   -25.14710 37.32558 1.000 92.08612  ? 34  ARG A NE  1 
ATOM   264  C CZ  . ARG A 1 34  ? 7.54582   -24.60479 36.90458 1.000 78.53612  ? 34  ARG A CZ  1 
ATOM   265  N NH1 . ARG A 1 34  ? 8.11893   -24.98877 35.77767 1.000 100.28612 ? 34  ARG A NH1 1 
ATOM   266  N NH2 . ARG A 1 34  ? 8.12409   -23.65211 37.62482 1.000 57.95989  ? 34  ARG A NH2 1 
ATOM   267  N N   . ALA A 1 35  ? 0.67669   -23.57744 36.06694 1.000 53.72298  ? 35  ALA A N   1 
ATOM   268  C CA  . ALA A 1 35  ? 0.48935   -22.21832 36.56256 1.000 56.94612  ? 35  ALA A CA  1 
ATOM   269  C C   . ALA A 1 35  ? -0.30626  -22.18794 37.86781 1.000 70.40634  ? 35  ALA A C   1 
ATOM   270  O O   . ALA A 1 35  ? 0.11784   -21.55538 38.84157 1.000 56.16612  ? 35  ALA A O   1 
ATOM   271  C CB  . ALA A 1 35  ? -0.18444  -21.36045 35.50458 1.000 48.51612  ? 35  ALA A CB  1 
ATOM   272  N N   . MET A 1 36  ? -1.46940  -22.85031 37.90868 1.000 56.69612  ? 36  MET A N   1 
ATOM   273  C CA  . MET A 1 36  ? -2.30240  -22.74999 39.10573 1.000 59.89524  ? 36  MET A CA  1 
ATOM   274  C C   . MET A 1 36  ? -1.69957  -23.50705 40.27709 1.000 68.42852  ? 36  MET A C   1 
ATOM   275  O O   . MET A 1 36  ? -1.88240  -23.10281 41.43232 1.000 56.16971  ? 36  MET A O   1 
ATOM   276  C CB  . MET A 1 36  ? -3.72511  -23.24600 38.84169 1.000 57.67612  ? 36  MET A CB  1 
ATOM   277  C CG  . MET A 1 36  ? -4.65591  -22.13495 38.38133 1.000 67.28820  ? 36  MET A CG  1 
ATOM   278  S SD  . MET A 1 36  ? -4.90498  -20.77181 39.56681 1.000 79.76032  ? 36  MET A SD  1 
ATOM   279  C CE  . MET A 1 36  ? -5.07106  -21.62369 41.14376 1.000 65.66949  ? 36  MET A CE  1 
ATOM   280  N N   . LYS A 1 37  ? -0.96992  -24.58840 40.00497 1.000 60.64468  ? 37  LYS A N   1 
ATOM   281  C CA  . LYS A 1 37  ? -0.25030  -25.27901 41.06954 1.000 68.19515  ? 37  LYS A CA  1 
ATOM   282  C C   . LYS A 1 37  ? 0.79593   -24.37077 41.72144 1.000 66.83148  ? 37  LYS A C   1 
ATOM   283  O O   . LYS A 1 37  ? 0.80931   -24.20960 42.94766 1.000 58.71612  ? 37  LYS A O   1 
ATOM   284  C CB  . LYS A 1 37  ? 0.37879   -26.54566 40.50796 1.000 63.51083  ? 37  LYS A CB  1 
ATOM   285  C CG  . LYS A 1 37  ? -0.66112  -27.58985 40.11715 1.000 86.56418  ? 37  LYS A CG  1 
ATOM   286  C CD  . LYS A 1 37  ? -0.03622  -28.87280 39.57482 1.000 96.95522  ? 37  LYS A CD  1 
ATOM   287  C CE  . LYS A 1 37  ? 1.48228   -28.86876 39.71251 1.000 108.07474 ? 37  LYS A CE  1 
ATOM   288  N NZ  . LYS A 1 37  ? 2.10042   -30.16139 39.32055 1.000 109.65530 ? 37  LYS A NZ  1 
ATOM   289  N N   . ASN A 1 38  ? 1.67005   -23.75630 40.91269 1.000 55.59612  ? 38  ASN A N   1 
ATOM   290  C CA  . ASN A 1 38  ? 2.64717   -22.80354 41.43670 1.000 67.53104  ? 38  ASN A CA  1 
ATOM   291  C C   . ASN A 1 38  ? 1.97226   -21.65147 42.17167 1.000 60.71313  ? 38  ASN A C   1 
ATOM   292  O O   . ASN A 1 38  ? 2.52695   -21.11666 43.13548 1.000 63.39612  ? 38  ASN A O   1 
ATOM   293  C CB  . ASN A 1 38  ? 3.51012   -22.25309 40.29898 1.000 64.44612  ? 38  ASN A CB  1 
ATOM   294  C CG  . ASN A 1 38  ? 4.58277   -23.22567 39.85591 1.000 72.72870  ? 38  ASN A CG  1 
ATOM   295  O OD1 . ASN A 1 38  ? 4.51679   -24.41198 40.17337 1.000 75.66612  ? 38  ASN A OD1 1 
ATOM   296  N ND2 . ASN A 1 38  ? 5.58839   -22.72621 39.12908 1.000 60.93074  ? 38  ASN A ND2 1 
ATOM   297  N N   . GLN A 1 39  ? 0.79493   -21.22957 41.69791 1.000 53.46612  ? 39  GLN A N   1 
ATOM   298  C CA  . GLN A 1 39  ? 0.07254   -20.13151 42.32692 1.000 58.24937  ? 39  GLN A CA  1 
ATOM   299  C C   . GLN A 1 39  ? -0.35525  -20.49398 43.74099 1.000 61.92712  ? 39  GLN A C   1 
ATOM   300  O O   . GLN A 1 39  ? -0.26947  -19.66419 44.65204 1.000 57.98612  ? 39  GLN A O   1 
ATOM   301  C CB  . GLN A 1 39  ? -1.13952  -19.74889 41.47625 1.000 54.68671  ? 39  GLN A CB  1 
ATOM   302  C CG  . GLN A 1 39  ? -1.68319  -18.37238 41.75894 1.000 60.71612  ? 39  GLN A CG  1 
ATOM   303  C CD  . GLN A 1 39  ? -1.19195  -17.33785 40.77194 1.000 58.24355  ? 39  GLN A CD  1 
ATOM   304  O OE1 . GLN A 1 39  ? -0.00145  -17.25923 40.47021 1.000 55.87612  ? 39  GLN A OE1 1 
ATOM   305  N NE2 . GLN A 1 39  ? -2.10738  -16.52664 40.27292 1.000 51.92612  ? 39  GLN A NE2 1 
ATOM   306  N N   . MET A 1 40  ? -0.80835  -21.73442 43.94479 1.000 56.33612  ? 40  MET A N   1 
ATOM   307  C CA  . MET A 1 40  ? -1.27469  -22.16755 45.25570 1.000 67.08506  ? 40  MET A CA  1 
ATOM   308  C C   . MET A 1 40  ? -0.13670  -22.59611 46.18181 1.000 61.85106  ? 40  MET A C   1 
ATOM   309  O O   . MET A 1 40  ? -0.33146  -22.62195 47.39929 1.000 61.05295  ? 40  MET A O   1 
ATOM   310  C CB  . MET A 1 40  ? -2.29095  -23.30301 45.09730 1.000 65.25090  ? 40  MET A CB  1 
ATOM   311  C CG  . MET A 1 40  ? -3.58969  -22.92722 44.36543 1.000 74.31576  ? 40  MET A CG  1 
ATOM   312  S SD  . MET A 1 40  ? -4.66985  -21.73770 45.22758 1.000 119.42345 ? 40  MET A SD  1 
ATOM   313  C CE  . MET A 1 40  ? -4.04252  -20.12655 44.72402 1.000 76.39302  ? 40  MET A CE  1 
ATOM   314  N N   . LEU A 1 41  ? 1.03482   -22.93969 45.63727 1.000 57.44838  ? 41  LEU A N   1 
ATOM   315  C CA  . LEU A 1 41  ? 2.22117   -23.17408 46.44739 1.000 68.77612  ? 41  LEU A CA  1 
ATOM   316  C C   . LEU A 1 41  ? 2.99961   -21.90407 46.77071 1.000 70.18612  ? 41  LEU A C   1 
ATOM   317  O O   . LEU A 1 41  ? 4.03894   -22.00328 47.42239 1.000 52.89985  ? 41  LEU A O   1 
ATOM   318  C CB  . LEU A 1 41  ? 3.16414   -24.17449 45.76214 1.000 63.88303  ? 41  LEU A CB  1 
ATOM   319  C CG  . LEU A 1 41  ? 2.90265   -25.68209 45.88043 1.000 71.15393  ? 41  LEU A CG  1 
ATOM   320  C CD1 . LEU A 1 41  ? 2.49732   -26.00887 47.31118 1.000 72.97240  ? 41  LEU A CD1 1 
ATOM   321  C CD2 . LEU A 1 41  ? 1.90933   -26.22685 44.88207 1.000 76.29889  ? 41  LEU A CD2 1 
ATOM   322  N N   . ASN A 1 42  ? 2.53096   -20.72735 46.34881 1.000 48.76612  ? 42  ASN A N   1 
ATOM   323  C CA  . ASN A 1 42  ? 3.30412   -19.48672 46.42357 1.000 52.76246  ? 42  ASN A CA  1 
ATOM   324  C C   . ASN A 1 42  ? 4.70245   -19.64671 45.81569 1.000 60.91612  ? 42  ASN A C   1 
ATOM   325  O O   . ASN A 1 42  ? 5.67047   -19.05129 46.28850 1.000 56.44591  ? 42  ASN A O   1 
ATOM   326  C CB  . ASN A 1 42  ? 3.40660   -18.96551 47.86474 1.000 56.94634  ? 42  ASN A CB  1 
ATOM   327  C CG  . ASN A 1 42  ? 2.10592   -18.38492 48.36119 1.000 60.45431  ? 42  ASN A CG  1 
ATOM   328  O OD1 . ASN A 1 42  ? 1.08970   -18.45356 47.67306 1.000 58.81201  ? 42  ASN A OD1 1 
ATOM   329  N ND2 . ASN A 1 42  ? 2.13334   -17.77921 49.54391 1.000 58.41168  ? 42  ASN A ND2 1 
ATOM   330  N N   . ALA A 1 43  ? 4.83835   -20.47190 44.78357 1.000 53.02749  ? 43  ALA A N   1 
ATOM   331  C CA  . ALA A 1 43  ? 6.10876   -20.57590 44.08187 1.000 64.01299  ? 43  ALA A CA  1 
ATOM   332  C C   . ALA A 1 43  ? 6.25659   -19.48456 43.03377 1.000 68.13612  ? 43  ALA A C   1 
ATOM   333  O O   . ALA A 1 43  ? 7.37017   -19.02423 42.76977 1.000 47.94612  ? 43  ALA A O   1 
ATOM   334  C CB  . ALA A 1 43  ? 6.24284   -21.95715 43.42410 1.000 54.44612  ? 43  ALA A CB  1 
ATOM   335  N N   . SER A 1 44  ? 5.14335   -19.05371 42.45549 1.000 51.64612  ? 44  SER A N   1 
ATOM   336  C CA  . SER A 1 44  ? 5.10812   -18.09119 41.36650 1.000 62.72429  ? 44  SER A CA  1 
ATOM   337  C C   . SER A 1 44  ? 3.84562   -17.26567 41.51218 1.000 53.02902  ? 44  SER A C   1 
ATOM   338  O O   . SER A 1 44  ? 2.90896   -17.63305 42.22899 1.000 48.46393  ? 44  SER A O   1 
ATOM   339  C CB  . SER A 1 44  ? 5.11016   -18.75501 39.96966 1.000 41.12612  ? 44  SER A CB  1 
ATOM   340  O OG  . SER A 1 44  ? 5.88909   -19.93150 39.91485 1.000 81.13612  ? 44  SER A OG  1 
ATOM   341  N N   . ARG A 1 45  ? 3.83314   -16.13676 40.82688 1.000 50.20612  ? 45  ARG A N   1 
ATOM   342  C CA  . ARG A 1 45  ? 2.61996   -15.36604 40.63307 1.000 38.81612  ? 45  ARG A CA  1 
ATOM   343  C C   . ARG A 1 45  ? 2.42414   -15.22942 39.12516 1.000 53.57187  ? 45  ARG A C   1 
ATOM   344  O O   . ARG A 1 45  ? 3.29250   -14.69350 38.42998 1.000 43.97872  ? 45  ARG A O   1 
ATOM   345  C CB  . ARG A 1 45  ? 2.70288   -14.00904 41.33809 1.000 43.81612  ? 45  ARG A CB  1 
ATOM   346  C CG  . ARG A 1 45  ? 2.65378   -14.10971 42.89848 1.000 49.62139  ? 45  ARG A CG  1 
ATOM   347  C CD  . ARG A 1 45  ? 1.22677   -14.16093 43.42465 1.000 54.36612  ? 45  ARG A CD  1 
ATOM   348  N NE  . ARG A 1 45  ? 0.82587   -15.54952 43.52304 1.000 72.16612  ? 45  ARG A NE  1 
ATOM   349  C CZ  . ARG A 1 45  ? 0.67269   -16.23671 44.64248 1.000 65.49726  ? 45  ARG A CZ  1 
ATOM   350  N NH1 . ARG A 1 45  ? 0.54614   -15.63900 45.81302 1.000 54.38612  ? 45  ARG A NH1 1 
ATOM   351  N NH2 . ARG A 1 45  ? 0.59084   -17.55967 44.57465 1.000 73.37612  ? 45  ARG A NH2 1 
ATOM   352  N N   . THR A 1 46  ? 1.31622   -15.77328 38.62379 1.000 38.05612  ? 46  THR A N   1 
ATOM   353  C CA  . THR A 1 46  ? 0.94428   -15.71849 37.21818 1.000 40.36095  ? 46  THR A CA  1 
ATOM   354  C C   . THR A 1 46  ? -0.14800  -14.67475 37.03040 1.000 42.14612  ? 46  THR A C   1 
ATOM   355  O O   . THR A 1 46  ? -1.18613  -14.72112 37.69584 1.000 41.31612  ? 46  THR A O   1 
ATOM   356  C CB  . THR A 1 46  ? 0.47557   -17.08303 36.71171 1.000 43.98612  ? 46  THR A CB  1 
ATOM   357  O OG1 . THR A 1 46  ? 1.54587   -18.02467 36.82642 1.000 47.97612  ? 46  THR A OG1 1 
ATOM   358  C CG2 . THR A 1 46  ? 0.06592   -16.99978 35.22231 1.000 49.24612  ? 46  THR A CG2 1 
ATOM   359  N N   . PHE A 1 47  ? 0.10974   -13.72803 36.14154 1.000 43.02612  ? 47  PHE A N   1 
ATOM   360  C CA  . PHE A 1 47  ? -0.82246  -12.68176 35.77367 1.000 48.62612  ? 47  PHE A CA  1 
ATOM   361  C C   . PHE A 1 47  ? -1.32629  -12.93418 34.35369 1.000 46.56612  ? 47  PHE A C   1 
ATOM   362  O O   . PHE A 1 47  ? -0.55142  -13.29729 33.46546 1.000 45.57612  ? 47  PHE A O   1 
ATOM   363  C CB  . PHE A 1 47  ? -0.15001  -11.31267 35.88739 1.000 40.77612  ? 47  PHE A CB  1 
ATOM   364  C CG  . PHE A 1 47  ? 0.25899   -10.95786 37.27984 1.000 45.41650  ? 47  PHE A CG  1 
ATOM   365  C CD1 . PHE A 1 47  ? 1.46843   -11.40072 37.79232 1.000 40.95612  ? 47  PHE A CD1 1 
ATOM   366  C CD2 . PHE A 1 47  ? -0.59642  -10.23221 38.11107 1.000 47.96612  ? 47  PHE A CD2 1 
ATOM   367  C CE1 . PHE A 1 47  ? 1.83928   -11.09170 39.09326 1.000 46.00612  ? 47  PHE A CE1 1 
ATOM   368  C CE2 . PHE A 1 47  ? -0.22972  -9.92098  39.41308 1.000 51.92892  ? 47  PHE A CE2 1 
ATOM   369  C CZ  . PHE A 1 47  ? 0.98445   -10.35246 39.90240 1.000 43.95612  ? 47  PHE A CZ  1 
ATOM   370  N N   . VAL A 1 48  ? -2.63316  -12.76968 34.15509 1.000 36.13612  ? 48  VAL A N   1 
ATOM   371  C CA  . VAL A 1 48  ? -3.30755  -13.04345 32.89549 1.000 42.24612  ? 48  VAL A CA  1 
ATOM   372  C C   . VAL A 1 48  ? -4.10129  -11.83675 32.44020 1.000 44.26940  ? 48  VAL A C   1 
ATOM   373  O O   . VAL A 1 48  ? -4.57980  -11.03315 33.24367 1.000 40.08462  ? 48  VAL A O   1 
ATOM   374  C CB  . VAL A 1 48  ? -4.24766  -14.25316 32.97727 1.000 43.64612  ? 48  VAL A CB  1 
ATOM   375  C CG1 . VAL A 1 48  ? -3.50072  -15.47252 33.41324 1.000 36.55612  ? 48  VAL A CG1 1 
ATOM   376  C CG2 . VAL A 1 48  ? -5.43101  -13.95357 33.88150 1.000 38.52612  ? 48  VAL A CG2 1 
ATOM   377  N N   . ILE A 1 49  ? -4.23819  -11.71179 31.12382 1.000 39.44612  ? 49  ILE A N   1 
ATOM   378  C CA  . ILE A 1 49  ? -5.17678  -10.76382 30.54615 1.000 41.69612  ? 49  ILE A CA  1 
ATOM   379  C C   . ILE A 1 49  ? -6.24212  -11.53725 29.79420 1.000 47.20612  ? 49  ILE A C   1 
ATOM   380  O O   . ILE A 1 49  ? -6.00612  -12.63950 29.28962 1.000 49.42612  ? 49  ILE A O   1 
ATOM   381  C CB  . ILE A 1 49  ? -4.49052  -9.72147  29.65581 1.000 46.37612  ? 49  ILE A CB  1 
ATOM   382  C CG1 . ILE A 1 49  ? -3.68619  -10.40229 28.55800 1.000 44.59612  ? 49  ILE A CG1 1 
ATOM   383  C CG2 . ILE A 1 49  ? -3.62619  -8.80759  30.50841 1.000 45.68612  ? 49  ILE A CG2 1 
ATOM   384  C CD1 . ILE A 1 49  ? -3.30250  -9.49511  27.45894 1.000 47.45612  ? 49  ILE A CD1 1 
ATOM   385  N N   . CYS A 1 50  ? -7.43957  -10.97715 29.77526 1.000 49.95612  ? 50  CYS A N   1 
ATOM   386  C CA  . CYS A 1 50  ? -8.59933  -11.66356 29.23702 1.000 48.84612  ? 50  CYS A CA  1 
ATOM   387  C C   . CYS A 1 50  ? -9.30855  -10.75517 28.26098 1.000 48.61612  ? 50  CYS A C   1 
ATOM   388  O O   . CYS A 1 50  ? -9.25247  -9.53220  28.38068 1.000 51.31612  ? 50  CYS A O   1 
ATOM   389  C CB  . CYS A 1 50  ? -9.60106  -12.06717 30.31619 1.000 55.51341  ? 50  CYS A CB  1 
ATOM   390  S SG  . CYS A 1 50  ? -9.05496  -13.37395 31.41308 1.000 63.78846  ? 50  CYS A SG  1 
ATOM   391  N N   . LEU A 1 51  ? -9.96609  -11.37876 27.29125 1.000 56.38837  ? 51  LEU A N   1 
ATOM   392  C CA  . LEU A 1 51  ? -10.93810 -10.68060 26.46402 1.000 65.02612  ? 51  LEU A CA  1 
ATOM   393  C C   . LEU A 1 51  ? -11.92822 -9.95810  27.35408 1.000 55.51946  ? 51  LEU A C   1 
ATOM   394  O O   . LEU A 1 51  ? -12.45790 -10.54721 28.30384 1.000 45.37612  ? 51  LEU A O   1 
ATOM   395  C CB  . LEU A 1 51  ? -11.67915 -11.67207 25.57416 1.000 55.58612  ? 51  LEU A CB  1 
ATOM   396  C CG  . LEU A 1 51  ? -10.88625 -12.28920 24.43277 1.000 63.18209  ? 51  LEU A CG  1 
ATOM   397  C CD1 . LEU A 1 51  ? -11.80573 -13.11293 23.54951 1.000 65.04415  ? 51  LEU A CD1 1 
ATOM   398  C CD2 . LEU A 1 51  ? -10.18983 -11.19490 23.64360 1.000 61.72612  ? 51  LEU A CD2 1 
ATOM   399  N N   . GLU A 1 52  ? -12.15140 -8.67872  27.05654 1.000 57.51612  ? 52  GLU A N   1 
ATOM   400  C CA  . GLU A 1 52  ? -13.07846 -7.86843  27.83122 1.000 69.06760  ? 52  GLU A CA  1 
ATOM   401  C C   . GLU A 1 52  ? -14.41042 -8.58449  27.99537 1.000 64.41939  ? 52  GLU A C   1 
ATOM   402  O O   . GLU A 1 52  ? -14.96937 -9.10366  27.02533 1.000 59.32612  ? 52  GLU A O   1 
ATOM   403  C CB  . GLU A 1 52  ? -13.28111 -6.51743  27.15315 1.000 71.12612  ? 52  GLU A CB  1 
ATOM   404  C CG  . GLU A 1 52  ? -14.16196 -5.56327  27.94266 1.000 86.84762  ? 52  GLU A CG  1 
ATOM   405  C CD  . GLU A 1 52  ? -14.54022 -4.30992  27.15555 1.000 98.81619  ? 52  GLU A CD  1 
ATOM   406  O OE1 . GLU A 1 52  ? -14.83216 -4.41431  25.93912 1.000 113.79232 ? 52  GLU A OE1 1 
ATOM   407  O OE2 . GLU A 1 52  ? -14.54835 -3.21491  27.76054 1.000 98.09897  ? 52  GLU A OE2 1 
ATOM   408  N N   . ASP A 1 53  ? -14.87794 -8.65513  29.24875 1.000 64.77512  ? 53  ASP A N   1 
ATOM   409  C CA  . ASP A 1 53  ? -16.15201 -9.25208  29.65265 1.000 66.22612  ? 53  ASP A CA  1 
ATOM   410  C C   . ASP A 1 53  ? -16.15762 -10.76977 29.53489 1.000 75.25612  ? 53  ASP A C   1 
ATOM   411  O O   . ASP A 1 53  ? -17.21929 -11.38110 29.37439 1.000 66.50612  ? 53  ASP A O   1 
ATOM   412  C CB  . ASP A 1 53  ? -17.33096 -8.66495  28.86395 1.000 79.80990  ? 53  ASP A CB  1 
ATOM   413  C CG  . ASP A 1 53  ? -17.85125 -7.36345  29.46513 1.000 98.03370  ? 53  ASP A CG  1 
ATOM   414  O OD1 . ASP A 1 53  ? -17.82669 -6.33045  28.75687 1.000 102.05305 ? 53  ASP A OD1 1 
ATOM   415  O OD2 . ASP A 1 53  ? -18.27993 -7.36837  30.64223 1.000 102.69880 ? 53  ASP A OD2 1 
ATOM   416  N N   . THR A 1 54  ? -14.98919 -11.39546 29.59118 1.000 59.73612  ? 54  THR A N   1 
ATOM   417  C CA  . THR A 1 54  ? -14.88472 -12.84393 29.65605 1.000 55.56055  ? 54  THR A CA  1 
ATOM   418  C C   . THR A 1 54  ? -13.79622 -13.18495 30.65948 1.000 52.76612  ? 54  THR A C   1 
ATOM   419  O O   . THR A 1 54  ? -13.09515 -12.31312 31.16997 1.000 55.16612  ? 54  THR A O   1 
ATOM   420  C CB  . THR A 1 54  ? -14.56122 -13.49446 28.28405 1.000 70.64321  ? 54  THR A CB  1 
ATOM   421  O OG1 . THR A 1 54  ? -13.19514 -13.23519 27.93517 1.000 59.09612  ? 54  THR A OG1 1 
ATOM   422  C CG2 . THR A 1 54  ? -15.46840 -12.97355 27.15486 1.000 59.06139  ? 54  THR A CG2 1 
ATOM   423  N N   . LEU A 1 55  ? -13.66755 -14.47450 30.94305 1.000 47.62364  ? 55  LEU A N   1 
ATOM   424  C CA  . LEU A 1 55  ? -12.50940 -15.01846 31.63249 1.000 52.21305  ? 55  LEU A CA  1 
ATOM   425  C C   . LEU A 1 55  ? -11.60783 -15.79517 30.66906 1.000 53.51005  ? 55  LEU A C   1 
ATOM   426  O O   . LEU A 1 55  ? -10.77726 -16.59675 31.10526 1.000 46.00953  ? 55  LEU A O   1 
ATOM   427  C CB  . LEU A 1 55  ? -12.97608 -15.89057 32.79897 1.000 55.31028  ? 55  LEU A CB  1 
ATOM   428  C CG  . LEU A 1 55  ? -13.74163 -15.14287 33.91590 1.000 66.03669  ? 55  LEU A CG  1 
ATOM   429  C CD1 . LEU A 1 55  ? -14.16990 -16.07922 35.02986 1.000 62.45881  ? 55  LEU A CD1 1 
ATOM   430  C CD2 . LEU A 1 55  ? -12.91938 -13.98240 34.49378 1.000 54.84603  ? 55  LEU A CD2 1 
ATOM   431  N N   . ARG A 1 56  ? -11.77361 -15.56465 29.36288 1.000 49.55612  ? 56  ARG A N   1 
ATOM   432  C CA  . ARG A 1 56  ? -10.97706 -16.18099 28.29863 1.000 52.59612  ? 56  ARG A CA  1 
ATOM   433  C C   . ARG A 1 56  ? -9.60225  -15.52328 28.26507 1.000 39.85141  ? 56  ARG A C   1 
ATOM   434  O O   . ARG A 1 56  ? -9.46966  -14.37213 27.83272 1.000 50.15612  ? 56  ARG A O   1 
ATOM   435  C CB  . ARG A 1 56  ? -11.70506 -16.01486 26.96077 1.000 55.07183  ? 56  ARG A CB  1 
ATOM   436  C CG  . ARG A 1 56  ? -11.35934 -16.99095 25.82594 1.000 50.25612  ? 56  ARG A CG  1 
ATOM   437  C CD  . ARG A 1 56  ? -9.96854  -16.79660 25.22183 1.000 52.69140  ? 56  ARG A CD  1 
ATOM   438  N NE  . ARG A 1 56  ? -9.91974  -17.31928 23.85901 1.000 45.67612  ? 56  ARG A NE  1 
