data_9EQE
# 
_entry.id   9EQE 
# 
_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   9EQE         pdb_00009eqe 10.2210/pdb9eqe/pdb 
WWPDB D_1292136828 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-04-02 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9EQE 
_pdbx_database_status.recvd_initial_deposition_date   2024-03-21 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_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 
# 
loop_
_pdbx_database_related.db_name 
_pdbx_database_related.details 
_pdbx_database_related.db_id 
_pdbx_database_related.content_type 
PDB . 8S3L unspecified 
PDB . 8S3F unspecified 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              leila@chem.ku.dk 
_pdbx_contact_author.name_first         Leila 
_pdbx_contact_author.name_last          'Lo Leggio' 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-5135-0882 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Frandsen, K.E.H.' 1 0000-0002-7136-9820 
'Di Domenico, V.'  2 ?                   
'Lo Leggio, L.'    3 0000-0002-5135-0882 
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   ? 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'To Be Published' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            0353 
_citation.journal_id_ISSN           ? 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     'X-ray crystal structure of LsAA9A' 
_citation.year                      ? 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      ? 
_citation.pdbx_database_id_PubMed   ? 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Frandsen, K.E.H.' 1 0000-0002-7136-9820 
primary 'Di Domenico, V.'  2 ?                   
primary 'Lo Leggio, L.'    3 0000-0002-5135-0882 
# 
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 'Endo-beta-1,4-glucanase D'              25272.850 1   3.2.1.4 ? ? ? 
2 non-polymer nat 'COPPER (II) ION'                        63.546    1   ?       ? ? ? 
3 non-polymer syn 2-acetamido-2-deoxy-beta-D-glucopyranose 221.208   2   ?       ? ? ? 
4 non-polymer syn 'CITRIC ACID'                            192.124   1   ?       ? ? ? 
5 non-polymer syn 'TRIETHYLENE GLYCOL'                     150.173   2   ?       ? ? ? 
6 water       nat water                                    18.015    127 ?       ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'Endoglucanase D,Carboxymethylcellulase D,Cellulase D' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   yes 
_entity_poly.pdbx_seq_one_letter_code       
;(HIC)TLVWGVWVNGVDQGDGRNIYIRSPPNNNPVKNLTSPDMTCNVDNRVVPKSVPVNAGDTLTFEWYHNTRDDDIIAS
SHHGPIAVYIAPAASNGQGNVWVKLFEDAYNVTNSTWAVDRLITAHGQHSVVVPHVAPGDYLFRAEIIALHEADSLYSQN
PIRGAQFYISCAQITINSSDDSTPLPAGVPFPGAYTDSTPGIQFNIYTTPATSYVAPPPSVWSGALGGSIAQVGDASLE
;
_entity_poly.pdbx_seq_one_letter_code_can   
;HTLVWGVWVNGVDQGDGRNIYIRSPPNNNPVKNLTSPDMTCNVDNRVVPKSVPVNAGDTLTFEWYHNTRDDDIIASSHHG
PIAVYIAPAASNGQGNVWVKLFEDAYNVTNSTWAVDRLITAHGQHSVVVPHVAPGDYLFRAEIIALHEADSLYSQNPIRG
AQFYISCAQITINSSDDSTPLPAGVPFPGAYTDSTPGIQFNIYTTPATSYVAPPPSVWSGALGGSIAQVGDASLE
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 'COPPER (II) ION'                        CU  
3 2-acetamido-2-deoxy-beta-D-glucopyranose NAG 
4 'CITRIC ACID'                            CIT 
5 'TRIETHYLENE GLYCOL'                     PGE 
6 water                                    HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   HIC n 
1 2   THR n 
1 3   LEU n 
1 4   VAL n 
1 5   TRP n 
1 6   GLY n 
1 7   VAL n 
1 8   TRP n 
1 9   VAL n 
1 10  ASN n 
1 11  GLY n 
1 12  VAL n 
1 13  ASP n 
1 14  GLN n 
1 15  GLY n 
1 16  ASP n 
1 17  GLY n 
1 18  ARG n 
1 19  ASN n 
1 20  ILE n 
1 21  TYR n 
1 22  ILE n 
1 23  ARG n 
1 24  SER n 
1 25  PRO n 
1 26  PRO n 
1 27  ASN n 
1 28  ASN n 
1 29  ASN n 
1 30  PRO n 
1 31  VAL n 
1 32  LYS n 
1 33  ASN n 
1 34  LEU n 
1 35  THR n 
1 36  SER n 
1 37  PRO n 
1 38  ASP n 
1 39  MET n 
1 40  THR n 
1 41  CYS n 
1 42  ASN n 
1 43  VAL n 
1 44  ASP n 
1 45  ASN n 
1 46  ARG n 
1 47  VAL n 
1 48  VAL n 
1 49  PRO n 
1 50  LYS n 
1 51  SER n 
1 52  VAL n 
1 53  PRO n 
1 54  VAL n 
1 55  ASN n 
1 56  ALA n 
1 57  GLY n 
1 58  ASP n 
1 59  THR n 
1 60  LEU n 
1 61  THR n 
1 62  PHE n 
1 63  GLU n 
1 64  TRP n 
1 65  TYR n 
1 66  HIS n 
1 67  ASN n 
1 68  THR n 
1 69  ARG n 
1 70  ASP n 
1 71  ASP n 
1 72  ASP n 
1 73  ILE n 
1 74  ILE n 
1 75  ALA n 
1 76  SER n 
1 77  SER n 
1 78  HIS n 
1 79  HIS n 
1 80  GLY n 
1 81  PRO n 
1 82  ILE n 
1 83  ALA n 
1 84  VAL n 
1 85  TYR n 
1 86  ILE n 
1 87  ALA n 
1 88  PRO n 
1 89  ALA n 
1 90  ALA n 
1 91  SER n 
1 92  ASN n 
1 93  GLY n 
1 94  GLN n 
1 95  GLY n 
1 96  ASN n 
1 97  VAL n 
1 98  TRP n 
1 99  VAL n 
1 100 LYS n 
1 101 LEU n 
1 102 PHE n 
1 103 GLU n 
1 104 ASP n 
1 105 ALA n 
1 106 TYR n 
1 107 ASN n 
1 108 VAL n 
1 109 THR n 
1 110 ASN n 
1 111 SER n 
1 112 THR n 
1 113 TRP n 
1 114 ALA n 
1 115 VAL n 
1 116 ASP n 
1 117 ARG n 
1 118 LEU n 
1 119 ILE n 
1 120 THR n 
1 121 ALA n 
1 122 HIS n 
1 123 GLY n 
1 124 GLN n 
1 125 HIS n 
1 126 SER n 
1 127 VAL n 
1 128 VAL n 
1 129 VAL n 
1 130 PRO n 
1 131 HIS n 
1 132 VAL n 
1 133 ALA n 
1 134 PRO n 
1 135 GLY n 
1 136 ASP n 
1 137 TYR n 
1 138 LEU n 
1 139 PHE n 
1 140 ARG n 
1 141 ALA n 
1 142 GLU n 
1 143 ILE n 
1 144 ILE n 
1 145 ALA n 
1 146 LEU n 
1 147 HIS n 
1 148 GLU n 
1 149 ALA n 
1 150 ASP n 
1 151 SER n 
1 152 LEU n 
1 153 TYR n 
1 154 SER n 
1 155 GLN n 
1 156 ASN n 
1 157 PRO n 
1 158 ILE n 
1 159 ARG n 
1 160 GLY n 
1 161 ALA n 
1 162 GLN n 
1 163 PHE n 
1 164 TYR n 
1 165 ILE n 
1 166 SER n 
1 167 CYS n 
1 168 ALA n 
1 169 GLN n 
1 170 ILE n 
1 171 THR n 
1 172 ILE n 
1 173 ASN n 
1 174 SER n 
1 175 SER n 
1 176 ASP n 
1 177 ASP n 
1 178 SER n 
1 179 THR n 
1 180 PRO n 
1 181 LEU n 
1 182 PRO n 
1 183 ALA n 
1 184 GLY n 
1 185 VAL n 
1 186 PRO n 
1 187 PHE n 
1 188 PRO n 
1 189 GLY n 
1 190 ALA n 
1 191 TYR n 
1 192 THR n 
1 193 ASP n 
1 194 SER n 
1 195 THR n 
1 196 PRO n 
1 197 GLY n 
1 198 ILE n 
1 199 GLN n 
1 200 PHE n 
1 201 ASN n 
1 202 ILE n 
1 203 TYR n 
1 204 THR n 
1 205 THR n 
1 206 PRO n 
1 207 ALA n 
1 208 THR n 
1 209 SER n 
1 210 TYR n 
1 211 VAL n 
1 212 ALA n 
1 213 PRO n 
1 214 PRO n 
1 215 PRO n 
1 216 SER n 
1 217 VAL n 
1 218 TRP n 
1 219 SER n 
1 220 GLY n 
1 221 ALA n 
1 222 LEU n 
1 223 GLY n 
1 224 GLY n 
1 225 SER n 
1 226 ILE n 
1 227 ALA n 
1 228 GLN n 
1 229 VAL n 
1 230 GLY n 
1 231 ASP n 
1 232 ALA n 
1 233 SER n 
1 234 LEU n 
1 235 GLU n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   235 
_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      'Panus similis' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     292560 
_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      'Aspergillus oryzae' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     5062 
_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                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking'          y ALANINE                                  ? 'C3 H7 N O2'     89.093  
ARG 'L-peptide linking'          y ARGININE                                 ? 'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking'          y ASPARAGINE                               ? 'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking'          y 'ASPARTIC ACID'                          ? 'C4 H7 N O4'     133.103 
CIT non-polymer                  . 'CITRIC ACID'                            ? 'C6 H8 O7'       192.124 
CU  non-polymer                  . 'COPPER (II) ION'                        ? 'Cu 2'           63.546  
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  
HIC 'L-peptide linking'          n 4-METHYL-HISTIDINE                       ? 'C7 H11 N3 O2'   169.181 
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 
NAG 'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose 
;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE
;
'C8 H15 N O6'    221.208 
PGE non-polymer                  . 'TRIETHYLENE GLYCOL'                     ? 'C6 H14 O4'      150.173 
PHE 'L-peptide linking'          y PHENYLALANINE                            ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking'          y PROLINE                                  ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking'          y SERINE                                   ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking'          y THREONINE                                ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking'          y TRYPTOPHAN                               ? 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking'          y TYROSINE                                 ? 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking'          y VALINE                                   ? 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_chem_comp_identifier.comp_id 
_pdbx_chem_comp_identifier.type 
_pdbx_chem_comp_identifier.program 
_pdbx_chem_comp_identifier.program_version 
_pdbx_chem_comp_identifier.identifier 
NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML     1.0 DGlcpNAcb                      
NAG 'COMMON NAME'                         GMML     1.0 N-acetyl-b-D-glucopyranosamine 
NAG 'IUPAC CARBOHYDRATE SYMBOL'           PDB-CARE 1.0 b-D-GlcpNAc                    
NAG 'SNFG CARBOHYDRATE SYMBOL'            GMML     1.0 GlcNAc                         
# 
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   HIC 1   1   1   HIC HIC A . n 
A 1 2   THR 2   2   2   THR THR A . n 
A 1 3   LEU 3   3   3   LEU LEU A . n 
A 1 4   VAL 4   4   4   VAL VAL A . n 
A 1 5   TRP 5   5   5   TRP TRP A . n 
A 1 6   GLY 6   6   6   GLY GLY A . n 
A 1 7   VAL 7   7   7   VAL VAL A . n 
A 1 8   TRP 8   8   8   TRP TRP A . n 
A 1 9   VAL 9   9   9   VAL VAL A . n 
A 1 10  ASN 10  10  10  ASN ASN A . n 
A 1 11  GLY 11  11  11  GLY GLY A . n 
A 1 12  VAL 12  12  12  VAL VAL A . n 
A 1 13  ASP 13  13  13  ASP ASP A . n 
A 1 14  GLN 14  14  14  GLN GLN A . n 
A 1 15  GLY 15  15  15  GLY GLY A . n 
A 1 16  ASP 16  16  16  ASP ASP A . n 
A 1 17  GLY 17  17  17  GLY GLY A . n 
A 1 18  ARG 18  18  18  ARG ARG A . n 
A 1 19  ASN 19  19  19  ASN ASN A . n 
A 1 20  ILE 20  20  20  ILE ILE A . n 
A 1 21  TYR 21  21  21  TYR TYR A . n 
A 1 22  ILE 22  22  22  ILE ILE A . n 
A 1 23  ARG 23  23  23  ARG ARG A . n 
A 1 24  SER 24  24  24  SER SER A . n 
A 1 25  PRO 25  25  25  PRO PRO A . n 
A 1 26  PRO 26  26  26  PRO PRO A . n 
A 1 27  ASN 27  27  27  ASN ASN A . n 
A 1 28  ASN 28  28  28  ASN ASN A . n 
A 1 29  ASN 29  29  29  ASN ASN A . n 
A 1 30  PRO 30  30  30  PRO PRO A . n 
A 1 31  VAL 31  31  31  VAL VAL A . n 
A 1 32  LYS 32  32  32  LYS LYS A . n 
A 1 33  ASN 33  33  33  ASN ASN A . n 
A 1 34  LEU 34  34  34  LEU LEU A . n 
A 1 35  THR 35  35  35  THR THR A . n 
A 1 36  SER 36  36  36  SER SER A . n 
A 1 37  PRO 37  37  37  PRO PRO A . n 
A 1 38  ASP 38  38  38  ASP ASP A . n 
A 1 39  MET 39  39  39  MET MET A . n 
A 1 40  THR 40  40  40  THR THR A . n 
A 1 41  CYS 41  41  41  CYS CYS A . n 
A 1 42  ASN 42  42  42  ASN ASN A . n 
A 1 43  VAL 43  43  43  VAL VAL A . n 
A 1 44  ASP 44  44  44  ASP ASP A . n 
A 1 45  ASN 45  45  45  ASN ASN A . n 
A 1 46  ARG 46  46  46  ARG ARG A . n 
A 1 47  VAL 47  47  47  VAL VAL A . n 
A 1 48  VAL 48  48  48  VAL VAL A . n 
A 1 49  PRO 49  49  49  PRO PRO A . n 
A 1 50  LYS 50  50  50  LYS LYS A . n 
A 1 51  SER 51  51  51  SER SER A . n 
A 1 52  VAL 52  52  52  VAL VAL A . n 
A 1 53  PRO 53  53  53  PRO PRO A . n 
A 1 54  VAL 54  54  54  VAL VAL A . n 
A 1 55  ASN 55  55  55  ASN ASN A . n 
A 1 56  ALA 56  56  56  ALA ALA A . n 
A 1 57  GLY 57  57  57  GLY GLY A . n 
A 1 58  ASP 58  58  58  ASP ASP A . n 
A 1 59  THR 59  59  59  THR THR A . n 
A 1 60  LEU 60  60  60  LEU LEU A . n 
A 1 61  THR 61  61  61  THR THR A . n 
A 1 62  PHE 62  62  62  PHE PHE A . n 
A 1 63  GLU 63  63  63  GLU GLU A . n 
A 1 64  TRP 64  64  64  TRP TRP A . n 
A 1 65  TYR 65  65  65  TYR TYR A . n 
A 1 66  HIS 66  66  66  HIS HIS A . n 
A 1 67  ASN 67  67  67  ASN ASN A . n 
A 1 68  THR 68  68  68  THR THR A . n 
A 1 69  ARG 69  69  69  ARG ARG A . n 
A 1 70  ASP 70  70  70  ASP ASP A . n 
A 1 71  ASP 71  71  71  ASP ASP A . n 
A 1 72  ASP 72  72  72  ASP ASP A . n 
A 1 73  ILE 73  73  73  ILE ILE A . n 
A 1 74  ILE 74  74  74  ILE ILE A . n 
A 1 75  ALA 75  75  75  ALA ALA A . n 
A 1 76  SER 76  76  76  SER SER A . n 
A 1 77  SER 77  77  77  SER SER A . n 
A 1 78  HIS 78  78  78  HIS HIS A . n 
A 1 79  HIS 79  79  79  HIS HIS A . n 
A 1 80  GLY 80  80  80  GLY GLY A . n 
A 1 81  PRO 81  81  81  PRO PRO A . n 
A 1 82  ILE 82  82  82  ILE ILE A . n 
A 1 83  ALA 83  83  83  ALA ALA A . n 
A 1 84  VAL 84  84  84  VAL VAL A . n 
A 1 85  TYR 85  85  85  TYR TYR A . n 
A 1 86  ILE 86  86  86  ILE ILE A . n 
A 1 87  ALA 87  87  87  ALA ALA A . n 
A 1 88  PRO 88  88  88  PRO PRO A . n 
A 1 89  ALA 89  89  89  ALA ALA A . n 
A 1 90  ALA 90  90  90  ALA ALA A . n 
A 1 91  SER 91  91  91  SER SER A . n 
A 1 92  ASN 92  92  92  ASN ASN A . n 
A 1 93  GLY 93  93  93  GLY GLY A . n 
A 1 94  GLN 94  94  94  GLN GLN A . n 
A 1 95  GLY 95  95  95  GLY GLY A . n 
A 1 96  ASN 96  96  96  ASN ASN A . n 
A 1 97  VAL 97  97  97  VAL VAL A . n 
A 1 98  TRP 98  98  98  TRP TRP A . n 
A 1 99  VAL 99  99  99  VAL VAL A . n 
A 1 100 LYS 100 100 100 LYS LYS A . n 
A 1 101 LEU 101 101 101 LEU LEU A . n 
A 1 102 PHE 102 102 102 PHE PHE A . n 
A 1 103 GLU 103 103 103 GLU GLU A . n 
A 1 104 ASP 104 104 104 ASP ASP A . n 
A 1 105 ALA 105 105 105 ALA ALA A . n 
A 1 106 TYR 106 106 106 TYR TYR A . n 
A 1 107 ASN 107 107 107 ASN ASN A . n 
A 1 108 VAL 108 108 108 VAL VAL A . n 
A 1 109 THR 109 109 109 THR THR A . n 
A 1 110 ASN 110 110 110 ASN ASN A . n 
A 1 111 SER 111 111 111 SER SER A . n 
A 1 112 THR 112 112 112 THR THR A . n 
A 1 113 TRP 113 113 113 TRP TRP A . n 
A 1 114 ALA 114 114 114 ALA ALA A . n 
A 1 115 VAL 115 115 115 VAL VAL A . n 
A 1 116 ASP 116 116 116 ASP ASP A . n 
A 1 117 ARG 117 117 117 ARG ARG A . n 
A 1 118 LEU 118 118 118 LEU LEU A . n 
A 1 119 ILE 119 119 119 ILE ILE A . n 
A 1 120 THR 120 120 120 THR THR A . n 
A 1 121 ALA 121 121 121 ALA ALA A . n 
A 1 122 HIS 122 122 122 HIS HIS A . n 
A 1 123 GLY 123 123 123 GLY GLY A . n 
A 1 124 GLN 124 124 124 GLN GLN A . n 
A 1 125 HIS 125 125 125 HIS HIS A . n 