ATOM   439  C CZ  . ARG A 1 56  ? -8.81025  -17.53132 23.16468 1.000 56.89151  ? 56  ARG A CZ  1 
ATOM   440  N NH1 . ARG A 1 56  ? -7.61320  -17.25912 23.66233 1.000 38.82612  ? 56  ARG A NH1 1 
ATOM   441  N NH2 . ARG A 1 56  ? -8.90059  -18.04748 21.94653 1.000 44.31869  ? 56  ARG A NH2 1 
ATOM   442  N N   . ILE A 1 57  ? -8.57257  -16.24253 28.71759 1.000 45.57612  ? 57  ILE A N   1 
ATOM   443  C CA  . ILE A 1 57  ? -7.22069  -15.68213 28.71181 1.000 44.96612  ? 57  ILE A CA  1 
ATOM   444  C C   . ILE A 1 57  ? -6.66339  -15.61310 27.29309 1.000 40.04612  ? 57  ILE A C   1 
ATOM   445  O O   . ILE A 1 57  ? -6.67822  -16.60696 26.55627 1.000 43.22612  ? 57  ILE A O   1 
ATOM   446  C CB  . ILE A 1 57  ? -6.28806  -16.49495 29.61525 1.000 50.64612  ? 57  ILE A CB  1 
ATOM   447  C CG1 . ILE A 1 57  ? -6.67109  -16.27381 31.06577 1.000 49.85974  ? 57  ILE A CG1 1 
ATOM   448  C CG2 . ILE A 1 57  ? -4.83667  -16.15543 29.35750 1.000 49.15612  ? 57  ILE A CG2 1 
ATOM   449  C CD1 . ILE A 1 57  ? -6.64813  -17.49253 31.82374 1.000 49.89612  ? 57  ILE A CD1 1 
ATOM   450  N N   . VAL A 1 58  ? -6.13738  -14.44159 26.93188 1.000 35.21612  ? 58  VAL A N   1 
ATOM   451  C CA  . VAL A 1 58  ? -5.43172  -14.23241 25.67816 1.000 43.23047  ? 58  VAL A CA  1 
ATOM   452  C C   . VAL A 1 58  ? -3.97800  -13.83565 25.89188 1.000 54.92496  ? 58  VAL A C   1 
ATOM   453  O O   . VAL A 1 58  ? -3.25898  -13.62862 24.91361 1.000 42.05612  ? 58  VAL A O   1 
ATOM   454  C CB  . VAL A 1 58  ? -6.14021  -13.17752 24.80705 1.000 46.76612  ? 58  VAL A CB  1 
ATOM   455  C CG1 . VAL A 1 58  ? -7.54524  -13.66130 24.44100 1.000 53.32612  ? 58  VAL A CG1 1 
ATOM   456  C CG2 . VAL A 1 58  ? -6.11866  -11.82514 25.48193 1.000 42.44612  ? 58  VAL A CG2 1 
ATOM   457  N N   . GLY A 1 59  ? -3.52796  -13.70922 27.14054 1.000 46.26612  ? 59  GLY A N   1 
ATOM   458  C CA  . GLY A 1 59  ? -2.15645  -13.35823 27.45712 1.000 40.13612  ? 59  GLY A CA  1 
ATOM   459  C C   . GLY A 1 59  ? -1.82933  -13.68307 28.90200 1.000 48.81612  ? 59  GLY A C   1 
ATOM   460  O O   . GLY A 1 59  ? -2.72784  -13.70158 29.75197 1.000 42.36612  ? 59  GLY A O   1 
ATOM   461  N N   . TYR A 1 60  ? -0.55940  -13.95752 29.19315 1.000 40.63612  ? 60  TYR A N   1 
ATOM   462  C CA  . TYR A 1 60  ? -0.12823  -14.14926 30.57258 1.000 37.91612  ? 60  TYR A CA  1 
ATOM   463  C C   . TYR A 1 60  ? 1.36823   -13.92616 30.69961 1.000 51.17971  ? 60  TYR A C   1 
ATOM   464  O O   . TYR A 1 60  ? 2.10217   -13.93191 29.70782 1.000 41.18612  ? 60  TYR A O   1 
ATOM   465  C CB  . TYR A 1 60  ? -0.50124  -15.53342 31.10634 1.000 37.48612  ? 60  TYR A CB  1 
ATOM   466  C CG  . TYR A 1 60  ? 0.41892   -16.65212 30.71189 1.000 42.17612  ? 60  TYR A CG  1 
ATOM   467  C CD1 . TYR A 1 60  ? 0.25760   -17.32572 29.50199 1.000 42.75612  ? 60  TYR A CD1 1 
ATOM   468  C CD2 . TYR A 1 60  ? 1.43529   -17.06695 31.55192 1.000 55.73612  ? 60  TYR A CD2 1 
ATOM   469  C CE1 . TYR A 1 60  ? 1.08636   -18.37604 29.14890 1.000 51.64612  ? 60  TYR A CE1 1 
ATOM   470  C CE2 . TYR A 1 60  ? 2.27091   -18.11190 31.21303 1.000 48.79612  ? 60  TYR A CE2 1 
ATOM   471  C CZ  . TYR A 1 60  ? 2.09556   -18.75954 30.01337 1.000 52.54870  ? 60  TYR A CZ  1 
ATOM   472  O OH  . TYR A 1 60  ? 2.93735   -19.79261 29.70030 1.000 53.08760  ? 60  TYR A OH  1 
ATOM   473  N N   . TYR A 1 61  ? 1.79987   -13.68814 31.94235 1.000 37.58612  ? 61  TYR A N   1 
ATOM   474  C CA  . TYR A 1 61  ? 3.20302   -13.73142 32.30527 1.000 41.30612  ? 61  TYR A CA  1 
ATOM   475  C C   . TYR A 1 61  ? 3.32767   -14.23355 33.72731 1.000 51.27612  ? 61  TYR A C   1 
ATOM   476  O O   . TYR A 1 61  ? 2.38383   -14.16016 34.50469 1.000 40.10612  ? 61  TYR A O   1 
ATOM   477  C CB  . TYR A 1 61  ? 3.88490   -12.37897 32.15333 1.000 37.20064  ? 61  TYR A CB  1 
ATOM   478  C CG  . TYR A 1 61  ? 3.47956   -11.27352 33.10216 1.000 49.59612  ? 61  TYR A CG  1 
ATOM   479  C CD1 . TYR A 1 61  ? 4.00325   -11.18034 34.38741 1.000 43.89612  ? 61  TYR A CD1 1 
ATOM   480  C CD2 . TYR A 1 61  ? 2.62326   -10.27454 32.67318 1.000 41.82612  ? 61  TYR A CD2 1 
ATOM   481  C CE1 . TYR A 1 61  ? 3.65526   -10.12649 35.22112 1.000 40.28612  ? 61  TYR A CE1 1 
ATOM   482  C CE2 . TYR A 1 61  ? 2.26586   -9.22572  33.48972 1.000 38.58612  ? 61  TYR A CE2 1 
ATOM   483  C CZ  . TYR A 1 61  ? 2.78264   -9.15318  34.76600 1.000 49.23354  ? 61  TYR A CZ  1 
ATOM   484  O OH  . TYR A 1 61  ? 2.42835   -8.10198  35.56667 1.000 43.77612  ? 61  TYR A OH  1 
ATOM   485  N N   . SER A 1 62  ? 4.51024   -14.74593 34.05456 1.000 43.06612  ? 62  SER A N   1 
ATOM   486  C CA  . SER A 1 62  ? 4.77619   -15.34679 35.34967 1.000 39.89612  ? 62  SER A CA  1 
ATOM   487  C C   . SER A 1 62  ? 5.99913   -14.69355 35.98886 1.000 46.81041  ? 62  SER A C   1 
ATOM   488  O O   . SER A 1 62  ? 6.97035   -14.36314 35.30404 1.000 47.06680  ? 62  SER A O   1 
ATOM   489  C CB  . SER A 1 62  ? 4.97521   -16.85752 35.19737 1.000 44.25612  ? 62  SER A CB  1 
ATOM   490  O OG  . SER A 1 62  ? 4.59627   -17.50872 36.39255 1.000 65.55612  ? 62  SER A OG  1 
ATOM   491  N N   . LEU A 1 63  ? 5.93313   -14.49329 37.29995 1.000 41.63612  ? 63  LEU A N   1 
ATOM   492  C CA  . LEU A 1 63  ? 7.00016   -13.88757 38.08803 1.000 48.40612  ? 63  LEU A CA  1 
ATOM   493  C C   . LEU A 1 63  ? 7.36944   -14.80134 39.24590 1.000 43.68438  ? 63  LEU A C   1 
ATOM   494  O O   . LEU A 1 63  ? 6.50608   -15.41597 39.87529 1.000 46.41612  ? 63  LEU A O   1 
ATOM   495  C CB  . LEU A 1 63  ? 6.59231   -12.54252 38.65009 1.000 41.26612  ? 63  LEU A CB  1 
ATOM   496  C CG  . LEU A 1 63  ? 6.32319   -11.37019 37.73098 1.000 40.73612  ? 63  LEU A CG  1 
ATOM   497  C CD1 . LEU A 1 63  ? 6.00745   -10.16327 38.61305 1.000 35.11612  ? 63  LEU A CD1 1 
ATOM   498  C CD2 . LEU A 1 63  ? 7.51525   -11.09625 36.85558 1.000 41.61208  ? 63  LEU A CD2 1 
ATOM   499  N N   . ALA A 1 64  ? 8.65973   -14.88062 39.51764 1.000 45.46612  ? 64  ALA A N   1 
ATOM   500  C CA  . ALA A 1 64  ? 9.18899   -15.65074 40.62260 1.000 39.23126  ? 64  ALA A CA  1 
ATOM   501  C C   . ALA A 1 64  ? 10.50642  -15.00648 41.01914 1.000 39.67363  ? 64  ALA A C   1 
ATOM   502  O O   . ALA A 1 64  ? 11.14079  -14.33267 40.20109 1.000 43.84612  ? 64  ALA A O   1 
ATOM   503  C CB  . ALA A 1 64  ? 9.38151   -17.12441 40.26236 1.000 38.57612  ? 64  ALA A CB  1 
ATOM   504  N N   . THR A 1 65  ? 10.89967  -15.19473 42.28195 1.000 42.30612  ? 65  THR A N   1 
ATOM   505  C CA  . THR A 1 65  ? 12.19388  -14.71927 42.75225 1.000 45.70612  ? 65  THR A CA  1 
ATOM   506  C C   . THR A 1 65  ? 13.27644  -15.71227 42.35924 1.000 50.02612  ? 65  THR A C   1 
ATOM   507  O O   . THR A 1 65  ? 13.02927  -16.91544 42.22490 1.000 44.77612  ? 65  THR A O   1 
ATOM   508  C CB  . THR A 1 65  ? 12.23289  -14.54461 44.28631 1.000 42.15612  ? 65  THR A CB  1 
ATOM   509  O OG1 . THR A 1 65  ? 11.75426  -15.72644 44.92439 1.000 43.90612  ? 65  THR A OG1 1 
ATOM   510  C CG2 . THR A 1 65  ? 11.38938  -13.38154 44.73128 1.000 45.00612  ? 65  THR A CG2 1 
ATOM   511  N N   . GLY A 1 66  ? 14.49618  -15.20981 42.21528 1.000 47.59612  ? 66  GLY A N   1 
ATOM   512  C CA  . GLY A 1 66  ? 15.61618  -16.06615 41.90805 1.000 60.08612  ? 66  GLY A CA  1 
ATOM   513  C C   . GLY A 1 66  ? 16.91153  -15.52404 42.48407 1.000 59.85612  ? 66  GLY A C   1 
ATOM   514  O O   . GLY A 1 66  ? 16.97942  -14.39233 42.95897 1.000 45.74612  ? 66  GLY A O   1 
ATOM   515  N N   . SER A 1 67  ? 17.94152  -16.35295 42.40266 1.000 49.48612  ? 67  SER A N   1 
ATOM   516  C CA  . SER A 1 67  ? 19.22658  -16.01003 42.99176 1.000 60.80165  ? 67  SER A CA  1 
ATOM   517  C C   . SER A 1 67  ? 20.35677  -16.42898 42.06526 1.000 52.81612  ? 67  SER A C   1 
ATOM   518  O O   . SER A 1 67  ? 20.30700  -17.48793 41.43603 1.000 53.42612  ? 67  SER A O   1 
ATOM   519  C CB  . SER A 1 67  ? 19.42968  -16.68122 44.36192 1.000 52.37612  ? 67  SER A CB  1 
ATOM   520  O OG  . SER A 1 67  ? 18.23989  -16.75200 45.12362 1.000 76.14612  ? 67  SER A OG  1 
ATOM   521  N N   . VAL A 1 68  ? 21.39516  -15.60988 42.03106 1.000 55.24612  ? 68  VAL A N   1 
ATOM   522  C CA  . VAL A 1 68  ? 22.64606  -15.93849 41.36397 1.000 56.81588  ? 68  VAL A CA  1 
ATOM   523  C C   . VAL A 1 68  ? 23.75975  -15.95401 42.41000 1.000 64.54612  ? 68  VAL A C   1 
ATOM   524  O O   . VAL A 1 68  ? 24.04800  -14.92875 43.02925 1.000 56.10612  ? 68  VAL A O   1 
ATOM   525  C CB  . VAL A 1 68  ? 22.96094  -14.94664 40.23702 1.000 43.84016  ? 68  VAL A CB  1 
ATOM   526  C CG1 . VAL A 1 68  ? 24.23509  -15.35065 39.55667 1.000 55.31235  ? 68  VAL A CG1 1 
ATOM   527  C CG2 . VAL A 1 68  ? 21.81243  -14.89606 39.23655 1.000 59.77612  ? 68  VAL A CG2 1 
ATOM   528  N N   . THR A 1 69  ? 24.38868  -17.10492 42.60589 1.000 62.34612  ? 69  THR A N   1 
ATOM   529  C CA  . THR A 1 69  ? 25.47003  -17.20997 43.57679 1.000 71.16507  ? 69  THR A CA  1 
ATOM   530  C C   . THR A 1 69  ? 26.70761  -17.81800 42.90156 1.000 68.13996  ? 69  THR A C   1 
ATOM   531  O O   . THR A 1 69  ? 26.68910  -18.15939 41.71664 1.000 59.71612  ? 69  THR A O   1 
ATOM   532  C CB  . THR A 1 69  ? 25.00486  -18.00278 44.81020 1.000 59.41612  ? 69  THR A CB  1 
ATOM   533  O OG1 . THR A 1 69  ? 26.06202  -18.07402 45.76409 1.000 76.53126  ? 69  THR A OG1 1 
ATOM   534  C CG2 . THR A 1 69  ? 24.56928  -19.40337 44.43361 1.000 63.01902  ? 69  THR A CG2 1 
ATOM   535  N N   . HIS A 1 70  ? 27.81151  -17.92642 43.64391 1.000 82.57638  ? 70  HIS A N   1 
ATOM   536  C CA  . HIS A 1 70  ? 29.07148  -18.41287 43.08971 1.000 71.68135  ? 70  HIS A CA  1 
ATOM   537  C C   . HIS A 1 70  ? 29.42352  -19.77496 43.67909 1.000 85.89763  ? 70  HIS A C   1 
ATOM   538  O O   . HIS A 1 70  ? 28.69607  -20.32268 44.50891 1.000 79.38612  ? 70  HIS A O   1 
ATOM   539  C CB  . HIS A 1 70  ? 30.20739  -17.41224 43.32066 1.000 78.80263  ? 70  HIS A CB  1 
ATOM   540  C CG  . HIS A 1 70  ? 30.25875  -16.85728 44.70805 1.000 89.14429  ? 70  HIS A CG  1 
ATOM   541  N ND1 . HIS A 1 70  ? 30.27173  -17.65659 45.83071 1.000 103.72816 ? 70  HIS A ND1 1 
ATOM   542  C CD2 . HIS A 1 70  ? 30.31373  -15.58139 45.15428 1.000 100.67040 ? 70  HIS A CD2 1 
ATOM   543  C CE1 . HIS A 1 70  ? 30.31789  -16.89697 46.91030 1.000 105.62813 ? 70  HIS A CE1 1 
ATOM   544  N NE2 . HIS A 1 70  ? 30.34603  -15.63307 46.52721 1.000 115.66577 ? 70  HIS A NE2 1 
ATOM   545  N N   . ALA A 1 71  ? 30.58430  -20.29454 43.25473 1.000 97.95747  ? 71  ALA A N   1 
ATOM   546  C CA  . ALA A 1 71  ? 30.94900  -21.69029 43.49541 1.000 97.73155  ? 71  ALA A CA  1 
ATOM   547  C C   . ALA A 1 71  ? 30.98508  -22.05446 44.98075 1.000 113.05685 ? 71  ALA A C   1 
ATOM   548  O O   . ALA A 1 71  ? 30.75990  -23.21933 45.33052 1.000 110.36597 ? 71  ALA A O   1 
ATOM   549  C CB  . ALA A 1 71  ? 32.30350  -21.98688 42.84512 1.000 93.46164  ? 71  ALA A CB  1 
ATOM   550  N N   . GLU A 1 72  ? 31.26231  -21.09301 45.86809 1.000 115.40956 ? 72  GLU A N   1 
ATOM   551  C CA  . GLU A 1 72  ? 31.40682  -21.38331 47.29118 1.000 118.73228 ? 72  GLU A CA  1 
ATOM   552  C C   . GLU A 1 72  ? 30.08596  -21.14886 48.04043 1.000 127.94101 ? 72  GLU A C   1 
ATOM   553  O O   . GLU A 1 72  ? 29.03180  -20.93397 47.43596 1.000 132.84637 ? 72  GLU A O   1 
ATOM   554  C CB  . GLU A 1 72  ? 32.54840  -20.55656 47.87697 1.000 120.54481 ? 72  GLU A CB  1 
ATOM   555  C CG  . GLU A 1 72  ? 33.90715  -21.22206 47.74302 1.000 126.49147 ? 72  GLU A CG  1 
ATOM   556  C CD  . GLU A 1 72  ? 34.28709  -22.01472 48.98416 1.000 138.44983 ? 72  GLU A CD  1 
ATOM   557  O OE1 . GLU A 1 72  ? 34.69087  -21.38653 49.98902 1.000 132.76902 ? 72  GLU A OE1 1 
ATOM   558  O OE2 . GLU A 1 72  ? 34.18872  -23.26490 48.95139 1.000 126.26496 ? 72  GLU A OE2 1 
ATOM   559  N N   . LEU A 1 73  ? 30.12551  -21.19692 49.37411 1.000 122.32742 ? 73  LEU A N   1 
ATOM   560  C CA  . LEU A 1 73  ? 28.91187  -21.05370 50.18824 1.000 117.81539 ? 73  LEU A CA  1 
ATOM   561  C C   . LEU A 1 73  ? 28.22468  -19.71407 49.94345 1.000 113.60962 ? 73  LEU A C   1 
ATOM   562  O O   . LEU A 1 73  ? 27.14890  -19.66369 49.35264 1.000 109.19633 ? 73  LEU A O   1 
ATOM   563  C CB  . LEU A 1 73  ? 29.23115  -21.20157 51.67986 1.000 106.62551 ? 73  LEU A CB  1 
ATOM   564  C CG  . LEU A 1 73  ? 29.98770  -22.44684 52.15340 1.000 105.66440 ? 73  LEU A CG  1 
ATOM   565  C CD1 . LEU A 1 73  ? 30.45720  -22.24561 53.58633 1.000 106.31842 ? 73  LEU A CD1 1 
ATOM   566  C CD2 . LEU A 1 73  ? 29.13994  -23.71530 52.03836 1.000 94.77127  ? 73  LEU A CD2 1 
ATOM   567  N N   . PRO A 1 82  ? 26.08855  -9.19475  48.71564 1.000 84.12619  ? 82  PRO A N   1 
ATOM   568  C CA  . PRO A 1 82  ? 24.97771  -10.15669 48.81803 1.000 102.52932 ? 82  PRO A CA  1 
ATOM   569  C C   . PRO A 1 82  ? 25.39382  -11.57429 48.36573 1.000 98.29898  ? 82  PRO A C   1 
ATOM   570  O O   . PRO A 1 82  ? 25.72697  -11.71796 47.19143 1.000 95.08959  ? 82  PRO A O   1 
ATOM   571  C CB  . PRO A 1 82  ? 23.90256  -9.55894  47.87874 1.000 95.51895  ? 82  PRO A CB  1 
ATOM   572  C CG  . PRO A 1 82  ? 24.41149  -8.15849  47.49566 1.000 86.39119  ? 82  PRO A CG  1 
ATOM   573  C CD  . PRO A 1 82  ? 25.90294  -8.25062  47.59907 1.000 94.95270  ? 82  PRO A CD  1 
ATOM   574  N N   . ASN A 1 83  ? 25.37103  -12.57984 49.26156 1.000 97.64342  ? 83  ASN A N   1 
ATOM   575  C CA  . ASN A 1 83  ? 25.92576  -13.89873 48.91816 1.000 94.19721  ? 83  ASN A CA  1 
ATOM   576  C C   . ASN A 1 83  ? 25.25158  -14.49068 47.69607 1.000 99.58528  ? 83  ASN A C   1 
ATOM   577  O O   . ASN A 1 83  ? 25.96758  -14.85555 46.73163 1.000 101.00524 ? 83  ASN A O   1 
ATOM   578  C CB  . ASN A 1 83  ? 25.86719  -14.82060 50.14798 1.000 99.15733  ? 83  ASN A CB  1 
ATOM   579  C CG  . ASN A 1 83  ? 26.58486  -16.17473 49.92555 1.000 114.55266 ? 83  ASN A CG  1 
ATOM   580  O OD1 . ASN A 1 83  ? 27.16594  -16.43723 48.86250 1.000 105.72067 ? 83  ASN A OD1 1 
ATOM   581  N ND2 . ASN A 1 83  ? 26.52484  -17.04124 50.93898 1.000 108.13132 ? 83  ASN A ND2 1 
ATOM   582  N N   . PRO A 1 84  ? 23.90765  -14.64948 47.62801 1.000 77.73576  ? 84  PRO A N   1 
ATOM   583  C CA  . PRO A 1 84  ? 23.26493  -14.68829 46.31086 1.000 74.34686  ? 84  PRO A CA  1 
ATOM   584  C C   . PRO A 1 84  ? 22.75112  -13.30112 45.95227 1.000 55.36148  ? 84  PRO A C   1 
ATOM   585  O O   . PRO A 1 84  ? 22.15773  -12.63214 46.80747 1.000 62.38943  ? 84  PRO A O   1 
ATOM   586  C CB  . PRO A 1 84  ? 22.12190  -15.69621 46.47931 1.000 61.24612  ? 84  PRO A CB  1 
ATOM   587  C CG  . PRO A 1 84  ? 22.05390  -16.03095 47.92252 1.000 75.71414  ? 84  PRO A CG  1 
ATOM   588  C CD  . PRO A 1 84  ? 23.01643  -15.18065 48.67927 1.000 76.79466  ? 84  PRO A CD  1 
ATOM   589  N N   . VAL A 1 85  ? 23.00936  -12.83326 44.73838 1.000 51.58612  ? 85  VAL A N   1 
ATOM   590  C CA  . VAL A 1 85  ? 22.37717  -11.59146 44.28957 1.000 61.31612  ? 85  VAL A CA  1 
ATOM   591  C C   . VAL A 1 85  ? 20.89728  -11.86694 44.00155 1.000 51.35612  ? 85  VAL A C   1 
ATOM   592  O O   . VAL A 1 85  ? 20.57225  -12.91370 43.41280 1.000 53.24612  ? 85  VAL A O   1 
ATOM   593  C CB  . VAL A 1 85  ? 23.10112  -11.02292 43.05763 1.000 59.50603  ? 85  VAL A CB  1 
ATOM   594  C CG1 . VAL A 1 85  ? 23.62587  -12.10874 42.20148 1.000 72.33619  ? 85  VAL A CG1 1 
ATOM   595  C CG2 . VAL A 1 85  ? 22.16428  -10.16400 42.23619 1.000 59.26612  ? 85  VAL A CG2 1 
ATOM   596  N N   . PRO A 1 86  ? 19.98601  -11.00749 44.45273 1.000 62.43612  ? 86  PRO A N   1 
ATOM   597  C CA  . PRO A 1 86  ? 18.55204  -11.29249 44.28891 1.000 46.57612  ? 86  PRO A CA  1 
ATOM   598  C C   . PRO A 1 86  ? 18.02067  -10.74931 42.96359 1.000 47.46612  ? 86  PRO A C   1 
ATOM   599  O O   . PRO A 1 86  ? 18.22536  -9.58210  42.61826 1.000 48.97612  ? 86  PRO A O   1 
ATOM   600  C CB  . PRO A 1 86  ? 17.91778  -10.57774 45.49020 1.000 45.44612  ? 86  PRO A CB  1 
ATOM   601  C CG  . PRO A 1 86  ? 18.81820  -9.42490  45.72761 1.000 49.18612  ? 86  PRO A CG  1 
ATOM   602  C CD  . PRO A 1 86  ? 20.21522  -9.87382  45.36629 1.000 53.56612  ? 86  PRO A CD  1 
ATOM   603  N N   . VAL A 1 87  ? 17.33396  -11.61113 42.21812 1.000 42.96612  ? 87  VAL A N   1 
ATOM   604  C CA  . VAL A 1 87  ? 16.73197  -11.24211 40.94352 1.000 45.31182  ? 87  VAL A CA  1 
ATOM   605  C C   . VAL A 1 87  ? 15.27326  -11.66879 40.95740 1.000 45.71983  ? 87  VAL A C   1 
ATOM   606  O O   . VAL A 1 87  ? 14.83332  -12.44499 41.80985 1.000 45.28612  ? 87  VAL A O   1 
ATOM   607  C CB  . VAL A 1 87  ? 17.45484  -11.86383 39.71949 1.000 41.73612  ? 87  VAL A CB  1 
ATOM   608  C CG1 . VAL A 1 87  ? 18.85599  -11.33094 39.58313 1.000 41.05612  ? 87  VAL A CG1 1 
ATOM   609  C CG2 . VAL A 1 87  ? 17.45424  -13.39110 39.80609 1.000 36.39612  ? 87  VAL A CG2 1 
ATOM   610  N N   . VAL A 1 88  ? 14.52025  -11.15475 39.98712 1.000 41.92612  ? 88  VAL A N   1 
ATOM   611  C CA  . VAL A 1 88  ? 13.18191  -11.65888 39.71603 1.000 41.82612  ? 88  VAL A CA  1 
ATOM   612  C C   . VAL A 1 88  ? 13.19547  -12.29266 38.32360 1.000 43.12612  ? 88  VAL A C   1 
ATOM   613  O O   . VAL A 1 88  ? 13.62400  -11.66815 37.34869 1.000 41.87612  ? 88  VAL A O   1 