A 1 126 SER 126 126 126 SER SER A . n 
A 1 127 VAL 127 127 127 VAL VAL A . n 
A 1 128 VAL 128 128 128 VAL VAL A . n 
A 1 129 VAL 129 129 129 VAL VAL A . n 
A 1 130 PRO 130 130 130 PRO PRO A . n 
A 1 131 HIS 131 131 131 HIS HIS A . n 
A 1 132 VAL 132 132 132 VAL VAL A . n 
A 1 133 ALA 133 133 133 ALA ALA A . n 
A 1 134 PRO 134 134 134 PRO PRO A . n 
A 1 135 GLY 135 135 135 GLY GLY A . n 
A 1 136 ASP 136 136 136 ASP ASP A . n 
A 1 137 TYR 137 137 137 TYR TYR A . n 
A 1 138 LEU 138 138 138 LEU LEU A . n 
A 1 139 PHE 139 139 139 PHE PHE A . n 
A 1 140 ARG 140 140 140 ARG ARG A . n 
A 1 141 ALA 141 141 141 ALA ALA A . n 
A 1 142 GLU 142 142 142 GLU GLU A . n 
A 1 143 ILE 143 143 143 ILE ILE A . n 
A 1 144 ILE 144 144 144 ILE ILE A . n 
A 1 145 ALA 145 145 145 ALA ALA A . n 
A 1 146 LEU 146 146 146 LEU LEU A . n 
A 1 147 HIS 147 147 147 HIS HIS A . n 
A 1 148 GLU 148 148 148 GLU GLU A . n 
A 1 149 ALA 149 149 149 ALA ALA A . n 
A 1 150 ASP 150 150 150 ASP ASP A . n 
A 1 151 SER 151 151 151 SER SER A . n 
A 1 152 LEU 152 152 152 LEU LEU A . n 
A 1 153 TYR 153 153 153 TYR TYR A . n 
A 1 154 SER 154 154 154 SER SER A . n 
A 1 155 GLN 155 155 155 GLN GLN A . n 
A 1 156 ASN 156 156 156 ASN ASN A . n 
A 1 157 PRO 157 157 157 PRO PRO A . n 
A 1 158 ILE 158 158 158 ILE ILE A . n 
A 1 159 ARG 159 159 159 ARG ARG A . n 
A 1 160 GLY 160 160 160 GLY GLY A . n 
A 1 161 ALA 161 161 161 ALA ALA A . n 
A 1 162 GLN 162 162 162 GLN GLN A . n 
A 1 163 PHE 163 163 163 PHE PHE A . n 
A 1 164 TYR 164 164 164 TYR TYR A . n 
A 1 165 ILE 165 165 165 ILE ILE A . n 
A 1 166 SER 166 166 166 SER SER A . n 
A 1 167 CYS 167 167 167 CYS CYS A . n 
A 1 168 ALA 168 168 168 ALA ALA A . n 
A 1 169 GLN 169 169 169 GLN GLN A . n 
A 1 170 ILE 170 170 170 ILE ILE A . n 
A 1 171 THR 171 171 171 THR THR A . n 
A 1 172 ILE 172 172 172 ILE ILE A . n 
A 1 173 ASN 173 173 173 ASN ASN A . n 
A 1 174 SER 174 174 174 SER SER A . n 
A 1 175 SER 175 175 175 SER SER A . n 
A 1 176 ASP 176 176 176 ASP ASP A . n 
A 1 177 ASP 177 177 177 ASP ASP A . n 
A 1 178 SER 178 178 178 SER SER A . n 
A 1 179 THR 179 179 179 THR THR A . n 
A 1 180 PRO 180 180 180 PRO PRO A . n 
A 1 181 LEU 181 181 181 LEU LEU A . n 
A 1 182 PRO 182 182 182 PRO PRO A . n 
A 1 183 ALA 183 183 183 ALA ALA A . n 
A 1 184 GLY 184 184 184 GLY GLY A . n 
A 1 185 VAL 185 185 185 VAL VAL A . n 
A 1 186 PRO 186 186 186 PRO PRO A . n 
A 1 187 PHE 187 187 187 PHE PHE A . n 
A 1 188 PRO 188 188 188 PRO PRO A . n 
A 1 189 GLY 189 189 189 GLY GLY A . n 
A 1 190 ALA 190 190 190 ALA ALA A . n 
A 1 191 TYR 191 191 191 TYR TYR A . n 
A 1 192 THR 192 192 192 THR THR A . n 
A 1 193 ASP 193 193 193 ASP ASP A . n 
A 1 194 SER 194 194 194 SER SER A . n 
A 1 195 THR 195 195 195 THR THR A . n 
A 1 196 PRO 196 196 196 PRO PRO A . n 
A 1 197 GLY 197 197 197 GLY GLY A . n 
A 1 198 ILE 198 198 198 ILE ILE A . n 
A 1 199 GLN 199 199 199 GLN GLN A . n 
A 1 200 PHE 200 200 200 PHE PHE A . n 
A 1 201 ASN 201 201 201 ASN ASN A . n 
A 1 202 ILE 202 202 202 ILE ILE A . n 
A 1 203 TYR 203 203 203 TYR TYR A . n 
A 1 204 THR 204 204 204 THR THR A . n 
A 1 205 THR 205 205 205 THR THR A . n 
A 1 206 PRO 206 206 206 PRO PRO A . n 
A 1 207 ALA 207 207 207 ALA ALA A . n 
A 1 208 THR 208 208 208 THR THR A . n 
A 1 209 SER 209 209 209 SER SER A . n 
A 1 210 TYR 210 210 210 TYR TYR A . n 
A 1 211 VAL 211 211 211 VAL VAL A . n 
A 1 212 ALA 212 212 212 ALA ALA A . n 
A 1 213 PRO 213 213 213 PRO PRO A . n 
A 1 214 PRO 214 214 214 PRO PRO A . n 
A 1 215 PRO 215 215 215 PRO PRO A . n 
A 1 216 SER 216 216 216 SER SER A . n 
A 1 217 VAL 217 217 217 VAL VAL A . n 
A 1 218 TRP 218 218 218 TRP TRP A . n 
A 1 219 SER 219 219 219 SER SER A . n 
A 1 220 GLY 220 220 220 GLY GLY A . n 
A 1 221 ALA 221 221 221 ALA ALA A . n 
A 1 222 LEU 222 222 222 LEU LEU A . n 
A 1 223 GLY 223 223 223 GLY GLY A . n 
A 1 224 GLY 224 224 224 GLY GLY A . n 
A 1 225 SER 225 225 225 SER SER A . n 
A 1 226 ILE 226 226 226 ILE ILE A . n 
A 1 227 ALA 227 227 227 ALA ALA A . n 
A 1 228 GLN 228 228 228 GLN GLN A . n 
A 1 229 VAL 229 229 229 VAL VAL A . n 
A 1 230 GLY 230 230 230 GLY GLY A . n 
A 1 231 ASP 231 231 231 ASP ASP A . n 
A 1 232 ALA 232 232 232 ALA ALA A . n 
A 1 233 SER 233 233 233 SER SER A . n 
A 1 234 LEU 234 234 234 LEU LEU A . n 
A 1 235 GLU 235 235 235 GLU GLU A . 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 CIT ? ? CIT ? ? 'SUBJECT OF INVESTIGATION' ? 
2 CU  ? ? CU  ? ? '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 
B 2 CU  1   301 301 CU  CU  A . 
C 3 NAG 1   302 401 NAG NAG A . 
D 4 CIT 1   303 501 CIT CIT A . 
E 5 PGE 1   304 601 PGE PGE A . 
F 5 PGE 1   305 701 PGE PGE A . 
G 3 NAG 1   306 702 NAG NAG A . 
H 6 HOH 1   401 6   HOH HOH A . 
H 6 HOH 2   402 44  HOH HOH A . 
H 6 HOH 3   403 10  HOH HOH A . 
H 6 HOH 4   404 19  HOH HOH A . 
H 6 HOH 5   405 115 HOH HOH A . 
H 6 HOH 6   406 109 HOH HOH A . 
H 6 HOH 7   407 86  HOH HOH A . 
H 6 HOH 8   408 12  HOH HOH A . 
H 6 HOH 9   409 114 HOH HOH A . 
H 6 HOH 10  410 79  HOH HOH A . 
H 6 HOH 11  411 46  HOH HOH A . 
H 6 HOH 12  412 51  HOH HOH A . 
H 6 HOH 13  413 103 HOH HOH A . 
H 6 HOH 14  414 108 HOH HOH A . 
H 6 HOH 15  415 84  HOH HOH A . 
H 6 HOH 16  416 120 HOH HOH A . 
H 6 HOH 17  417 14  HOH HOH A . 
H 6 HOH 18  418 57  HOH HOH A . 
H 6 HOH 19  419 27  HOH HOH A . 
H 6 HOH 20  420 106 HOH HOH A . 
H 6 HOH 21  421 1   HOH HOH A . 
H 6 HOH 22  422 93  HOH HOH A . 
H 6 HOH 23  423 105 HOH HOH A . 
H 6 HOH 24  424 5   HOH HOH A . 
H 6 HOH 25  425 54  HOH HOH A . 
H 6 HOH 26  426 42  HOH HOH A . 
H 6 HOH 27  427 112 HOH HOH A . 
H 6 HOH 28  428 23  HOH HOH A . 
H 6 HOH 29  429 89  HOH HOH A . 
H 6 HOH 30  430 111 HOH HOH A . 
H 6 HOH 31  431 55  HOH HOH A . 
H 6 HOH 32  432 98  HOH HOH A . 
H 6 HOH 33  433 142 HOH HOH A . 
H 6 HOH 34  434 74  HOH HOH A . 
H 6 HOH 35  435 68  HOH HOH A . 
H 6 HOH 36  436 82  HOH HOH A . 
H 6 HOH 37  437 37  HOH HOH A . 
H 6 HOH 38  438 96  HOH HOH A . 
H 6 HOH 39  439 2   HOH HOH A . 
H 6 HOH 40  440 3   HOH HOH A . 
H 6 HOH 41  441 90  HOH HOH A . 
H 6 HOH 42  442 49  HOH HOH A . 
H 6 HOH 43  443 13  HOH HOH A . 
H 6 HOH 44  444 128 HOH HOH A . 
H 6 HOH 45  445 48  HOH HOH A . 
H 6 HOH 46  446 146 HOH HOH A . 
H 6 HOH 47  447 21  HOH HOH A . 
H 6 HOH 48  448 20  HOH HOH A . 
H 6 HOH 49  449 143 HOH HOH A . 
H 6 HOH 50  450 132 HOH HOH A . 
H 6 HOH 51  451 100 HOH HOH A . 
H 6 HOH 52  452 101 HOH HOH A . 
H 6 HOH 53  453 38  HOH HOH A . 
H 6 HOH 54  454 32  HOH HOH A . 
H 6 HOH 55  455 92  HOH HOH A . 
H 6 HOH 56  456 30  HOH HOH A . 
H 6 HOH 57  457 130 HOH HOH A . 
H 6 HOH 58  458 110 HOH HOH A . 
H 6 HOH 59  459 104 HOH HOH A . 
H 6 HOH 60  460 83  HOH HOH A . 
H 6 HOH 61  461 94  HOH HOH A . 
H 6 HOH 62  462 36  HOH HOH A . 
H 6 HOH 63  463 50  HOH HOH A . 
H 6 HOH 64  464 118 HOH HOH A . 
H 6 HOH 65  465 15  HOH HOH A . 
H 6 HOH 66  466 28  HOH HOH A . 
H 6 HOH 67  467 26  HOH HOH A . 
H 6 HOH 68  468 8   HOH HOH A . 
H 6 HOH 69  469 52  HOH HOH A . 
H 6 HOH 70  470 80  HOH HOH A . 
H 6 HOH 71  471 87  HOH HOH A . 
H 6 HOH 72  472 85  HOH HOH A . 
H 6 HOH 73  473 35  HOH HOH A . 
H 6 HOH 74  474 56  HOH HOH A . 
H 6 HOH 75  475 75  HOH HOH A . 
H 6 HOH 76  476 117 HOH HOH A . 
H 6 HOH 77  477 131 HOH HOH A . 
H 6 HOH 78  478 77  HOH HOH A . 
H 6 HOH 79  479 102 HOH HOH A . 
H 6 HOH 80  480 17  HOH HOH A . 
H 6 HOH 81  481 133 HOH HOH A . 
H 6 HOH 82  482 34  HOH HOH A . 
H 6 HOH 83  483 116 HOH HOH A . 
H 6 HOH 84  484 4   HOH HOH A . 
H 6 HOH 85  485 43  HOH HOH A . 
H 6 HOH 86  486 122 HOH HOH A . 
H 6 HOH 87  487 107 HOH HOH A . 
H 6 HOH 88  488 60  HOH HOH A . 
H 6 HOH 89  489 91  HOH HOH A . 
H 6 HOH 90  490 53  HOH HOH A . 
H 6 HOH 91  491 45  HOH HOH A . 
H 6 HOH 92  492 25  HOH HOH A . 
H 6 HOH 93  493 119 HOH HOH A . 
H 6 HOH 94  494 7   HOH HOH A . 
H 6 HOH 95  495 11  HOH HOH A . 
H 6 HOH 96  496 66  HOH HOH A . 
H 6 HOH 97  497 31  HOH HOH A . 
H 6 HOH 98  498 65  HOH HOH A . 
H 6 HOH 99  499 99  HOH HOH A . 
H 6 HOH 100 500 125 HOH HOH A . 
H 6 HOH 101 501 113 HOH HOH A . 
H 6 HOH 102 502 22  HOH HOH A . 
H 6 HOH 103 503 61  HOH HOH A . 
H 6 HOH 104 504 81  HOH HOH A . 
H 6 HOH 105 505 9   HOH HOH A . 
H 6 HOH 106 506 76  HOH HOH A . 
H 6 HOH 107 507 78  HOH HOH A . 
H 6 HOH 108 508 67  HOH HOH A . 
H 6 HOH 109 509 58  HOH HOH A . 
H 6 HOH 110 510 47  HOH HOH A . 
H 6 HOH 111 511 29  HOH HOH A . 
H 6 HOH 112 512 137 HOH HOH A . 
H 6 HOH 113 513 41  HOH HOH A . 
H 6 HOH 114 514 63  HOH HOH A . 
H 6 HOH 115 515 144 HOH HOH A . 
H 6 HOH 116 516 127 HOH HOH A . 
H 6 HOH 117 517 121 HOH HOH A . 
H 6 HOH 118 518 139 HOH HOH A . 
H 6 HOH 119 519 141 HOH HOH A . 
H 6 HOH 120 520 33  HOH HOH A . 
H 6 HOH 121 521 134 HOH HOH A . 
H 6 HOH 122 522 140 HOH HOH A . 
H 6 HOH 123 523 95  HOH HOH A . 
H 6 HOH 124 524 138 HOH HOH A . 
H 6 HOH 125 525 145 HOH HOH A . 
H 6 HOH 126 526 135 HOH HOH A . 
H 6 HOH 127 527 136 HOH HOH A . 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0405 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .        2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? XSCALE ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? .        4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9EQE 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     125.610 
_cell.length_a_esd                 ? 
_cell.length_b                     125.610 
_cell.length_b_esd                 ? 
_cell.length_c                     125.610 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        24 
_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                         9EQE 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                213 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 41 3 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                   9EQE 
_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             3.27 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          62.36 
_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    
'3.5M NaCl, 0.1M citrate buffer pH 3.5 in 96-wells MRC-2 plates with 70 microliter of reservoirs and 0.3 microliter drops' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2019-08-10 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.805 
_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                        'PETRA III, DESY BEAMLINE P11' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.805 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   P11 
_diffrn_source.pdbx_synchrotron_site       'PETRA III, DESY' 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9EQE 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              2.70 
_reflns.d_resolution_low                               50.0 
_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                                     9557 
_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                           97.5 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                3.88 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          15.52 
_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                                0.077 
_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                                   0.994 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    2.70 
_reflns_shell.d_res_low                                     2.77 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           ? 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             683 
_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                               3.64 
_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                               0.212 
_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                                  0.973 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          97.3 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            0.00 
_refine.aniso_B[1][2]                            0.00 
_refine.aniso_B[1][3]                            0.00 
_refine.aniso_B[2][2]                            0.00 
_refine.aniso_B[2][3]                            0.00 
_refine.aniso_B[3][3]                            0.00 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               22.029 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.941 
_refine.correlation_coeff_Fo_to_Fc_free          0.894 
_refine.details                                  'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9EQE 
_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                            2.70 
_refine.ls_d_res_low                             44.45 
_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                     9049 
_refine.ls_number_reflns_R_free                  508 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    97.45 
_refine.ls_percent_reflns_R_free                 5.3 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.17966 
_refine.ls_R_factor_R_free                       0.23848 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.17632 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    MASK 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'FOURIER SYNTHESIS' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'MAXIMUM LIKELIHOOD' 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.704 
_refine.pdbx_overall_ESU_R_Free                  0.312 
_refine.pdbx_solvent_vdw_probe_radii             1.20 
_refine.pdbx_solvent_ion_probe_radii             0.80 
_refine.pdbx_solvent_shrinkage_radii             0.80 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             10.873 
_refine.overall_SU_ML                            0.203 
_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                         1 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       2.70 
_refine_hist.d_res_low                        44.45 
_refine_hist.number_atoms_solvent             127 
_refine_hist.number_atoms_total               1977 
_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        1788 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         62 
_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' ? 0.006  0.012  1954 ? r_bond_refined_d             ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.016  1724 ? r_bond_other_d               ? ? 
'X-RAY DIFFRACTION' ? 1.404  1.651  2700 ? r_angle_refined_deg          ? ? 
'X-RAY DIFFRACTION' ? 0.470  1.565  3987 ? r_angle_other_deg            ? ? 
'X-RAY DIFFRACTION' ? 6.878  5.000  249  ? r_dihedral_angle_1_deg       ? ? 
'X-RAY DIFFRACTION' ? 4.979  5.000  7    ? r_dihedral_angle_2_deg       ? ? 
'X-RAY DIFFRACTION' ? 12.972 10.000 247  ? r_dihedral_angle_3_deg       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_dihedral_angle_4_deg       ? ? 
'X-RAY DIFFRACTION' ? 0.057  0.200  301  ? r_chiral_restr               ? ? 
'X-RAY DIFFRACTION' ? 0.006  0.020  2329 ? r_gen_planes_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  438  ? r_gen_planes_other           ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbd_refined                ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbd_other                  ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbtor_refined              ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbtor_other                ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_xyhbond_nbd_refined        ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_xyhbond_nbd_other          ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_metal_ion_refined          ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_metal_ion_other            ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_vdw_refined       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_vdw_other         ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_hbond_refined     ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_hbond_other       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_metal_ion_refined ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_metal_ion_other   ? ? 
'X-RAY DIFFRACTION' ? 1.597  2.271  963  ? r_mcbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 1.599  2.271  963  ? r_mcbond_other               ? ? 
'X-RAY DIFFRACTION' ? 2.635  4.088  1208 ? r_mcangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 2.638  4.090  1209 ? r_mcangle_other              ? ? 
'X-RAY DIFFRACTION' ? 2.207  2.562  991  ? r_scbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 2.212  2.570  992  ? r_scbond_other               ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_scangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 3.489  4.617  1488 ? r_scangle_other              ? ? 
'X-RAY DIFFRACTION' ? 5.750  23.51  2147 ? r_long_range_B_refined       ? ? 
'X-RAY DIFFRACTION' ? 5.730  23.58  2135 ? r_long_range_B_other         ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_rigid_bond_restr           ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_sphericity_free            ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_sphericity_bonded          ? ? 
# 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.d_res_high                       2.700 
_refine_ls_shell.d_res_low                        2.770 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                ? 
_refine_ls_shell.number_reflns_R_free             41 
_refine_ls_shell.number_reflns_R_work             637 
_refine_ls_shell.percent_reflns_obs               97.84 
_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                  0.411 
_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   20 
_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                  0.452 
# 
_struct.entry_id                     9EQE 
_struct.title                        'X-ray crystal structure of LsAA9A' 
_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        9EQE 
_struct_keywords.text            'LPMO, OXIDOREDUCTASE' 
_struct_keywords.pdbx_keywords   OXIDOREDUCTASE 
# 
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 ? 
G N N 3 ? 
H N N 6 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    A0A0S2GKZ1_9APHY 
_struct_ref.pdbx_db_accession          A0A0S2GKZ1 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;HTLVWGVWVNGVDQGDGRNIYIRSPPNNNPVKNLTSPDMTCNVDNRVVPKSVPVNAGDTLTFEWYHNTRDDDIIASSHHG
PIAVYIAPAASNGQGNVWVKLFEDAYNVTNSTWAVDRLITAHGQHSVVVPHVAPGDYLFRAEIIALHEADSLYSQNPIRG
AQFYISCAQITINSSDDSTPLPAGVPFPGAYTDSTPGIQFNIYTTPATSYVAPPPSVWSGALGGSIAQVGDASLE
;
_struct_ref.pdbx_align_begin           20 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9EQE 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 1 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 235 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             A0A0S2GKZ1 
_struct_ref_seq.db_align_beg                  20 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  254 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       1 
_struct_ref_seq.pdbx_auth_seq_align_end       235 
# 
_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   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
_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,G,H 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   none 
_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]         1.0 
_pdbx_struct_oper_list.matrix[1][2]         0.0 
_pdbx_struct_oper_list.matrix[1][3]         0.0 
_pdbx_struct_oper_list.vector[1]            0.0 
_pdbx_struct_oper_list.matrix[2][1]         0.0 
_pdbx_struct_oper_list.matrix[2][2]         1.0 
_pdbx_struct_oper_list.matrix[2][3]         0.0 
_pdbx_struct_oper_list.vector[2]            0.0 
_pdbx_struct_oper_list.matrix[3][1]         0.0 
_pdbx_struct_oper_list.matrix[3][2]         0.0 
_pdbx_struct_oper_list.matrix[3][3]         1.0 
_pdbx_struct_oper_list.vector[3]            0.0 
# 
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 PRO A 37  ? ASN A 42  ? PRO A 37  ASN A 42  1 ? 6 
HELX_P HELX_P2 AA2 ALA A 75  ? HIS A 79  ? ALA A 75  HIS A 79  5 ? 5 
HELX_P HELX_P3 AA3 ALA A 90  ? ASN A 92  ? ALA A 90  ASN A 92  5 ? 3 
HELX_P HELX_P4 AA4 ALA A 114 ? ALA A 121 ? ALA A 114 ALA A 121 1 ? 8 
HELX_P HELX_P5 AA5 PRO A 206 ? TYR A 210 ? PRO A 206 TYR A 210 5 ? 5 
HELX_P HELX_P6 AA6 ASP A 231 ? GLU A 235 ? ASP A 231 GLU A 235 5 ? 5 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_conn.id 
_struct_conn.conn_type_id 
_struct_conn.pdbx_leaving_atom_flag 
_struct_conn.pdbx_PDB_id 
_struct_conn.ptnr1_label_asym_id 
_struct_conn.ptnr1_label_comp_id 
_struct_conn.ptnr1_label_seq_id 
_struct_conn.ptnr1_label_atom_id 
_struct_conn.pdbx_ptnr1_label_alt_id 
_struct_conn.pdbx_ptnr1_PDB_ins_code 
_struct_conn.pdbx_ptnr1_standard_comp_id 
_struct_conn.ptnr1_symmetry 
_struct_conn.ptnr2_label_asym_id 
_struct_conn.ptnr2_label_comp_id 
_struct_conn.ptnr2_label_seq_id 
_struct_conn.ptnr2_label_atom_id 
_struct_conn.pdbx_ptnr2_label_alt_id 
_struct_conn.pdbx_ptnr2_PDB_ins_code 
_struct_conn.ptnr1_auth_asym_id 
_struct_conn.ptnr1_auth_comp_id 
_struct_conn.ptnr1_auth_seq_id 
_struct_conn.ptnr2_auth_asym_id 
_struct_conn.ptnr2_auth_comp_id 
_struct_conn.ptnr2_auth_seq_id 
_struct_conn.ptnr2_symmetry 
_struct_conn.pdbx_ptnr3_label_atom_id 
_struct_conn.pdbx_ptnr3_label_seq_id 
_struct_conn.pdbx_ptnr3_label_comp_id 
_struct_conn.pdbx_ptnr3_label_asym_id 
_struct_conn.pdbx_ptnr3_label_alt_id 
_struct_conn.pdbx_ptnr3_PDB_ins_code 
_struct_conn.details 
_struct_conn.pdbx_dist_value 
_struct_conn.pdbx_value_order 
_struct_conn.pdbx_role 
disulf1 disulf ?    ? A CYS 41  SG  ? ? ? 1_555 A CYS 167 SG ? ? A CYS 41  A CYS 167 1_555 ? ? ? ? ? ? ? 2.069 ? ?               
covale1 covale both ? A HIC 1   C   ? ? ? 1_555 A THR 2   N  ? ? A HIC 1   A THR 2   1_555 ? ? ? ? ? ? ? 1.340 ? ?               
covale2 covale one  ? A ASN 33  ND2 ? ? ? 1_555 C NAG .   C1 ? ? A ASN 33  A NAG 302 1_555 ? ? ? ? ? ? ? 1.458 ? N-Glycosylation 
covale3 covale one  ? A ASN 110 ND2 ? ? ? 1_555 G NAG .   C1 ? ? A ASN 110 A NAG 306 1_555 ? ? ? ? ? ? ? 1.406 ? N-Glycosylation 
metalc1 metalc ?    ? A HIC 1   N   ? ? ? 1_555 B CU  .   CU ? ? A HIC 1   A CU  301 1_555 ? ? ? ? ? ? ? 2.169 ? ?               
metalc2 metalc ?    ? A HIC 1   ND1 ? ? ? 1_555 B CU  .   CU ? ? A HIC 1   A CU  301 1_555 ? ? ? ? ? ? ? 1.932 ? ?               
metalc3 metalc ?    ? A HIS 78  NE2 ? ? ? 1_555 B CU  .   CU ? ? A HIS 78  A CU  301 1_555 ? ? ? ? ? ? ? 2.050 ? ?               
metalc4 metalc ?    ? B CU  .   CU  ? ? ? 1_555 D CIT .   O6 ? ? A CU  301 A CIT 303 1_555 ? ? ? ? ? ? ? 2.642 ? ?               
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
covale ? ? 
metalc ? ? 
# 
loop_
_pdbx_struct_conn_angle.id 
_pdbx_struct_conn_angle.ptnr1_label_atom_id 
_pdbx_struct_conn_angle.ptnr1_label_alt_id 
_pdbx_struct_conn_angle.ptnr1_label_asym_id 
_pdbx_struct_conn_angle.ptnr1_label_comp_id 
_pdbx_struct_conn_angle.ptnr1_label_seq_id 
_pdbx_struct_conn_angle.ptnr1_auth_atom_id 
_pdbx_struct_conn_angle.ptnr1_auth_asym_id 
_pdbx_struct_conn_angle.ptnr1_auth_comp_id 
_pdbx_struct_conn_angle.ptnr1_auth_seq_id 
_pdbx_struct_conn_angle.ptnr1_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr1_symmetry 
_pdbx_struct_conn_angle.ptnr2_label_atom_id 
_pdbx_struct_conn_angle.ptnr2_label_alt_id 
_pdbx_struct_conn_angle.ptnr2_label_asym_id 
_pdbx_struct_conn_angle.ptnr2_label_comp_id 
_pdbx_struct_conn_angle.ptnr2_label_seq_id 
_pdbx_struct_conn_angle.ptnr2_auth_atom_id 
_pdbx_struct_conn_angle.ptnr2_auth_asym_id 
_pdbx_struct_conn_angle.ptnr2_auth_comp_id 
_pdbx_struct_conn_angle.ptnr2_auth_seq_id 
_pdbx_struct_conn_angle.ptnr2_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr2_symmetry 
_pdbx_struct_conn_angle.ptnr3_label_atom_id 
_pdbx_struct_conn_angle.ptnr3_label_alt_id 
_pdbx_struct_conn_angle.ptnr3_label_asym_id 
_pdbx_struct_conn_angle.ptnr3_label_comp_id 
_pdbx_struct_conn_angle.ptnr3_label_seq_id 
_pdbx_struct_conn_angle.ptnr3_auth_atom_id 
_pdbx_struct_conn_angle.ptnr3_auth_asym_id 
_pdbx_struct_conn_angle.ptnr3_auth_comp_id 
_pdbx_struct_conn_angle.ptnr3_auth_seq_id 
_pdbx_struct_conn_angle.ptnr3_PDB_ins_code 
_pdbx_struct_conn_angle.ptnr3_symmetry 
_pdbx_struct_conn_angle.value 
_pdbx_struct_conn_angle.value_esd 
1 N   ? A HIC 1  ? A HIC 1  ? 1_555 CU ? B CU . ? A CU 301 ? 1_555 ND1 ? A HIC 1  ? A HIC 1   ? 1_555 83.7  ? 
2 N   ? A HIC 1  ? A HIC 1  ? 1_555 CU ? B CU . ? A CU 301 ? 1_555 NE2 ? A HIS 78 ? A HIS 78  ? 1_555 100.3 ? 
3 ND1 ? A HIC 1  ? A HIC 1  ? 1_555 CU ? B CU . ? A CU 301 ? 1_555 NE2 ? A HIS 78 ? A HIS 78  ? 1_555 174.1 ? 
4 N   ? A HIC 1  ? A HIC 1  ? 1_555 CU ? B CU . ? A CU 301 ? 1_555 O6  ? D CIT .  ? A CIT 303 ? 1_555 143.8 ? 
5 ND1 ? A HIC 1  ? A HIC 1  ? 1_555 CU ? B CU . ? A CU 301 ? 1_555 O6  ? D CIT .  ? A CIT 303 ? 1_555 97.4  ? 
6 NE2 ? A HIS 78 ? A HIS 78 ? 1_555 CU ? B CU . ? A CU 301 ? 1_555 O6  ? D CIT .  ? A CIT 303 ? 1_555 81.9  ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 HIC A 1  ? .   . .   . HIC A 1   ? 1_555 .   . .   . .     .  .   HIS 1 HIC Methylation     'Named protein modification' 
2 NAG C .  ? ASN A 33  ? NAG A 302 ? 1_555 ASN A 33  ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate                 
3 NAG G .  ? ASN A 110 ? NAG A 306 ? 1_555 ASN A 110 ? 1_555 C1 ND2 ASN 1 NAG N-Glycosylation Carbohydrate                 
4 CYS A 41 ? CYS A 167 ? CYS A 41  ? 1_555 CYS A 167 ? 1_555 SG SG  .   . .   None            'Disulfide bridge'           
# 
loop_
_struct_mon_prot_cis.pdbx_id 
_struct_mon_prot_cis.label_comp_id 
_struct_mon_prot_cis.label_seq_id 
_struct_mon_prot_cis.label_asym_id 
_struct_mon_prot_cis.label_alt_id 
_struct_mon_prot_cis.pdbx_PDB_ins_code 
_struct_mon_prot_cis.auth_comp_id 
_struct_mon_prot_cis.auth_seq_id 
_struct_mon_prot_cis.auth_asym_id 
_struct_mon_prot_cis.pdbx_label_comp_id_2 
_struct_mon_prot_cis.pdbx_label_seq_id_2 
_struct_mon_prot_cis.pdbx_label_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_ins_code_2 
_struct_mon_prot_cis.pdbx_auth_comp_id_2 
_struct_mon_prot_cis.pdbx_auth_seq_id_2 
_struct_mon_prot_cis.pdbx_auth_asym_id_2 
_struct_mon_prot_cis.pdbx_PDB_model_num 
_struct_mon_prot_cis.pdbx_omega_angle 
1 PHE 187 A . ? PHE 187 A PRO 188 A ? PRO 188 A 1 -6.49 
2 PRO 214 A . ? PRO 214 A PRO 215 A ? PRO 215 A 1 15.16 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 5 ? 
AA2 ? 5 ? 
AA3 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
AA2 1 2 ? parallel      
AA2 2 3 ? anti-parallel 
AA2 3 4 ? anti-parallel 
AA2 4 5 ? anti-parallel 
AA3 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 VAL A 12  ? ASP A 16  ? VAL A 12  ASP A 16  
AA1 2 LEU A 3   ? VAL A 9   ? LEU A 3   VAL A 9   
AA1 3 THR A 59  ? TYR A 65  ? THR A 59  TYR A 65  
AA1 4 GLN A 124 ? VAL A 128 ? GLN A 124 VAL A 128 
AA1 5 GLY A 224 ? ILE A 226 ? GLY A 224 ILE A 226 
AA2 1 VAL A 52  ? VAL A 54  ? VAL A 52  VAL A 54  
AA2 2 GLN A 162 ? ILE A 172 ? GLN A 162 ILE A 172 
AA2 3 GLY A 135 ? ALA A 145 ? GLY A 135 ALA A 145 
AA2 4 ILE A 82  ? PRO A 88  ? ILE A 82  PRO A 88  
AA2 5 VAL A 99  ? ASP A 104 ? VAL A 99  ASP A 104 
AA3 1 TYR A 106 ? ASN A 107 ? TYR A 106 ASN A 107 
AA3 2 THR A 112 ? TRP A 113 ? THR A 112 TRP A 113 
# 
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 O VAL A 12  ? O VAL A 12  N VAL A 9   ? N VAL A 9   
AA1 2 3 N TRP A 5   ? N TRP A 5   O GLU A 63  ? O GLU A 63  
AA1 3 4 N LEU A 60  ? N LEU A 60  O VAL A 127 ? O VAL A 127 
AA1 4 5 N SER A 126 ? N SER A 126 O SER A 225 ? O SER A 225 
AA2 1 2 N VAL A 52  ? N VAL A 52  O GLN A 169 ? O GLN A 169 
AA2 2 3 O ALA A 168 ? O ALA A 168 N PHE A 139 ? N PHE A 139 
AA2 3 4 O LEU A 138 ? O LEU A 138 N ALA A 87  ? N ALA A 87  
AA2 4 5 N VAL A 84  ? N VAL A 84  O LEU A 101 ? O LEU A 101 
AA3 1 2 N ASN A 107 ? N ASN A 107 O THR A 112 ? O THR A 112 
# 
_pdbx_entry_details.entry_id                   9EQE 
_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   Y 
# 
loop_
_pdbx_validate_torsion.id 
_pdbx_validate_torsion.PDB_model_num 
_pdbx_validate_torsion.auth_comp_id 
_pdbx_validate_torsion.auth_asym_id 
_pdbx_validate_torsion.auth_seq_id 
_pdbx_validate_torsion.PDB_ins_code 
_pdbx_validate_torsion.label_alt_id 
_pdbx_validate_torsion.phi 
_pdbx_validate_torsion.psi 
1  1 ILE A 20  ? ? -123.61 -62.19  
2  1 PRO A 37  ? ? -59.55  -8.02   
3  1 ASN A 42  ? ? 77.53   -159.56 
4  1 HIS A 66  ? ? -97.28  -66.24  
5  1 ASP A 71  ? ? -92.43  -148.13 
6  1 ILE A 73  ? ? 84.02   -57.17  
7  1 ILE A 74  ? ? -172.71 144.30  
8  1 HIS A 78  ? ? -79.00  33.52   
9  1 ALA A 105 ? ? -110.12 -75.27  
10 1 THR A 179 ? ? -117.65 76.45   
11 1 ALA A 227 ? ? 179.90  143.66  
# 
_pdbx_struct_mod_residue.id               1 
_pdbx_struct_mod_residue.label_asym_id    A 
_pdbx_struct_mod_residue.label_comp_id    HIC 
_pdbx_struct_mod_residue.label_seq_id     1 
_pdbx_struct_mod_residue.auth_asym_id     A 
_pdbx_struct_mod_residue.auth_comp_id     HIC 
_pdbx_struct_mod_residue.auth_seq_id      1 
_pdbx_struct_mod_residue.PDB_ins_code     ? 