ATOM   614  C CB  . VAL A 1 88  ? 12.10705  -10.56331 39.82433 1.000 44.11612  ? 88  VAL A CB  1 
ATOM   615  C CG1 . VAL A 1 88  ? 10.81151  -11.04154 39.19258 1.000 39.39612  ? 88  VAL A CG1 1 
ATOM   616  C CG2 . VAL A 1 88  ? 11.88176  -10.16607 41.28821 1.000 40.39612  ? 88  VAL A CG2 1 
ATOM   617  N N   . LEU A 1 89  ? 12.75817  -13.53854 38.25044 1.000 41.85612  ? 89  LEU A N   1 
ATOM   618  C CA  . LEU A 1 89  ? 12.66032  -14.27380 37.00656 1.000 41.70612  ? 89  LEU A CA  1 
ATOM   619  C C   . LEU A 1 89  ? 11.30080  -14.01241 36.38313 1.000 48.36052  ? 89  LEU A C   1 
ATOM   620  O O   . LEU A 1 89  ? 10.26896  -14.38214 36.95974 1.000 42.97612  ? 89  LEU A O   1 
ATOM   621  C CB  . LEU A 1 89  ? 12.83024  -15.76720 37.25513 1.000 42.66612  ? 89  LEU A CB  1 
ATOM   622  C CG  . LEU A 1 89  ? 14.12717  -16.14730 37.95382 1.000 55.78033  ? 89  LEU A CG  1 
ATOM   623  C CD1 . LEU A 1 89  ? 14.05510  -17.57374 38.46486 1.000 56.12343  ? 89  LEU A CD1 1 
ATOM   624  C CD2 . LEU A 1 89  ? 15.29206  -15.94526 37.00469 1.000 58.01612  ? 89  LEU A CD2 1 
ATOM   625  N N   . LEU A 1 90  ? 11.30311  -13.36565 35.21919 1.000 40.22612  ? 90  LEU A N   1 
ATOM   626  C CA  . LEU A 1 90  ? 10.12263  -13.28761 34.36603 1.000 49.11612  ? 90  LEU A CA  1 
ATOM   627  C C   . LEU A 1 90  ? 10.19855  -14.52186 33.47575 1.000 44.41612  ? 90  LEU A C   1 
ATOM   628  O O   . LEU A 1 90  ? 10.84339  -14.51951 32.43659 1.000 45.23612  ? 90  LEU A O   1 
ATOM   629  C CB  . LEU A 1 90  ? 10.10463  -11.98586 33.57241 1.000 40.19612  ? 90  LEU A CB  1 
ATOM   630  C CG  . LEU A 1 90  ? 9.04009   -11.83217 32.47812 1.000 56.96612  ? 90  LEU A CG  1 
ATOM   631  C CD1 . LEU A 1 90  ? 7.63958   -11.82971 33.03916 1.000 40.30612  ? 90  LEU A CD1 1 
ATOM   632  C CD2 . LEU A 1 90  ? 9.27429   -10.57800 31.68251 1.000 46.59612  ? 90  LEU A CD2 1 
ATOM   633  N N   . GLY A 1 91  ? 9.58634   -15.60940 33.93374 1.000 50.31612  ? 91  GLY A N   1 
ATOM   634  C CA  . GLY A 1 91  ? 9.85807   -16.90854 33.36181 1.000 54.25612  ? 91  GLY A CA  1 
ATOM   635  C C   . GLY A 1 91  ? 9.03936   -17.26009 32.13964 1.000 57.89676  ? 91  GLY A C   1 
ATOM   636  O O   . GLY A 1 91  ? 9.44821   -18.13645 31.37295 1.000 56.54401  ? 91  GLY A O   1 
ATOM   637  N N   . ARG A 1 92  ? 7.89119   -16.62254 31.95124 1.000 52.98612  ? 92  ARG A N   1 
ATOM   638  C CA  . ARG A 1 92  ? 7.03283   -16.90366 30.81453 1.000 53.92612  ? 92  ARG A CA  1 
ATOM   639  C C   . ARG A 1 92  ? 6.32086   -15.61378 30.47176 1.000 54.17166  ? 92  ARG A C   1 
ATOM   640  O O   . ARG A 1 92  ? 6.00400   -14.83419 31.36753 1.000 48.67612  ? 92  ARG A O   1 
ATOM   641  C CB  . ARG A 1 92  ? 6.02313   -18.01847 31.11789 1.000 48.31612  ? 92  ARG A CB  1 
ATOM   642  C CG  . ARG A 1 92  ? 6.60052   -19.43163 31.14190 1.000 42.19612  ? 92  ARG A CG  1 
ATOM   643  C CD  . ARG A 1 92  ? 6.38049   -20.10445 32.47589 1.000 52.55612  ? 92  ARG A CD  1 
ATOM   644  N NE  . ARG A 1 92  ? 7.22530   -21.28375 32.63674 1.000 62.41331  ? 92  ARG A NE  1 
ATOM   645  C CZ  . ARG A 1 92  ? 7.81461   -21.65201 33.77019 1.000 65.36158  ? 92  ARG A CZ  1 
ATOM   646  N NH1 . ARG A 1 92  ? 7.66380   -20.95898 34.89283 1.000 62.70181  ? 92  ARG A NH1 1 
ATOM   647  N NH2 . ARG A 1 92  ? 8.56657   -22.75159 33.78195 1.000 70.21640  ? 92  ARG A NH2 1 
ATOM   648  N N   . LEU A 1 93  ? 6.14437   -15.36187 29.17614 1.000 38.05612  ? 93  LEU A N   1 
ATOM   649  C CA  . LEU A 1 93  ? 5.32001   -14.25669 28.70184 1.000 45.66612  ? 93  LEU A CA  1 
ATOM   650  C C   . LEU A 1 93  ? 4.87694   -14.62618 27.29766 1.000 57.08612  ? 93  LEU A C   1 
ATOM   651  O O   . LEU A 1 93  ? 5.71734   -14.96229 26.44840 1.000 44.48612  ? 93  LEU A O   1 
ATOM   652  C CB  . LEU A 1 93  ? 6.06955   -12.92384 28.71184 1.000 36.97612  ? 93  LEU A CB  1 
ATOM   653  C CG  . LEU A 1 93  ? 5.17544   -11.68914 28.45025 1.000 49.52612  ? 93  LEU A CG  1 
ATOM   654  C CD1 . LEU A 1 93  ? 5.62605   -10.44834 29.19978 1.000 53.23612  ? 93  LEU A CD1 1 
ATOM   655  C CD2 . LEU A 1 93  ? 5.07996   -11.37098 26.98911 1.000 44.81612  ? 93  LEU A CD2 1 
ATOM   656  N N   . ALA A 1 94  ? 3.57088   -14.56180 27.05590 1.000 46.96612  ? 94  ALA A N   1 
ATOM   657  C CA  . ALA A 1 94  ? 2.98626   -15.12090 25.85157 1.000 49.79539  ? 94  ALA A CA  1 
ATOM   658  C C   . ALA A 1 94  ? 1.66427   -14.42833 25.57396 1.000 53.45800  ? 94  ALA A C   1 
ATOM   659  O O   . ALA A 1 94  ? 0.89621   -14.14329 26.48881 1.000 45.50612  ? 94  ALA A O   1 
ATOM   660  C CB  . ALA A 1 94  ? 2.77936   -16.64466 25.97204 1.000 38.05612  ? 94  ALA A CB  1 
ATOM   661  N N   . VAL A 1 95  ? 1.41533   -14.16417 24.29459 1.000 41.17612  ? 95  VAL A N   1 
ATOM   662  C CA  . VAL A 1 95  ? 0.14955   -13.62742 23.80968 1.000 43.65612  ? 95  VAL A CA  1 
ATOM   663  C C   . VAL A 1 95  ? -0.48202  -14.65575 22.88376 1.000 48.32381  ? 95  VAL A C   1 
ATOM   664  O O   . VAL A 1 95  ? 0.22475   -15.35163 22.14629 1.000 47.45612  ? 95  VAL A O   1 
ATOM   665  C CB  . VAL A 1 95  ? 0.36865   -12.28541 23.09081 1.000 49.82612  ? 95  VAL A CB  1 
ATOM   666  C CG1 . VAL A 1 95  ? -0.88172  -11.82596 22.39534 1.000 48.16488  ? 95  VAL A CG1 1 
ATOM   667  C CG2 . VAL A 1 95  ? 0.80529   -11.24280 24.08792 1.000 48.96751  ? 95  VAL A CG2 1 
ATOM   668  N N   . ASP A 1 96  ? -1.80094  -14.78511 22.95545 1.000 46.44612  ? 96  ASP A N   1 
ATOM   669  C CA  . ASP A 1 96  ? -2.50543  -15.72791 22.09580 1.000 43.71612  ? 96  ASP A CA  1 
ATOM   670  C C   . ASP A 1 96  ? -2.25976  -15.43076 20.61895 1.000 43.02248  ? 96  ASP A C   1 
ATOM   671  O O   . ASP A 1 96  ? -2.22357  -14.27143 20.19908 1.000 45.17612  ? 96  ASP A O   1 
ATOM   672  C CB  . ASP A 1 96  ? -4.00769  -15.70066 22.38847 1.000 50.24612  ? 96  ASP A CB  1 
ATOM   673  C CG  . ASP A 1 96  ? -4.74179  -16.88681 21.79204 1.000 67.73113  ? 96  ASP A CG  1 
ATOM   674  O OD1 . ASP A 1 96  ? -5.08060  -16.81758 20.59470 1.000 59.56612  ? 96  ASP A OD1 1 
ATOM   675  O OD2 . ASP A 1 96  ? -4.94848  -17.89592 22.49757 1.000 55.41958  ? 96  ASP A OD2 1 
ATOM   676  N N   . VAL A 1 97  ? -2.04658  -16.50413 19.84947 1.000 42.54612  ? 97  VAL A N   1 
ATOM   677  C CA  . VAL A 1 97  ? -1.89729  -16.41799 18.38641 1.000 60.40608  ? 97  VAL A CA  1 
ATOM   678  C C   . VAL A 1 97  ? -2.96615  -15.52822 17.75547 1.000 63.50612  ? 97  VAL A C   1 
ATOM   679  O O   . VAL A 1 97  ? -2.68195  -14.74338 16.83973 1.000 58.79612  ? 97  VAL A O   1 
ATOM   680  C CB  . VAL A 1 97  ? -1.92421  -17.82940 17.77184 1.000 52.95612  ? 97  VAL A CB  1 
ATOM   681  C CG1 . VAL A 1 97  ? -2.35205  -17.76908 16.34111 1.000 80.39402  ? 97  VAL A CG1 1 
ATOM   682  C CG2 . VAL A 1 97  ? -0.56218  -18.44041 17.86572 1.000 54.75599  ? 97  VAL A CG2 1 
ATOM   683  N N   . CYS A 1 98  ? -4.21037  -15.64162 18.22459 1.000 54.89612  ? 98  CYS A N   1 
ATOM   684  C CA  . CYS A 1 98  ? -5.32737  -14.89385 17.65605 1.000 60.86104  ? 98  CYS A CA  1 
ATOM   685  C C   . CYS A 1 98  ? -5.30261  -13.41774 18.00526 1.000 57.01864  ? 98  CYS A C   1 
ATOM   686  O O   . CYS A 1 98  ? -6.17442  -12.67916 17.53116 1.000 61.23612  ? 98  CYS A O   1 
ATOM   687  C CB  . CYS A 1 98  ? -6.67835  -15.46789 18.11852 1.000 72.61612  ? 98  CYS A CB  1 
ATOM   688  S SG  . CYS A 1 98  ? -6.87999  -17.25791 18.01447 1.000 78.78612  ? 98  CYS A SG  1 
ATOM   689  N N   . THR A 1 99  ? -4.36142  -12.96393 18.83486 1.000 48.47822  ? 99  THR A N   1 
ATOM   690  C CA  . THR A 1 99  ? -4.38605  -11.57606 19.28232 1.000 59.82632  ? 99  THR A CA  1 
ATOM   691  C C   . THR A 1 99  ? -3.02745  -10.90425 19.12212 1.000 60.51393  ? 99  THR A C   1 
ATOM   692  O O   . THR A 1 99  ? -2.73568  -9.91601  19.80334 1.000 63.64612  ? 99  THR A O   1 
ATOM   693  C CB  . THR A 1 99  ? -4.88297  -11.47879 20.72816 1.000 64.98612  ? 99  THR A CB  1 
ATOM   694  O OG1 . THR A 1 99  ? -4.18871  -12.42928 21.54390 1.000 66.72283  ? 99  THR A OG1 1 
ATOM   695  C CG2 . THR A 1 99  ? -6.36397  -11.76132 20.80862 1.000 56.66612  ? 99  THR A CG2 1 
ATOM   696  N N   . ARG A 1 100 ? -2.20279  -11.41190 18.20366 1.000 63.71405  ? 100 ARG A N   1 
ATOM   697  C CA  . ARG A 1 100 ? -0.91853  -10.80435 17.89292 1.000 54.22612  ? 100 ARG A CA  1 
ATOM   698  C C   . ARG A 1 100 ? -1.09848  -9.50017  17.12930 1.000 64.86612  ? 100 ARG A C   1 
ATOM   699  O O   . ARG A 1 100 ? -2.07440  -9.30921  16.40032 1.000 65.51855  ? 100 ARG A O   1 
ATOM   700  C CB  . ARG A 1 100 ? -0.07327  -11.76401 17.07951 1.000 54.15612  ? 100 ARG A CB  1 
ATOM   701  C CG  . ARG A 1 100 ? 0.14497   -13.06199 17.80495 1.000 63.48612  ? 100 ARG A CG  1 
ATOM   702  C CD  . ARG A 1 100 ? 1.21503   -12.92108 18.86626 1.000 42.99997  ? 100 ARG A CD  1 
ATOM   703  N NE  . ARG A 1 100 ? 1.39567   -14.16537 19.60384 1.000 58.67612  ? 100 ARG A NE  1 
ATOM   704  C CZ  . ARG A 1 100 ? 1.99928   -15.25105 19.14768 1.000 52.21612  ? 100 ARG A CZ  1 
ATOM   705  N NH1 . ARG A 1 100 ? 2.58450   -15.26969 17.96210 1.000 59.28194  ? 100 ARG A NH1 1 
ATOM   706  N NH2 . ARG A 1 100 ? 2.01236   -16.34999 19.90215 1.000 52.98612  ? 100 ARG A NH2 1 
ATOM   707  N N   . GLY A 1 101 ? -0.14740  -8.59309  17.31892 1.000 52.48191  ? 101 GLY A N   1 
ATOM   708  C CA  . GLY A 1 101 ? -0.09594  -7.35184  16.58253 1.000 52.34612  ? 101 GLY A CA  1 
ATOM   709  C C   . GLY A 1 101 ? -0.87718  -6.20839  17.17658 1.000 58.65612  ? 101 GLY A C   1 
ATOM   710  O O   . GLY A 1 101 ? -0.92362  -5.13067  16.57867 1.000 55.66612  ? 101 GLY A O   1 
ATOM   711  N N   . HIS A 1 102 ? -1.48674  -6.39248  18.33328 1.000 59.65022  ? 102 HIS A N   1 
ATOM   712  C CA  . HIS A 1 102 ? -2.29569  -5.34582  18.93231 1.000 59.13558  ? 102 HIS A CA  1 
ATOM   713  C C   . HIS A 1 102 ? -1.57928  -4.61226  20.06277 1.000 65.70612  ? 102 HIS A C   1 
ATOM   714  O O   . HIS A 1 102 ? -2.18302  -3.74073  20.69943 1.000 63.31612  ? 102 HIS A O   1 
ATOM   715  C CB  . HIS A 1 102 ? -3.59570  -5.95404  19.43919 1.000 62.89312  ? 102 HIS A CB  1 
ATOM   716  C CG  . HIS A 1 102 ? -4.44138  -6.54448  18.35575 1.000 68.35582  ? 102 HIS A CG  1 
ATOM   717  N ND1 . HIS A 1 102 ? -5.37815  -5.81265  17.66161 1.000 77.89396  ? 102 HIS A ND1 1 
ATOM   718  C CD2 . HIS A 1 102 ? -4.48367  -7.79700  17.84262 1.000 74.27612  ? 102 HIS A CD2 1 
ATOM   719  C CE1 . HIS A 1 102 ? -5.96818  -6.59196  16.77312 1.000 78.96647  ? 102 HIS A CE1 1 
ATOM   720  N NE2 . HIS A 1 102 ? -5.44331  -7.80052  16.86253 1.000 74.10877  ? 102 HIS A NE2 1 
ATOM   721  N N   . GLY A 1 103 ? -0.30556  -4.92899  20.31868 1.000 57.38612  ? 103 GLY A N   1 
ATOM   722  C CA  . GLY A 1 103 ? 0.44704   -4.27690  21.36921 1.000 55.35150  ? 103 GLY A CA  1 
ATOM   723  C C   . GLY A 1 103 ? 0.32715   -4.93119  22.73095 1.000 51.14758  ? 103 GLY A C   1 
ATOM   724  O O   . GLY A 1 103 ? 0.94805   -4.45246  23.67998 1.000 57.00076  ? 103 GLY A O   1 
ATOM   725  N N   . PHE A 1 104 ? -0.43595  -6.01867  22.84172 1.000 42.95612  ? 104 PHE A N   1 
ATOM   726  C CA  . PHE A 1 104 ? -0.60594  -6.70429  24.11217 1.000 49.36612  ? 104 PHE A CA  1 
ATOM   727  C C   . PHE A 1 104 ? 0.71051   -7.24608  24.63575 1.000 51.80836  ? 104 PHE A C   1 
ATOM   728  O O   . PHE A 1 104 ? 0.89638   -7.32823  25.85533 1.000 50.62431  ? 104 PHE A O   1 
ATOM   729  C CB  . PHE A 1 104 ? -1.61899  -7.83556  23.96252 1.000 40.00612  ? 104 PHE A CB  1 
ATOM   730  C CG  . PHE A 1 104 ? -2.95799  -7.36587  23.51856 1.000 62.74612  ? 104 PHE A CG  1 
ATOM   731  C CD1 . PHE A 1 104 ? -3.33016  -6.04839  23.71114 1.000 55.57886  ? 104 PHE A CD1 1 
ATOM   732  C CD2 . PHE A 1 104 ? -3.84153  -8.22481  22.90718 1.000 53.74612  ? 104 PHE A CD2 1 
ATOM   733  C CE1 . PHE A 1 104 ? -4.55229  -5.59901  23.30186 1.000 57.59769  ? 104 PHE A CE1 1 
ATOM   734  C CE2 . PHE A 1 104 ? -5.07308  -7.78295  22.49827 1.000 54.08612  ? 104 PHE A CE2 1 
ATOM   735  C CZ  . PHE A 1 104 ? -5.42676  -6.47184  22.68795 1.000 52.34408  ? 104 PHE A CZ  1 
ATOM   736  N N   . GLY A 1 105 ? 1.62387   -7.60846  23.73101 1.000 49.26508  ? 105 GLY A N   1 
ATOM   737  C CA  . GLY A 1 105 ? 2.91675   -8.12655  24.14669 1.000 42.56543  ? 105 GLY A CA  1 
ATOM   738  C C   . GLY A 1 105 ? 3.73884   -7.08482  24.86861 1.000 41.49962  ? 105 GLY A C   1 
ATOM   739  O O   . GLY A 1 105 ? 4.19217   -7.29883  26.00228 1.000 43.76666  ? 105 GLY A O   1 
ATOM   740  N N   . LYS A 1 106 ? 3.89651   -5.92052  24.25789 1.000 42.21612  ? 106 LYS A N   1 
ATOM   741  C CA  . LYS A 1 106 ? 4.61252   -4.87770  24.96076 1.000 44.79612  ? 106 LYS A CA  1 
ATOM   742  C C   . LYS A 1 106 ? 3.82050   -4.33717  26.15156 1.000 46.80237  ? 106 LYS A C   1 
ATOM   743  O O   . LYS A 1 106 ? 4.42834   -3.87409  27.11652 1.000 45.77612  ? 106 LYS A O   1 
ATOM   744  C CB  . LYS A 1 106 ? 4.99990   -3.76803  23.99380 1.000 55.68612  ? 106 LYS A CB  1 
ATOM   745  C CG  . LYS A 1 106 ? 3.88718   -2.86282  23.58583 1.000 51.45786  ? 106 LYS A CG  1 
ATOM   746  C CD  . LYS A 1 106 ? 4.41466   -1.86501  22.59545 1.000 70.80112  ? 106 LYS A CD  1 
ATOM   747  C CE  . LYS A 1 106 ? 3.32905   -0.93907  22.10381 1.000 62.30809  ? 106 LYS A CE  1 
ATOM   748  N NZ  . LYS A 1 106 ? 3.89697   -0.03280  21.06702 1.000 59.76881  ? 106 LYS A NZ  1 
ATOM   749  N N   . TRP A 1 107 ? 2.48994   -4.41159  26.13015 1.000 48.54612  ? 107 TRP A N   1 
ATOM   750  C CA  . TRP A 1 107 ? 1.73181   -4.01588  27.31248 1.000 47.27612  ? 107 TRP A CA  1 
ATOM   751  C C   . TRP A 1 107 ? 2.01824   -4.95099  28.47895 1.000 46.20678  ? 107 TRP A C   1 
ATOM   752  O O   . TRP A 1 107 ? 2.32942   -4.49527  29.58144 1.000 43.74612  ? 107 TRP A O   1 
ATOM   753  C CB  . TRP A 1 107 ? 0.24390   -4.00500  27.02181 1.000 45.43041  ? 107 TRP A CB  1 
ATOM   754  C CG  . TRP A 1 107 ? -0.18884  -2.94997  26.07942 1.000 59.30047  ? 107 TRP A CG  1 
ATOM   755  C CD1 . TRP A 1 107 ? 0.60027   -2.05297  25.42333 1.000 56.54612  ? 107 TRP A CD1 1 
ATOM   756  C CD2 . TRP A 1 107 ? -1.52960  -2.69723  25.65292 1.000 53.96612  ? 107 TRP A CD2 1 
ATOM   757  N NE1 . TRP A 1 107 ? -0.16790  -1.25156  24.62866 1.000 59.85612  ? 107 TRP A NE1 1 
ATOM   758  C CE2 . TRP A 1 107 ? -1.48057  -1.62551  24.75134 1.000 60.78118  ? 107 TRP A CE2 1 
ATOM   759  C CE3 . TRP A 1 107 ? -2.77078  -3.26971  25.95956 1.000 52.99226  ? 107 TRP A CE3 1 
ATOM   760  C CZ2 . TRP A 1 107 ? -2.62356  -1.10967  24.14554 1.000 64.07524  ? 107 TRP A CZ2 1 
ATOM   761  C CZ3 . TRP A 1 107 ? -3.90172  -2.75773  25.36215 1.000 70.31362  ? 107 TRP A CZ3 1 
ATOM   762  C CH2 . TRP A 1 107 ? -3.82100  -1.68558  24.46016 1.000 59.54397  ? 107 TRP A CH2 1 
ATOM   763  N N   . LEU A 1 108 ? 1.91027   -6.26082  28.25058 1.000 39.10612  ? 108 LEU A N   1 
ATOM   764  C CA  . LEU A 1 108 ? 2.24295   -7.21896  29.29380 1.000 40.81612  ? 108 LEU A CA  1 
ATOM   765  C C   . LEU A 1 108 ? 3.63524   -6.96056  29.84912 1.000 48.02223  ? 108 LEU A C   1 
ATOM   766  O O   . LEU A 1 108 ? 3.83017   -6.92137  31.06904 1.000 47.90612  ? 108 LEU A O   1 
ATOM   767  C CB  . LEU A 1 108 ? 2.14986   -8.64182  28.75779 1.000 35.74612  ? 108 LEU A CB  1 
ATOM   768  C CG  . LEU A 1 108 ? 0.75313   -9.22344  28.65871 1.000 44.50612  ? 108 LEU A CG  1 
ATOM   769  C CD1 . LEU A 1 108 ? 0.80718   -10.58885 27.97853 1.000 41.75612  ? 108 LEU A CD1 1 
ATOM   770  C CD2 . LEU A 1 108 ? 0.13680   -9.32056  30.06630 1.000 41.80612  ? 108 LEU A CD2 1 
ATOM   771  N N   . LEU A 1 109 ? 4.61705   -6.77148  28.96784 1.000 40.88612  ? 109 LEU A N   1 
ATOM   772  C CA  . LEU A 1 109 ? 5.98297   -6.57823  29.42981 1.000 45.54612  ? 109 LEU A CA  1 
ATOM   773  C C   . LEU A 1 109 ? 6.12101   -5.28654  30.21032 1.000 45.47716  ? 109 LEU A C   1 
ATOM   774  O O   . LEU A 1 109 ? 6.85403   -5.23121  31.19955 1.000 50.94612  ? 109 LEU A O   1 
ATOM   775  C CB  . LEU A 1 109 ? 6.94899   -6.58683  28.25796 1.000 38.90885  ? 109 LEU A CB  1 
ATOM   776  C CG  . LEU A 1 109 ? 8.41696   -6.44817  28.65206 1.000 44.37586  ? 109 LEU A CG  1 
ATOM   777  C CD1 . LEU A 1 109 ? 8.86473   -7.53129  29.61349 1.000 39.93612  ? 109 LEU A CD1 1 
ATOM   778  C CD2 . LEU A 1 109 ? 9.25803   -6.48261  27.40822 1.000 43.38612  ? 109 LEU A CD2 1 
ATOM   779  N N   . SER A 1 110 ? 5.43263   -4.23563  29.78249 1.000 49.55612  ? 110 SER A N   1 
ATOM   780  C CA  . SER A 1 110 ? 5.46603   -3.00093  30.54422 1.000 46.41612  ? 110 SER A CA  1 
ATOM   781  C C   . SER A 1 110 ? 4.86306   -3.20588  31.93173 1.000 45.33573  ? 110 SER A C   1 
ATOM   782  O O   . SER A 1 110 ? 5.43544   -2.76556  32.93237 1.000 45.88612  ? 110 SER A O   1 
ATOM   783  C CB  . SER A 1 110 ? 4.73754   -1.90617  29.77570 1.000 49.91612  ? 110 SER A CB  1 
ATOM   784  O OG  . SER A 1 110 ? 4.27762   -0.88660  30.62866 1.000 60.55612  ? 110 SER A OG  1 
ATOM   785  N N   . ASP A 1 111 ? 3.71963   -3.89161  32.01043 1.000 44.19612  ? 111 ASP A N   1 
ATOM   786  C CA  . ASP A 1 111 ? 3.11700   -4.17234  33.30595 1.000 49.70132  ? 111 ASP A CA  1 
ATOM   787  C C   . ASP A 1 111 ? 4.06466   -4.97714  34.18792 1.000 44.39612  ? 111 ASP A C   1 
ATOM   788  O O   . ASP A 1 111 ? 4.29164   -4.61642  35.34078 1.000 42.44612  ? 111 ASP A O   1 