_pdbx_struct_mod_residue.parent_comp_id   HIS 
_pdbx_struct_mod_residue.details          'modified residue' 
# 
_pdbx_distant_solvent_atoms.id                                1 
_pdbx_distant_solvent_atoms.PDB_model_num                     1 
_pdbx_distant_solvent_atoms.auth_atom_id                      O 
_pdbx_distant_solvent_atoms.label_alt_id                      ? 
_pdbx_distant_solvent_atoms.auth_asym_id                      A 
_pdbx_distant_solvent_atoms.auth_comp_id                      HOH 
_pdbx_distant_solvent_atoms.auth_seq_id                       527 
_pdbx_distant_solvent_atoms.PDB_ins_code                      ? 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance   6.19 
_pdbx_distant_solvent_atoms.neighbor_ligand_distance          . 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N  N N 1   
ALA CA   C  N S 2   
ALA C    C  N N 3   
ALA O    O  N N 4   
ALA CB   C  N N 5   
ALA OXT  O  N N 6   
ALA H    H  N N 7   
ALA H2   H  N N 8   
ALA HA   H  N N 9   
ALA HB1  H  N N 10  
ALA HB2  H  N N 11  
ALA HB3  H  N N 12  
ALA HXT  H  N N 13  
ARG N    N  N N 14  
ARG CA   C  N S 15  
ARG C    C  N N 16  
ARG O    O  N N 17  
ARG CB   C  N N 18  
ARG CG   C  N N 19  
ARG CD   C  N N 20  
ARG NE   N  N N 21  
ARG CZ   C  N N 22  
ARG NH1  N  N N 23  
ARG NH2  N  N N 24  
ARG OXT  O  N N 25  
ARG H    H  N N 26  
ARG H2   H  N N 27  
ARG HA   H  N N 28  
ARG HB2  H  N N 29  
ARG HB3  H  N N 30  
ARG HG2  H  N N 31  
ARG HG3  H  N N 32  
ARG HD2  H  N N 33  
ARG HD3  H  N N 34  
ARG HE   H  N N 35  
ARG HH11 H  N N 36  
ARG HH12 H  N N 37  
ARG HH21 H  N N 38  
ARG HH22 H  N N 39  
ARG HXT  H  N N 40  
ASN N    N  N N 41  
ASN CA   C  N S 42  
ASN C    C  N N 43  
ASN O    O  N N 44  
ASN CB   C  N N 45  
ASN CG   C  N N 46  
ASN OD1  O  N N 47  
ASN ND2  N  N N 48  
ASN OXT  O  N N 49  
ASN H    H  N N 50  
ASN H2   H  N N 51  
ASN HA   H  N N 52  
ASN HB2  H  N N 53  
ASN HB3  H  N N 54  
ASN HD21 H  N N 55  
ASN HD22 H  N N 56  
ASN HXT  H  N N 57  
ASP N    N  N N 58  
ASP CA   C  N S 59  
ASP C    C  N N 60  
ASP O    O  N N 61  
ASP CB   C  N N 62  
ASP CG   C  N N 63  
ASP OD1  O  N N 64  
ASP OD2  O  N N 65  
ASP OXT  O  N N 66  
ASP H    H  N N 67  
ASP H2   H  N N 68  
ASP HA   H  N N 69  
ASP HB2  H  N N 70  
ASP HB3  H  N N 71  
ASP HD2  H  N N 72  
ASP HXT  H  N N 73  
CIT C1   C  N N 74  
CIT O1   O  N N 75  
CIT O2   O  N N 76  
CIT C2   C  N N 77  
CIT C3   C  N N 78  
CIT O7   O  N N 79  
CIT C4   C  N N 80  
CIT C5   C  N N 81  
CIT O3   O  N N 82  
CIT O4   O  N N 83  
CIT C6   C  N N 84  
CIT O5   O  N N 85  
CIT O6   O  N N 86  
CIT HO2  H  N N 87  
CIT H21  H  N N 88  
CIT H22  H  N N 89  
CIT HO7  H  N N 90  
CIT H41  H  N N 91  
CIT H42  H  N N 92  
CIT HO4  H  N N 93  
CIT HO6  H  N N 94  
CU  CU   CU N N 95  
CYS N    N  N N 96  
CYS CA   C  N R 97  
CYS C    C  N N 98  
CYS O    O  N N 99  
CYS CB   C  N N 100 
CYS SG   S  N N 101 
CYS OXT  O  N N 102 
CYS H    H  N N 103 
CYS H2   H  N N 104 
CYS HA   H  N N 105 
CYS HB2  H  N N 106 
CYS HB3  H  N N 107 
CYS HG   H  N N 108 
CYS HXT  H  N N 109 
GLN N    N  N N 110 
GLN CA   C  N S 111 
GLN C    C  N N 112 
GLN O    O  N N 113 
GLN CB   C  N N 114 
GLN CG   C  N N 115 
GLN CD   C  N N 116 
GLN OE1  O  N N 117 
GLN NE2  N  N N 118 
GLN OXT  O  N N 119 
GLN H    H  N N 120 
GLN H2   H  N N 121 
GLN HA   H  N N 122 
GLN HB2  H  N N 123 
GLN HB3  H  N N 124 
GLN HG2  H  N N 125 
GLN HG3  H  N N 126 
GLN HE21 H  N N 127 
GLN HE22 H  N N 128 
GLN HXT  H  N N 129 
GLU N    N  N N 130 
GLU CA   C  N S 131 
GLU C    C  N N 132 
GLU O    O  N N 133 
GLU CB   C  N N 134 
GLU CG   C  N N 135 
GLU CD   C  N N 136 
GLU OE1  O  N N 137 
GLU OE2  O  N N 138 
GLU OXT  O  N N 139 
GLU H    H  N N 140 
GLU H2   H  N N 141 
GLU HA   H  N N 142 
GLU HB2  H  N N 143 
GLU HB3  H  N N 144 
GLU HG2  H  N N 145 
GLU HG3  H  N N 146 
GLU HE2  H  N N 147 
GLU HXT  H  N N 148 
GLY N    N  N N 149 
GLY CA   C  N N 150 
GLY C    C  N N 151 
GLY O    O  N N 152 
GLY OXT  O  N N 153 
GLY H    H  N N 154 
GLY H2   H  N N 155 
GLY HA2  H  N N 156 
GLY HA3  H  N N 157 
GLY HXT  H  N N 158 
HIC N    N  N N 159 
HIC CA   C  N S 160 
HIC C    C  N N 161 
HIC O    O  N N 162 
HIC CB   C  N N 163 
HIC CG   C  Y N 164 
HIC ND1  N  Y N 165 
HIC CD2  C  Y N 166 
HIC CE1  C  Y N 167 
HIC NE2  N  Y N 168 
HIC CZ   C  N N 169 
HIC OXT  O  N N 170 
HIC H    H  N N 171 
HIC H2   H  N N 172 
HIC HA   H  N N 173 
HIC HB2  H  N N 174 
HIC HB3  H  N N 175 
HIC HD2  H  N N 176 
HIC HE1  H  N N 177 
HIC HZ1  H  N N 178 
HIC HZ2  H  N N 179 
HIC HZ3  H  N N 180 
HIC HXT  H  N N 181 
HIS N    N  N N 182 
HIS CA   C  N S 183 
HIS C    C  N N 184 
HIS O    O  N N 185 
HIS CB   C  N N 186 
HIS CG   C  Y N 187 
HIS ND1  N  Y N 188 
HIS CD2  C  Y N 189 
HIS CE1  C  Y N 190 
HIS NE2  N  Y N 191 
HIS OXT  O  N N 192 
HIS H    H  N N 193 
HIS H2   H  N N 194 
HIS HA   H  N N 195 
HIS HB2  H  N N 196 
HIS HB3  H  N N 197 
HIS HD1  H  N N 198 
HIS HD2  H  N N 199 
HIS HE1  H  N N 200 
HIS HE2  H  N N 201 
HIS HXT  H  N N 202 
HOH O    O  N N 203 
HOH H1   H  N N 204 
HOH H2   H  N N 205 
ILE N    N  N N 206 
ILE CA   C  N S 207 
ILE C    C  N N 208 
ILE O    O  N N 209 
ILE CB   C  N S 210 
ILE CG1  C  N N 211 
ILE CG2  C  N N 212 
ILE CD1  C  N N 213 
ILE OXT  O  N N 214 
ILE H    H  N N 215 
ILE H2   H  N N 216 
ILE HA   H  N N 217 
ILE HB   H  N N 218 
ILE HG12 H  N N 219 
ILE HG13 H  N N 220 
ILE HG21 H  N N 221 
ILE HG22 H  N N 222 
ILE HG23 H  N N 223 
ILE HD11 H  N N 224 
ILE HD12 H  N N 225 
ILE HD13 H  N N 226 
ILE HXT  H  N N 227 
LEU N    N  N N 228 
LEU CA   C  N S 229 
LEU C    C  N N 230 
LEU O    O  N N 231 
LEU CB   C  N N 232 
LEU CG   C  N N 233 
LEU CD1  C  N N 234 
LEU CD2  C  N N 235 
LEU OXT  O  N N 236 
LEU H    H  N N 237 
LEU H2   H  N N 238 
LEU HA   H  N N 239 
LEU HB2  H  N N 240 
LEU HB3  H  N N 241 
LEU HG   H  N N 242 
LEU HD11 H  N N 243 
LEU HD12 H  N N 244 
LEU HD13 H  N N 245 
LEU HD21 H  N N 246 
LEU HD22 H  N N 247 
LEU HD23 H  N N 248 
LEU HXT  H  N N 249 
LYS N    N  N N 250 
LYS CA   C  N S 251 
LYS C    C  N N 252 
LYS O    O  N N 253 
LYS CB   C  N N 254 
LYS CG   C  N N 255 
LYS CD   C  N N 256 
LYS CE   C  N N 257 
LYS NZ   N  N N 258 
LYS OXT  O  N N 259 
LYS H    H  N N 260 
LYS H2   H  N N 261 
LYS HA   H  N N 262 
LYS HB2  H  N N 263 
LYS HB3  H  N N 264 
LYS HG2  H  N N 265 
LYS HG3  H  N N 266 
LYS HD2  H  N N 267 
LYS HD3  H  N N 268 
LYS HE2  H  N N 269 
LYS HE3  H  N N 270 
LYS HZ1  H  N N 271 
LYS HZ2  H  N N 272 
LYS HZ3  H  N N 273 
LYS HXT  H  N N 274 
MET N    N  N N 275 
MET CA   C  N S 276 
MET C    C  N N 277 
MET O    O  N N 278 
MET CB   C  N N 279 
MET CG   C  N N 280 
MET SD   S  N N 281 
MET CE   C  N N 282 
MET OXT  O  N N 283 
MET H    H  N N 284 
MET H2   H  N N 285 
MET HA   H  N N 286 
MET HB2  H  N N 287 
MET HB3  H  N N 288 
MET HG2  H  N N 289 
MET HG3  H  N N 290 
MET HE1  H  N N 291 
MET HE2  H  N N 292 
MET HE3  H  N N 293 
MET HXT  H  N N 294 
NAG C1   C  N R 295 
NAG C2   C  N R 296 
NAG C3   C  N R 297 
NAG C4   C  N S 298 
NAG C5   C  N R 299 
NAG C6   C  N N 300 
NAG C7   C  N N 301 
NAG C8   C  N N 302 
NAG N2   N  N N 303 
NAG O1   O  N N 304 
NAG O3   O  N N 305 
NAG O4   O  N N 306 
NAG O5   O  N N 307 
NAG O6   O  N N 308 
NAG O7   O  N N 309 
NAG H1   H  N N 310 
NAG H2   H  N N 311 
NAG H3   H  N N 312 
NAG H4   H  N N 313 
NAG H5   H  N N 314 
NAG H61  H  N N 315 
NAG H62  H  N N 316 
NAG H81  H  N N 317 
NAG H82  H  N N 318 
NAG H83  H  N N 319 
NAG HN2  H  N N 320 
NAG HO1  H  N N 321 
NAG HO3  H  N N 322 
NAG HO4  H  N N 323 
NAG HO6  H  N N 324 
PGE C1   C  N N 325 
PGE O1   O  N N 326 
PGE C2   C  N N 327 
PGE O2   O  N N 328 
PGE C3   C  N N 329 
PGE C4   C  N N 330 
PGE O4   O  N N 331 
PGE C6   C  N N 332 
PGE C5   C  N N 333 
PGE O3   O  N N 334 
PGE H1   H  N N 335 
PGE H12  H  N N 336 
PGE HO1  H  N N 337 
PGE H2   H  N N 338 
PGE H22  H  N N 339 
PGE H3   H  N N 340 
PGE H32  H  N N 341 
PGE H4   H  N N 342 
PGE H42  H  N N 343 
PGE HO4  H  N N 344 
PGE H6   H  N N 345 
PGE H62  H  N N 346 
PGE H5   H  N N 347 
PGE H52  H  N N 348 
PHE N    N  N N 349 
PHE CA   C  N S 350 
PHE C    C  N N 351 
PHE O    O  N N 352 
PHE CB   C  N N 353 
PHE CG   C  Y N 354 
PHE CD1  C  Y N 355 
PHE CD2  C  Y N 356 
PHE CE1  C  Y N 357 
PHE CE2  C  Y N 358 
PHE CZ   C  Y N 359 
PHE OXT  O  N N 360 
PHE H    H  N N 361 
PHE H2   H  N N 362 
PHE HA   H  N N 363 
PHE HB2  H  N N 364 
PHE HB3  H  N N 365 
PHE HD1  H  N N 366 
PHE HD2  H  N N 367 
PHE HE1  H  N N 368 
PHE HE2  H  N N 369 
PHE HZ   H  N N 370 
PHE HXT  H  N N 371 
PRO N    N  N N 372 
PRO CA   C  N S 373 
PRO C    C  N N 374 
PRO O    O  N N 375 
PRO CB   C  N N 376 
PRO CG   C  N N 377 
PRO CD   C  N N 378 
PRO OXT  O  N N 379 
PRO H    H  N N 380 
PRO HA   H  N N 381 
PRO HB2  H  N N 382 
PRO HB3  H  N N 383 
PRO HG2  H  N N 384 
PRO HG3  H  N N 385 
PRO HD2  H  N N 386 
PRO HD3  H  N N 387 
PRO HXT  H  N N 388 
SER N    N  N N 389 
SER CA   C  N S 390 
SER C    C  N N 391 
SER O    O  N N 392 
SER CB   C  N N 393 
SER OG   O  N N 394 
SER OXT  O  N N 395 
SER H    H  N N 396 
SER H2   H  N N 397 
SER HA   H  N N 398 
SER HB2  H  N N 399 
SER HB3  H  N N 400 
SER HG   H  N N 401 
SER HXT  H  N N 402 
THR N    N  N N 403 
THR CA   C  N S 404 
THR C    C  N N 405 
THR O    O  N N 406 
THR CB   C  N R 407 
THR OG1  O  N N 408 
THR CG2  C  N N 409 
THR OXT  O  N N 410 
THR H    H  N N 411 
THR H2   H  N N 412 
THR HA   H  N N 413 
THR HB   H  N N 414 
THR HG1  H  N N 415 
THR HG21 H  N N 416 
THR HG22 H  N N 417 
THR HG23 H  N N 418 
THR HXT  H  N N 419 
TRP N    N  N N 420 
TRP CA   C  N S 421 
TRP C    C  N N 422 
TRP O    O  N N 423 
TRP CB   C  N N 424 
TRP CG   C  Y N 425 
TRP CD1  C  Y N 426 
TRP CD2  C  Y N 427 
TRP NE1  N  Y N 428 
TRP CE2  C  Y N 429 
TRP CE3  C  Y N 430 
TRP CZ2  C  Y N 431 
TRP CZ3  C  Y N 432 
TRP CH2  C  Y N 433 
TRP OXT  O  N N 434 
TRP H    H  N N 435 
TRP H2   H  N N 436 
TRP HA   H  N N 437 
TRP HB2  H  N N 438 
TRP HB3  H  N N 439 
TRP HD1  H  N N 440 
TRP HE1  H  N N 441 
TRP HE3  H  N N 442 
TRP HZ2  H  N N 443 
TRP HZ3  H  N N 444 
TRP HH2  H  N N 445 
TRP HXT  H  N N 446 
TYR N    N  N N 447 
TYR CA   C  N S 448 
TYR C    C  N N 449 
TYR O    O  N N 450 
TYR CB   C  N N 451 
TYR CG   C  Y N 452 
TYR CD1  C  Y N 453 
TYR CD2  C  Y N 454 
TYR CE1  C  Y N 455 
TYR CE2  C  Y N 456 
TYR CZ   C  Y N 457 
TYR OH   O  N N 458 
TYR OXT  O  N N 459 
TYR H    H  N N 460 
TYR H2   H  N N 461 
TYR HA   H  N N 462 
TYR HB2  H  N N 463 
TYR HB3  H  N N 464 
TYR HD1  H  N N 465 
TYR HD2  H  N N 466 
TYR HE1  H  N N 467 
TYR HE2  H  N N 468 
TYR HH   H  N N 469 
TYR HXT  H  N N 470 
VAL N    N  N N 471 
VAL CA   C  N S 472 
VAL C    C  N N 473 
VAL O    O  N N 474 