ATOM   789  C CB  . ASP A 1 111 ? 1.79327   -4.91332  33.12464 1.000 48.80612  ? 111 ASP A CB  1 
ATOM   790  C CG  . ASP A 1 111 ? 0.97912   -4.98278  34.41302 1.000 57.10934  ? 111 ASP A CG  1 
ATOM   791  O OD1 . ASP A 1 111 ? 0.41625   -3.92966  34.80808 1.000 56.56612  ? 111 ASP A OD1 1 
ATOM   792  O OD2 . ASP A 1 111 ? 0.88819   -6.08063  35.02026 1.000 50.14612  ? 111 ASP A OD2 1 
ATOM   793  N N   . ALA A 1 112 ? 4.64103   -6.05909  33.65421 1.000 42.13612  ? 112 ALA A N   1 
ATOM   794  C CA  . ALA A 1 112 ? 5.53854   -6.89257  34.44626 1.000 45.62612  ? 112 ALA A CA  1 
ATOM   795  C C   . ALA A 1 112 ? 6.72438   -6.09751  34.98647 1.000 49.71864  ? 112 ALA A C   1 
ATOM   796  O O   . ALA A 1 112 ? 7.10889   -6.26693  36.14648 1.000 45.10612  ? 112 ALA A O   1 
ATOM   797  C CB  . ALA A 1 112 ? 6.03310   -8.07054  33.61448 1.000 37.47612  ? 112 ALA A CB  1 
ATOM   798  N N   . ILE A 1 113 ? 7.32803   -5.23766  34.16407 1.000 43.90612  ? 113 ILE A N   1 
ATOM   799  C CA  . ILE A 1 113 ? 8.49352   -4.49718  34.63269 1.000 48.46479  ? 113 ILE A CA  1 
ATOM   800  C C   . ILE A 1 113 ? 8.07551   -3.46153  35.66467 1.000 53.67803  ? 113 ILE A C   1 
ATOM   801  O O   . ILE A 1 113 ? 8.76113   -3.26292  36.67076 1.000 46.48612  ? 113 ILE A O   1 
ATOM   802  C CB  . ILE A 1 113 ? 9.25648   -3.83609  33.46825 1.000 48.75612  ? 113 ILE A CB  1 
ATOM   803  C CG1 . ILE A 1 113 ? 9.98757   -4.86238  32.60198 1.000 50.67032  ? 113 ILE A CG1 1 
ATOM   804  C CG2 . ILE A 1 113 ? 10.28273  -2.85800  33.99809 1.000 53.44612  ? 113 ILE A CG2 1 
ATOM   805  C CD1 . ILE A 1 113 ? 10.46523  -6.09975  33.29300 1.000 57.73612  ? 113 ILE A CD1 1 
ATOM   806  N N   . HIS A 1 114 ? 6.96719   -2.76476  35.41753 1.000 47.40612  ? 114 HIS A N   1 
ATOM   807  C CA  . HIS A 1 114 ? 6.47233   -1.81280  36.40232 1.000 48.21776  ? 114 HIS A CA  1 
ATOM   808  C C   . HIS A 1 114 ? 6.14288   -2.51049  37.72078 1.000 45.93612  ? 114 HIS A C   1 
ATOM   809  O O   . HIS A 1 114 ? 6.47394   -2.00050  38.79485 1.000 49.98612  ? 114 HIS A O   1 
ATOM   810  C CB  . HIS A 1 114 ? 5.26055   -1.05695  35.85536 1.000 47.93612  ? 114 HIS A CB  1 
ATOM   811  C CG  . HIS A 1 114 ? 5.62105   0.09177   34.95763 1.000 67.26227  ? 114 HIS A CG  1 
ATOM   812  N ND1 . HIS A 1 114 ? 6.21903   1.24413   35.42274 1.000 70.16544  ? 114 HIS A ND1 1 
ATOM   813  C CD2 . HIS A 1 114 ? 5.48779   0.25489   33.61696 1.000 63.03274  ? 114 HIS A CD2 1 
ATOM   814  C CE1 . HIS A 1 114 ? 6.42441   2.07306   34.41467 1.000 67.88394  ? 114 HIS A CE1 1 
ATOM   815  N NE2 . HIS A 1 114 ? 5.99059   1.49655   33.30804 1.000 63.45105  ? 114 HIS A NE2 1 
ATOM   816  N N   . ARG A 1 115 ? 5.53280   -3.69669  37.65207 1.000 46.34612  ? 115 ARG A N   1 
ATOM   817  C CA  . ARG A 1 115 ? 5.28906   -4.48190  38.85803 1.000 40.39612  ? 115 ARG A CA  1 
ATOM   818  C C   . ARG A 1 115 ? 6.58464   -4.78589  39.58970 1.000 45.09990  ? 115 ARG A C   1 
ATOM   819  O O   . ARG A 1 115 ? 6.63928   -4.70145  40.81832 1.000 49.48612  ? 115 ARG A O   1 
ATOM   820  C CB  . ARG A 1 115 ? 4.57921   -5.78239  38.50760 1.000 41.25612  ? 115 ARG A CB  1 
ATOM   821  C CG  . ARG A 1 115 ? 3.79077   -6.38705  39.62518 1.000 41.42979  ? 115 ARG A CG  1 
ATOM   822  C CD  . ARG A 1 115 ? 3.14593   -7.65792  39.14313 1.000 42.62612  ? 115 ARG A CD  1 
ATOM   823  N NE  . ARG A 1 115 ? 2.00970   -7.36564  38.27835 1.000 44.40612  ? 115 ARG A NE  1 
ATOM   824  C CZ  . ARG A 1 115 ? 0.90555   -6.72280  38.63390 1.000 54.11612  ? 115 ARG A CZ  1 
ATOM   825  N NH1 . ARG A 1 115 ? 0.63102   -6.46394  39.89361 1.000 45.31612  ? 115 ARG A NH1 1 
ATOM   826  N NH2 . ARG A 1 115 ? 0.03948   -6.34590  37.69471 1.000 47.47612  ? 115 ARG A NH2 1 
ATOM   827  N N   . VAL A 1 116 ? 7.63917   -5.14399  38.85814 1.000 46.41612  ? 116 VAL A N   1 
ATOM   828  C CA  . VAL A 1 116 ? 8.88854   -5.47887  39.52239 1.000 46.00612  ? 116 VAL A CA  1 
ATOM   829  C C   . VAL A 1 116 ? 9.55462   -4.23909  40.10091 1.000 49.73614  ? 116 VAL A C   1 
ATOM   830  O O   . VAL A 1 116 ? 10.15085  -4.30197  41.17851 1.000 52.46612  ? 116 VAL A O   1 
ATOM   831  C CB  . VAL A 1 116 ? 9.82959   -6.22456  38.56498 1.000 43.72612  ? 116 VAL A CB  1 
ATOM   832  C CG1 . VAL A 1 116 ? 11.20837  -6.36542  39.19177 1.000 42.94612  ? 116 VAL A CG1 1 
ATOM   833  C CG2 . VAL A 1 116 ? 9.26880   -7.59167  38.26335 1.000 43.74612  ? 116 VAL A CG2 1 
ATOM   834  N N   . VAL A 1 117 ? 9.46599   -3.09689  39.42214 1.000 45.42612  ? 117 VAL A N   1 
ATOM   835  C CA  . VAL A 1 117 ? 10.12683  -1.89965  39.93286 1.000 46.99612  ? 117 VAL A CA  1 
ATOM   836  C C   . VAL A 1 117 ? 9.53007   -1.48694  41.28340 1.000 56.24156  ? 117 VAL A C   1 
ATOM   837  O O   . VAL A 1 117 ? 10.26180  -1.20370  42.23903 1.000 56.55612  ? 117 VAL A O   1 
ATOM   838  C CB  . VAL A 1 117 ? 10.07044  -0.77022  38.88974 1.000 55.74612  ? 117 VAL A CB  1 
ATOM   839  C CG1 . VAL A 1 117 ? 10.38812  0.55592   39.50464 1.000 58.45612  ? 117 VAL A CG1 1 
ATOM   840  C CG2 . VAL A 1 117 ? 11.06625  -1.05390  37.81158 1.000 42.99612  ? 117 VAL A CG2 1 
ATOM   841  N N   . ASN A 1 118 ? 8.19587   -1.48045  41.39168 1.000 44.78612  ? 118 ASN A N   1 
ATOM   842  C CA  . ASN A 1 118 ? 7.55083   -1.12406  42.65281 1.000 52.64303  ? 118 ASN A CA  1 
ATOM   843  C C   . ASN A 1 118 ? 7.81803   -2.18275  43.70290 1.000 49.02319  ? 118 ASN A C   1 
ATOM   844  O O   . ASN A 1 118 ? 8.04648   -1.87494  44.87557 1.000 52.55612  ? 118 ASN A O   1 
ATOM   845  C CB  . ASN A 1 118 ? 6.04753   -0.95338  42.44196 1.000 50.06612  ? 118 ASN A CB  1 
ATOM   846  C CG  . ASN A 1 118 ? 5.71962   0.20212   41.50890 1.000 61.02527  ? 118 ASN A CG  1 
ATOM   847  O OD1 . ASN A 1 118 ? 6.28015   1.29211   41.63352 1.000 80.50879  ? 118 ASN A OD1 1 
ATOM   848  N ND2 . ASN A 1 118 ? 4.80958   -0.03114  40.57487 1.000 62.64612  ? 118 ASN A ND2 1 
ATOM   849  N N   . LEU A 1 119 ? 7.75967   -3.43727  43.28906 1.000 55.38612  ? 119 LEU A N   1 
ATOM   850  C CA  . LEU A 1 119 ? 8.27576   -4.54456  44.07112 1.000 46.41612  ? 119 LEU A CA  1 
ATOM   851  C C   . LEU A 1 119 ? 9.64391   -4.23939  44.68532 1.000 52.16997  ? 119 LEU A C   1 
ATOM   852  O O   . LEU A 1 119 ? 9.88569   -4.54981  45.85227 1.000 50.31612  ? 119 LEU A O   1 
ATOM   853  C CB  . LEU A 1 119 ? 8.35673   -5.74726  43.14991 1.000 78.07612  ? 119 LEU A CB  1 
ATOM   854  C CG  . LEU A 1 119 ? 8.56829   -7.13509  43.66978 1.000 57.87550  ? 119 LEU A CG  1 
ATOM   855  C CD1 . LEU A 1 119 ? 9.96624   -7.33363  44.21726 1.000 67.37612  ? 119 LEU A CD1 1 
ATOM   856  C CD2 . LEU A 1 119 ? 7.53546   -7.23867  44.68522 1.000 71.63271  ? 119 LEU A CD2 1 
ATOM   857  N N   . ALA A 1 120 ? 10.56963  -3.67283  43.90155 1.000 47.75612  ? 120 ALA A N   1 
ATOM   858  C CA  . ALA A 1 120 ? 11.93672  -3.52229  44.38478 1.000 53.73612  ? 120 ALA A CA  1 
ATOM   859  C C   . ALA A 1 120 ? 12.08189  -2.38821  45.39055 1.000 49.02612  ? 120 ALA A C   1 
ATOM   860  O O   . ALA A 1 120 ? 13.17226  -2.19421  45.93808 1.000 50.24612  ? 120 ALA A O   1 
ATOM   861  C CB  . ALA A 1 120 ? 12.89290  -3.31207  43.21275 1.000 43.85612  ? 120 ALA A CB  1 
ATOM   862  N N   . ASP A 1 121 ? 11.01772  -1.63313  45.62810 1.000 47.04612  ? 121 ASP A N   1 
ATOM   863  C CA  . ASP A 1 121 ? 10.96829  -0.71447  46.75225 1.000 56.57332  ? 121 ASP A CA  1 
ATOM   864  C C   . ASP A 1 121 ? 10.65457  -1.42838  48.06248 1.000 54.51807  ? 121 ASP A C   1 
ATOM   865  O O   . ASP A 1 121 ? 10.89488  -0.87062  49.13053 1.000 52.71774  ? 121 ASP A O   1 
ATOM   866  C CB  . ASP A 1 121 ? 9.92052   0.36134   46.48496 1.000 57.31612  ? 121 ASP A CB  1 
ATOM   867  C CG  . ASP A 1 121 ? 10.36682  1.35602   45.42635 1.000 77.42932  ? 121 ASP A CG  1 
ATOM   868  O OD1 . ASP A 1 121 ? 9.49699   1.87163   44.68157 1.000 85.94612  ? 121 ASP A OD1 1 
ATOM   869  O OD2 . ASP A 1 121 ? 11.59084  1.61389   45.33611 1.000 85.99685  ? 121 ASP A OD2 1 
ATOM   870  N N   . GLN A 1 122 ? 10.13217  -2.64564  48.00270 1.000 43.74612  ? 122 GLN A N   1 
ATOM   871  C CA  . GLN A 1 122 ? 9.78119   -3.38839  49.19535 1.000 49.75612  ? 122 GLN A CA  1 
ATOM   872  C C   . GLN A 1 122 ? 10.90555  -4.30792  49.64444 1.000 51.22216  ? 122 GLN A C   1 
ATOM   873  O O   . GLN A 1 122 ? 11.16409  -4.39835  50.84319 1.000 46.27612  ? 122 GLN A O   1 
ATOM   874  C CB  . GLN A 1 122 ? 8.50484   -4.19525  48.96511 1.000 43.69612  ? 122 GLN A CB  1 
ATOM   875  C CG  . GLN A 1 122 ? 7.42776   -3.43183  48.24345 1.000 52.61289  ? 122 GLN A CG  1 
ATOM   876  C CD  . GLN A 1 122 ? 7.09227   -2.12483  48.91760 1.000 60.36867  ? 122 GLN A CD  1 
ATOM   877  O OE1 . GLN A 1 122 ? 7.09514   -2.01612  50.14281 1.000 61.23612  ? 122 GLN A OE1 1 
ATOM   878  N NE2 . GLN A 1 122 ? 6.80176   -1.11623  48.11357 1.000 64.44204  ? 122 GLN A NE2 1 
ATOM   879  N N   . VAL A 1 123 ? 11.56800  -4.99687  48.70730 1.000 52.49612  ? 123 VAL A N   1 
ATOM   880  C CA  . VAL A 1 123 ? 12.73439  -5.82882  48.97392 1.000 44.35612  ? 123 VAL A CA  1 
ATOM   881  C C   . VAL A 1 123 ? 13.81679  -5.47620  47.96631 1.000 41.72832  ? 123 VAL A C   1 
ATOM   882  O O   . VAL A 1 123 ? 13.56266  -4.81722  46.95539 1.000 51.41612  ? 123 VAL A O   1 
ATOM   883  C CB  . VAL A 1 123 ? 12.43478  -7.33809  48.90701 1.000 46.58612  ? 123 VAL A CB  1 
ATOM   884  C CG1 . VAL A 1 123 ? 11.49259  -7.73673  49.99647 1.000 51.62612  ? 123 VAL A CG1 1 
ATOM   885  C CG2 . VAL A 1 123 ? 11.85792  -7.70707  47.51817 1.000 41.90916  ? 123 VAL A CG2 1 
ATOM   886  N N   . GLY A 1 124 ? 15.03324  -5.91390  48.25116 1.000 50.29612  ? 124 GLY A N   1 
ATOM   887  C CA  . GLY A 1 124 ? 16.12906  -5.69657  47.32926 1.000 43.68612  ? 124 GLY A CA  1 
ATOM   888  C C   . GLY A 1 124 ? 16.01316  -6.62650  46.13615 1.000 45.24851  ? 124 GLY A C   1 
ATOM   889  O O   . GLY A 1 124 ? 15.93857  -7.85551  46.30835 1.000 44.69612  ? 124 GLY A O   1 
ATOM   890  N N   . ILE A 1 125 ? 15.96388  -6.07093  44.92108 1.000 40.28612  ? 125 ILE A N   1 
ATOM   891  C CA  . ILE A 1 125 ? 15.96859  -6.80762  43.65921 1.000 44.35612  ? 125 ILE A CA  1 
ATOM   892  C C   . ILE A 1 125 ? 16.98008  -6.14959  42.74025 1.000 43.43612  ? 125 ILE A C   1 
ATOM   893  O O   . ILE A 1 125 ? 16.90051  -4.94060  42.49266 1.000 44.51612  ? 125 ILE A O   1 
ATOM   894  C CB  . ILE A 1 125 ? 14.58519  -6.83561  42.97123 1.000 48.98612  ? 125 ILE A CB  1 
ATOM   895  C CG1 . ILE A 1 125 ? 13.54289  -7.43099  43.90718 1.000 35.38612  ? 125 ILE A CG1 1 
ATOM   896  C CG2 . ILE A 1 125 ? 14.65835  -7.52868  41.61065 1.000 41.02612  ? 125 ILE A CG2 1 
ATOM   897  C CD1 . ILE A 1 125 ? 13.74430  -8.92016  44.13430 1.000 49.42612  ? 125 ILE A CD1 1 
ATOM   898  N N   . LYS A 1 126 ? 17.93042  -6.92542  42.23393 1.000 42.56612  ? 126 LYS A N   1 
ATOM   899  C CA  . LYS A 1 126 ? 18.94441  -6.27673  41.41273 1.000 40.11768  ? 126 LYS A CA  1 
ATOM   900  C C   . LYS A 1 126 ? 18.62593  -6.28849  39.92352 1.000 45.73612  ? 126 LYS A C   1 
ATOM   901  O O   . LYS A 1 126 ? 19.11138  -5.40816  39.20496 1.000 46.56612  ? 126 LYS A O   1 
ATOM   902  C CB  . LYS A 1 126 ? 20.33173  -6.88438  41.65649 1.000 45.23612  ? 126 LYS A CB  1 
ATOM   903  C CG  . LYS A 1 126 ? 20.98737  -6.36963  42.94848 1.000 71.19706  ? 126 LYS A CG  1 
ATOM   904  C CD  . LYS A 1 126 ? 22.46598  -6.77195  43.06829 1.000 76.74404  ? 126 LYS A CD  1 
ATOM   905  C CE  . LYS A 1 126 ? 23.45087  -5.59768  42.89582 1.000 77.51735  ? 126 LYS A CE  1 
ATOM   906  N NZ  . LYS A 1 126 ? 23.05927  -4.57271  41.87387 1.000 80.10272  ? 126 LYS A NZ  1 
ATOM   907  N N   . ALA A 1 127 ? 17.80971  -7.22841  39.43986 1.000 46.82612  ? 127 ALA A N   1 
ATOM   908  C CA  . ALA A 1 127 ? 17.47332  -7.25485  38.01840 1.000 44.83049  ? 127 ALA A CA  1 
ATOM   909  C C   . ALA A 1 127 ? 16.30502  -8.19837  37.74700 1.000 37.83612  ? 127 ALA A C   1 
ATOM   910  O O   . ALA A 1 127 ? 15.96823  -9.06028  38.56806 1.000 41.02706  ? 127 ALA A O   1 
ATOM   911  C CB  . ALA A 1 127 ? 18.68037  -7.67692  37.18246 1.000 31.21582  ? 127 ALA A CB  1 
ATOM   912  N N   . VAL A 1 128 ? 15.70433  -8.03113  36.56016 1.000 43.99612  ? 128 VAL A N   1 
ATOM   913  C CA  . VAL A 1 128 ? 14.75700  -8.98977  35.99691 1.000 50.79612  ? 128 VAL A CA  1 
ATOM   914  C C   . VAL A 1 128 ? 15.49431  -9.85026  34.98711 1.000 44.83301  ? 128 VAL A C   1 
ATOM   915  O O   . VAL A 1 128 ? 16.17371  -9.33003  34.09226 1.000 44.23612  ? 128 VAL A O   1 
ATOM   916  C CB  . VAL A 1 128 ? 13.56466  -8.30224  35.31168 1.000 46.09579  ? 128 VAL A CB  1 
ATOM   917  C CG1 . VAL A 1 128 ? 12.70354  -9.35935  34.64037 1.000 39.47612  ? 128 VAL A CG1 1 
ATOM   918  C CG2 . VAL A 1 128 ? 12.75913  -7.50850  36.28680 1.000 41.67612  ? 128 VAL A CG2 1 
ATOM   919  N N   . MET A 1 129 ? 15.33547  -11.15835 35.09102 1.000 44.65612  ? 129 MET A N   1 
ATOM   920  C CA  . MET A 1 129 ? 15.95718  -12.05113 34.13039 1.000 46.16612  ? 129 MET A CA  1 
ATOM   921  C C   . MET A 1 129 ? 14.89138  -12.78911 33.32551 1.000 51.16612  ? 129 MET A C   1 
ATOM   922  O O   . MET A 1 129 ? 13.86249  -13.20389 33.86924 1.000 46.67612  ? 129 MET A O   1 
ATOM   923  C CB  . MET A 1 129 ? 16.89113  -13.00624 34.84631 1.000 45.76612  ? 129 MET A CB  1 
ATOM   924  C CG  . MET A 1 129 ? 17.88790  -12.23259 35.71088 1.000 55.45085  ? 129 MET A CG  1 
ATOM   925  S SD  . MET A 1 129 ? 19.54625  -12.69489 35.30495 1.000 84.84612  ? 129 MET A SD  1 
ATOM   926  C CE  . MET A 1 129 ? 19.40964  -14.43449 35.75419 1.000 57.91896  ? 129 MET A CE  1 
ATOM   927  N N   . VAL A 1 130 ? 15.13722  -12.91918 32.02969 1.000 39.34612  ? 130 VAL A N   1 
ATOM   928  C CA  . VAL A 1 130 ? 14.29296  -13.66569 31.10285 1.000 39.88612  ? 130 VAL A CA  1 
ATOM   929  C C   . VAL A 1 130 ? 15.12354  -14.69094 30.37904 1.000 56.84612  ? 130 VAL A C   1 
ATOM   930  O O   . VAL A 1 130 ? 16.34336  -14.55662 30.22380 1.000 47.47612  ? 130 VAL A O   1 
ATOM   931  C CB  . VAL A 1 130 ? 13.59251  -12.76742 30.06826 1.000 37.37612  ? 130 VAL A CB  1 
ATOM   932  C CG1 . VAL A 1 130 ? 12.69388  -11.79501 30.75584 1.000 50.75612  ? 130 VAL A CG1 1 
ATOM   933  C CG2 . VAL A 1 130 ? 14.62336  -12.02410 29.26556 1.000 62.42612  ? 130 VAL A CG2 1 
ATOM   934  N N   A HIS A 1 131 ? 14.44898  -15.72618 29.90075 0.540 51.01942  ? 131 HIS A N   1 
ATOM   935  N N   B HIS A 1 131 ? 14.45088  -15.73163 29.91183 0.460 51.08147  ? 131 HIS A N   1 
ATOM   936  C CA  A HIS A 1 131 ? 15.05960  -16.76272 29.08585 0.540 55.44129  ? 131 HIS A CA  1 
ATOM   937  C CA  B HIS A 1 131 ? 15.04948  -16.77165 29.09124 0.460 55.44991  ? 131 HIS A CA  1 
ATOM   938  C C   A HIS A 1 131 ? 14.38677  -16.73212 27.71940 0.540 55.16612  ? 131 HIS A C   1 
ATOM   939  C C   B HIS A 1 131 ? 14.37687  -16.71743 27.72151 0.460 55.16612  ? 131 HIS A C   1 
ATOM   940  O O   A HIS A 1 131 ? 13.21665  -17.10453 27.58825 0.540 55.37894  ? 131 HIS A O   1 
ATOM   941  O O   B HIS A 1 131 ? 13.19698  -17.05791 27.58910 0.460 55.38457  ? 131 HIS A O   1 
ATOM   942  C CB  A HIS A 1 131 ? 14.92640  -18.11764 29.77302 0.540 54.32814  ? 131 HIS A CB  1 
ATOM   943  C CB  B HIS A 1 131 ? 14.88552  -18.13451 29.76248 0.460 54.33831  ? 131 HIS A CB  1 
ATOM   944  C CG  A HIS A 1 131 ? 15.48720  -18.13847 31.16144 0.540 57.99080  ? 131 HIS A CG  1 
ATOM   945  C CG  B HIS A 1 131 ? 15.46394  -19.27357 28.98100 0.460 66.08503  ? 131 HIS A CG  1 
ATOM   946  N ND1 A HIS A 1 131 ? 14.82666  -17.58390 32.23637 0.540 66.79294  ? 131 HIS A ND1 1 
ATOM   947  N ND1 B HIS A 1 131 ? 14.80902  -19.85638 27.91631 0.460 75.27028  ? 131 HIS A ND1 1 
ATOM   948  C CD2 A HIS A 1 131 ? 16.64100  -18.64809 31.65338 0.540 61.65326  ? 131 HIS A CD2 1 
ATOM   949  C CD2 B HIS A 1 131 ? 16.63646  -19.94020 29.11130 0.460 70.85455  ? 131 HIS A CD2 1 
ATOM   950  C CE1 A HIS A 1 131 ? 15.54798  -17.75011 33.33021 0.540 56.10445  ? 131 HIS A CE1 1 
ATOM   951  C CE1 B HIS A 1 131 ? 15.55271  -20.83140 27.42399 0.460 68.28278  ? 131 HIS A CE1 1 
ATOM   952  N NE2 A HIS A 1 131 ? 16.65305  -18.39443 33.00407 0.540 49.00463  ? 131 HIS A NE2 1 
ATOM   953  N NE2 B HIS A 1 131 ? 16.66798  -20.90212 28.12957 0.460 64.99998  ? 131 HIS A NE2 1 
ATOM   954  N N   . ALA A 1 132 ? 15.11090  -16.25063 26.71135 1.000 54.91708  ? 132 ALA A N   1 
ATOM   955  C CA  . ALA A 1 132 ? 14.61695  -16.20456 25.33464 1.000 61.84501  ? 132 ALA A CA  1 
ATOM   956  C C   . ALA A 1 132 ? 14.85274  -17.56055 24.68392 1.000 66.26612  ? 132 ALA A C   1 
ATOM   957  O O   . ALA A 1 132 ? 15.98881  -17.89817 24.34445 1.000 80.34612  ? 132 ALA A O   1 
ATOM   958  C CB  . ALA A 1 132 ? 15.30973  -15.10383 24.53416 1.000 55.65643  ? 132 ALA A CB  1 
ATOM   959  N N   . ILE A 1 133 ? 13.78129  -18.33670 24.50868 1.000 62.84612  ? 133 ILE A N   1 
ATOM   960  C CA  . ILE A 1 133 ? 13.91063  -19.66627 23.91335 1.000 82.41569  ? 133 ILE A CA  1 
ATOM   961  C C   . ILE A 1 133 ? 14.32919  -19.57525 22.44785 1.000 63.99960  ? 133 ILE A C   1 
ATOM   962  O O   . ILE A 1 133 ? 15.07336  -20.42211 21.94496 1.000 92.66612  ? 133 ILE A O   1 
ATOM   963  C CB  . ILE A 1 133 ? 12.59576  -20.44483 24.08629 1.000 86.43242  ? 133 ILE A CB  1 
ATOM   964  C CG1 . ILE A 1 133 ? 11.40391  -19.58278 23.67288 1.000 76.89384  ? 133 ILE A CG1 1 
ATOM   965  C CG2 . ILE A 1 133 ? 12.43602  -20.88269 25.52858 1.000 85.51108  ? 133 ILE A CG2 1 
ATOM   966  C CD1 . ILE A 1 133 ? 10.08312  -20.15223 24.10838 1.000 82.22146  ? 133 ILE A CD1 1 
ATOM   967  N N   . ASP A 1 134 ? 13.90197  -18.53355 21.75635 1.000 59.82612  ? 134 ASP A N   1 
ATOM   968  C CA  . ASP A 1 134 ? 14.10631  -18.43060 20.32422 1.000 55.12088  ? 134 ASP A CA  1 
ATOM   969  C C   . ASP A 1 134 ? 14.58974  -17.02901 19.96973 1.000 61.71316  ? 134 ASP A C   1 
ATOM   970  O O   . ASP A 1 134 ? 14.60010  -16.11743 20.79692 1.000 51.93612  ? 134 ASP A O   1 
ATOM   971  C CB  . ASP A 1 134 ? 12.80803  -18.79395 19.58288 1.000 51.82612  ? 134 ASP A CB  1 
ATOM   972  C CG  . ASP A 1 134 ? 11.76097  -17.70300 19.67465 1.000 60.09718  ? 134 ASP A CG  1 
ATOM   973  O OD1 . ASP A 1 134 ? 10.68679  -17.96591 20.25421 1.000 90.99612  ? 134 ASP A OD1 1 
ATOM   974  O OD2 . ASP A 1 134 ? 11.99145  -16.58325 19.16030 1.000 85.44889  ? 134 ASP A OD2 1 
ATOM   975  N N   . ASP A 1 135 ? 14.97234  -16.85102 18.70637 1.000 45.46612  ? 135 ASP A N   1 
ATOM   976  C CA  . ASP A 1 135 ? 15.55463  -15.58233 18.29937 1.000 48.65612  ? 135 ASP A CA  1 
ATOM   977  C C   . ASP A 1 135 ? 14.52119  -14.46341 18.24806 1.000 49.28612  ? 135 ASP A C   1 
ATOM   978  O O   . ASP A 1 135 ? 14.87471  -13.30027 18.46724 1.000 68.44612  ? 135 ASP A O   1 
ATOM   979  C CB  . ASP A 1 135 ? 16.28566  -15.75396 16.95831 1.000 59.80365  ? 135 ASP A CB  1 
ATOM   980  C CG  . ASP A 1 135 ? 17.41857  -16.80270 17.03002 1.000 76.91992  ? 135 ASP A CG  1 
ATOM   981  O OD1 . ASP A 1 135 ? 18.05649  -16.92833 18.10987 1.000 74.10691  ? 135 ASP A OD1 1 
ATOM   982  O OD2 . ASP A 1 135 ? 17.68099  -17.48881 16.01045 1.000 75.23093  ? 135 ASP A OD2 1 
ATOM   983  N N   . ASP A 1 136 ? 13.24313  -14.78398 17.98778 1.000 51.74612  ? 136 ASP A N   1 
ATOM   984  C CA  . ASP A 1 136 ? 12.20318  -13.74997 17.99421 1.000 40.03612  ? 136 ASP A CA  1 
ATOM   985  C C   . ASP A 1 136 ? 11.90909  -13.26252 19.40896 1.000 43.85617  ? 136 ASP A C   1 
ATOM   986  O O   . ASP A 1 136 ? 11.63485  -12.07145 19.62594 1.000 49.25612  ? 136 ASP A O   1 
ATOM   987  C CB  . ASP A 1 136 ? 10.92567  -14.28208 17.35720 1.000 71.04612  ? 136 ASP A CB  1 
ATOM   988  C CG  . ASP A 1 136 ? 11.19599  -15.06412 16.09747 1.000 84.89655  ? 136 ASP A CG  1 
ATOM   989  O OD1 . ASP A 1 136 ? 11.64683  -16.23166 16.20725 1.000 91.30281  ? 136 ASP A OD1 1 
ATOM   990  O OD2 . ASP A 1 136 ? 10.98561  -14.49456 15.00346 1.000 75.01377  ? 136 ASP A OD2 1 
ATOM   991  N N   . ALA A 1 137 ? 11.91436  -14.19466 20.36494 1.000 36.41972  ? 137 ALA A N   1 
ATOM   992  C CA  . ALA A 1 137 ? 11.89813  -13.85615 21.78080 1.000 56.90469  ? 137 ALA A CA  1 
ATOM   993  C C   . ALA A 1 137 ? 13.00381  -12.87689 22.10423 1.000 46.79612  ? 137 ALA A C   1 
ATOM   994  O O   . ALA A 1 137 ? 12.74991  -11.79180 22.63383 1.000 48.55612  ? 137 ALA A O   1 
ATOM   995  C CB  . ALA A 1 137 ? 12.07104  -15.12286 22.61439 1.000 42.21612  ? 137 ALA A CB  1 
ATOM   996  N N   . ARG A 1 138 ? 14.24106  -13.24153 21.75763 1.000 56.84612  ? 138 ARG A N   1 
ATOM   997  C CA  . ARG A 1 138 ? 15.37500  -12.36792 22.01348 1.000 48.63612  ? 138 ARG A CA  1 
ATOM   998  C C   . ARG A 1 138 ? 15.15238  -11.00716 21.38848 1.000 46.62612  ? 138 ARG A C   1 
ATOM   999  O O   . ARG A 1 138 ? 15.41727  -9.97728  22.01075 1.000 50.59612  ? 138 ARG A O   1 
ATOM   1000 C CB  . ARG A 1 138 ? 16.66670  -12.98213 21.47180 1.000 41.01612  ? 138 ARG A CB  1 
ATOM   1001 C CG  . ARG A 1 138 ? 17.85139  -12.04602 21.57537 1.000 51.68612  ? 138 ARG A CG  1 
ATOM   1002 C CD  . ARG A 1 138 ? 19.04856  -12.66897 20.93125 1.000 41.52612  ? 138 ARG A CD  1 
ATOM   1003 N NE  . ARG A 1 138 ? 19.43803  -13.89359 21.60946 1.000 45.90612  ? 138 ARG A NE  1 
ATOM   1004 C CZ  . ARG A 1 138 ? 20.16096  -13.94634 22.72121 1.000 47.03568  ? 138 ARG A CZ  1 
ATOM   1005 N NH1 . ARG A 1 138 ? 20.63261  -12.84926 23.28841 1.000 40.88612  ? 138 ARG A NH1 1 
ATOM   1006 N NH2 . ARG A 1 138 ? 20.43653  -15.13298 23.25631 1.000 41.95612  ? 138 ARG A NH2 1 
ATOM   1007 N N   . ALA A 1 139 ? 14.66365  -10.97692 20.15078 1.000 41.72612  ? 139 ALA A N   1 
ATOM   1008 C CA  . ALA A 1 139 ? 14.50420  -9.68190  19.50323 1.000 51.97612  ? 139 ALA A CA  1 
ATOM   1009 C C   . ALA A 1 139 ? 13.48344  -8.82940  20.23679 1.000 44.96612  ? 139 ALA A C   1 
ATOM   1010 O O   . ALA A 1 139 ? 13.68467  -7.62129  20.40164 1.000 50.59612  ? 139 ALA A O   1 
ATOM   1011 C CB  . ALA A 1 139 ? 14.11372  -9.85666  18.04351 1.000 51.19612  ? 139 ALA A CB  1 
ATOM   1012 N N   . PHE A 1 140 ? 12.40423  -9.44519  20.71483 1.000 47.83612  ? 140 PHE A N   1 
ATOM   1013 C CA  . PHE A 1 140 ? 11.39017  -8.70884  21.46592 1.000 46.74098  ? 140 PHE A CA  1 
ATOM   1014 C C   . PHE A 1 140 ? 11.97200  -8.14776  22.76271 1.000 45.44612  ? 140 PHE A C   1 
ATOM   1015 O O   . PHE A 1 140 ? 11.89197  -6.94589  23.03470 1.000 43.07612  ? 140 PHE A O   1 
ATOM   1016 C CB  . PHE A 1 140 ? 10.21078  -9.64007  21.74737 1.000 46.73612  ? 140 PHE A CB  1 
ATOM   1017 C CG  . PHE A 1 140 ? 9.13602   -9.03910  22.60180 1.000 46.76612  ? 140 PHE A CG  1 
ATOM   1018 C CD1 . PHE A 1 140 ? 8.22917   -8.14275  22.06446 1.000 50.14612  ? 140 PHE A CD1 1 
ATOM   1019 C CD2 . PHE A 1 140 ? 8.99764   -9.40434  23.92983 1.000 49.75612  ? 140 PHE A CD2 1 
ATOM   1020 C CE1 . PHE A 1 140 ? 7.21960   -7.60818  22.82896 1.000 53.14911  ? 140 PHE A CE1 1 
ATOM   1021 C CE2 . PHE A 1 140 ? 7.98256   -8.86906  24.70904 1.000 52.07612  ? 140 PHE A CE2 1 
ATOM   1022 C CZ  . PHE A 1 140 ? 7.10077   -7.97139  24.16810 1.000 52.25612  ? 140 PHE A CZ  1 
ATOM   1023 N N   . TYR A 1 141 ? 12.59207  -9.00842  23.55715 1.000 41.03612  ? 141 TYR A N   1 
ATOM   1024 C CA  . TYR A 1 141 ? 13.17698  -8.56329  24.81317 1.000 43.96140  ? 141 TYR A CA  1 
ATOM   1025 C C   . TYR A 1 141 ? 14.21867  -7.46999  24.59739 1.000 50.16612  ? 141 TYR A C   1 
ATOM   1026 O O   . TYR A 1 141 ? 14.22961  -6.46008  25.31374 1.000 47.38612  ? 141 TYR A O   1 
ATOM   1027 C CB  . TYR A 1 141 ? 13.76942  -9.76249  25.52433 1.000 39.67612  ? 141 TYR A CB  1 
ATOM   1028 C CG  . TYR A 1 141 ? 12.71265  -10.59698 26.15421 1.000 44.11612  ? 141 TYR A CG  1 
ATOM   1029 C CD1 . TYR A 1 141 ? 11.72669  -10.01123 26.92320 1.000 49.90612  ? 141 TYR A CD1 1 
ATOM   1030 C CD2 . TYR A 1 141 ? 12.71277  -11.95725 26.01158 1.000 47.98612  ? 141 TYR A CD2 1 
ATOM   1031 C CE1 . TYR A 1 141 ? 10.76543  -10.75347 27.52209 1.000 46.93612  ? 141 TYR A CE1 1 
ATOM   1032 C CE2 . TYR A 1 141 ? 11.75930  -12.71733 26.61201 1.000 58.71464  ? 141 TYR A CE2 1 
ATOM   1033 C CZ  . TYR A 1 141 ? 10.78355  -12.11476 27.37314 1.000 52.93612  ? 141 TYR A CZ  1 
ATOM   1034 O OH  . TYR A 1 141 ? 9.81693   -12.87554 27.98015 1.000 60.02612  ? 141 TYR A OH  1 
ATOM   1035 N N   . GLU A 1 142 ? 15.10182  -7.64877  23.60826 1.000 47.38858  ? 142 GLU A N   1 
ATOM   1036 C CA  . GLU A 1 142 ? 16.14030  -6.64892  23.35099 1.000 52.26612  ? 142 GLU A CA  1 
ATOM   1037 C C   . GLU A 1 142 ? 15.55395  -5.34156  22.84396 1.000 53.96612  ? 142 GLU A C   1 
ATOM   1038 O O   . GLU A 1 142 ? 16.08910  -4.27044  23.13707 1.000 48.25612  ? 142 GLU A O   1 
ATOM   1039 C CB  . GLU A 1 142 ? 17.18636  -7.18484  22.36018 1.000 49.31612  ? 142 GLU A CB  1 
ATOM   1040 C CG  . GLU A 1 142 ? 17.97260  -8.40607  22.88883 1.000 61.69368  ? 142 GLU A CG  1 
ATOM   1041 C CD  . GLU A 1 142 ? 19.13038  -8.83082  21.97957 1.000 78.49965  ? 142 GLU A CD  1 
ATOM   1042 O OE1 . GLU A 1 142 ? 20.05056  -9.54265  22.46150 1.000 91.23612  ? 142 GLU A OE1 1 
ATOM   1043 O OE2 . GLU A 1 142 ? 19.11570  -8.45063  20.78110 1.000 88.68863  ? 142 GLU A OE2 1 
ATOM   1044 N N   . ARG A 1 143 ? 14.45388  -5.40163  22.09877 1.000 45.96612  ? 143 ARG A N   1 
ATOM   1045 C CA  . ARG A 1 143 ? 13.77713  -4.17654  21.68918 1.000 45.49612  ? 143 ARG A CA  1 
ATOM   1046 C C   . ARG A 1 143 ? 13.32421  -3.34058  22.88779 1.000 46.66385  ? 143 ARG A C   1 
ATOM   1047 O O   . ARG A 1 143 ? 13.18503  -2.11838  22.77693 1.000 48.35612  ? 143 ARG A O   1 
ATOM   1048 C CB  . ARG A 1 143 ? 12.58609  -4.52881  20.79812 1.000 50.78612  ? 143 ARG A CB  1 
ATOM   1049 C CG  . ARG A 1 143 ? 11.67688  -3.37027  20.48191 1.000 53.49612  ? 143 ARG A CG  1 
ATOM   1050 C CD  . ARG A 1 143 ? 10.70292  -3.72317  19.38390 1.000 57.66885  ? 143 ARG A CD  1 
ATOM   1051 N NE  . ARG A 1 143 ? 9.97404   -2.53928  18.95588 1.000 69.64375  ? 143 ARG A NE  1 
ATOM   1052 C CZ  . ARG A 1 143 ? 10.45190  -1.61929  18.13221 1.000 76.62701  ? 143 ARG A CZ  1 
ATOM   1053 N NH1 . ARG A 1 143 ? 11.63067  -1.76357  17.54256 1.000 65.05612  ? 143 ARG A NH1 1 
ATOM   1054 N NH2 . ARG A 1 143 ? 9.73750   -0.51873  17.91279 1.000 70.31611  ? 143 ARG A NH2 1 
ATOM   1055 N N   . PHE A 1 144 ? 13.09841  -3.96303  24.04305 1.000 53.49612  ? 144 PHE A N   1 
ATOM   1056 C CA  . PHE A 1 144 ? 12.52576  -3.23108  25.15813 1.000 45.46732  ? 144 PHE A CA  1 
ATOM   1057 C C   . PHE A 1 144 ? 13.46221  -3.18025  26.36187 1.000 56.32534  ? 144 PHE A C   1 
ATOM   1058 O O   . PHE A 1 144 ? 13.01749  -3.04820  27.50921 1.000 50.95612  ? 144 PHE A O   1 
ATOM   1059 C CB  . PHE A 1 144 ? 11.15331  -3.79799  25.52419 1.000 41.54324  ? 144 PHE A CB  1 
ATOM   1060 C CG  . PHE A 1 144 ? 10.13111  -3.56883  24.45702 1.000 45.64862  ? 144 PHE A CG  1 
ATOM   1061 C CD1 . PHE A 1 144 ? 9.62325   -2.30171  24.25004 1.000 50.01612  ? 144 PHE A CD1 1 
ATOM   1062 C CD2 . PHE A 1 144 ? 9.69562   -4.60210  23.64345 1.000 45.48778  ? 144 PHE A CD2 1 
ATOM   1063 C CE1 . PHE A 1 144 ? 8.71072   -2.06936  23.26510 1.000 57.09612  ? 144 PHE A CE1 1 
ATOM   1064 C CE2 . PHE A 1 144 ? 8.77222   -4.36954  22.67093 1.000 46.78612  ? 144 PHE A CE2 1 
ATOM   1065 C CZ  . PHE A 1 144 ? 8.28321   -3.10145  22.47518 1.000 51.08612  ? 144 PHE A CZ  1 
ATOM   1066 N N   . GLY A 1 145 ? 14.76641  -3.24915  26.11707 1.000 51.24612  ? 145 GLY A N   1 
ATOM   1067 C CA  . GLY A 1 145 ? 15.71272  -2.88903  27.14988 1.000 43.81226  ? 145 GLY A CA  1 
ATOM   1068 C C   . GLY A 1 145 ? 16.50472  -4.01726  27.75860 1.000 48.30612  ? 145 GLY A C   1 
ATOM   1069 O O   . GLY A 1 145 ? 17.41949  -3.73729  28.52871 1.000 54.17490  ? 145 GLY A O   1 
ATOM   1070 N N   . PHE A 1 146 ? 16.22209  -5.26872  27.43505 1.000 42.38612  ? 146 PHE A N   1 
ATOM   1071 C CA  . PHE A 1 146 ? 17.01161  -6.35550  27.99171 1.000 49.94612  ? 146 PHE A CA  1 
ATOM   1072 C C   . PHE A 1 146 ? 18.40483  -6.41710  27.34743 1.000 48.35744  ? 146 PHE A C   1 
ATOM   1073 O O   . PHE A 1 146 ? 18.64329  -5.86654  26.27127 1.000 45.68612  ? 146 PHE A O   1 
ATOM   1074 C CB  . PHE A 1 146 ? 16.26418  -7.67158  27.82023 1.000 33.15612  ? 146 PHE A CB  1 
ATOM   1075 C CG  . PHE A 1 146 ? 15.20290  -7.87206  28.85031 1.000 53.86858  ? 146 PHE A CG  1 
ATOM   1076 C CD1 . PHE A 1 146 ? 13.98190  -7.24651  28.70821 1.000 37.20780  ? 146 PHE A CD1 1 
ATOM   1077 C CD2 . PHE A 1 146 ? 15.42931  -8.65397  29.97013 1.000 42.01612  ? 146 PHE A CD2 1 
ATOM   1078 C CE1 . PHE A 1 146 ? 12.99252  -7.39425  29.66411 1.000 52.85396  ? 146 PHE A CE1 1 
ATOM   1079 C CE2 . PHE A 1 146 ? 14.43115  -8.81503  30.92533 1.000 42.69612  ? 146 PHE A CE2 1 
ATOM   1080 C CZ  . PHE A 1 146 ? 13.21336  -8.17979  30.77051 1.000 36.44066  ? 146 PHE A CZ  1 
ATOM   1081 N N   . VAL A 1 147 ? 19.31956  -7.10193  28.04153 1.000 54.24612  ? 147 VAL A N   1 
ATOM   1082 C CA  . VAL A 1 147 ? 20.73913  -7.18860  27.71797 1.000 47.57612  ? 147 VAL A CA  1 
ATOM   1083 C C   . VAL A 1 147 ? 21.19369  -8.63062  27.89765 1.000 42.65293  ? 147 VAL A C   1 
ATOM   1084 O O   . VAL A 1 147 ? 20.79330  -9.28824  28.86365 1.000 53.73612  ? 147 VAL A O   1 
ATOM   1085 C CB  . VAL A 1 147 ? 21.57757  -6.27042  28.63376 1.000 61.82612  ? 147 VAL A CB  1 
ATOM   1086 C CG1 . VAL A 1 147 ? 23.05934  -6.38515  28.31305 1.000 55.12612  ? 147 VAL A CG1 1 
ATOM   1087 C CG2 . VAL A 1 147 ? 21.10532  -4.82313  28.55454 1.000 54.97612  ? 147 VAL A CG2 1 
ATOM   1088 N N   . GLN A 1 148 ? 22.05176  -9.11612  26.99089 1.000 51.18612  ? 148 GLN A N   1 
ATOM   1089 C CA  . GLN A 1 148 ? 22.66120  -10.43029 27.17839 1.000 42.43744  ? 148 GLN A CA  1 
ATOM   1090 C C   . GLN A 1 148 ? 23.34750  -10.51173 28.52906 1.000 47.98059  ? 148 GLN A C   1 
ATOM   1091 O O   . GLN A 1 148 ? 24.08325  -9.60921  28.92313 1.000 53.47612  ? 148 GLN A O   1 
ATOM   1092 C CB  . GLN A 1 148 ? 23.71008  -10.72582 26.10931 1.000 51.80612  ? 148 GLN A CB  1 
ATOM   1093 C CG  . GLN A 1 148 ? 24.27160  -12.18033 26.05306 1.000 44.16612  ? 148 GLN A CG  1 
ATOM   1094 C CD  . GLN A 1 148 ? 23.23430  -13.29834 26.18681 1.000 43.28359  ? 148 GLN A CD  1 
ATOM   1095 O OE1 . GLN A 1 148 ? 22.31073  -13.37363 25.38201 1.000 57.34612  ? 148 GLN A OE1 1 
ATOM   1096 N NE2 . GLN A 1 148 ? 23.46474  -14.24314 27.10359 1.000 52.17612  ? 148 GLN A NE2 1 
ATOM   1097 N N   . SER A 1 149 ? 23.15691  -11.63152 29.19788 1.000 42.01612  ? 149 SER A N   1 
ATOM   1098 C CA  . SER A 1 149 ? 23.77558  -11.89825 30.48176 1.000 57.36618  ? 149 SER A CA  1 
ATOM   1099 C C   . SER A 1 149 ? 24.88318  -12.94250 30.33774 1.000 55.05816  ? 149 SER A C   1 
ATOM   1100 O O   . SER A 1 149 ? 24.88688  -13.74985 29.41069 1.000 54.03612  ? 149 SER A O   1 
ATOM   1101 C CB  . SER A 1 149 ? 22.71804  -12.38023 31.47866 1.000 39.61680  ? 149 SER A CB  1 
ATOM   1102 O OG  . SER A 1 149 ? 23.34147  -12.89323 32.63376 1.000 75.01387  ? 149 SER A OG  1 
ATOM   1103 N N   . VAL A 1 150 ? 25.83234  -12.93977 31.27994 1.000 49.53612  ? 150 VAL A N   1 
ATOM   1104 C CA  . VAL A 1 150 ? 26.84033  -13.99518 31.30778 1.000 51.95612  ? 150 VAL A CA  1 
ATOM   1105 C C   . VAL A 1 150 ? 26.38225  -15.24396 32.04624 1.000 51.81612  ? 150 VAL A C   1 
ATOM   1106 O O   . VAL A 1 150 ? 27.16145  -16.19981 32.13951 1.000 58.42612  ? 150 VAL A O   1 
ATOM   1107 C CB  . VAL A 1 150 ? 28.17369  -13.50962 31.92018 1.000 61.05845  ? 150 VAL A CB  1 
ATOM   1108 C CG1 . VAL A 1 150 ? 28.64495  -12.24408 31.23866 1.000 62.83612  ? 150 VAL A CG1 1 
ATOM   1109 C CG2 . VAL A 1 150 ? 28.02773  -13.27963 33.42801 1.000 56.94612  ? 150 VAL A CG2 1 
ATOM   1110 N N   . VAL A 1 151 ? 25.14917  -15.28771 32.56779 1.000 59.55612  ? 151 VAL A N   1 
ATOM   1111 C CA  . VAL A 1 151 ? 24.78053  -16.46470 33.36076 1.000 55.32816  ? 151 VAL A CA  1 
ATOM   1112 C C   . VAL A 1 151 ? 24.33740  -17.62850 32.47589 1.000 54.66015  ? 151 VAL A C   1 
ATOM   1113 O O   . VAL A 1 151 ? 24.46864  -18.79045 32.87509 1.000 54.51612  ? 151 VAL A O   1 
ATOM   1114 C CB  . VAL A 1 151 ? 23.71172  -16.14747 34.43217 1.000 68.49612  ? 151 VAL A CB  1 
ATOM   1115 C CG1 . VAL A 1 151 ? 23.87502  -14.74113 34.99327 1.000 58.93612  ? 151 VAL A CG1 1 
ATOM   1116 C CG2 . VAL A 1 151 ? 22.31375  -16.38060 33.91680 1.000 51.93612  ? 151 VAL A CG2 1 
ATOM   1117 N N   . ALA A 1 152 ? 23.81533  -17.35865 31.28237 1.000 61.58612  ? 152 ALA A N   1 
ATOM   1118 C CA  . ALA A 1 152 ? 23.37262  -18.41775 30.38646 1.000 60.96850  ? 152 ALA A CA  1 
ATOM   1119 C C   . ALA A 1 152 ? 23.23987  -17.84326 28.99144 1.000 48.66627  ? 152 ALA A C   1 
ATOM   1120 O O   . ALA A 1 152 ? 22.94649  -16.64597 28.83409 1.000 50.95612  ? 152 ALA A O   1 
ATOM   1121 C CB  . ALA A 1 152 ? 22.04067  -19.02715 30.84665 1.000 57.87612  ? 152 ALA A CB  1 
ATOM   1122 N N   . PRO A 1 153 ? 23.43991  -18.65257 27.95305 1.000 58.35982  ? 153 PRO A N   1 
ATOM   1123 C CA  . PRO A 1 153 ? 23.43378  -18.11159 26.58553 1.000 49.32010  ? 153 PRO A CA  1 
ATOM   1124 C C   . PRO A 1 153 ? 22.08593  -17.55295 26.16770 1.000 43.58144  ? 153 PRO A C   1 
ATOM   1125 O O   . PRO A 1 153 ? 22.04529  -16.61300 25.36235 1.000 53.60612  ? 153 PRO A O   1 
ATOM   1126 C CB  . PRO A 1 153 ? 23.84780  -19.31653 25.73301 1.000 56.51453  ? 153 PRO A CB  1 
ATOM   1127 C CG  . PRO A 1 153 ? 23.49394  -20.51201 26.58149 1.000 61.80906  ? 153 PRO A CG  1 
ATOM   1128 C CD  . PRO A 1 153 ? 23.76598  -20.09159 27.98854 1.000 51.20892  ? 153 PRO A CD  1 
ATOM   1129 N N   . ASN A 1 154 ? 20.98828  -18.06827 26.72704 1.000 44.68612  ? 154 ASN A N   1 
ATOM   1130 C CA  . ASN A 1 154 ? 19.65470  -17.56414 26.42352 1.000 58.02612  ? 154 ASN A CA  1 
ATOM   1131 C C   . ASN A 1 154 ? 19.12418  -16.57011 27.43460 1.000 61.51575  ? 154 ASN A C   1 
ATOM   1132 O O   . ASN A 1 154 ? 17.99792  -16.09686 27.27338 1.000 52.37612  ? 154 ASN A O   1 
ATOM   1133 C CB  . ASN A 1 154 ? 18.65172  -18.70459 26.30885 1.000 61.62612  ? 154 ASN A CB  1 
ATOM   1134 C CG  . ASN A 1 154 ? 18.84812  -19.50528 25.05225 1.000 74.35652  ? 154 ASN A CG  1 
ATOM   1135 O OD1 . ASN A 1 154 ? 18.90098  -20.73568 25.09219 1.000 82.66472  ? 154 ASN A OD1 1 
ATOM   1136 N ND2 . ASN A 1 154 ? 18.98604  -18.80548 23.91357 1.000 83.20315  ? 154 ASN A ND2 1 
ATOM   1137 N N   . THR A 1 155 ? 19.88559  -16.23300 28.45791 1.000 52.32612  ? 155 THR A N   1 
ATOM   1138 C CA  . THR A 1 155 ? 19.35345  -15.46204 29.56523 1.000 43.70612  ? 155 THR A CA  1 