VAL CB   C  N N 475 
VAL CG1  C  N N 476 
VAL CG2  C  N N 477 
VAL OXT  O  N N 478 
VAL H    H  N N 479 
VAL H2   H  N N 480 
VAL HA   H  N N 481 
VAL HB   H  N N 482 
VAL HG11 H  N N 483 
VAL HG12 H  N N 484 
VAL HG13 H  N N 485 
VAL HG21 H  N N 486 
VAL HG22 H  N N 487 
VAL HG23 H  N N 488 
VAL HXT  H  N N 489 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CIT C1  O1   doub N N 70  
CIT C1  O2   sing N N 71  
CIT C1  C2   sing N N 72  
CIT O2  HO2  sing N N 73  
CIT C2  C3   sing N N 74  
CIT C2  H21  sing N N 75  
CIT C2  H22  sing N N 76  
CIT C3  O7   sing N N 77  
CIT C3  C4   sing N N 78  
CIT C3  C6   sing N N 79  
CIT O7  HO7  sing N N 80  
CIT C4  C5   sing N N 81  
CIT C4  H41  sing N N 82  
CIT C4  H42  sing N N 83  
CIT C5  O3   doub N N 84  
CIT C5  O4   sing N N 85  
CIT O4  HO4  sing N N 86  
CIT C6  O5   doub N N 87  
CIT C6  O6   sing N N 88  
CIT O6  HO6  sing N N 89  
CYS N   CA   sing N N 90  
CYS N   H    sing N N 91  
CYS N   H2   sing N N 92  
CYS CA  C    sing N N 93  
CYS CA  CB   sing N N 94  
CYS CA  HA   sing N N 95  
CYS C   O    doub N N 96  
CYS C   OXT  sing N N 97  
CYS CB  SG   sing N N 98  
CYS CB  HB2  sing N N 99  
CYS CB  HB3  sing N N 100 
CYS SG  HG   sing N N 101 
CYS OXT HXT  sing N N 102 
GLN N   CA   sing N N 103 
GLN N   H    sing N N 104 
GLN N   H2   sing N N 105 
GLN CA  C    sing N N 106 
GLN CA  CB   sing N N 107 
GLN CA  HA   sing N N 108 
GLN C   O    doub N N 109 
GLN C   OXT  sing N N 110 
GLN CB  CG   sing N N 111 
GLN CB  HB2  sing N N 112 
GLN CB  HB3  sing N N 113 
GLN CG  CD   sing N N 114 
GLN CG  HG2  sing N N 115 
GLN CG  HG3  sing N N 116 
GLN CD  OE1  doub N N 117 
GLN CD  NE2  sing N N 118 
GLN NE2 HE21 sing N N 119 
GLN NE2 HE22 sing N N 120 
GLN OXT HXT  sing N N 121 
GLU N   CA   sing N N 122 
GLU N   H    sing N N 123 
GLU N   H2   sing N N 124 
GLU CA  C    sing N N 125 
GLU CA  CB   sing N N 126 
GLU CA  HA   sing N N 127 
GLU C   O    doub N N 128 
GLU C   OXT  sing N N 129 
GLU CB  CG   sing N N 130 
GLU CB  HB2  sing N N 131 
GLU CB  HB3  sing N N 132 
GLU CG  CD   sing N N 133 
GLU CG  HG2  sing N N 134 
GLU CG  HG3  sing N N 135 
GLU CD  OE1  doub N N 136 
GLU CD  OE2  sing N N 137 
GLU OE2 HE2  sing N N 138 
GLU OXT HXT  sing N N 139 
GLY N   CA   sing N N 140 
GLY N   H    sing N N 141 
GLY N   H2   sing N N 142 
GLY CA  C    sing N N 143 
GLY CA  HA2  sing N N 144 
GLY CA  HA3  sing N N 145 
GLY C   O    doub N N 146 
GLY C   OXT  sing N N 147 
GLY OXT HXT  sing N N 148 
HIC N   CA   sing N N 149 
HIC N   H    sing N N 150 
HIC N   H2   sing N N 151 
HIC CA  C    sing N N 152 
HIC CA  CB   sing N N 153 
HIC CA  HA   sing N N 154 
HIC C   O    doub N N 155 
HIC C   OXT  sing N N 156 
HIC CB  CG   sing N N 157 
HIC CB  HB2  sing N N 158 
HIC CB  HB3  sing N N 159 
HIC CG  ND1  sing Y N 160 
HIC CG  CD2  doub Y N 161 
HIC ND1 CE1  doub Y N 162 
HIC CD2 NE2  sing Y N 163 
HIC CD2 HD2  sing N N 164 
HIC CE1 NE2  sing Y N 165 
HIC CE1 HE1  sing N N 166 
HIC NE2 CZ   sing N N 167 
HIC CZ  HZ1  sing N N 168 
HIC CZ  HZ2  sing N N 169 
HIC CZ  HZ3  sing N N 170 
HIC OXT HXT  sing N N 171 
HIS N   CA   sing N N 172 
HIS N   H    sing N N 173 
HIS N   H2   sing N N 174 
HIS CA  C    sing N N 175 
HIS CA  CB   sing N N 176 
HIS CA  HA   sing N N 177 
HIS C   O    doub N N 178 
HIS C   OXT  sing N N 179 
HIS CB  CG   sing N N 180 
HIS CB  HB2  sing N N 181 
HIS CB  HB3  sing N N 182 
HIS CG  ND1  sing Y N 183 
HIS CG  CD2  doub Y N 184 
HIS ND1 CE1  doub Y N 185 
HIS ND1 HD1  sing N N 186 
HIS CD2 NE2  sing Y N 187 
HIS CD2 HD2  sing N N 188 
HIS CE1 NE2  sing Y N 189 
HIS CE1 HE1  sing N N 190 
HIS NE2 HE2  sing N N 191 
HIS OXT HXT  sing N N 192 
HOH O   H1   sing N N 193 
HOH O   H2   sing N N 194 
ILE N   CA   sing N N 195 
ILE N   H    sing N N 196 
ILE N   H2   sing N N 197 
ILE CA  C    sing N N 198 
ILE CA  CB   sing N N 199 
ILE CA  HA   sing N N 200 
ILE C   O    doub N N 201 
ILE C   OXT  sing N N 202 
ILE CB  CG1  sing N N 203 
ILE CB  CG2  sing N N 204 
ILE CB  HB   sing N N 205 
ILE CG1 CD1  sing N N 206 
ILE CG1 HG12 sing N N 207 
ILE CG1 HG13 sing N N 208 
ILE CG2 HG21 sing N N 209 
ILE CG2 HG22 sing N N 210 
ILE CG2 HG23 sing N N 211 
ILE CD1 HD11 sing N N 212 
ILE CD1 HD12 sing N N 213 
ILE CD1 HD13 sing N N 214 
ILE OXT HXT  sing N N 215 
LEU N   CA   sing N N 216 
LEU N   H    sing N N 217 
LEU N   H2   sing N N 218 
LEU CA  C    sing N N 219 
LEU CA  CB   sing N N 220 
LEU CA  HA   sing N N 221 
LEU C   O    doub N N 222 
LEU C   OXT  sing N N 223 
LEU CB  CG   sing N N 224 
LEU CB  HB2  sing N N 225 
LEU CB  HB3  sing N N 226 
LEU CG  CD1  sing N N 227 
LEU CG  CD2  sing N N 228 
LEU CG  HG   sing N N 229 
LEU CD1 HD11 sing N N 230 
LEU CD1 HD12 sing N N 231 
LEU CD1 HD13 sing N N 232 
LEU CD2 HD21 sing N N 233 
LEU CD2 HD22 sing N N 234 
LEU CD2 HD23 sing N N 235 
LEU OXT HXT  sing N N 236 
LYS N   CA   sing N N 237 
LYS N   H    sing N N 238 
LYS N   H2   sing N N 239 
LYS CA  C    sing N N 240 
LYS CA  CB   sing N N 241 
LYS CA  HA   sing N N 242 
LYS C   O    doub N N 243 
LYS C   OXT  sing N N 244 
LYS CB  CG   sing N N 245 
LYS CB  HB2  sing N N 246 
LYS CB  HB3  sing N N 247 
LYS CG  CD   sing N N 248 
LYS CG  HG2  sing N N 249 
LYS CG  HG3  sing N N 250 
LYS CD  CE   sing N N 251 
LYS CD  HD2  sing N N 252 
LYS CD  HD3  sing N N 253 
LYS CE  NZ   sing N N 254 
LYS CE  HE2  sing N N 255 
LYS CE  HE3  sing N N 256 
LYS NZ  HZ1  sing N N 257 
LYS NZ  HZ2  sing N N 258 
LYS NZ  HZ3  sing N N 259 
LYS OXT HXT  sing N N 260 
MET N   CA   sing N N 261 
MET N   H    sing N N 262 
MET N   H2   sing N N 263 
MET CA  C    sing N N 264 
MET CA  CB   sing N N 265 
MET CA  HA   sing N N 266 
MET C   O    doub N N 267 
MET C   OXT  sing N N 268 
MET CB  CG   sing N N 269 
MET CB  HB2  sing N N 270 
MET CB  HB3  sing N N 271 
MET CG  SD   sing N N 272 
MET CG  HG2  sing N N 273 
MET CG  HG3  sing N N 274 
MET SD  CE   sing N N 275 
MET CE  HE1  sing N N 276 
MET CE  HE2  sing N N 277 
MET CE  HE3  sing N N 278 
MET OXT HXT  sing N N 279 
NAG C1  C2   sing N N 280 
NAG C1  O1   sing N N 281 
NAG C1  O5   sing N N 282 
NAG C1  H1   sing N N 283 
NAG C2  C3   sing N N 284 
NAG C2  N2   sing N N 285 
NAG C2  H2   sing N N 286 
NAG C3  C4   sing N N 287 
NAG C3  O3   sing N N 288 
NAG C3  H3   sing N N 289 
NAG C4  C5   sing N N 290 
NAG C4  O4   sing N N 291 
NAG C4  H4   sing N N 292 
NAG C5  C6   sing N N 293 
NAG C5  O5   sing N N 294 
NAG C5  H5   sing N N 295 
NAG C6  O6   sing N N 296 
NAG C6  H61  sing N N 297 
NAG C6  H62  sing N N 298 
NAG C7  C8   sing N N 299 
NAG C7  N2   sing N N 300 
NAG C7  O7   doub N N 301 
NAG C8  H81  sing N N 302 
NAG C8  H82  sing N N 303 
NAG C8  H83  sing N N 304 
NAG N2  HN2  sing N N 305 
NAG O1  HO1  sing N N 306 
NAG O3  HO3  sing N N 307 
NAG O4  HO4  sing N N 308 
NAG O6  HO6  sing N N 309 
PGE C1  O1   sing N N 310 
PGE C1  C2   sing N N 311 
PGE C1  H1   sing N N 312 
PGE C1  H12  sing N N 313 
PGE O1  HO1  sing N N 314 
PGE C2  O2   sing N N 315 
PGE C2  H2   sing N N 316 
PGE C2  H22  sing N N 317 
PGE O2  C3   sing N N 318 
PGE C3  C4   sing N N 319 
PGE C3  H3   sing N N 320 
PGE C3  H32  sing N N 321 
PGE C4  O3   sing N N 322 
PGE C4  H4   sing N N 323 
PGE C4  H42  sing N N 324 
PGE O4  C6   sing N N 325 
PGE O4  HO4  sing N N 326 
PGE C6  C5   sing N N 327 
PGE C6  H6   sing N N 328 
PGE C6  H62  sing N N 329 
PGE C5  O3   sing N N 330 
PGE C5  H5   sing N N 331 
PGE C5  H52  sing N N 332 
PHE N   CA   sing N N 333 
PHE N   H    sing N N 334 
PHE N   H2   sing N N 335 
PHE CA  C    sing N N 336 
PHE CA  CB   sing N N 337 
PHE CA  HA   sing N N 338 
PHE C   O    doub N N 339 
PHE C   OXT  sing N N 340 
PHE CB  CG   sing N N 341 
PHE CB  HB2  sing N N 342 
PHE CB  HB3  sing N N 343 
PHE CG  CD1  doub Y N 344 
PHE CG  CD2  sing Y N 345 
PHE CD1 CE1  sing Y N 346 
PHE CD1 HD1  sing N N 347 
PHE CD2 CE2  doub Y N 348 
PHE CD2 HD2  sing N N 349 
PHE CE1 CZ   doub Y N 350 
PHE CE1 HE1  sing N N 351 
PHE CE2 CZ   sing Y N 352 
PHE CE2 HE2  sing N N 353 
PHE CZ  HZ   sing N N 354 
PHE OXT HXT  sing N N 355 
PRO N   CA   sing N N 356 
PRO N   CD   sing N N 357 
PRO N   H    sing N N 358 
PRO CA  C    sing N N 359 
PRO CA  CB   sing N N 360 
PRO CA  HA   sing N N 361 
PRO C   O    doub N N 362 
PRO C   OXT  sing N N 363 
PRO CB  CG   sing N N 364 
PRO CB  HB2  sing N N 365 
PRO CB  HB3  sing N N 366 
PRO CG  CD   sing N N 367 
PRO CG  HG2  sing N N 368 
PRO CG  HG3  sing N N 369 
PRO CD  HD2  sing N N 370 
PRO CD  HD3  sing N N 371 
PRO OXT HXT  sing N N 372 
SER N   CA   sing N N 373 
SER N   H    sing N N 374 
SER N   H2   sing N N 375 
SER CA  C    sing N N 376 
SER CA  CB   sing N N 377 
SER CA  HA   sing N N 378 
SER C   O    doub N N 379 
SER C   OXT  sing N N 380 
SER CB  OG   sing N N 381 
SER CB  HB2  sing N N 382 
SER CB  HB3  sing N N 383 
SER OG  HG   sing N N 384 
SER OXT HXT  sing N N 385 
THR N   CA   sing N N 386 
THR N   H    sing N N 387 
THR N   H2   sing N N 388 
THR CA  C    sing N N 389 
THR CA  CB   sing N N 390 
THR CA  HA   sing N N 391 
THR C   O    doub N N 392 
THR C   OXT  sing N N 393 
THR CB  OG1  sing N N 394 
THR CB  CG2  sing N N 395 
THR CB  HB   sing N N 396 
THR OG1 HG1  sing N N 397 
THR CG2 HG21 sing N N 398 
THR CG2 HG22 sing N N 399 
THR CG2 HG23 sing N N 400 
THR OXT HXT  sing N N 401 
TRP N   CA   sing N N 402 
TRP N   H    sing N N 403 
TRP N   H2   sing N N 404 
TRP CA  C    sing N N 405 
TRP CA  CB   sing N N 406 
TRP CA  HA   sing N N 407 
TRP C   O    doub N N 408 
TRP C   OXT  sing N N 409 
TRP CB  CG   sing N N 410 
TRP CB  HB2  sing N N 411 
TRP CB  HB3  sing N N 412 
TRP CG  CD1  doub Y N 413 
TRP CG  CD2  sing Y N 414 
TRP CD1 NE1  sing Y N 415 
TRP CD1 HD1  sing N N 416 
TRP CD2 CE2  doub Y N 417 
TRP CD2 CE3  sing Y N 418 
TRP NE1 CE2  sing Y N 419 
TRP NE1 HE1  sing N N 420 
TRP CE2 CZ2  sing Y N 421 
TRP CE3 CZ3  doub Y N 422 
TRP CE3 HE3  sing N N 423 
TRP CZ2 CH2  doub Y N 424 
TRP CZ2 HZ2  sing N N 425 
TRP CZ3 CH2  sing Y N 426 
TRP CZ3 HZ3  sing N N 427 
TRP CH2 HH2  sing N N 428 
TRP OXT HXT  sing N N 429 
TYR N   CA   sing N N 430 
TYR N   H    sing N N 431 
TYR N   H2   sing N N 432 
TYR CA  C    sing N N 433 
TYR CA  CB   sing N N 434 
TYR CA  HA   sing N N 435 
TYR C   O    doub N N 436 
TYR C   OXT  sing N N 437 
TYR CB  CG   sing N N 438 
TYR CB  HB2  sing N N 439 
TYR CB  HB3  sing N N 440 
TYR CG  CD1  doub Y N 441 
TYR CG  CD2  sing Y N 442 
TYR CD1 CE1  sing Y N 443 
TYR CD1 HD1  sing N N 444 
TYR CD2 CE2  doub Y N 445 
TYR CD2 HD2  sing N N 446 
TYR CE1 CZ   doub Y N 447 
TYR CE1 HE1  sing N N 448 
TYR CE2 CZ   sing Y N 449 
TYR CE2 HE2  sing N N 450 
TYR CZ  OH   sing N N 451 
TYR OH  HH   sing N N 452 
TYR OXT HXT  sing N N 453 
VAL N   CA   sing N N 454 
VAL N   H    sing N N 455 