ATOM   1139 C C   . THR A 1 155 ? 19.69276  -13.99114 29.39834 1.000 38.93612  ? 155 THR A C   1 
ATOM   1140 O O   . THR A 1 155 ? 20.85854  -13.63331 29.19854 1.000 50.34612  ? 155 THR A O   1 
ATOM   1141 C CB  . THR A 1 155 ? 19.87977  -16.00633 30.88910 1.000 51.44612  ? 155 THR A CB  1 
ATOM   1142 O OG1 . THR A 1 155 ? 19.38060  -17.33856 31.05234 1.000 54.19612  ? 155 THR A OG1 1 
ATOM   1143 C CG2 . THR A 1 155 ? 19.41508  -15.12253 32.06211 1.000 49.97612  ? 155 THR A CG2 1 
ATOM   1144 N N   . LEU A 1 156 ? 18.67251  -13.14716 29.44038 1.000 44.04612  ? 156 LEU A N   1 
ATOM   1145 C CA  . LEU A 1 156 ? 18.88138  -11.71333 29.38591 1.000 36.03926  ? 156 LEU A CA  1 
ATOM   1146 C C   . LEU A 1 156 ? 18.44332  -11.07225 30.70024 1.000 47.35612  ? 156 LEU A C   1 
ATOM   1147 O O   . LEU A 1 156 ? 17.73001  -11.68078 31.49717 1.000 45.51612  ? 156 LEU A O   1 
ATOM   1148 C CB  . LEU A 1 156 ? 18.13327  -11.09271 28.20521 1.000 41.96612  ? 156 LEU A CB  1 
ATOM   1149 C CG  . LEU A 1 156 ? 18.48352  -11.71626 26.84450 1.000 50.57612  ? 156 LEU A CG  1 
ATOM   1150 C CD1 . LEU A 1 156 ? 17.26082  -12.33473 26.23489 1.000 54.09612  ? 156 LEU A CD1 1 
ATOM   1151 C CD2 . LEU A 1 156 ? 19.07467  -10.69022 25.92691 1.000 59.91612  ? 156 LEU A CD2 1 
ATOM   1152 N N   . PHE A 1 157 ? 18.86678  -9.82598  30.91919 1.000 35.63612  ? 157 PHE A N   1 
ATOM   1153 C CA  . PHE A 1 157 ? 18.55919  -9.14731  32.16452 1.000 45.68429  ? 157 PHE A CA  1 
ATOM   1154 C C   . PHE A 1 157 ? 18.23022  -7.68463  31.91993 1.000 43.18612  ? 157 PHE A C   1 
ATOM   1155 O O   . PHE A 1 157 ? 18.74056  -7.05191  31.00007 1.000 40.83612  ? 157 PHE A O   1 
ATOM   1156 C CB  . PHE A 1 157 ? 19.70363  -9.29285  33.19659 1.000 42.13612  ? 157 PHE A CB  1 
ATOM   1157 C CG  . PHE A 1 157 ? 20.84084  -8.33747  33.00108 1.000 53.49612  ? 157 PHE A CG  1 
ATOM   1158 C CD1 . PHE A 1 157 ? 21.83428  -8.60395  32.07816 1.000 45.38612  ? 157 PHE A CD1 1 
ATOM   1159 C CD2 . PHE A 1 157 ? 20.94566  -7.19739  33.78428 1.000 48.09612  ? 157 PHE A CD2 1 
ATOM   1160 C CE1 . PHE A 1 157 ? 22.89139  -7.72720  31.90797 1.000 55.64818  ? 157 PHE A CE1 1 
ATOM   1161 C CE2 . PHE A 1 157 ? 21.99137  -6.32220  33.62242 1.000 47.85612  ? 157 PHE A CE2 1 
ATOM   1162 C CZ  . PHE A 1 157 ? 22.97068  -6.58241  32.68085 1.000 56.93612  ? 157 PHE A CZ  1 
ATOM   1163 N N   . TYR A 1 158 ? 17.33311  -7.17235  32.75648 1.000 38.31612  ? 158 TYR A N   1 
ATOM   1164 C CA  . TYR A 1 158 ? 16.90362  -5.77776  32.76483 1.000 42.17612  ? 158 TYR A CA  1 
ATOM   1165 C C   . TYR A 1 158 ? 17.24951  -5.23371  34.15663 1.000 50.15425  ? 158 TYR A C   1 
ATOM   1166 O O   . TYR A 1 158 ? 16.66477  -5.66418  35.16141 1.000 44.05612  ? 158 TYR A O   1 
ATOM   1167 C CB  . TYR A 1 158 ? 15.40370  -5.69499  32.45133 1.000 44.39612  ? 158 TYR A CB  1 
ATOM   1168 C CG  . TYR A 1 158 ? 14.81996  -4.30555  32.35564 1.000 44.28746  ? 158 TYR A CG  1 
ATOM   1169 C CD1 . TYR A 1 158 ? 14.51105  -3.59031  33.49807 1.000 46.85612  ? 158 TYR A CD1 1 
ATOM   1170 C CD2 . TYR A 1 158 ? 14.54946  -3.71102  31.11622 1.000 47.03612  ? 158 TYR A CD2 1 
ATOM   1171 C CE1 . TYR A 1 158 ? 13.97223  -2.30785  33.43031 1.000 51.54612  ? 158 TYR A CE1 1 
ATOM   1172 C CE2 . TYR A 1 158 ? 14.00133  -2.42506  31.04053 1.000 50.96612  ? 158 TYR A CE2 1 
ATOM   1173 C CZ  . TYR A 1 158 ? 13.72219  -1.73140  32.21405 1.000 53.57014  ? 158 TYR A CZ  1 
ATOM   1174 O OH  . TYR A 1 158 ? 13.17865  -0.46730  32.20001 1.000 71.17612  ? 158 TYR A OH  1 
ATOM   1175 N N   . LYS A 1 159 ? 18.23194  -4.33169  34.21504 1.000 45.33164  ? 159 LYS A N   1 
ATOM   1176 C CA  . LYS A 1 159 ? 18.71683  -3.79691  35.48611 1.000 45.61612  ? 159 LYS A CA  1 
ATOM   1177 C C   . LYS A 1 159 ? 17.65037  -2.98767  36.20307 1.000 42.30630  ? 159 LYS A C   1 
ATOM   1178 O O   . LYS A 1 159 ? 17.04388  -2.08507  35.62861 1.000 49.06612  ? 159 LYS A O   1 
ATOM   1179 C CB  . LYS A 1 159 ? 19.93199  -2.89593  35.27518 1.000 53.08612  ? 159 LYS A CB  1 
ATOM   1180 C CG  . LYS A 1 159 ? 20.80066  -2.70963  36.51675 1.000 64.74612  ? 159 LYS A CG  1 
ATOM   1181 C CD  . LYS A 1 159 ? 21.79756  -1.56493  36.31707 1.000 69.80223  ? 159 LYS A CD  1 
ATOM   1182 C CE  . LYS A 1 159 ? 22.82831  -1.49452  37.43999 1.000 77.52371  ? 159 LYS A CE  1 
ATOM   1183 N NZ  . LYS A 1 159 ? 22.65877  -0.37242  38.39660 1.000 91.32615  ? 159 LYS A NZ  1 
ATOM   1184 N N   . VAL A 1 160 ? 17.46310  -3.27400  37.47961 1.000 43.80612  ? 160 VAL A N   1 
ATOM   1185 C CA  . VAL A 1 160 ? 16.62230  -2.45193  38.33603 1.000 49.40654  ? 160 VAL A CA  1 
ATOM   1186 C C   . VAL A 1 160 ? 17.51142  -1.43162  39.03098 1.000 64.29612  ? 160 VAL A C   1 
ATOM   1187 O O   . VAL A 1 160 ? 18.55209  -1.78173  39.60252 1.000 68.19612  ? 160 VAL A O   1 
ATOM   1188 C CB  . VAL A 1 160 ? 15.84774  -3.31336  39.34008 1.000 52.54612  ? 160 VAL A CB  1 
ATOM   1189 C CG1 . VAL A 1 160 ? 14.99442  -2.44455  40.23918 1.000 58.39612  ? 160 VAL A CG1 1 
ATOM   1190 C CG2 . VAL A 1 160 ? 15.01237  -4.34046  38.58421 1.000 48.56612  ? 160 VAL A CG2 1 
ATOM   1191 N N   . LEU A 1 161 ? 17.11916  -0.16876  38.95595 1.000 53.87521  ? 161 LEU A N   1 
ATOM   1192 C CA  . LEU A 1 161 ? 17.90058  0.92264   39.51114 1.000 75.97093  ? 161 LEU A CA  1 
ATOM   1193 C C   . LEU A 1 161 ? 17.55875  1.12397   40.99353 1.000 86.28557  ? 161 LEU A C   1 
ATOM   1194 O O   . LEU A 1 161 ? 16.80353  0.35472   41.59740 1.000 81.50508  ? 161 LEU A O   1 
ATOM   1195 C CB  . LEU A 1 161 ? 17.65661  2.17741   38.67567 1.000 76.51785  ? 161 LEU A CB  1 
ATOM   1196 C CG  . LEU A 1 161 ? 17.88965  1.88605   37.18501 1.000 61.65202  ? 161 LEU A CG  1 
ATOM   1197 C CD1 . LEU A 1 161 ? 17.81753  3.12515   36.33000 1.000 56.32867  ? 161 LEU A CD1 1 
ATOM   1198 C CD2 . LEU A 1 161 ? 19.22888  1.20146   37.00115 1.000 70.38612  ? 161 LEU A CD2 1 
ATOM   1199 N N   . GLU A 1 162 ? 18.14158  2.15734   41.60075 1.000 87.01229  ? 162 GLU A N   1 
ATOM   1200 C CA  . GLU A 1 162 ? 17.75102  2.55774   42.94853 1.000 100.07478 ? 162 GLU A CA  1 
ATOM   1201 C C   . GLU A 1 162 ? 16.32372  3.11064   42.94242 1.000 99.90417  ? 162 GLU A C   1 
ATOM   1202 O O   . GLU A 1 162 ? 15.77427  3.46342   41.89488 1.000 96.68817  ? 162 GLU A O   1 
ATOM   1203 C CB  . GLU A 1 162 ? 18.72766  3.60294   43.48481 1.000 99.86963  ? 162 GLU A CB  1 
ATOM   1204 C CG  . GLU A 1 162 ? 18.38391  5.02478   43.05610 1.000 115.03643 ? 162 GLU A CG  1 
ATOM   1205 C CD  . GLU A 1 162 ? 19.04338  5.42521   41.73610 1.000 126.97224 ? 162 GLU A CD  1 
ATOM   1206 O OE1 . GLU A 1 162 ? 18.97839  4.63069   40.76641 1.000 115.82378 ? 162 GLU A OE1 1 
ATOM   1207 O OE2 . GLU A 1 162 ? 19.62150  6.53577   41.66958 1.000 121.92555 ? 162 GLU A OE2 1 
ATOM   1208 N N   . HIS A 1 163 ? 15.72034  3.19165   44.13352 1.000 103.29412 ? 163 HIS A N   1 
ATOM   1209 C CA  . HIS A 1 163 ? 14.32950  3.63468   44.25760 1.000 103.73702 ? 163 HIS A CA  1 
ATOM   1210 C C   . HIS A 1 163 ? 14.10583  5.01017   43.63086 1.000 109.11086 ? 163 HIS A C   1 
ATOM   1211 O O   . HIS A 1 163 ? 14.51483  6.03123   44.19175 1.000 110.73335 ? 163 HIS A O   1 
ATOM   1212 C CB  . HIS A 1 163 ? 13.87894  3.64341   45.72805 1.000 107.41282 ? 163 HIS A CB  1 
ATOM   1213 C CG  . HIS A 1 163 ? 14.91322  4.14268   46.69289 1.000 115.92916 ? 163 HIS A CG  1 
ATOM   1214 N ND1 . HIS A 1 163 ? 15.61555  3.30230   47.53046 1.000 110.28958 ? 163 HIS A ND1 1 
ATOM   1215 C CD2 . HIS A 1 163 ? 15.33626  5.39718   46.98145 1.000 122.17078 ? 163 HIS A CD2 1 
ATOM   1216 C CE1 . HIS A 1 163 ? 16.44305  4.01392   48.27598 1.000 102.93199 ? 163 HIS A CE1 1 
ATOM   1217 N NE2 . HIS A 1 163 ? 16.29196  5.28826   47.96356 1.000 126.84528 ? 163 HIS A NE2 1 
ATOM   1218 N N   . HIS A 1 164 ? 13.45350  5.03350   42.46754 1.000 119.63068 ? 164 HIS A N   1 
ATOM   1219 C CA  . HIS A 1 164 ? 13.22033  6.25006   41.68267 1.000 107.85499 ? 164 HIS A CA  1 
ATOM   1220 C C   . HIS A 1 164 ? 14.48241  7.09664   41.49401 1.000 117.97360 ? 164 HIS A C   1 
ATOM   1221 O O   . HIS A 1 164 ? 15.40711  6.70590   40.77580 1.000 113.91256 ? 164 HIS A O   1 
ATOM   1222 C CB  . HIS A 1 164 ? 12.11801  7.09637   42.32177 1.000 105.51155 ? 164 HIS A CB  1 
ATOM   1223 C CG  . HIS A 1 164 ? 10.82399  7.06931   41.56600 1.000 131.87403 ? 164 HIS A CG  1 
ATOM   1224 N ND1 . HIS A 1 164 ? 10.60236  7.83432   40.43943 1.000 131.77767 ? 164 HIS A ND1 1 
ATOM   1225 C CD2 . HIS A 1 164 ? 9.68240   6.37022   41.77473 1.000 129.68305 ? 164 HIS A CD2 1 
ATOM   1226 C CE1 . HIS A 1 164 ? 9.38161   7.60689   39.98663 1.000 125.85359 ? 164 HIS A CE1 1 
ATOM   1227 N NE2 . HIS A 1 164 ? 8.80152   6.72399   40.77986 1.000 127.36809 ? 164 HIS A NE2 1 
ATOM   1228 N N   . ALA B 2 2   ? 10.80719  -28.14312 35.84189 1.000 89.44714  ? 60  ALA B N   1 
ATOM   1229 C CA  . ALA B 2 2   ? 11.82875  -27.31879 35.19953 1.000 94.44184  ? 60  ALA B CA  1 
ATOM   1230 C C   . ALA B 2 2   ? 11.86902  -25.92283 35.84113 1.000 95.68897  ? 60  ALA B C   1 
ATOM   1231 O O   . ALA B 2 2   ? 11.63391  -25.80054 37.04264 1.000 104.18857 ? 60  ALA B O   1 
ATOM   1232 C CB  . ALA B 2 2   ? 11.56891  -27.22956 33.68115 1.000 90.86025  ? 60  ALA B CB  1 
ATOM   1233 N N   . SER B 2 3   ? 12.14174  -24.88776 35.02969 1.000 89.36826  ? 61  SER B N   1 
ATOM   1234 C CA  . SER B 2 3   ? 12.33471  -23.48869 35.43869 1.000 84.47563  ? 61  SER B CA  1 
ATOM   1235 C C   . SER B 2 3   ? 13.39797  -23.32759 36.53306 1.000 75.62093  ? 61  SER B C   1 
ATOM   1236 O O   . SER B 2 3   ? 13.13520  -23.55834 37.72009 1.000 89.23193  ? 61  SER B O   1 
ATOM   1237 C CB  . SER B 2 3   ? 11.01408  -22.82895 35.89345 1.000 92.07480  ? 61  SER B CB  1 
ATOM   1238 O OG  . SER B 2 3   ? 10.13340  -23.69247 36.59681 1.000 95.20524  ? 61  SER B OG  1 
ATOM   1239 N N   . GLN B 2 4   ? 14.59710  -22.89914 36.14267 1.000 70.12748  ? 62  GLN B N   1 
ATOM   1240 C CA  . GLN B 2 4   ? 15.72024  -22.80859 37.06491 1.000 64.68185  ? 62  GLN B CA  1 
ATOM   1241 C C   . GLN B 2 4   ? 15.68274  -21.48856 37.81803 1.000 71.63463  ? 62  GLN B C   1 
ATOM   1242 O O   . GLN B 2 4   ? 15.69733  -20.41556 37.20318 1.000 58.96091  ? 62  GLN B O   1 
ATOM   1243 C CB  . GLN B 2 4   ? 17.04459  -22.92317 36.31658 1.000 62.13048  ? 62  GLN B CB  1 
ATOM   1244 C CG  . GLN B 2 4   ? 18.25407  -23.14902 37.21206 1.000 79.63718  ? 62  GLN B CG  1 
ATOM   1245 C CD  . GLN B 2 4   ? 19.54405  -22.95928 36.44533 1.000 84.11600  ? 62  GLN B CD  1 
ATOM   1246 O OE1 . GLN B 2 4   ? 19.51864  -22.79187 35.22782 1.000 81.75054  ? 62  GLN B OE1 1 
ATOM   1247 N NE2 . GLN B 2 4   ? 20.67858  -22.99852 37.14191 1.000 62.95612  ? 62  GLN B NE2 1 
ATOM   1248 N N   . ARG B 2 5   ? 15.67119  -21.57151 39.15258 1.000 56.91826  ? 63  ARG B N   1 
ATOM   1249 C CA  . ARG B 2 5   ? 15.63676  -20.38612 39.99310 1.000 65.00878  ? 63  ARG B CA  1 
ATOM   1250 C C   . ARG B 2 5   ? 16.97657  -20.03633 40.61509 1.000 61.88612  ? 63  ARG B C   1 
ATOM   1251 O O   . ARG B 2 5   ? 17.22348  -18.85580 40.86449 1.000 53.90612  ? 63  ARG B O   1 
ATOM   1252 C CB  . ARG B 2 5   ? 14.59455  -20.56223 41.09871 1.000 63.22089  ? 63  ARG B CB  1 
ATOM   1253 C CG  . ARG B 2 5   ? 13.36909  -21.25642 40.58836 1.000 79.16151  ? 63  ARG B CG  1 
ATOM   1254 C CD  . ARG B 2 5   ? 12.12436  -20.44540 40.77640 1.000 65.96612  ? 63  ARG B CD  1 
ATOM   1255 N NE  . ARG B 2 5   ? 10.95162  -21.25463 40.47681 1.000 75.60551  ? 63  ARG B NE  1 
ATOM   1256 C CZ  . ARG B 2 5   ? 9.78454   -21.13721 41.08932 1.000 83.87807  ? 63  ARG B CZ  1 
ATOM   1257 N NH1 . ARG B 2 5   ? 9.62042   -20.30766 42.10955 1.000 84.30967  ? 63  ARG B NH1 1 
ATOM   1258 N NH2 . ARG B 2 5   ? 8.76011   -21.87671 40.67487 1.000 74.93631  ? 63  ARG B NH2 1 
ATOM   1259 N N   . LEU B 2 6   ? 17.84809  -21.01230 40.84602 1.000 59.01612  ? 64  LEU B N   1 
ATOM   1260 C CA  . LEU B 2 6   ? 19.14912  -20.77699 41.45835 1.000 52.83934  ? 64  LEU B CA  1 
ATOM   1261 C C   . LEU B 2 6   ? 20.25133  -21.00218 40.43279 1.000 54.30612  ? 64  LEU B C   1 
ATOM   1262 O O   . LEU B 2 6   ? 20.44536  -22.12262 39.95430 1.000 57.87612  ? 64  LEU B O   1 
ATOM   1263 C CB  . LEU B 2 6   ? 19.34660  -21.68254 42.66578 1.000 58.41612  ? 64  LEU B CB  1 
ATOM   1264 C CG  . LEU B 2 6   ? 20.63404  -21.47617 43.44984 1.000 60.39122  ? 64  LEU B CG  1 
ATOM   1265 C CD1 . LEU B 2 6   ? 20.79282  -20.04385 43.91566 1.000 51.49928  ? 64  LEU B CD1 1 
ATOM   1266 C CD2 . LEU B 2 6   ? 20.60969  -22.41637 44.62531 1.000 66.58612  ? 64  LEU B CD2 1 
ATOM   1267 N N   . PHE B 2 7   ? 20.97162  -19.94728 40.11358 1.000 47.91612  ? 65  PHE B N   1 
ATOM   1268 C CA  . PHE B 2 7   ? 22.06443  -19.98233 39.15270 1.000 51.90003  ? 65  PHE B CA  1 
ATOM   1269 C C   . PHE B 2 7   ? 23.38880  -19.94869 39.91380 1.000 65.71612  ? 65  PHE B C   1 
ATOM   1270 O O   . PHE B 2 7   ? 23.70086  -18.95194 40.57263 1.000 67.51612  ? 65  PHE B O   1 
ATOM   1271 C CB  . PHE B 2 7   ? 21.95357  -18.80490 38.18651 1.000 48.26612  ? 65  PHE B CB  1 
ATOM   1272 C CG  . PHE B 2 7   ? 20.69890  -18.82676 37.36013 1.000 73.40896  ? 65  PHE B CG  1 
ATOM   1273 C CD1 . PHE B 2 7   ? 20.72348  -19.29714 36.06021 1.000 67.33056  ? 65  PHE B CD1 1 
ATOM   1274 C CD2 . PHE B 2 7   ? 19.48661  -18.39775 37.88978 1.000 66.71612  ? 65  PHE B CD2 1 
ATOM   1275 C CE1 . PHE B 2 7   ? 19.56680  -19.32631 35.29531 1.000 73.91045  ? 65  PHE B CE1 1 
ATOM   1276 C CE2 . PHE B 2 7   ? 18.32821  -18.42842 37.12991 1.000 75.06786  ? 65  PHE B CE2 1 
ATOM   1277 C CZ  . PHE B 2 7   ? 18.37020  -18.89526 35.83100 1.000 77.30206  ? 65  PHE B CZ  1 
ATOM   1278 N N   . VAL B 2 8   ? 24.16197  -21.03164 39.82827 1.000 69.37612  ? 66  VAL B N   1 
ATOM   1279 C CA  . VAL B 2 8   ? 25.48209  -21.11220 40.45316 1.000 66.33230  ? 66  VAL B CA  1 
ATOM   1280 C C   . VAL B 2 8   ? 26.55490  -20.94472 39.38134 1.000 63.32612  ? 66  VAL B C   1 
ATOM   1281 O O   . VAL B 2 8   ? 26.67742  -21.76170 38.46041 1.000 75.66035  ? 66  VAL B O   1 
ATOM   1282 C CB  . VAL B 2 8   ? 25.66266  -22.41905 41.25101 1.000 68.34735  ? 66  VAL B CB  1 
ATOM   1283 C CG1 . VAL B 2 8   ? 24.48862  -22.64280 42.15992 1.000 53.69612  ? 66  VAL B CG1 1 
ATOM   1284 C CG2 . VAL B 2 8   ? 25.80571  -23.64270 40.35221 1.000 96.46366  ? 66  VAL B CG2 1 
ATOM   1285 N N   . LEU B 2 9   ? 27.32257  -19.86939 39.48315 1.000 55.96801  ? 67  LEU B N   1 
ATOM   1286 C CA  . LEU B 2 9   ? 28.35617  -19.57066 38.50903 1.000 65.69165  ? 67  LEU B CA  1 
ATOM   1287 C C   . LEU B 2 9   ? 29.73288  -19.87976 39.08377 1.000 78.80627  ? 67  LEU B C   1 
ATOM   1288 O O   . LEU B 2 9   ? 29.94130  -19.84098 40.29909 1.000 66.11026  ? 67  LEU B O   1 
ATOM   1289 C CB  . LEU B 2 9   ? 28.30621  -18.10407 38.06626 1.000 55.80630  ? 67  LEU B CB  1 
ATOM   1290 C CG  . LEU B 2 9   ? 27.02990  -17.56115 37.43220 1.000 53.36612  ? 67  LEU B CG  1 
ATOM   1291 C CD1 . LEU B 2 9   ? 27.07099  -16.04996 37.41654 1.000 64.67612  ? 67  LEU B CD1 1 
ATOM   1292 C CD2 . LEU B 2 9   ? 26.88112  -18.11018 36.04197 1.000 73.11635  ? 67  LEU B CD2 1 
ATOM   1293 N N   . ASP B 2 10  ? 30.66806  -20.20322 38.19480 1.000 76.94218  ? 68  ASP B N   1 
ATOM   1294 C CA  . ASP B 2 10  ? 32.06919  -20.22817 38.57254 1.000 76.58849  ? 68  ASP B CA  1 
ATOM   1295 C C   . ASP B 2 10  ? 32.52495  -18.81837 38.93420 1.000 73.96491  ? 68  ASP B C   1 
ATOM   1296 O O   . ASP B 2 10  ? 31.89819  -17.81935 38.56842 1.000 75.34612  ? 68  ASP B O   1 
ATOM   1297 C CB  . ASP B 2 10  ? 32.92221  -20.80858 37.44067 1.000 77.63147  ? 68  ASP B CB  1 
ATOM   1298 C CG  . ASP B 2 10  ? 33.16416  -19.80626 36.30634 1.000 101.30749 ? 68  ASP B CG  1 
ATOM   1299 O OD1 . ASP B 2 10  ? 34.10517  -18.98507 36.42323 1.000 95.46103  ? 68  ASP B OD1 1 
ATOM   1300 O OD2 . ASP B 2 10  ? 32.41240  -19.84412 35.29553 1.000 85.37112  ? 68  ASP B OD2 1 
ATOM   1301 N N   . ASN B 2 11  ? 33.64297  -18.74659 39.65860 1.000 76.83838  ? 69  ASN B N   1 
ATOM   1302 C CA  . ASN B 2 11  ? 34.03156  -17.49096 40.28677 1.000 77.76141  ? 69  ASN B CA  1 
ATOM   1303 C C   . ASN B 2 11  ? 34.43882  -16.44041 39.26001 1.000 66.59505  ? 69  ASN B C   1 
ATOM   1304 O O   . ASN B 2 11  ? 34.23380  -15.24267 39.48567 1.000 79.48612  ? 69  ASN B O   1 
ATOM   1305 C CB  . ASN B 2 11  ? 35.13796  -17.76548 41.30268 1.000 86.16407  ? 69  ASN B CB  1 
ATOM   1306 C CG  . ASN B 2 11  ? 34.87659  -19.03706 42.10825 1.000 94.52668  ? 69  ASN B CG  1 
ATOM   1307 O OD1 . ASN B 2 11  ? 35.18806  -20.14908 41.66979 1.000 99.21975  ? 69  ASN B OD1 1 
ATOM   1308 N ND2 . ASN B 2 11  ? 34.27915  -18.87525 43.28319 1.000 92.03474  ? 69  ASN B ND2 1 
ATOM   1309 N N   . GLU B 2 12  ? 34.96676  -16.86372 38.11189 1.000 74.70284  ? 70  GLU B N   1 
ATOM   1310 C CA  . GLU B 2 12  ? 35.30525  -15.91431 37.05143 1.000 89.40254  ? 70  GLU B CA  1 
ATOM   1311 C C   . GLU B 2 12  ? 34.05220  -15.38003 36.36042 1.000 76.33456  ? 70  GLU B C   1 
ATOM   1312 O O   . GLU B 2 12  ? 33.97612  -14.18956 36.02227 1.000 66.88275  ? 70  GLU B O   1 
ATOM   1313 C CB  . GLU B 2 12  ? 36.23166  -16.57829 36.02788 1.000 93.89957  ? 70  GLU B CB  1 
ATOM   1314 C CG  . GLU B 2 12  ? 37.69833  -16.68001 36.44809 1.000 109.24565 ? 70  GLU B CG  1 
ATOM   1315 C CD  . GLU B 2 12  ? 37.92262  -17.62090 37.63571 1.000 119.64294 ? 70  GLU B CD  1 
ATOM   1316 O OE1 . GLU B 2 12  ? 37.48967  -18.79671 37.57687 1.000 114.45231 ? 70  GLU B OE1 1 
ATOM   1317 O OE2 . GLU B 2 12  ? 38.54051  -17.18069 38.63205 1.000 125.06745 ? 70  GLU B OE2 1 
ATOM   1318 N N   . ARG B 2 13  ? 33.06563  -16.24739 36.12554 1.000 65.59276  ? 71  ARG B N   1 
ATOM   1319 C CA  . ARG B 2 13  ? 31.82065  -15.78677 35.51860 1.000 78.32066  ? 71  ARG B CA  1 
ATOM   1320 C C   . ARG B 2 13  ? 31.00459  -14.95784 36.50130 1.000 74.69318  ? 71  ARG B C   1 
ATOM   1321 O O   . ARG B 2 13  ? 30.44891  -13.91458 36.12809 1.000 60.36612  ? 71  ARG B O   1 
ATOM   1322 C CB  . ARG B 2 13  ? 31.00812  -16.97780 35.02054 1.000 71.36647  ? 71  ARG B CB  1 
ATOM   1323 C CG  . ARG B 2 13  ? 30.17195  -16.66549 33.79496 1.000 79.65820  ? 71  ARG B CG  1 
ATOM   1324 C CD  . ARG B 2 13  ? 30.23424  -17.79006 32.79501 1.000 59.39660  ? 71  ARG B CD  1 
ATOM   1325 N NE  . ARG B 2 13  ? 29.79618  -19.06141 33.35882 1.000 65.47612  ? 71  ARG B NE  1 
ATOM   1326 C CZ  . ARG B 2 13  ? 28.55883  -19.52871 33.26740 1.000 67.80408  ? 71  ARG B CZ  1 
ATOM   1327 N NH1 . ARG B 2 13  ? 27.59919  -18.82751 32.68384 1.000 62.85117  ? 71  ARG B NH1 1 
ATOM   1328 N NH2 . ARG B 2 13  ? 28.28292  -20.73971 33.74892 1.000 65.67612  ? 71  ARG B NH2 1 
ATOM   1329 N N   . TYR B 2 14  ? 30.92633  -15.41282 37.76108 1.000 63.77745  ? 72  TYR B N   1 
ATOM   1330 C CA  . TYR B 2 14  ? 30.26199  -14.63698 38.79965 1.000 61.78590  ? 72  TYR B CA  1 
ATOM   1331 C C   . TYR B 2 14  ? 30.78256  -13.21519 38.82508 1.000 67.12245  ? 72  TYR B C   1 
ATOM   1332 O O   . TYR B 2 14  ? 30.00457  -12.25849 38.92074 1.000 70.89612  ? 72  TYR B O   1 
ATOM   1333 C CB  . TYR B 2 14  ? 30.46099  -15.29743 40.16288 1.000 62.38902  ? 72  TYR B CB  1 
ATOM   1334 C CG  . TYR B 2 14  ? 29.71972  -14.62402 41.30274 1.000 76.85471  ? 72  TYR B CG  1 
ATOM   1335 C CD1 . TYR B 2 14  ? 28.43992  -15.03557 41.65128 1.000 64.02230  ? 72  TYR B CD1 1 
ATOM   1336 C CD2 . TYR B 2 14  ? 30.30717  -13.60234 42.05080 1.000 77.09038  ? 72  TYR B CD2 1 
ATOM   1337 C CE1 . TYR B 2 14  ? 27.75882  -14.45206 42.68907 1.000 80.67958  ? 72  TYR B CE1 1 
ATOM   1338 C CE2 . TYR B 2 14  ? 29.62722  -13.00410 43.10276 1.000 71.53392  ? 72  TYR B CE2 1 
ATOM   1339 C CZ  . TYR B 2 14  ? 28.35022  -13.43691 43.41406 1.000 83.20540  ? 72  TYR B CZ  1 
ATOM   1340 O OH  . TYR B 2 14  ? 27.64804  -12.86561 44.45137 1.000 82.90682  ? 72  TYR B OH  1 
ATOM   1341 N N   . ASP B 2 15  ? 32.09442  -13.05106 38.70619 1.000 64.75612  ? 73  ASP B N   1 
ATOM   1342 C CA  . ASP B 2 15  ? 32.63935  -11.70795 38.80082 1.000 67.75923  ? 73  ASP B CA  1 
ATOM   1343 C C   . ASP B 2 15  ? 32.26734  -10.87830 37.58508 1.000 69.17370  ? 73  ASP B C   1 
ATOM   1344 O O   . ASP B 2 15  ? 31.93850  -9.69260  37.72237 1.000 68.06520  ? 73  ASP B O   1 
ATOM   1345 C CB  . ASP B 2 15  ? 34.14613  -11.77563 39.01647 1.000 73.70458  ? 73  ASP B CB  1 
ATOM   1346 C CG  . ASP B 2 15  ? 34.49243  -11.94385 40.49078 1.000 100.78845 ? 73  ASP B CG  1 
ATOM   1347 O OD1 . ASP B 2 15  ? 34.09581  -11.06665 41.29422 1.000 101.73828 ? 73  ASP B OD1 1 
ATOM   1348 O OD2 . ASP B 2 15  ? 35.10705  -12.96982 40.85710 1.000 93.43946  ? 73  ASP B OD2 1 
ATOM   1349 N N   . SER B 2 16  ? 32.28036  -11.48767 36.39044 1.000 68.31504  ? 74  SER B N   1 
ATOM   1350 C CA  . SER B 2 16  ? 31.76004  -10.79938 35.20974 1.000 67.19117  ? 74  SER B CA  1 
ATOM   1351 C C   . SER B 2 16  ? 30.30741  -10.40053 35.41714 1.000 60.56371  ? 74  SER B C   1 
ATOM   1352 O O   . SER B 2 16  ? 29.90618  -9.27601  35.08524 1.000 57.62851  ? 74  SER B O   1 
ATOM   1353 C CB  . SER B 2 16  ? 31.88472  -11.68906 33.97241 1.000 61.55406  ? 74  SER B CB  1 
ATOM   1354 O OG  . SER B 2 16  ? 33.05642  -12.47494 34.02740 1.000 86.48895  ? 74  SER B OG  1 
ATOM   1355 N N   . PHE B 2 17  ? 29.50721  -11.31361 35.97424 1.000 52.27538  ? 75  PHE B N   1 
ATOM   1356 C CA  . PHE B 2 17  ? 28.10705  -11.00991 36.24516 1.000 62.55733  ? 75  PHE B CA  1 
ATOM   1357 C C   . PHE B 2 17  ? 27.97664  -9.78386  37.13493 1.000 61.79206  ? 75  PHE B C   1 
ATOM   1358 O O   . PHE B 2 17  ? 27.16276  -8.89389  36.86772 1.000 62.23145  ? 75  PHE B O   1 
ATOM   1359 C CB  . PHE B 2 17  ? 27.41738  -12.20429 36.89694 1.000 56.13373  ? 75  PHE B CB  1 
ATOM   1360 C CG  . PHE B 2 17  ? 25.97615  -11.96588 37.16995 1.000 62.61097  ? 75  PHE B CG  1 
ATOM   1361 C CD1 . PHE B 2 17  ? 25.42114  -12.31010 38.38684 1.000 73.16370  ? 75  PHE B CD1 1 
ATOM   1362 C CD2 . PHE B 2 17  ? 25.17512  -11.37609 36.21556 1.000 75.72612  ? 75  PHE B CD2 1 
ATOM   1363 C CE1 . PHE B 2 17  ? 24.08778  -12.07947 38.63971 1.000 76.69963  ? 75  PHE B CE1 1 
ATOM   1364 C CE2 . PHE B 2 17  ? 23.84400  -11.15037 36.45731 1.000 76.37540  ? 75  PHE B CE2 1 
ATOM   1365 C CZ  . PHE B 2 17  ? 23.29534  -11.50821 37.66672 1.000 76.39010  ? 75  PHE B CZ  1 
ATOM   1366 N N   . ILE B 2 18  ? 28.77888  -9.71689  38.19778 1.000 61.06612  ? 76  ILE B N   1 
ATOM   1367 C CA  . ILE B 2 18  ? 28.71130  -8.56866  39.09519 1.000 62.69150  ? 76  ILE B CA  1 
ATOM   1368 C C   . ILE B 2 18  ? 29.10882  -7.29889  38.35556 1.000 59.52612  ? 76  ILE B C   1 
ATOM   1369 O O   . ILE B 2 18  ? 28.45016  -6.25776  38.46799 1.000 62.63612  ? 76  ILE B O   1 
ATOM   1370 C CB  . ILE B 2 18  ? 29.59532  -8.80589  40.33474 1.000 70.75970  ? 76  ILE B CB  1 
ATOM   1371 C CG1 . ILE B 2 18  ? 28.95836  -9.84815  41.25637 1.000 68.77415  ? 76  ILE B CG1 1 
ATOM   1372 C CG2 . ILE B 2 18  ? 29.80291  -7.50720  41.08558 1.000 70.61246  ? 76  ILE B CG2 1 
ATOM   1373 C CD1 . ILE B 2 18  ? 27.50795  -9.57617  41.54102 1.000 64.64920  ? 76  ILE B CD1 1 
ATOM   1374 N N   . THR B 2 19  ? 30.18177  -7.37002  37.57234 1.000 56.80265  ? 77  THR B N   1 
ATOM   1375 C CA  . THR B 2 19  ? 30.63373  -6.20382  36.81913 1.000 68.83085  ? 77  THR B CA  1 
ATOM   1376 C C   . THR B 2 19  ? 29.56693  -5.71492  35.84825 1.000 70.73612  ? 77  THR B C   1 
ATOM   1377 O O   . THR B 2 19  ? 29.31209  -4.50924  35.74381 1.000 72.12611  ? 77  THR B O   1 
ATOM   1378 C CB  . THR B 2 19  ? 31.90664  -6.53225  36.05103 1.000 68.01612  ? 77  THR B CB  1 
ATOM   1379 O OG1 . THR B 2 19  ? 32.70638  -7.44349  36.80775 1.000 75.13612  ? 77  THR B OG1 1 
ATOM   1380 C CG2 . THR B 2 19  ? 32.68232  -5.26583  35.79976 1.000 73.20612  ? 77  THR B CG2 1 
ATOM   1381 N N   . GLN B 2 20  ? 28.95719  -6.63054  35.09571 1.000 55.80612  ? 78  GLN B N   1 
ATOM   1382 C CA  . GLN B 2 20  ? 27.93186  -6.19350  34.16038 1.000 63.10389  ? 78  GLN B CA  1 
ATOM   1383 C C   . GLN B 2 20  ? 26.68275  -5.73730  34.89995 1.000 60.15593  ? 78  GLN B C   1 
ATOM   1384 O O   . GLN B 2 20  ? 26.03464  -4.76819  34.47990 1.000 56.02612  ? 78  GLN B O   1 
ATOM   1385 C CB  . GLN B 2 20  ? 27.66003  -7.30522  33.13660 1.000 75.51612  ? 78  GLN B CB  1 
ATOM   1386 C CG  . GLN B 2 20  ? 26.50728  -8.24927  33.42738 1.000 74.76204  ? 78  GLN B CG  1 
ATOM   1387 C CD  . GLN B 2 20  ? 26.32918  -9.29883  32.32022 1.000 77.12585  ? 78  GLN B CD  1 
ATOM   1388 O OE1 . GLN B 2 20  ? 26.51832  -9.01263  31.13561 1.000 63.78087  ? 78  GLN B OE1 1 
ATOM   1389 N NE2 . GLN B 2 20  ? 25.96850  -10.51757 32.71204 1.000 64.23452  ? 78  GLN B NE2 1 
ATOM   1390 N N   . LEU B 2 21  ? 26.37737  -6.36715  36.04074 1.000 58.51614  ? 79  LEU B N   1 
ATOM   1391 C CA  . LEU B 2 21  ? 25.26649  -5.90903  36.86688 1.000 62.62188  ? 79  LEU B CA  1 
ATOM   1392 C C   . LEU B 2 21  ? 25.50973  -4.51861  37.42052 1.000 77.88612  ? 79  LEU B C   1 
ATOM   1393 O O   . LEU B 2 21  ? 24.56748  -3.74599  37.59327 1.000 76.26448  ? 79  LEU B O   1 
ATOM   1394 C CB  . LEU B 2 21  ? 25.02689  -6.86698  38.02255 1.000 60.96867  ? 79  LEU B CB  1 
ATOM   1395 C CG  . LEU B 2 21  ? 23.57364  -7.07330  38.37490 1.000 58.58612  ? 79  LEU B CG  1 
ATOM   1396 C CD1 . LEU B 2 21  ? 22.71989  -7.11786  37.11606 1.000 69.94749  ? 79  LEU B CD1 1 
ATOM   1397 C CD2 . LEU B 2 21  ? 23.49832  -8.36571  39.12233 1.000 67.12168  ? 79  LEU B CD2 1 
ATOM   1398 N N   . GLU B 2 22  ? 26.74703  -4.19749  37.76217 1.000 78.29827  ? 80  GLU B N   1 
ATOM   1399 C CA  . GLU B 2 22  ? 26.99391  -2.92846  38.41954 1.000 75.41721  ? 80  GLU B CA  1 
ATOM   1400 C C   . GLU B 2 22  ? 27.39664  -1.83215  37.44630 1.000 72.84094  ? 80  GLU B C   1 
ATOM   1401 O O   . GLU B 2 22  ? 27.44979  -0.66593  37.84578 1.000 74.92967  ? 80  GLU B O   1 
ATOM   1402 C CB  . GLU B 2 22  ? 28.05343  -3.10977  39.50943 1.000 79.83462  ? 80  GLU B CB  1 
ATOM   1403 C CG  . GLU B 2 22  ? 29.45330  -2.68554  39.11324 1.000 106.21115 ? 80  GLU B CG  1 
ATOM   1404 C CD  . GLU B 2 22  ? 30.45748  -2.82572  40.25695 1.000 125.79501 ? 80  GLU B CD  1 
ATOM   1405 O OE1 . GLU B 2 22  ? 30.09581  -3.39109  41.31855 1.000 123.48884 ? 80  GLU B OE1 1 
ATOM   1406 O OE2 . GLU B 2 22  ? 31.60969  -2.36129  40.09078 1.000 129.38185 ? 80  GLU B OE2 1 
ATOM   1407 N N   . ALA B 2 23  ? 27.63992  -2.16851  36.17824 1.000 76.71612  ? 81  ALA B N   1 
ATOM   1408 C CA  . ALA B 2 23  ? 27.94847  -1.16077  35.17939 1.000 74.93168  ? 81  ALA B CA  1 
ATOM   1409 C C   . ALA B 2 23  ? 26.75722  -0.22990  34.97988 1.000 77.63332  ? 81  ALA B C   1 
ATOM   1410 O O   . ALA B 2 23  ? 25.63316  -0.54808  35.37571 1.000 81.02612  ? 81  ALA B O   1 
ATOM   1411 C CB  . ALA B 2 23  ? 28.32211  -1.81538  33.85113 1.000 60.56785  ? 81  ALA B CB  1 
ATOM   1412 N N   . PRO B 2 24  ? 26.98544  0.94181   34.39203 1.000 86.09123  ? 82  PRO B N   1 
ATOM   1413 C CA  . PRO B 2 24  ? 25.85998  1.78781   33.98281 1.000 90.69649  ? 82  PRO B CA  1 
ATOM   1414 C C   . PRO B 2 24  ? 24.92251  1.02401   33.06150 1.000 85.54193  ? 82  PRO B C   1 
ATOM   1415 O O   . PRO B 2 24  ? 25.33147  0.10314   32.34823 1.000 78.18480  ? 82  PRO B O   1 
ATOM   1416 C CB  . PRO B 2 24  ? 26.53751  2.94789   33.25019 1.000 89.35732  ? 82  PRO B CB  1 
ATOM   1417 C CG  . PRO B 2 24  ? 27.90192  3.00318   33.84081 1.000 82.65154  ? 82  PRO B CG  1 
ATOM   1418 C CD  . PRO B 2 24  ? 28.28465  1.59094   34.15357 1.000 73.65557  ? 82  PRO B CD  1 
ATOM   1419 N N   . VAL B 2 25  ? 23.64795  1.41717   33.08398 1.000 76.56612  ? 83  VAL B N   1 
ATOM   1420 C CA  . VAL B 2 25  ? 22.63896  0.66060   32.35851 1.000 77.32766  ? 83  VAL B CA  1 
ATOM   1421 C C   . VAL B 2 25  ? 22.97984  0.63626   30.87931 1.000 74.03915  ? 83  VAL B C   1 
ATOM   1422 O O   . VAL B 2 25  ? 23.44968  1.62801   30.30543 1.000 82.40612  ? 83  VAL B O   1 
ATOM   1423 C CB  . VAL B 2 25  ? 21.23738  1.24132   32.60613 1.000 72.11612  ? 83  VAL B CB  1 
ATOM   1424 C CG1 . VAL B 2 25  ? 21.08402  1.57998   34.05786 1.000 89.06176  ? 83  VAL B CG1 1 
ATOM   1425 C CG2 . VAL B 2 25  ? 20.99049  2.47267   31.75979 1.000 70.12299  ? 83  VAL B CG2 1 
ATOM   1426 N N   . GLN B 2 26  ? 22.79724  -0.52505  30.26794 1.000 65.49798  ? 84  GLN B N   1 
ATOM   1427 C CA  . GLN B 2 26  ? 22.94167  -0.68250  28.83170 1.000 69.13890  ? 84  GLN B CA  1 
ATOM   1428 C C   . GLN B 2 26  ? 21.57235  -0.72055  28.17080 1.000 65.17612  ? 84  GLN B C   1 
ATOM   1429 O O   . GLN B 2 26  ? 20.54296  -0.84087  28.83248 1.000 71.75612  ? 84  GLN B O   1 
ATOM   1430 C CB  . GLN B 2 26  ? 23.73013  -1.94705  28.51906 1.000 65.67612  ? 84  GLN B CB  1 
ATOM   1431 C CG  . GLN B 2 26  ? 24.99761  -2.05267  29.32042 1.000 72.90268  ? 84  GLN B CG  1 
ATOM   1432 C CD  . GLN B 2 26  ? 25.69103  -3.37969  29.11774 1.000 87.04619  ? 84  GLN B CD  1 
ATOM   1433 O OE1 . GLN B 2 26  ? 25.77949  -4.19815  30.04385 1.000 86.05078  ? 84  GLN B OE1 1 
ATOM   1434 N NE2 . GLN B 2 26  ? 26.15784  -3.62186  27.88904 1.000 76.51564  ? 84  GLN B NE2 1 
ATOM   1435 N N   . ASN B 2 27  ? 21.57435  -0.60623  26.84504 1.000 60.12912  ? 85  ASN B N   1 
ATOM   1436 C CA  . ASN B 2 27  ? 20.35240  -0.63760  26.04350 1.000 57.32612  ? 85  ASN B CA  1 
ATOM   1437 C C   . ASN B 2 27  ? 19.33152  0.36298   26.57235 1.000 64.18612  ? 85  ASN B C   1 
ATOM   1438 O O   . ASN B 2 27  ? 18.14794  0.05910   26.73601 1.000 63.78612  ? 85  ASN B O   1 
ATOM   1439 C CB  . ASN B 2 27  ? 19.76275  -2.04723  25.99278 1.000 58.13594  ? 85  ASN B CB  1 
ATOM   1440 C CG  . ASN B 2 27  ? 18.70517  -2.19620  24.92531 1.000 61.33612  ? 85  ASN B CG  1 
ATOM   1441 O OD1 . ASN B 2 27  ? 18.35360  -1.23191  24.23933 1.000 64.21612  ? 85  ASN B OD1 1 
ATOM   1442 N ND2 . ASN B 2 27  ? 18.15208  -3.39723  24.81383 1.000 47.38612  ? 85  ASN B ND2 1 
ATOM   1443 N N   . ALA B 2 28  ? 19.81698  1.57222   26.86138 1.000 59.91612  ? 86  ALA B N   1 
ATOM   1444 C CA  . ALA B 2 28  ? 18.93046  2.65392   27.26881 1.000 67.04612  ? 86  ALA B CA  1 
ATOM   1445 C C   . ALA B 2 28  ? 17.89347  2.94710   26.20042 1.000 60.52684  ? 86  ALA B C   1 
ATOM   1446 O O   . ALA B 2 28  ? 16.78115  3.38041   26.51853 1.000 71.16612  ? 86  ALA B O   1 
ATOM   1447 C CB  . ALA B 2 28  ? 19.74185  3.90599   27.57560 1.000 61.64612  ? 86  ALA B CB  1 
ATOM   1448 N N   . GLU B 2 29  ? 18.23564  2.70108   24.93538 1.000 66.79612  ? 87  GLU B N   1 
ATOM   1449 C CA  . GLU B 2 29  ? 17.29186  2.90351   23.84360 1.000 71.68779  ? 87  GLU B CA  1 
ATOM   1450 C C   . GLU B 2 29  ? 16.06077  2.01885   24.00159 1.000 69.51612  ? 87  GLU B C   1 
ATOM   1451 O O   . GLU B 2 29  ? 14.93125  2.51771   24.06575 1.000 65.81375  ? 87  GLU B O   1 
ATOM   1452 C CB  . GLU B 2 29  ? 17.98350  2.64447   22.50854 1.000 64.72589  ? 87  GLU B CB  1 
ATOM   1453 C CG  . GLU B 2 29  ? 17.30500  3.32872   21.33653 1.000 94.45489  ? 87  GLU B CG  1 
ATOM   1454 C CD  . GLU B 2 29  ? 17.80837  2.83385   19.98569 1.000 115.38929 ? 87  GLU B CD  1 
ATOM   1455 O OE1 . GLU B 2 29  ? 18.07816  1.61935   19.84818 1.000 113.01697 ? 87  GLU B OE1 1 
ATOM   1456 O OE2 . GLU B 2 29  ? 17.94142  3.66463   19.06097 1.000 120.18866 ? 87  GLU B OE2 1 
ATOM   1457 N N   . GLY B 2 30  ? 16.25550  0.69820   24.06027 1.000 67.82612  ? 88  GLY B N   1 
ATOM   1458 C CA  . GLY B 2 30  ? 15.11457  -0.17683  24.25979 1.000 67.94612  ? 88  GLY B CA  1 
ATOM   1459 C C   . GLY B 2 30  ? 14.39816  0.08153   25.56071 1.000 63.59000  ? 88  GLY B C   1 
ATOM   1460 O O   . GLY B 2 30  ? 13.21948  -0.24972  25.71089 1.000 65.27612  ? 88  GLY B O   1 
ATOM   1461 N N   . ARG B 2 31  ? 15.07837  0.70548   26.48649 1.000 59.36009  ? 89  ARG B N   1 
ATOM   1462 C CA  . ARG B 2 31  ? 14.58684  0.90941   27.82628 1.000 61.52612  ? 89  ARG B CA  1 
ATOM   1463 C C   . ARG B 2 31  ? 13.67257  2.13235   27.90031 1.000 63.86105  ? 89  ARG B C   1 
ATOM   1464 O O   . ARG B 2 31  ? 12.66540  2.10995   28.62533 1.000 55.97612  ? 89  ARG B O   1 
ATOM   1465 C CB  . ARG B 2 31  ? 15.83160  0.99851   28.70688 1.000 65.79291  ? 89  ARG B CB  1 
ATOM   1466 C CG  . ARG B 2 31  ? 15.68700  1.01188   30.15510 1.000 64.02128  ? 89  ARG B CG  1 
ATOM   1467 C CD  . ARG B 2 31  ? 17.08423  0.94794   30.74133 1.000 58.58726  ? 89  ARG B CD  1 
ATOM   1468 N NE  . ARG B 2 31  ? 16.99519  0.97610   32.19096 1.000 56.40612  ? 89  ARG B NE  1 
ATOM   1469 C CZ  . ARG B 2 31  ? 16.80939  -0.08435  32.96063 1.000 55.36612  ? 89  ARG B CZ  1 
ATOM   1470 N NH1 . ARG B 2 31  ? 16.98206  -1.31092  32.50529 1.000 70.90612  ? 89  ARG B NH1 1 
ATOM   1471 N NH2 . ARG B 2 31  ? 16.44578  0.09239   34.21925 1.000 49.55612  ? 89  ARG B NH2 1 
ATOM   1472 N N   . GLU B 2 32  ? 13.97948  3.17707   27.11268 1.000 67.84156  ? 90  GLU B N   1 
ATOM   1473 C CA  . GLU B 2 32  ? 13.05293  4.29179   26.91430 1.000 72.45745  ? 90  GLU B CA  1 
ATOM   1474 C C   . GLU B 2 32  ? 11.83455  3.86232   26.11679 1.000 62.85311  ? 90  GLU B C   1 
ATOM   1475 O O   . GLU B 2 32  ? 10.74158  4.40733   26.30871 1.000 60.40612  ? 90  GLU B O   1 
ATOM   1476 C CB  . GLU B 2 32  ? 13.74955  5.44859   26.19667 1.000 75.17472  ? 90  GLU B CB  1 
ATOM   1477 C CG  . GLU B 2 32  ? 14.37928  6.47698   27.12267 1.000 90.42457  ? 90  GLU B CG  1 
ATOM   1478 C CD  . GLU B 2 32  ? 15.78660  6.08700   27.57397 1.000 114.39018 ? 90  GLU B CD  1 
ATOM   1479 O OE1 . GLU B 2 32  ? 16.73553  6.24287   26.77224 1.000 114.16891 ? 90  GLU B OE1 1 
ATOM   1480 O OE2 . GLU B 2 32  ? 15.94517  5.62557   28.73173 1.000 109.53673 ? 90  GLU B OE2 1 
ATOM   1481 N N   . ARG B 2 33  ? 12.00854  2.89892   25.21137 1.000 51.53291  ? 91  ARG B N   1 
ATOM   1482 C CA  . ARG B 2 33  ? 10.87401  2.31021   24.50365 1.000 63.76826  ? 91  ARG B CA  1 
ATOM   1483 C C   . ARG B 2 33  ? 9.87953   1.69498   25.48056 1.000 58.68612  ? 91  ARG B C   1 
ATOM   1484 O O   . ARG B 2 33  ? 8.68191   1.99140   25.43611 1.000 65.55612  ? 91  ARG B O   1 
ATOM   1485 C CB  . ARG B 2 33  ? 11.37591  1.25496   23.51911 1.000 56.21390  ? 91  ARG B CB  1 
ATOM   1486 C CG  . ARG B 2 33  ? 11.55346  1.74190   22.10708 1.000 71.05612  ? 91  ARG B CG  1 
ATOM   1487 C CD  . ARG B 2 33  ? 11.77760  0.58857   21.15531 1.000 55.99688  ? 91  ARG B CD  1 
ATOM   1488 N NE  . ARG B 2 33  ? 12.73938  0.92401   20.10919 1.000 66.58918  ? 91  ARG B NE  1 
ATOM   1489 C CZ  . ARG B 2 33  ? 14.01507  0.55254   20.08649 1.000 83.43064  ? 91  ARG B CZ  1 