VAL N   H2   sing N N 456 
VAL CA  C    sing N N 457 
VAL CA  CB   sing N N 458 
VAL CA  HA   sing N N 459 
VAL C   O    doub N N 460 
VAL C   OXT  sing N N 461 
VAL CB  CG1  sing N N 462 
VAL CB  CG2  sing N N 463 
VAL CB  HB   sing N N 464 
VAL CG1 HG11 sing N N 465 
VAL CG1 HG12 sing N N 466 
VAL CG1 HG13 sing N N 467 
VAL CG2 HG21 sing N N 468 
VAL CG2 HG22 sing N N 469 
VAL CG2 HG23 sing N N 470 
VAL OXT HXT  sing N N 471 
# 
loop_
_pdbx_audit_support.funding_organization 
_pdbx_audit_support.country 
_pdbx_audit_support.grant_number 
_pdbx_audit_support.ordinal 
'Novo Nordisk Foundation'                 Denmark NNF17SA0027704 1 
'Novo Nordisk Foundation'                 Denmark NNF21OC0071799 2 
'Danish Council for Independent Research' Denmark 8021-00273B    3 
'The Carlsberg Foundation'                Denmark CF16-0673      4 
'The Carlsberg Foundation'                Denmark CF17-0533      5 
# 
_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   5ach 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9EQE 
_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]   0.007961 
_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]   0.007961 
_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]   0.007961 
_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 
C  
CU 
N  
O  
S  
# 
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 
HETATM 1    N  N   . HIC A 1 1   ? -5.520  -4.463  18.174 1.00 19.89  ? 1   HIC A N   1 
HETATM 2    C  CA  . HIC A 1 1   ? -5.397  -4.305  16.699 1.00 20.22  ? 1   HIC A CA  1 
HETATM 3    C  C   . HIC A 1 1   ? -4.190  -5.088  16.182 1.00 18.88  ? 1   HIC A C   1 
HETATM 4    O  O   . HIC A 1 1   ? -3.059  -4.862  16.621 1.00 18.49  ? 1   HIC A O   1 
HETATM 5    C  CB  . HIC A 1 1   ? -5.338  -2.819  16.314 1.00 20.45  ? 1   HIC A CB  1 
HETATM 6    C  CG  . HIC A 1 1   ? -6.577  -2.064  16.669 1.00 20.12  ? 1   HIC A CG  1 
HETATM 7    N  ND1 . HIC A 1 1   ? -7.270  -2.380  17.826 1.00 19.28  ? 1   HIC A ND1 1 
HETATM 8    C  CD2 . HIC A 1 1   ? -7.226  -1.073  15.992 1.00 19.72  ? 1   HIC A CD2 1 
HETATM 9    C  CE1 . HIC A 1 1   ? -8.299  -1.562  17.847 1.00 19.63  ? 1   HIC A CE1 1 
HETATM 10   N  NE2 . HIC A 1 1   ? -8.337  -0.740  16.756 1.00 19.39  ? 1   HIC A NE2 1 
HETATM 11   C  CZ  . HIC A 1 1   ? -9.325  0.295   16.445 1.00 18.92  ? 1   HIC A CZ  1 
ATOM   12   N  N   . THR A 1 2   ? -4.475  -6.028  15.270 1.00 17.45  ? 2   THR A N   1 
ATOM   13   C  CA  . THR A 1 2   ? -3.488  -6.984  14.801 1.00 17.17  ? 2   THR A CA  1 
ATOM   14   C  C   . THR A 1 2   ? -3.990  -7.558  13.484 1.00 17.24  ? 2   THR A C   1 
ATOM   15   O  O   . THR A 1 2   ? -5.196  -7.539  13.250 1.00 16.18  ? 2   THR A O   1 
ATOM   16   C  CB  . THR A 1 2   ? -3.171  -8.048  15.868 1.00 16.09  ? 2   THR A CB  1 
ATOM   17   O  OG1 . THR A 1 2   ? -2.110  -8.867  15.391 1.00 15.10  ? 2   THR A OG1 1 
ATOM   18   C  CG2 . THR A 1 2   ? -4.332  -8.946  16.217 1.00 15.75  ? 2   THR A CG2 1 
ATOM   19   N  N   . LEU A 1 3   ? -3.037  -8.051  12.672 1.00 17.97  ? 3   LEU A N   1 
ATOM   20   C  CA  . LEU A 1 3   ? -3.241  -8.482  11.293 1.00 18.16  ? 3   LEU A CA  1 
ATOM   21   C  C   . LEU A 1 3   ? -2.321  -9.648  10.979 1.00 16.36  ? 3   LEU A C   1 
ATOM   22   O  O   . LEU A 1 3   ? -1.346  -9.859  11.699 1.00 14.82  ? 3   LEU A O   1 
ATOM   23   C  CB  . LEU A 1 3   ? -2.866  -7.317  10.379 1.00 20.82  ? 3   LEU A CB  1 
ATOM   24   C  CG  . LEU A 1 3   ? -3.992  -6.345  10.039 1.00 22.83  ? 3   LEU A CG  1 
ATOM   25   C  CD1 . LEU A 1 3   ? -3.429  -5.137  9.298  1.00 23.51  ? 3   LEU A CD1 1 
ATOM   26   C  CD2 . LEU A 1 3   ? -5.068  -7.028  9.208  1.00 22.37  ? 3   LEU A CD2 1 
ATOM   27   N  N   . VAL A 1 4   ? -2.573  -10.342 9.862  1.00 16.61  ? 4   VAL A N   1 
ATOM   28   C  CA  . VAL A 1 4   ? -1.676  -11.421 9.435  1.00 16.66  ? 4   VAL A CA  1 
ATOM   29   C  C   . VAL A 1 4   ? -0.759  -10.951 8.310  1.00 16.93  ? 4   VAL A C   1 
ATOM   30   O  O   . VAL A 1 4   ? -1.228  -10.336 7.353  1.00 16.00  ? 4   VAL A O   1 
ATOM   31   C  CB  . VAL A 1 4   ? -2.423  -12.709 9.030  1.00 16.54  ? 4   VAL A CB  1 
ATOM   32   C  CG1 . VAL A 1 4   ? -1.500  -13.720 8.352  1.00 15.51  ? 4   VAL A CG1 1 
ATOM   33   C  CG2 . VAL A 1 4   ? -3.117  -13.342 10.239 1.00 17.41  ? 4   VAL A CG2 1 
ATOM   34   N  N   . TRP A 1 5   ? 0.537   -11.293 8.452  1.00 18.24  ? 5   TRP A N   1 
ATOM   35   C  CA  . TRP A 1 5   ? 1.579   -10.947 7.494  1.00 19.62  ? 5   TRP A CA  1 
ATOM   36   C  C   . TRP A 1 5   ? 1.711   -12.058 6.464  1.00 20.17  ? 5   TRP A C   1 
ATOM   37   O  O   . TRP A 1 5   ? 1.781   -11.774 5.268  1.00 23.27  ? 5   TRP A O   1 
ATOM   38   C  CB  . TRP A 1 5   ? 2.919   -10.684 8.190  1.00 21.15  ? 5   TRP A CB  1 
ATOM   39   C  CG  . TRP A 1 5   ? 3.934   -9.997  7.329  1.00 24.73  ? 5   TRP A CG  1 
ATOM   40   C  CD1 . TRP A 1 5   ? 4.186   -8.653  7.222  1.00 27.72  ? 5   TRP A CD1 1 
ATOM   41   C  CD2 . TRP A 1 5   ? 4.894   -10.650 6.489  1.00 29.56  ? 5   TRP A CD2 1 
ATOM   42   N  NE1 . TRP A 1 5   ? 5.217   -8.422  6.343  1.00 29.49  ? 5   TRP A NE1 1 
ATOM   43   C  CE2 . TRP A 1 5   ? 5.664   -9.635  5.873  1.00 31.52  ? 5   TRP A CE2 1 
ATOM   44   C  CE3 . TRP A 1 5   ? 5.175   -11.998 6.210  1.00 35.02  ? 5   TRP A CE3 1 
ATOM   45   C  CZ2 . TRP A 1 5   ? 6.696   -9.943  4.982  1.00 36.58  ? 5   TRP A CZ2 1 
ATOM   46   C  CZ3 . TRP A 1 5   ? 6.194   -12.305 5.330  1.00 38.70  ? 5   TRP A CZ3 1 
ATOM   47   C  CH2 . TRP A 1 5   ? 6.939   -11.283 4.720  1.00 40.36  ? 5   TRP A CH2 1 
ATOM   48   N  N   . GLY A 1 6   ? 1.787   -13.311 6.947  1.00 19.24  ? 6   GLY A N   1 
ATOM   49   C  CA  . GLY A 1 6   ? 1.856   -14.481 6.083  1.00 17.12  ? 6   GLY A CA  1 
ATOM   50   C  C   . GLY A 1 6   ? 1.838   -15.752 6.913  1.00 16.26  ? 6   GLY A C   1 
ATOM   51   O  O   . GLY A 1 6   ? 1.436   -15.719 8.065  1.00 16.24  ? 6   GLY A O   1 
ATOM   52   N  N   . VAL A 1 7   ? 2.333   -16.841 6.322  1.00 16.30  ? 7   VAL A N   1 
ATOM   53   C  CA  . VAL A 1 7   ? 2.409   -18.141 6.972  1.00 15.63  ? 7   VAL A CA  1 
ATOM   54   C  C   . VAL A 1 7   ? 3.749   -18.800 6.679  1.00 15.23  ? 7   VAL A C   1 
ATOM   55   O  O   . VAL A 1 7   ? 4.355   -18.559 5.648  1.00 15.06  ? 7   VAL A O   1 
ATOM   56   C  CB  . VAL A 1 7   ? 1.287   -19.068 6.487  1.00 15.29  ? 7   VAL A CB  1 
ATOM   57   C  CG1 . VAL A 1 7   ? -0.059  -18.374 6.605  1.00 15.29  ? 7   VAL A CG1 1 
ATOM   58   C  CG2 . VAL A 1 7   ? 1.535   -19.545 5.062  1.00 15.21  ? 7   VAL A CG2 1 
ATOM   59   N  N   . TRP A 1 8   ? 4.169   -19.660 7.603  1.00 15.09  ? 8   TRP A N   1 
ATOM   60   C  CA  . TRP A 1 8   ? 5.283   -20.549 7.385  1.00 15.30  ? 8   TRP A CA  1 
ATOM   61   C  C   . TRP A 1 8   ? 4.727   -21.971 7.273  1.00 16.62  ? 8   TRP A C   1 
ATOM   62   O  O   . TRP A 1 8   ? 3.678   -22.282 7.829  1.00 16.19  ? 8   TRP A O   1 
ATOM   63   C  CB  . TRP A 1 8   ? 6.310   -20.450 8.514  1.00 15.10  ? 8   TRP A CB  1 
ATOM   64   C  CG  . TRP A 1 8   ? 6.816   -19.084 8.867  1.00 14.96  ? 8   TRP A CG  1 
ATOM   65   C  CD1 . TRP A 1 8   ? 6.093   -18.003 9.276  1.00 15.25  ? 8   TRP A CD1 1 
ATOM   66   C  CD2 . TRP A 1 8   ? 8.195   -18.688 8.969  1.00 14.97  ? 8   TRP A CD2 1 
ATOM   67   N  NE1 . TRP A 1 8   ? 6.913   -16.947 9.563  1.00 14.85  ? 8   TRP A NE1 1 
ATOM   68   C  CE2 . TRP A 1 8   ? 8.211   -17.339 9.395  1.00 14.78  ? 8   TRP A CE2 1 
ATOM   69   C  CE3 . TRP A 1 8   ? 9.420   -19.343 8.742  1.00 14.40  ? 8   TRP A CE3 1 
ATOM   70   C  CZ2 . TRP A 1 8   ? 9.404   -16.646 9.618  1.00 14.49  ? 8   TRP A CZ2 1 
ATOM   71   C  CZ3 . TRP A 1 8   ? 10.597  -18.649 8.926  1.00 13.82  ? 8   TRP A CZ3 1 
ATOM   72   C  CH2 . TRP A 1 8   ? 10.584  -17.321 9.369  1.00 14.33  ? 8   TRP A CH2 1 
ATOM   73   N  N   . VAL A 1 9   ? 5.441   -22.810 6.514  1.00 17.26  ? 9   VAL A N   1 
ATOM   74   C  CA  . VAL A 1 9   ? 5.128   -24.211 6.339  1.00 17.15  ? 9   VAL A CA  1 
ATOM   75   C  C   . VAL A 1 9   ? 6.381   -24.989 6.711  1.00 16.77  ? 9   VAL A C   1 
ATOM   76   O  O   . VAL A 1 9   ? 7.462   -24.740 6.172  1.00 17.02  ? 9   VAL A O   1 
ATOM   77   C  CB  . VAL A 1 9   ? 4.707   -24.545 4.897  1.00 17.68  ? 9   VAL A CB  1 
ATOM   78   C  CG1 . VAL A 1 9   ? 4.347   -26.020 4.788  1.00 18.38  ? 9   VAL A CG1 1 
ATOM   79   C  CG2 . VAL A 1 9   ? 3.570   -23.672 4.389  1.00 17.65  ? 9   VAL A CG2 1 
ATOM   80   N  N   . ASN A 1 10  ? 6.210   -25.912 7.662  1.00 16.54  ? 10  ASN A N   1 
ATOM   81   C  CA  . ASN A 1 10  ? 7.286   -26.728 8.199  1.00 15.19  ? 10  ASN A CA  1 
ATOM   82   C  C   . ASN A 1 10  ? 8.506   -25.860 8.438  1.00 13.95  ? 10  ASN A C   1 
ATOM   83   O  O   . ASN A 1 10  ? 9.613   -26.255 8.113  1.00 14.05  ? 10  ASN A O   1 
ATOM   84   C  CB  . ASN A 1 10  ? 7.622   -27.888 7.264  1.00 15.58  ? 10  ASN A CB  1 
ATOM   85   C  CG  . ASN A 1 10  ? 6.435   -28.786 6.978  1.00 15.77  ? 10  ASN A CG  1 
ATOM   86   O  OD1 . ASN A 1 10  ? 5.348   -28.621 7.521  1.00 15.30  ? 10  ASN A OD1 1 
ATOM   87   N  ND2 . ASN A 1 10  ? 6.649   -29.790 6.153  1.00 16.74  ? 10  ASN A ND2 1 
ATOM   88   N  N   . GLY A 1 11  ? 8.272   -24.667 8.970  1.00 13.53  ? 11  GLY A N   1 
ATOM   89   C  CA  . GLY A 1 11  ? 9.347   -23.832 9.460  1.00 14.15  ? 11  GLY A CA  1 
ATOM   90   C  C   . GLY A 1 11  ? 9.977   -22.980 8.367  1.00 14.28  ? 11  GLY A C   1 
ATOM   91   O  O   . GLY A 1 11  ? 10.949  -22.282 8.636  1.00 13.16  ? 11  GLY A O   1 
ATOM   92   N  N   . VAL A 1 12  ? 9.380   -22.993 7.166  1.00 15.27  ? 12  VAL A N   1 
ATOM   93   C  CA  . VAL A 1 12  ? 9.884   -22.216 6.034  1.00 15.61  ? 12  VAL A CA  1 
ATOM   94   C  C   . VAL A 1 12  ? 8.889   -21.116 5.653  1.00 14.22  ? 12  VAL A C   1 
ATOM   95   O  O   . VAL A 1 12  ? 7.755   -21.386 5.278  1.00 13.59  ? 12  VAL A O   1 
ATOM   96   C  CB  . VAL A 1 12  ? 10.167  -23.143 4.830  1.00 15.84  ? 12  VAL A CB  1 
ATOM   97   C  CG1 . VAL A 1 12  ? 10.779  -22.370 3.670  1.00 15.49  ? 12  VAL A CG1 1 
ATOM   98   C  CG2 . VAL A 1 12  ? 11.035  -24.329 5.225  1.00 15.69  ? 12  VAL A CG2 1 
ATOM   99   N  N   . ASP A 1 13  ? 9.361   -19.875 5.649  1.00 14.67  ? 13  ASP A N   1 
ATOM   100  C  CA  . ASP A 1 13  ? 8.522   -18.718 5.359  1.00 15.14  ? 13  ASP A CA  1 
ATOM   101  C  C   . ASP A 1 13  ? 8.052   -18.762 3.905  1.00 14.30  ? 13  ASP A C   1 
ATOM   102  O  O   . ASP A 1 13  ? 8.863   -18.866 2.995  1.00 15.22  ? 13  ASP A O   1 
ATOM   103  C  CB  . ASP A 1 13  ? 9.309   -17.427 5.633  1.00 15.86  ? 13  ASP A CB  1 
ATOM   104  C  CG  . ASP A 1 13  ? 8.535   -16.119 5.578  1.00 16.22  ? 13  ASP A CG  1 
ATOM   105  O  OD1 . ASP A 1 13  ? 7.328   -16.151 5.240  1.00 18.08  ? 13  ASP A OD1 1 