ATOM   1490 N NH1 . ARG B 2 33  ? 14.54095  -0.18357  21.04786 1.000 61.98558  ? 91  ARG B NH1 1 
ATOM   1491 N NH2 . ARG B 2 33  ? 14.78325  0.92426   19.06662 1.000 84.43878  ? 91  ARG B NH2 1 
ATOM   1492 N N   . LEU B 2 34  ? 10.36636  0.82663   26.36881 1.000 56.46612  ? 92  LEU B N   1 
ATOM   1493 C CA  . LEU B 2 34  ? 9.48999   0.18488   27.33850 1.000 58.63237  ? 92  LEU B CA  1 
ATOM   1494 C C   . LEU B 2 34  ? 8.79268   1.21631   28.20806 1.000 53.33612  ? 92  LEU B C   1 
ATOM   1495 O O   . LEU B 2 34  ? 7.58235   1.13765   28.43204 1.000 56.70612  ? 92  LEU B O   1 
ATOM   1496 C CB  . LEU B 2 34  ? 10.28111  -0.78332  28.21795 1.000 48.97863  ? 92  LEU B CB  1 
ATOM   1497 C CG  . LEU B 2 34  ? 9.41873   -1.66362  29.12116 1.000 49.68896  ? 92  LEU B CG  1 
ATOM   1498 C CD1 . LEU B 2 34  ? 8.37751   -2.45009  28.31670 1.000 49.41165  ? 92  LEU B CD1 1 
ATOM   1499 C CD2 . LEU B 2 34  ? 10.30212  -2.57795  29.92041 1.000 56.10807  ? 92  LEU B CD2 1 
ATOM   1500 N N   . MET B 2 35  ? 9.54152   2.19144   28.71370 1.000 58.97991  ? 93  MET B N   1 
ATOM   1501 C CA  . MET B 2 35  ? 8.90959   3.19420   29.54892 1.000 64.74612  ? 93  MET B CA  1 
ATOM   1502 C C   . MET B 2 35  ? 7.89594   4.02113   28.77711 1.000 60.86362  ? 93  MET B C   1 
ATOM   1503 O O   . MET B 2 35  ? 7.00652   4.61742   29.39198 1.000 65.34612  ? 93  MET B O   1 
ATOM   1504 C CB  . MET B 2 35  ? 9.97165   4.07910   30.19338 1.000 59.79612  ? 93  MET B CB  1 
ATOM   1505 C CG  . MET B 2 35  ? 10.86991  3.29776   31.15829 1.000 83.51255  ? 93  MET B CG  1 
ATOM   1506 S SD  . MET B 2 35  ? 9.97805   2.68819   32.61431 1.000 90.74612  ? 93  MET B SD  1 
ATOM   1507 C CE  . MET B 2 35  ? 9.84778   0.93064   32.28909 1.000 69.92931  ? 93  MET B CE  1 
ATOM   1508 N N   . ALA B 2 36  ? 7.97566   4.03547   27.44750 1.000 63.92551  ? 94  ALA B N   1 
ATOM   1509 C CA  . ALA B 2 36  ? 7.03194   4.81263   26.66321 1.000 56.33279  ? 94  ALA B CA  1 
ATOM   1510 C C   . ALA B 2 36  ? 5.73911   4.06494   26.37600 1.000 72.33612  ? 94  ALA B C   1 
ATOM   1511 O O   . ALA B 2 36  ? 4.77923   4.68335   25.90178 1.000 69.66612  ? 94  ALA B O   1 
ATOM   1512 C CB  . ALA B 2 36  ? 7.68342   5.24551   25.35331 1.000 58.03272  ? 94  ALA B CB  1 
ATOM   1513 N N   . VAL B 2 37  ? 5.69521   2.76121   26.64295 1.000 64.53612  ? 95  VAL B N   1 
ATOM   1514 C CA  . VAL B 2 37  ? 4.50046   1.97418   26.38466 1.000 58.28612  ? 95  VAL B CA  1 
ATOM   1515 C C   . VAL B 2 37  ? 3.39086   2.41841   27.32733 1.000 64.09551  ? 95  VAL B C   1 
ATOM   1516 O O   . VAL B 2 37  ? 3.57351   2.47008   28.55217 1.000 57.87612  ? 95  VAL B O   1 
ATOM   1517 C CB  . VAL B 2 37  ? 4.81432   0.47919   26.53713 1.000 57.92612  ? 95  VAL B CB  1 
ATOM   1518 C CG1 . VAL B 2 37  ? 3.58833   -0.36896  26.25759 1.000 57.22612  ? 95  VAL B CG1 1 
ATOM   1519 C CG2 . VAL B 2 37  ? 5.95671   0.08624   25.61772 1.000 52.85612  ? 95  VAL B CG2 1 
ATOM   1520 N N   . LYS B 2 38  ? 2.23509   2.75244   26.76205 1.000 66.79612  ? 96  LYS B N   1 
ATOM   1521 C CA  . LYS B 2 38  ? 1.07277   3.16749   27.54738 1.000 67.04560  ? 96  LYS B CA  1 
ATOM   1522 C C   . LYS B 2 38  ? -0.06388  2.19403   27.27502 1.000 68.26609  ? 96  LYS B C   1 
ATOM   1523 O O   . LYS B 2 38  ? -0.73205  2.29652   26.23341 1.000 75.20612  ? 96  LYS B O   1 
ATOM   1524 C CB  . LYS B 2 38  ? 0.66162   4.59663   27.20258 1.000 63.13612  ? 96  LYS B CB  1 
ATOM   1525 N N   . PRO B 2 39  ? -0.29513  1.21235   28.14592 1.000 74.08040  ? 97  PRO B N   1 
ATOM   1526 C CA  . PRO B 2 39  ? -1.34815  0.22661   27.87722 1.000 67.68612  ? 97  PRO B CA  1 
ATOM   1527 C C   . PRO B 2 39  ? -2.73018  0.84049   27.99775 1.000 66.53677  ? 97  PRO B C   1 
ATOM   1528 O O   . PRO B 2 39  ? -2.92723  1.87441   28.63663 1.000 64.12755  ? 97  PRO B O   1 
ATOM   1529 C CB  . PRO B 2 39  ? -1.12698  -0.84326  28.95570 1.000 60.77244  ? 97  PRO B CB  1 
ATOM   1530 C CG  . PRO B 2 39  ? 0.28087   -0.61687  29.45550 1.000 62.00067  ? 97  PRO B CG  1 
ATOM   1531 C CD  . PRO B 2 39  ? 0.49701   0.86539   29.33802 1.000 59.82612  ? 97  PRO B CD  1 
ATOM   1532 N N   . GLU B 2 40  ? -3.69523  0.18362   27.35815 1.000 55.76745  ? 98  GLU B N   1 
ATOM   1533 C CA  . GLU B 2 40  ? -5.09026  0.60351   27.41307 1.000 69.85438  ? 98  GLU B CA  1 
ATOM   1534 C C   . GLU B 2 40  ? -5.97513  -0.51794  27.93811 1.000 65.20703  ? 98  GLU B C   1 
ATOM   1535 O O   . GLU B 2 40  ? -6.87664  -0.99858  27.24367 1.000 63.18612  ? 98  GLU B O   1 
ATOM   1536 C CB  . GLU B 2 40  ? -5.56613  1.04626   26.04114 1.000 69.43612  ? 98  GLU B CB  1 
ATOM   1537 C CG  . GLU B 2 40  ? -4.95746  2.34782   25.59552 1.000 74.61357  ? 98  GLU B CG  1 
ATOM   1538 C CD  . GLU B 2 40  ? -5.38416  2.71267   24.18547 1.000 110.69534 ? 98  GLU B CD  1 
ATOM   1539 O OE1 . GLU B 2 40  ? -5.61818  1.78532   23.37529 1.000 90.01424  ? 98  GLU B OE1 1 
ATOM   1540 O OE2 . GLU B 2 40  ? -5.49307  3.92458   23.89202 1.000 125.21470 ? 98  GLU B OE2 1 
ATOM   1541 N N   . TRP B 2 41  ? -5.71990  -0.92911  29.17014 1.000 57.03612  ? 99  TRP B N   1 
ATOM   1542 C CA  . TRP B 2 41  ? -6.47790  -2.00768  29.76481 1.000 61.04642  ? 99  TRP B CA  1 
ATOM   1543 C C   . TRP B 2 41  ? -7.92362  -1.58769  29.99714 1.000 68.57612  ? 99  TRP B C   1 
ATOM   1544 O O   . TRP B 2 41  ? -8.22774  -0.40980  30.19242 1.000 71.60612  ? 99  TRP B O   1 
ATOM   1545 C CB  . TRP B 2 41  ? -5.85684  -2.41497  31.09261 1.000 61.32692  ? 99  TRP B CB  1 
ATOM   1546 C CG  . TRP B 2 41  ? -4.37504  -2.67790  31.07927 1.000 63.27240  ? 99  TRP B CG  1 
ATOM   1547 C CD1 . TRP B 2 41  ? -3.42352  -1.98674  31.76325 1.000 52.79612  ? 99  TRP B CD1 1 
ATOM   1548 C CD2 . TRP B 2 41  ? -3.69129  -3.73597  30.40168 1.000 59.47612  ? 99  TRP B CD2 1 
ATOM   1549 N NE1 . TRP B 2 41  ? -2.19551  -2.53723  31.54685 1.000 62.89612  ? 99  TRP B NE1 1 
ATOM   1550 C CE2 . TRP B 2 41  ? -2.32900  -3.61159  30.71315 1.000 59.88612  ? 99  TRP B CE2 1 
ATOM   1551 C CE3 . TRP B 2 41  ? -4.09880  -4.76641  29.54826 1.000 49.62612  ? 99  TRP B CE3 1 
ATOM   1552 C CZ2 . TRP B 2 41  ? -1.36572  -4.47611  30.20808 1.000 52.63612  ? 99  TRP B CZ2 1 
ATOM   1553 C CZ3 . TRP B 2 41  ? -3.14492  -5.62973  29.04811 1.000 54.24612  ? 99  TRP B CZ3 1 
ATOM   1554 C CH2 . TRP B 2 41  ? -1.79090  -5.48207  29.38409 1.000 45.54937  ? 99  TRP B CH2 1 
ATOM   1555 N N   . LYS B 2 42  ? -8.81488  -2.57504  29.99752 1.000 63.55407  ? 100 LYS B N   1 
ATOM   1556 C CA  . LYS B 2 42  ? -10.23298 -2.34106  30.25486 1.000 69.16512  ? 100 LYS B CA  1 
ATOM   1557 C C   . LYS B 2 42  ? -10.69075 -3.00883  31.55875 1.000 79.95077  ? 100 LYS B C   1 
ATOM   1558 O O   . LYS B 2 42  ? -9.89533  -3.61166  32.28712 1.000 78.97612  ? 100 LYS B O   1 
ATOM   1559 C CB  . LYS B 2 42  ? -11.08325 -2.84722  29.08240 1.000 72.81612  ? 100 LYS B CB  1 
ATOM   1560 C CG  . LYS B 2 42  ? -10.72253 -2.22939  27.73828 1.000 71.32611  ? 100 LYS B CG  1 
ATOM   1561 C CD  . LYS B 2 42  ? -10.63361 -0.71799  27.82706 1.000 84.51304  ? 100 LYS B CD  1 
ATOM   1562 C CE  . LYS B 2 42  ? -11.12558 -0.05139  26.55203 1.000 86.86450  ? 100 LYS B CE  1 
ATOM   1563 N NZ  . LYS B 2 42  ? -9.98269  0.50413   25.75732 1.000 93.15184  ? 100 LYS B NZ  1 
HETATM 1564 N N1A . ACO C 3 .   ? 10.95227  -9.50890  17.67441 1.000 70.66334  ? 201 ACO A N1A 1 
HETATM 1565 C C2A . ACO C 3 .   ? 11.09503  -8.14772  17.55604 1.000 59.67705  ? 201 ACO A C2A 1 
HETATM 1566 N N3A . ACO C 3 .   ? 10.15296  -7.19796  17.64883 1.000 65.90563  ? 201 ACO A N3A 1 
HETATM 1567 C C4A . ACO C 3 .   ? 8.93214   -7.73198  17.87955 1.000 57.16959  ? 201 ACO A C4A 1 
HETATM 1568 C C5A . ACO C 3 .   ? 8.63248   -9.10055  17.97765 1.000 56.67725  ? 201 ACO A C5A 1 
HETATM 1569 C C6A . ACO C 3 .   ? 9.69485   -10.00195 17.88705 1.000 69.18275  ? 201 ACO A C6A 1 
HETATM 1570 N N6A . ACO C 3 .   ? 9.54135   -11.35397 18.00354 1.000 59.50956  ? 201 ACO A N6A 1 
HETATM 1571 N N7A . ACO C 3 .   ? 7.25692   -9.28430  18.20288 1.000 62.69312  ? 201 ACO A N7A 1 
HETATM 1572 C C8A . ACO C 3 .   ? 6.76914   -8.04249  18.23298 1.000 62.84342  ? 201 ACO A C8A 1 
HETATM 1573 N N9A . ACO C 3 .   ? 7.72017   -7.06151  17.96920 1.000 64.52483  ? 201 ACO A N9A 1 
HETATM 1574 C C1B . ACO C 3 .   ? 7.43916   -5.62566  17.97022 1.000 51.15407  ? 201 ACO A C1B 1 
HETATM 1575 C C2B . ACO C 3 .   ? 6.23295   -5.19685  17.13465 1.000 60.92688  ? 201 ACO A C2B 1 
HETATM 1576 O O2B . ACO C 3 .   ? 6.52103   -4.71063  15.82337 1.000 61.89108  ? 201 ACO A O2B 1 
HETATM 1577 C C3B . ACO C 3 .   ? 5.74639   -3.96194  17.90146 1.000 58.80170  ? 201 ACO A C3B 1 
HETATM 1578 O O3B . ACO C 3 .   ? 6.47662   -2.80811  17.43171 1.000 61.59138  ? 201 ACO A O3B 1 
HETATM 1579 P P3B . ACO C 3 .   ? 6.14292   -1.34993  17.94986 1.000 81.39913  ? 201 ACO A P3B 1 
HETATM 1580 O O7A . ACO C 3 .   ? 6.58351   -0.36069  16.86862 1.000 83.13687  ? 201 ACO A O7A 1 
HETATM 1581 O O8A . ACO C 3 .   ? 4.57596   -1.27035  18.22377 1.000 77.61262  ? 201 ACO A O8A 1 
HETATM 1582 O O9A . ACO C 3 .   ? 6.87291   -1.11260  19.33506 1.000 73.69679  ? 201 ACO A O9A 1 
HETATM 1583 C C4B . ACO C 3 .   ? 6.09939   -4.24975  19.35537 1.000 54.51051  ? 201 ACO A C4B 1 
HETATM 1584 O O4B . ACO C 3 .   ? 7.05524   -5.33289  19.29906 1.000 55.25423  ? 201 ACO A O4B 1 
HETATM 1585 C C5B . ACO C 3 .   ? 4.93241   -4.71469  20.20073 1.000 57.93409  ? 201 ACO A C5B 1 
HETATM 1586 O O5B . ACO C 3 .   ? 4.33774   -5.79794  19.44644 1.000 52.64757  ? 201 ACO A O5B 1 
HETATM 1587 P P1A . ACO C 3 .   ? 3.04453   -6.52629  20.00748 1.000 59.14717  ? 201 ACO A P1A 1 
HETATM 1588 O O1A . ACO C 3 .   ? 1.91102   -6.46472  19.04127 1.000 64.71523  ? 201 ACO A O1A 1 
HETATM 1589 O O2A . ACO C 3 .   ? 2.99662   -6.18713  21.48281 1.000 81.86611  ? 201 ACO A O2A 1 
HETATM 1590 O O3A . ACO C 3 .   ? 3.50234   -8.07677  19.86822 1.000 40.94605  ? 201 ACO A O3A 1 
HETATM 1591 P P2A . ACO C 3 .   ? 2.68753   -9.43838  19.90226 1.000 58.11587  ? 201 ACO A P2A 1 
HETATM 1592 O O4A . ACO C 3 .   ? 1.36698   -8.73885  20.11165 1.000 62.68648  ? 201 ACO A O4A 1 
HETATM 1593 O O5A . ACO C 3 .   ? 3.32211   -10.42889 18.87814 1.000 62.10352  ? 201 ACO A O5A 1 
HETATM 1594 O O6A . ACO C 3 .   ? 3.21398   -10.02593 21.33514 1.000 68.83573  ? 201 ACO A O6A 1 
HETATM 1595 C CBP . ACO C 3 .   ? 4.99721   -11.62789 21.72914 1.000 49.28335  ? 201 ACO A CBP 1 
HETATM 1596 C CCP . ACO C 3 .   ? 4.58671   -10.34089 21.00147 1.000 45.71225  ? 201 ACO A CCP 1 
HETATM 1597 C CDP . ACO C 3 .   ? 4.70403   -11.53334 23.22607 1.000 50.17127  ? 201 ACO A CDP 1 
HETATM 1598 C CEP . ACO C 3 .   ? 6.49540   -11.88670 21.47338 1.000 50.42956  ? 201 ACO A CEP 1 
HETATM 1599 C CAP . ACO C 3 .   ? 4.11453   -12.68941 21.08605 1.000 46.73748  ? 201 ACO A CAP 1 
HETATM 1600 O OAP . ACO C 3 .   ? 4.58381   -12.62860 19.73484 1.000 56.57517  ? 201 ACO A OAP 1 
HETATM 1601 C C9P . ACO C 3 .   ? 4.30923   -14.09317 21.58780 1.000 49.78756  ? 201 ACO A C9P 1 
HETATM 1602 O O9P . ACO C 3 .   ? 3.74167   -14.52394 22.62209 1.000 54.19595  ? 201 ACO A O9P 1 
HETATM 1603 N N8P . ACO C 3 .   ? 5.10889   -14.86990 20.86263 1.000 50.51076  ? 201 ACO A N8P 1 
HETATM 1604 C C7P . ACO C 3 .   ? 5.44187   -16.25262 21.24778 1.000 46.61279  ? 201 ACO A C7P 1 
HETATM 1605 C C6P . ACO C 3 .   ? 5.68210   -16.38037 22.73328 1.000 56.39120  ? 201 ACO A C6P 1 
HETATM 1606 C C5P . ACO C 3 .   ? 7.13196   -15.99559 23.08982 1.000 61.14545  ? 201 ACO A C5P 1 
HETATM 1607 O O5P . ACO C 3 .   ? 8.07683   -16.24334 22.33761 1.000 75.34964  ? 201 ACO A O5P 1 
HETATM 1608 N N4P . ACO C 3 .   ? 7.27749   -15.32050 24.21011 1.000 65.44125  ? 201 ACO A N4P 1 
HETATM 1609 C C3P . ACO C 3 .   ? 8.57813   -14.88568 24.74785 1.000 68.00866  ? 201 ACO A C3P 1 
HETATM 1610 C C2P . ACO C 3 .   ? 9.53452   -16.06236 24.61475 1.000 70.30088  ? 201 ACO A C2P 1 
HETATM 1611 S S1P . ACO C 3 .   ? 10.61672  -15.72050 26.03309 1.000 166.52916 ? 201 ACO A S1P 1 
HETATM 1612 C C   . ACO C 3 .   ? 9.57657   -16.08397 27.35434 1.000 68.67030  ? 201 ACO A C   1 
HETATM 1613 O O   . ACO C 3 .   ? 8.45711   -16.52047 27.21430 1.000 70.12075  ? 201 ACO A O   1 
HETATM 1614 C CH3 . ACO C 3 .   ? 10.23939  -15.78642 28.67019 1.000 71.61933  ? 201 ACO A CH3 1 
HETATM 1615 P P   . PO4 D 4 .   ? 11.81358  2.61999   16.43851 1.000 131.53278 ? 202 PO4 A P   1 
HETATM 1616 O O1  . PO4 D 4 .   ? 13.04146  3.22256   15.79893 1.000 123.02279 ? 202 PO4 A O1  1 
HETATM 1617 O O2  . PO4 D 4 .   ? 10.55302  3.15789   15.80343 1.000 127.83650 ? 202 PO4 A O2  1 
HETATM 1618 O O3  . PO4 D 4 .   ? 11.85770  1.12315   16.24730 1.000 121.60340 ? 202 PO4 A O3  1 
HETATM 1619 O O4  . PO4 D 4 .   ? 11.80959  2.96748   17.90906 1.000 101.17777 ? 202 PO4 A O4  1 
HETATM 1620 O O   . HOH E 5 .   ? 0.59922   -22.46583 22.01130 1.000 72.75426  ? 301 HOH A O   1 
HETATM 1621 O O   . HOH E 5 .   ? 11.46162  -18.36192 43.28071 1.000 57.24012  ? 302 HOH A O   1 
HETATM 1622 O O   . HOH E 5 .   ? -0.65795  -26.52880 25.31131 1.000 83.28612  ? 303 HOH A O   1 
HETATM 1623 O O   . HOH E 5 .   ? 12.66492  0.74373   34.27340 1.000 68.20457  ? 304 HOH A O   1 
HETATM 1624 O O   . HOH E 5 .   ? -9.21662  -11.69657 34.80340 1.000 54.63612  ? 305 HOH A O   1 
HETATM 1625 O O   . HOH E 5 .   ? 18.60450  -2.43121  30.35341 1.000 56.35612  ? 306 HOH A O   1 
HETATM 1626 O O   . HOH E 5 .   ? -1.01474  -7.94021  20.55170 1.000 55.58927  ? 307 HOH A O   1 
HETATM 1627 O O   . HOH E 5 .   ? 16.87455  -8.55864  48.63936 1.000 51.47612  ? 308 HOH A O   1 
HETATM 1628 O O   . HOH E 5 .   ? 1.95288   -19.17108 39.17963 1.000 52.67299  ? 309 HOH A O   1 
HETATM 1629 O O   . HOH E 5 .   ? -6.39026  -19.43214 20.88960 1.000 60.90645  ? 310 HOH A O   1 
HETATM 1630 O O   . HOH E 5 .   ? 2.31439   -0.63201  32.41506 1.000 72.98612  ? 311 HOH A O   1 
HETATM 1631 O O   . HOH E 5 .   ? 15.526    -3.233    45.189   1.000 52.08368  ? 312 HOH A O   1 
HETATM 1632 O O   . HOH E 5 .   ? -2.82807  -4.92682  36.79224 1.000 62.24819  ? 313 HOH A O   1 
HETATM 1633 O O   . HOH E 5 .   ? -7.50653  -12.11484 39.79772 1.000 55.55612  ? 314 HOH A O   1 
HETATM 1634 O O   . HOH E 5 .   ? -7.28195  -9.98021  33.49685 1.000 51.60612  ? 315 HOH A O   1 
HETATM 1635 O O   . HOH E 5 .   ? -5.37189  -10.77906 15.75853 1.000 75.50612  ? 316 HOH A O   1 
HETATM 1636 O O   . HOH E 5 .   ? -15.42273 -19.60812 34.36405 1.000 75.72612  ? 317 HOH A O   1 
HETATM 1637 O O   . HOH E 5 .   ? 4.44443   -4.73290  42.48025 1.000 48.44612  ? 318 HOH A O   1 
HETATM 1638 O O   . HOH E 5 .   ? -7.33501  -2.65173  22.81192 1.000 70.20612  ? 319 HOH A O   1 
HETATM 1639 O O   . HOH E 5 .   ? 20.93517  -3.50344  40.44402 1.000 67.94612  ? 320 HOH A O   1 
HETATM 1640 O O   . HOH E 5 .   ? -8.41105  -6.90775  35.43557 1.000 64.62732  ? 321 HOH A O   1 
HETATM 1641 O O   . HOH E 5 .   ? -7.79499  -19.18325 26.95256 1.000 47.09612  ? 322 HOH A O   1 
HETATM 1642 O O   . HOH E 5 .   ? -2.74303  -24.22865 35.76740 1.000 61.25612  ? 323 HOH A O   1 
HETATM 1643 O O   . HOH E 5 .   ? 15.10041  -0.53113  43.70531 1.000 59.28612  ? 324 HOH A O   1 
HETATM 1644 O O   . HOH E 5 .   ? 20.48499  -20.34622 28.37875 1.000 70.18031  ? 325 HOH A O   1 
HETATM 1645 O O   . HOH E 5 .   ? 0.22093   -1.66270  33.04462 1.000 60.86612  ? 326 HOH A O   1 
HETATM 1646 O O   . HOH E 5 .   ? 19.72945  -4.30404  31.74884 1.000 50.05612  ? 327 HOH A O   1 
HETATM 1647 O O   . HOH E 5 .   ? -8.08580  -21.65852 35.67276 1.000 55.03612  ? 328 HOH A O   1 
HETATM 1648 O O   . HOH E 5 .   ? -10.64511 -23.86539 30.64618 1.000 66.35612  ? 329 HOH A O   1 
HETATM 1649 O O   . HOH E 5 .   ? 9.02654   -17.07938 36.55363 1.000 57.95612  ? 330 HOH A O   1 
HETATM 1650 O O   . HOH E 5 .   ? 8.88528   1.24278   49.84043 1.000 57.07612  ? 331 HOH A O   1 
HETATM 1651 O O   . HOH E 5 .   ? 7.25856   -19.05346 37.17904 1.000 65.52612  ? 332 HOH A O   1 
HETATM 1652 O O   . HOH E 5 .   ? -7.87021  -12.34621 15.07028 1.000 63.48612  ? 333 HOH A O   1 
HETATM 1653 O O   . HOH E 5 .   ? 18.39331  -17.04094 21.11373 1.000 53.81612  ? 334 HOH A O   1 
HETATM 1654 O O   . HOH E 5 .   ? -1.69001  -25.80858 37.28411 1.000 72.05460  ? 335 HOH A O   1 
HETATM 1655 O O   . HOH E 5 .   ? 27.438    -13.038   27.774   1.000 59.63612  ? 336 HOH A O   1 
HETATM 1656 O O   . HOH E 5 .   ? 15.13236  -19.25057 16.60860 1.000 54.73012  ? 337 HOH A O   1 
HETATM 1657 O O   . HOH E 5 .   ? -0.85320  -26.99395 44.00578 1.000 77.21612  ? 338 HOH A O   1 
HETATM 1658 O O   . HOH E 5 .   ? -2.01920  -4.25980  39.85364 1.000 67.95612  ? 339 HOH A O   1 
HETATM 1659 O O   . HOH E 5 .   ? 3.320     -2.457    50.719   1.000 67.41612  ? 340 HOH A O   1 
HETATM 1660 O O   . HOH E 5 .   ? -9.29008  -8.69662  36.80970 1.000 73.87612  ? 341 HOH A O   1 
HETATM 1661 O O   . HOH F 5 .   ? 5.81420   1.55310   30.25896 1.000 53.48612  ? 201 HOH B O   1 
HETATM 1662 O O   . HOH F 5 .   ? 16.45807  -23.66395 40.54327 1.000 67.71771  ? 202 HOH B O   1 
HETATM 1663 O O   . HOH F 5 .   ? -7.93324  -3.15812  25.58228 1.000 63.28612  ? 203 HOH B O   1 
HETATM 1664 O O   . HOH F 5 .   ? 15.17592  3.18837   33.65782 1.000 66.26163  ? 204 HOH B O   1 
# 