ATOM   106  O  OD2 . ASP A 1 13  ? 9.149   -15.070 5.885  1.00 15.92  ? 13  ASP A OD2 1 
ATOM   107  N  N   . GLN A 1 14  ? 6.750   -18.579 3.685  1.00 13.45  ? 14  GLN A N   1 
ATOM   108  C  CA  . GLN A 1 14  ? 6.179   -18.546 2.347  1.00 12.86  ? 14  GLN A CA  1 
ATOM   109  C  C   . GLN A 1 14  ? 6.187   -17.141 1.735  1.00 12.18  ? 14  GLN A C   1 
ATOM   110  O  O   . GLN A 1 14  ? 5.781   -16.988 0.579  1.00 11.22  ? 14  GLN A O   1 
ATOM   111  C  CB  . GLN A 1 14  ? 4.757   -19.095 2.414  1.00 12.68  ? 14  GLN A CB  1 
ATOM   112  C  CG  . GLN A 1 14  ? 4.704   -20.525 2.945  1.00 12.73  ? 14  GLN A CG  1 
ATOM   113  C  CD  . GLN A 1 14  ? 5.379   -21.533 2.050  1.00 11.78  ? 14  GLN A CD  1 
ATOM   114  O  OE1 . GLN A 1 14  ? 4.829   -21.905 1.026  1.00 11.06  ? 14  GLN A OE1 1 
ATOM   115  N  NE2 . GLN A 1 14  ? 6.558   -21.990 2.446  1.00 11.99  ? 14  GLN A NE2 1 
ATOM   116  N  N   . GLY A 1 15  ? 6.653   -16.151 2.511  1.00 12.35  ? 15  GLY A N   1 
ATOM   117  C  CA  . GLY A 1 15  ? 6.729   -14.758 2.097  1.00 13.23  ? 15  GLY A CA  1 
ATOM   118  C  C   . GLY A 1 15  ? 5.443   -13.999 2.420  1.00 14.23  ? 15  GLY A C   1 
ATOM   119  O  O   . GLY A 1 15  ? 4.459   -14.581 2.878  1.00 15.73  ? 15  GLY A O   1 
ATOM   120  N  N   . ASP A 1 16  ? 5.437   -12.702 2.111  1.00 14.32  ? 16  ASP A N   1 
ATOM   121  C  CA  . ASP A 1 16  ? 4.319   -11.829 2.412  1.00 14.25  ? 16  ASP A CA  1 
ATOM   122  C  C   . ASP A 1 16  ? 3.080   -12.329 1.680  1.00 14.41  ? 16  ASP A C   1 
ATOM   123  O  O   . ASP A 1 16  ? 3.139   -12.510 0.468  1.00 14.35  ? 16  ASP A O   1 
ATOM   124  C  CB  . ASP A 1 16  ? 4.707   -10.411 1.998  1.00 14.77  ? 16  ASP A CB  1 
ATOM   125  C  CG  . ASP A 1 16  ? 3.710   -9.335  2.384  1.00 15.73  ? 16  ASP A CG  1 
ATOM   126  O  OD1 . ASP A 1 16  ? 2.552   -9.681  2.736  1.00 16.72  ? 16  ASP A OD1 1 
ATOM   127  O  OD2 . ASP A 1 16  ? 4.099   -8.166  2.336  1.00 15.21  ? 16  ASP A OD2 1 
ATOM   128  N  N   . GLY A 1 17  ? 1.968   -12.522 2.410  1.00 14.61  ? 17  GLY A N   1 
ATOM   129  C  CA  . GLY A 1 17  ? 0.739   -13.078 1.840  1.00 15.01  ? 17  GLY A CA  1 
ATOM   130  C  C   . GLY A 1 17  ? -0.416  -12.078 1.695  1.00 15.12  ? 17  GLY A C   1 
ATOM   131  O  O   . GLY A 1 17  ? -1.494  -12.407 1.204  1.00 15.05  ? 17  GLY A O   1 
ATOM   132  N  N   . ARG A 1 18  ? -0.168  -10.835 2.096  1.00 15.49  ? 18  ARG A N   1 
ATOM   133  C  CA  . ARG A 1 18  ? -1.211  -9.837  2.223  1.00 15.21  ? 18  ARG A CA  1 
ATOM   134  C  C   . ARG A 1 18  ? -1.775  -9.460  0.859  1.00 14.51  ? 18  ARG A C   1 
ATOM   135  O  O   . ARG A 1 18  ? -1.048  -8.955  0.013  1.00 13.91  ? 18  ARG A O   1 
ATOM   136  C  CB  . ARG A 1 18  ? -0.641  -8.623  2.952  1.00 14.99  ? 18  ARG A CB  1 
ATOM   137  C  CG  . ARG A 1 18  ? -0.261  -8.943  4.389  1.00 14.76  ? 18  ARG A CG  1 
ATOM   138  C  CD  . ARG A 1 18  ? 0.327   -7.748  5.090  1.00 14.57  ? 18  ARG A CD  1 
ATOM   139  N  NE  . ARG A 1 18  ? 1.502   -7.300  4.366  1.00 14.92  ? 18  ARG A NE  1 
ATOM   140  C  CZ  . ARG A 1 18  ? 2.301   -6.324  4.773  1.00 14.98  ? 18  ARG A CZ  1 
ATOM   141  N  NH1 . ARG A 1 18  ? 3.444   -6.110  4.162  1.00 14.85  ? 18  ARG A NH1 1 
ATOM   142  N  NH2 . ARG A 1 18  ? 2.012   -5.616  5.848  1.00 15.24  ? 18  ARG A NH2 1 
ATOM   143  N  N   . ASN A 1 19  ? -3.086  -9.719  0.719  1.00 14.03  ? 19  ASN A N   1 
ATOM   144  C  CA  . ASN A 1 19  ? -3.881  -9.574  -0.491 1.00 13.95  ? 19  ASN A CA  1 
ATOM   145  C  C   . ASN A 1 19  ? -3.389  -10.495 -1.596 1.00 14.20  ? 19  ASN A C   1 
ATOM   146  O  O   . ASN A 1 19  ? -3.746  -10.284 -2.751 1.00 13.96  ? 19  ASN A O   1 
ATOM   147  C  CB  . ASN A 1 19  ? -3.982  -8.125  -0.943 1.00 13.85  ? 19  ASN A CB  1 
ATOM   148  C  CG  . ASN A 1 19  ? -4.470  -7.268  0.196  1.00 13.49  ? 19  ASN A CG  1 
ATOM   149  O  OD1 . ASN A 1 19  ? -5.529  -7.513  0.779  1.00 12.68  ? 19  ASN A OD1 1 
ATOM   150  N  ND2 . ASN A 1 19  ? -3.650  -6.302  0.556  1.00 13.30  ? 19  ASN A ND2 1 
ATOM   151  N  N   . ILE A 1 20  ? -2.679  -11.561 -1.192 1.00 15.06  ? 20  ILE A N   1 
ATOM   152  C  CA  . ILE A 1 20  ? -2.106  -12.521 -2.113 1.00 15.48  ? 20  ILE A CA  1 
ATOM   153  C  C   . ILE A 1 20  ? -2.594  -13.934 -1.797 1.00 15.09  ? 20  ILE A C   1 
ATOM   154  O  O   . ILE A 1 20  ? -3.230  -14.559 -2.645 1.00 15.57  ? 20  ILE A O   1 
ATOM   155  C  CB  . ILE A 1 20  ? -0.578  -12.388 -2.101 1.00 15.61  ? 20  ILE A CB  1 
ATOM   156  C  CG1 . ILE A 1 20  ? -0.192  -10.933 -2.370 1.00 15.79  ? 20  ILE A CG1 1 
ATOM   157  C  CG2 . ILE A 1 20  ? 0.027   -13.341 -3.116 1.00 15.32  ? 20  ILE A CG2 1 
ATOM   158  C  CD1 . ILE A 1 20  ? 1.292   -10.663 -2.348 1.00 16.48  ? 20  ILE A CD1 1 
ATOM   159  N  N   . TYR A 1 21  ? -2.279  -14.443 -0.602 1.00 14.65  ? 21  TYR A N   1 
ATOM   160  C  CA  . TYR A 1 21  ? -2.869  -15.700 -0.166 1.00 14.61  ? 21  TYR A CA  1 
ATOM   161  C  C   . TYR A 1 21  ? -3.731  -15.489 1.072  1.00 14.99  ? 21  TYR A C   1 
ATOM   162  O  O   . TYR A 1 21  ? -4.497  -16.392 1.445  1.00 14.22  ? 21  TYR A O   1 
ATOM   163  C  CB  . TYR A 1 21  ? -1.823  -16.810 0.003  1.00 14.30  ? 21  TYR A CB  1 
ATOM   164  C  CG  . TYR A 1 21  ? -0.675  -16.603 0.963  1.00 13.76  ? 21  TYR A CG  1 
ATOM   165  C  CD1 . TYR A 1 21  ? -0.856  -16.682 2.333  1.00 13.23  ? 21  TYR A CD1 1 
ATOM   166  C  CD2 . TYR A 1 21  ? 0.623   -16.434 0.494  1.00 13.53  ? 21  TYR A CD2 1 
ATOM   167  C  CE1 . TYR A 1 21  ? 0.213   -16.541 3.208  1.00 13.27  ? 21  TYR A CE1 1 
ATOM   168  C  CE2 . TYR A 1 21  ? 1.700   -16.285 1.359  1.00 13.33  ? 21  TYR A CE2 1 
ATOM   169  C  CZ  . TYR A 1 21  ? 1.497   -16.338 2.729  1.00 13.10  ? 21  TYR A CZ  1 
ATOM   170  O  OH  . TYR A 1 21  ? 2.549   -16.189 3.602  1.00 12.17  ? 21  TYR A OH  1 
ATOM   171  N  N   . ILE A 1 22  ? -3.636  -14.284 1.651  1.00 14.58  ? 22  ILE A N   1 
ATOM   172  C  CA  . ILE A 1 22  ? -4.509  -13.891 2.743  1.00 15.41  ? 22  ILE A CA  1 
ATOM   173  C  C   . ILE A 1 22  ? -5.580  -12.959 2.203  1.00 15.35  ? 22  ILE A C   1 
ATOM   174  O  O   . ILE A 1 22  ? -5.249  -12.029 1.498  1.00 15.89  ? 22  ILE A O   1 
ATOM   175  C  CB  . ILE A 1 22  ? -3.716  -13.188 3.861  1.00 15.78  ? 22  ILE A CB  1 
ATOM   176  C  CG1 . ILE A 1 22  ? -2.505  -14.007 4.317  1.00 15.82  ? 22  ILE A CG1 1 
ATOM   177  C  CG2 . ILE A 1 22  ? -4.642  -12.846 5.018  1.00 15.51  ? 22  ILE A CG2 1 
ATOM   178  C  CD1 . ILE A 1 22  ? -2.863  -15.292 5.045  1.00 15.60  ? 22  ILE A CD1 1 
ATOM   179  N  N   . ARG A 1 23  ? -6.839  -13.160 2.600  1.00 15.71  ? 23  ARG A N   1 
ATOM   180  C  CA  . ARG A 1 23  ? -7.918  -12.262 2.213  1.00 15.65  ? 23  ARG A CA  1 
ATOM   181  C  C   . ARG A 1 23  ? -7.929  -11.102 3.194  1.00 15.57  ? 23  ARG A C   1 
ATOM   182  O  O   . ARG A 1 23  ? -8.806  -11.011 4.049  1.00 14.91  ? 23  ARG A O   1 
ATOM   183  C  CB  . ARG A 1 23  ? -9.261  -12.993 2.198  1.00 16.45  ? 23  ARG A CB  1 
ATOM   184  C  CG  . ARG A 1 23  ? -9.226  -14.306 1.423  1.00 17.33  ? 23  ARG A CG  1 
ATOM   185  C  CD  . ARG A 1 23  ? -10.553 -15.037 1.376  1.00 17.32  ? 23  ARG A CD  1 
ATOM   186  N  NE  . ARG A 1 23  ? -10.644 -15.883 0.201  1.00 17.52  ? 23  ARG A NE  1 
ATOM   187  C  CZ  . ARG A 1 23  ? -11.717 -16.592 -0.128 1.00 18.47  ? 23  ARG A CZ  1 
ATOM   188  N  NH1 . ARG A 1 23  ? -12.786 -16.566 0.641  1.00 18.71  ? 23  ARG A NH1 1 
ATOM   189  N  NH2 . ARG A 1 23  ? -11.717 -17.335 -1.219 1.00 18.55  ? 23  ARG A NH2 1 
ATOM   190  N  N   . SER A 1 24  ? -6.926  -10.239 3.045  1.00 16.20  ? 24  SER A N   1 
ATOM   191  C  CA  . SER A 1 24  ? -6.586  -9.234  4.037  1.00 17.97  ? 24  SER A CA  1 
ATOM   192  C  C   . SER A 1 24  ? -7.646  -8.141  4.092  1.00 18.89  ? 24  SER A C   1 
ATOM   193  O  O   . SER A 1 24  ? -8.133  -7.675  3.072  1.00 21.58  ? 24  SER A O   1 
ATOM   194  C  CB  . SER A 1 24  ? -5.228  -8.609  3.750  1.00 18.63  ? 24  SER A CB  1 
ATOM   195  O  OG  . SER A 1 24  ? -4.184  -9.583  3.789  1.00 20.14  ? 24  SER A OG  1 
ATOM   196  N  N   . PRO A 1 25  ? -8.008  -7.637  5.280  1.00 18.09  ? 25  PRO A N   1 
ATOM   197  C  CA  . PRO A 1 25  ? -8.764  -6.394  5.351  1.00 18.19  ? 25  PRO A CA  1 
ATOM   198  C  C   . PRO A 1 25  ? -7.880  -5.163  5.129  1.00 18.47  ? 25  PRO A C   1 
ATOM   199  O  O   . PRO A 1 25  ? -6.646  -5.233  5.133  1.00 15.94  ? 25  PRO A O   1 
ATOM   200  C  CB  . PRO A 1 25  ? -9.320  -6.460  6.774  1.00 18.52  ? 25  PRO A CB  1 
ATOM   201  C  CG  . PRO A 1 25  ? -8.195  -7.131  7.523  1.00 18.19  ? 25  PRO A CG  1 
ATOM   202  C  CD  . PRO A 1 25  ? -7.714  -8.216  6.590  1.00 17.80  ? 25  PRO A CD  1 
ATOM   203  N  N   . PRO A 1 26  ? -8.516  -3.986  4.938  1.00 20.16  ? 26  PRO A N   1 
ATOM   204  C  CA  . PRO A 1 26  ? -7.792  -2.738  4.700  1.00 20.01  ? 26  PRO A CA  1 
ATOM   205  C  C   . PRO A 1 26  ? -6.950  -2.286  5.887  1.00 18.52  ? 26  PRO A C   1 
ATOM   206  O  O   . PRO A 1 26  ? -5.932  -1.631  5.670  1.00 18.25  ? 26  PRO A O   1 
ATOM   207  C  CB  . PRO A 1 26  ? -8.880  -1.695  4.381  1.00 21.85  ? 26  PRO A CB  1 
ATOM   208  C  CG  . PRO A 1 26  ? -10.192 -2.302  4.909  1.00 22.60  ? 26  PRO A CG  1 
ATOM   209  C  CD  . PRO A 1 26  ? -9.982  -3.805  4.912  1.00 21.95  ? 26  PRO A CD  1 
ATOM   210  N  N   . ASN A 1 27  ? -7.361  -2.669  7.110  1.00 16.97  ? 27  ASN A N   1 
ATOM   211  C  CA  . ASN A 1 27  ? -6.650  -2.313  8.333  1.00 15.64  ? 27  ASN A CA  1 
ATOM   212  C  C   . ASN A 1 27  ? -6.902  -3.339  9.447  1.00 14.59  ? 27  ASN A C   1 
ATOM   213  O  O   . ASN A 1 27  ? -7.554  -4.350  9.244  1.00 12.92  ? 27  ASN A O   1 
ATOM   214  C  CB  . ASN A 1 27  ? -7.064  -0.916  8.794  1.00 15.63  ? 27  ASN A CB  1 
ATOM   215  C  CG  . ASN A 1 27  ? -8.538  -0.831  9.138  1.00 15.31  ? 27  ASN A CG  1 
ATOM   216  O  OD1 . ASN A 1 27  ? -9.076  -1.664  9.871  1.00 13.64  ? 27  ASN A OD1 1 
ATOM   217  N  ND2 . ASN A 1 27  ? -9.212  0.147   8.553  1.00 16.08  ? 27  ASN A ND2 1 
ATOM   218  N  N   . ASN A 1 28  ? -6.403  -3.020  10.647 1.00 15.19  ? 28  ASN A N   1 
ATOM   219  C  CA  . ASN A 1 28  ? -6.312  -3.927  11.783 1.00 15.84  ? 28  ASN A CA  1 
ATOM   220  C  C   . ASN A 1 28  ? -7.465  -3.704  12.780 1.00 16.98  ? 28  ASN A C   1 
ATOM   221  O  O   . ASN A 1 28  ? -7.426  -4.202  13.902 1.00 16.97  ? 28  ASN A O   1 
ATOM   222  C  CB  . ASN A 1 28  ? -4.927  -3.784  12.438 1.00 15.09  ? 28  ASN A CB  1 
ATOM   223  C  CG  . ASN A 1 28  ? -4.595  -2.395  12.959 1.00 15.08  ? 28  ASN A CG  1 
ATOM   224  O  OD1 . ASN A 1 28  ? -5.436  -1.505  13.032 1.00 15.80  ? 28  ASN A OD1 1 
ATOM   225  N  ND2 . ASN A 1 28  ? -3.353  -2.181  13.353 1.00 15.31  ? 28  ASN A ND2 1 
ATOM   226  N  N   . ASN A 1 29  ? -8.499  -2.948  12.383 1.00 17.70  ? 29  ASN A N   1 
ATOM   227  C  CA  . ASN A 1 29  ? -9.682  -2.736  13.207 1.00 18.07  ? 29  ASN A CA  1 
ATOM   228  C  C   . ASN A 1 29  ? -10.369 -4.063  13.495 1.00 17.32  ? 29  ASN A C   1 
ATOM   229  O  O   . ASN A 1 29  ? -10.506 -4.891  12.601 1.00 16.74  ? 29  ASN A O   1 
ATOM   230  C  CB  . ASN A 1 29  ? -10.743 -1.852  12.540 1.00 18.09  ? 29  ASN A CB  1 
ATOM   231  C  CG  . ASN A 1 29  ? -10.256 -0.436  12.316 1.00 19.05  ? 29  ASN A CG  1 
ATOM   232  O  OD1 . ASN A 1 29  ? -9.136  -0.079  12.729 1.00 20.73  ? 29  ASN A OD1 1 
ATOM   233  N  ND2 . ASN A 1 29  ? -11.082 0.352   11.639 1.00 17.22  ? 29  ASN A ND2 1 
ATOM   234  N  N   . PRO A 1 30  ? -10.872 -4.267  14.731 1.00 16.05  ? 30  PRO A N   1 
ATOM   235  C  CA  . PRO A 1 30  ? -11.565 -5.502  15.079 1.00 15.32  ? 30  PRO A CA  1 
ATOM   236  C  C   . PRO A 1 30  ? -12.942 -5.543  14.451 1.00 14.88  ? 30  PRO A C   1 
ATOM   237  O  O   . PRO A 1 30  ? -13.500 -4.482  14.200 1.00 14.57  ? 30  PRO A O   1 
ATOM   238  C  CB  . PRO A 1 30  ? -11.730 -5.387  16.590 1.00 15.96  ? 30  PRO A CB  1 
ATOM   239  C  CG  . PRO A 1 30  ? -11.833 -3.884  16.823 1.00 15.94  ? 30  PRO A CG  1 
ATOM   240  C  CD  . PRO A 1 30  ? -10.846 -3.298  15.838 1.00 15.92  ? 30  PRO A CD  1 
ATOM   241  N  N   . VAL A 1 31  ? -13.451 -6.757  14.214 1.00 14.42  ? 31  VAL A N   1 
ATOM   242  C  CA  . VAL A 1 31  ? -14.860 -6.968  13.958 1.00 14.90  ? 31  VAL A CA  1 
ATOM   243  C  C   . VAL A 1 31  ? -15.544 -7.117  15.312 1.00 13.91  ? 31  VAL A C   1 
ATOM   244  O  O   . VAL A 1 31  ? -14.964 -7.743  16.178 1.00 13.77  ? 31  VAL A O   1 
ATOM   245  C  CB  . VAL A 1 31  ? -15.036 -8.226  13.087 1.00 16.00  ? 31  VAL A CB  1 
ATOM   246  C  CG1 . VAL A 1 31  ? -16.504 -8.588  12.906 1.00 16.51  ? 31  VAL A CG1 1 
ATOM   247  C  CG2 . VAL A 1 31  ? -14.338 -8.086  11.739 1.00 15.57  ? 31  VAL A CG2 1 
ATOM   248  N  N   . LYS A 1 32  ? -16.746 -6.565  15.511 1.00 14.33  ? 32  LYS A N   1 
ATOM   249  C  CA  . LYS A 1 32  ? -17.427 -6.737  16.794 1.00 15.97  ? 32  LYS A CA  1 
ATOM   250  C  C   . LYS A 1 32  ? -18.874 -7.231  16.665 1.00 15.27  ? 32  LYS A C   1 
ATOM   251  O  O   . LYS A 1 32  ? -19.479 -7.684  17.642 1.00 13.76  ? 32  LYS A O   1 
ATOM   252  C  CB  . LYS A 1 32  ? -17.414 -5.436  17.606 1.00 17.86  ? 32  LYS A CB  1 
ATOM   253  C  CG  . LYS A 1 32  ? -16.041 -4.836  17.853 1.00 20.30  ? 32  LYS A CG  1 
ATOM   254  C  CD  . LYS A 1 32  ? -15.893 -3.955  19.097 1.00 22.47  ? 32  LYS A CD  1 
ATOM   255  C  CE  . LYS A 1 32  ? -16.570 -2.601  19.006 1.00 25.09  ? 32  LYS A CE  1 
ATOM   256  N  NZ  . LYS A 1 32  ? -16.128 -1.684  20.091 1.00 26.22  ? 32  LYS A NZ  1 
ATOM   257  N  N   . ASN A 1 33  ? -19.434 -7.142  15.465 1.00 16.73  ? 33  ASN A N   1 
ATOM   258  C  CA  . ASN A 1 33  ? -20.850 -7.388  15.247 1.00 19.10  ? 33  ASN A CA  1 
ATOM   259  C  C   . ASN A 1 33  ? -21.038 -8.871  14.918 1.00 18.96  ? 33  ASN A C   1 
ATOM   260  O  O   . ASN A 1 33  ? -20.706 -9.311  13.828 1.00 19.52  ? 33  ASN A O   1 
ATOM   261  C  CB  . ASN A 1 33  ? -21.364 -6.416  14.179 1.00 20.36  ? 33  ASN A CB  1 
ATOM   262  C  CG  . ASN A 1 33  ? -22.810 -6.606  13.813 1.00 23.05  ? 33  ASN A CG  1 
ATOM   263  O  OD1 . ASN A 1 33  ? -23.494 -7.455  14.378 1.00 20.90  ? 33  ASN A OD1 1 
ATOM   264  N  ND2 . ASN A 1 33  ? -23.279 -5.818  12.861 1.00 30.75  ? 33  ASN A ND2 1 
ATOM   265  N  N   . LEU A 1 34  ? -21.573 -9.637  15.874 1.00 19.19  ? 34  LEU A N   1 
ATOM   266  C  CA  . LEU A 1 34  ? -21.674 -11.086 15.782 1.00 20.41  ? 34  LEU A CA  1 
ATOM   267  C  C   . LEU A 1 34  ? -22.592 -11.588 14.669 1.00 21.35  ? 34  LEU A C   1 
ATOM   268  O  O   . LEU A 1 34  ? -22.504 -12.767 14.353 1.00 24.33  ? 34  LEU A O   1 
ATOM   269  C  CB  . LEU A 1 34  ? -22.193 -11.640 17.110 1.00 20.91  ? 34  LEU A CB  1 
ATOM   270  C  CG  . LEU A 1 34  ? -21.312 -11.403 18.339 1.00 20.92  ? 34  LEU A CG  1 
ATOM   271  C  CD1 . LEU A 1 34  ? -21.940 -12.056 19.558 1.00 20.23  ? 34  LEU A CD1 1 
ATOM   272  C  CD2 . LEU A 1 34  ? -19.890 -11.911 18.129 1.00 21.12  ? 34  LEU A CD2 1 
ATOM   273  N  N   . THR A 1 35  ? -23.475 -10.744 14.116 1.00 21.28  ? 35  THR A N   1 
ATOM   274  C  CA  . THR A 1 35  ? -24.358 -11.138 13.026 1.00 20.66  ? 35  THR A CA  1 
ATOM   275  C  C   . THR A 1 35  ? -23.852 -10.616 11.685 1.00 20.81  ? 35  THR A C   1 
ATOM   276  O  O   . THR A 1 35  ? -24.455 -10.917 10.666 1.00 22.90  ? 35  THR A O   1 
ATOM   277  C  CB  . THR A 1 35  ? -25.791 -10.619 13.215 1.00 20.77  ? 35  THR A CB  1 
ATOM   278  O  OG1 . THR A 1 35  ? -25.797 -9.198  13.069 1.00 23.50  ? 35  THR A OG1 1 
ATOM   279  C  CG2 . THR A 1 35  ? -26.394 -10.965 14.556 1.00 20.63  ? 35  THR A CG2 1 
ATOM   280  N  N   . SER A 1 36  ? -22.760 -9.838  11.669 1.00 21.27  ? 36  SER A N   1 
ATOM   281  C  CA  . SER A 1 36  ? -22.203 -9.310  10.428 1.00 21.18  ? 36  SER A CA  1 
ATOM   282  C  C   . SER A 1 36  ? -21.526 -10.420 9.621  1.00 22.65  ? 36  SER A C   1 
ATOM   283  O  O   . SER A 1 36  ? -20.879 -11.311 10.170 1.00 20.14  ? 36  SER A O   1 
ATOM   284  C  CB  . SER A 1 36  ? -21.240 -8.167  10.697 1.00 20.67  ? 36  SER A CB  1 
ATOM   285  O  OG  . SER A 1 36  ? -20.666 -7.651  9.501  1.00 19.12  ? 36  SER A OG  1 
ATOM   286  N  N   . PRO A 1 37  ? -21.652 -10.391 8.275  1.00 28.00  ? 37  PRO A N   1 
ATOM   287  C  CA  . PRO A 1 37  ? -20.827 -11.218 7.387  1.00 28.54  ? 37  PRO A CA  1 
ATOM   288  C  C   . PRO A 1 37  ? -19.331 -10.972 7.505  1.00 27.85  ? 37  PRO A C   1 
ATOM   289  O  O   . PRO A 1 37  ? -18.540 -11.683 6.887  1.00 31.51  ? 37  PRO A O   1 
ATOM   290  C  CB  . PRO A 1 37  ? -21.250 -10.791 5.973  1.00 28.66  ? 37  PRO A CB  1 
ATOM   291  C  CG  . PRO A 1 37  ? -22.654 -10.272 6.154  1.00 29.38  ? 37  PRO A CG  1 
ATOM   292  C  CD  . PRO A 1 37  ? -22.655 -9.618  7.525  1.00 29.22  ? 37  PRO A CD  1 
ATOM   293  N  N   . ASP A 1 38  ? -18.969 -9.935  8.265  1.00 25.75  ? 38  ASP A N   1 
ATOM   294  C  CA  . ASP A 1 38  ? -17.580 -9.658  8.589  1.00 24.14  ? 38  ASP A CA  1 
ATOM   295  C  C   . ASP A 1 38  ? -17.002 -10.740 9.504  1.00 21.89  ? 38  ASP A C   1 
ATOM   296  O  O   . ASP A 1 38  ? -15.794 -10.952 9.522  1.00 20.44  ? 38  ASP A O   1 
ATOM   297  C  CB  . ASP A 1 38  ? -17.477 -8.258  9.186  1.00 24.84  ? 38  ASP A CB  1 
ATOM   298  C  CG  . ASP A 1 38  ? -17.733 -7.155  8.171  1.00 26.04  ? 38  ASP A CG  1 
ATOM   299  O  OD1 . ASP A 1 38  ? -17.630 -7.453  6.954  1.00 27.88  ? 38  ASP A OD1 1 
ATOM   300  O  OD2 . ASP A 1 38  ? -18.020 -6.002  8.599  1.00 24.96  ? 38  ASP A OD2 1 
ATOM   301  N  N   . MET A 1 39  ? -17.882 -11.453 10.225 1.00 20.79  ? 39  MET A N   1 
ATOM   302  C  CA  . MET A 1 39  ? -17.492 -12.557 11.091 1.00 18.57  ? 39  MET A CA  1 
ATOM   303  C  C   . MET A 1 39  ? -16.885 -13.712 10.290 1.00 17.84  ? 39  MET A C   1 
ATOM   304  O  O   . MET A 1 39  ? -16.118 -14.494 10.843 1.00 18.92  ? 39  MET A O   1 
ATOM   305  C  CB  . MET A 1 39  ? -18.685 -13.076 11.908 1.00 16.90  ? 39  MET A CB  1 
ATOM   306  C  CG  . MET A 1 39  ? -19.132 -12.131 13.016 1.00 16.26  ? 39  MET A CG  1 
ATOM   307  S  SD  . MET A 1 39  ? -17.911 -11.854 14.340 1.00 14.36  ? 39  MET A SD  1 
ATOM   308  C  CE  . MET A 1 39  ? -17.767 -13.529 14.949 1.00 15.54  ? 39  MET A CE  1 
ATOM   309  N  N   . THR A 1 40  ? -17.197 -13.836 9.000  1.00 16.75  ? 40  THR A N   1 
ATOM   310  C  CA  . THR A 1 40  ? -16.698 -14.980 8.256  1.00 17.39  ? 40  THR A CA  1 
ATOM   311  C  C   . THR A 1 40  ? -15.185 -14.854 8.015  1.00 18.07  ? 40  THR A C   1 
ATOM   312  O  O   . THR A 1 40  ? -14.414 -15.643 8.565  1.00 17.22  ? 40  THR A O   1 
ATOM   313  C  CB  . THR A 1 40  ? -17.504 -15.182 6.968  1.00 16.82  ? 40  THR A CB  1 
ATOM   314  O  OG1 . THR A 1 40  ? -18.868 -15.341 7.360  1.00 15.97  ? 40  THR A OG1 1 
ATOM   315  C  CG2 . THR A 1 40  ? -17.051 -16.376 6.155  1.00 15.65  ? 40  THR A CG2 1 
ATOM   316  N  N   . CYS A 1 41  ? -14.777 -13.893 7.164  1.00 18.03  ? 41  CYS A N   1 
ATOM   317  C  CA  . CYS A 1 41  ? -13.380 -13.705 6.778  1.00 18.39  ? 41  CYS A CA  1 
ATOM   318  C  C   . CYS A 1 41  ? -13.033 -12.210 6.804  1.00 19.02  ? 41  CYS A C   1 
ATOM   319  O  O   . CYS A 1 41  ? -12.153 -11.738 6.077  1.00 18.32  ? 41  CYS A O   1 
ATOM   320  C  CB  . CYS A 1 41  ? -13.069 -14.322 5.410  1.00 17.99  ? 41  CYS A CB  1 
ATOM   321  S  SG  . CYS A 1 41  ? -12.925 -16.129 5.421  1.00 18.80  ? 41  CYS A SG  1 
ATOM   322  N  N   . ASN A 1 42  ? -13.730 -11.477 7.681  1.00 19.54  ? 42  ASN A N   1 
ATOM   323  C  CA  . ASN A 1 42  ? -13.456 -10.072 7.923  1.00 19.35  ? 42  ASN A CA  1 
ATOM   324  C  C   . ASN A 1 42  ? -14.052 -9.268  6.763  1.00 19.90  ? 42  ASN A C   1 
ATOM   325  O  O   . ASN A 1 42  ? -14.914 -9.726  6.029  1.00 21.50  ? 42  ASN A O   1 
ATOM   326  C  CB  . ASN A 1 42  ? -11.960 -9.885  8.207  1.00 18.92  ? 42  ASN A CB  1 
ATOM   327  C  CG  . ASN A 1 42  ? -11.610 -8.716  9.114  1.00 18.26  ? 42  ASN A CG  1 
ATOM   328  O  OD1 . ASN A 1 42  ? -12.217 -7.654  9.009  1.00 19.73  ? 42  ASN A OD1 1 
ATOM   329  N  ND2 . ASN A 1 42  ? -10.613 -8.881  9.973  1.00 16.07  ? 42  ASN A ND2 1 
ATOM   330  N  N   . VAL A 1 43  ? -13.560 -8.056  6.584  1.00 21.38  ? 43  VAL A N   1 
ATOM   331  C  CA  . VAL A 1 43  ? -14.304 -6.980  5.959  1.00 22.48  ? 43  VAL A CA  1 
ATOM   332  C  C   . VAL A 1 43  ? -14.219 -7.068  4.432  1.00 20.79  ? 43  VAL A C   1 
ATOM   333  O  O   . VAL A 1 43  ? -15.150 -6.619  3.772  1.00 22.03  ? 43  VAL A O   1 
ATOM   334  C  CB  . VAL A 1 43  ? -13.786 -5.639  6.543  1.00 24.07  ? 43  VAL A CB  1 
ATOM   335  C  CG1 . VAL A 1 43  ? -13.795 -4.472  5.561  1.00 25.92  ? 43  VAL A CG1 1 
ATOM   336  C  CG2 . VAL A 1 43  ? -14.537 -5.273  7.813  1.00 23.22  ? 43  VAL A CG2 1 
ATOM   337  N  N   . ASP A 1 44  ? -13.111 -7.609  3.886  1.00 18.12  ? 44  ASP A N   1 
ATOM   338  C  CA  . ASP A 1 44  ? -12.902 -7.709  2.445  1.00 16.62  ? 44  ASP A CA  1 
ATOM   339  C  C   . ASP A 1 44  ? -12.721 -9.176  2.054  1.00 15.65  ? 44  ASP A C   1 
ATOM   340  O  O   . ASP A 1 44  ? -11.623 -9.614  1.712  1.00 14.52  ? 44  ASP A O   1 
ATOM   341  C  CB  . ASP A 1 44  ? -11.732 -6.834  1.973  1.00 15.93  ? 44  ASP A CB  1 
ATOM   342  C  CG  . ASP A 1 44  ? -11.639 -6.636  0.461  1.00 15.90  ? 44  ASP A CG  1 
ATOM   343  O  OD1 . ASP A 1 44  ? -12.552 -7.108  -0.251 1.00 15.55  ? 44  ASP A OD1 1 
ATOM   344  O  OD2 . ASP A 1 44  ? -10.651 -5.991  -0.011 1.00 15.67  ? 44  ASP A OD2 1 
ATOM   345  N  N   . ASN A 1 45  ? -13.828 -9.922  2.103  1.00 16.47  ? 45  ASN A N   1 
ATOM   346  C  CA  . ASN A 1 45  ? -13.835 -11.335 1.769  1.00 18.21  ? 45  ASN A CA  1 
ATOM   347  C  C   . ASN A 1 45  ? -14.038 -11.539 0.264  1.00 19.00  ? 45  ASN A C   1 
ATOM   348  O  O   . ASN A 1 45  ? -15.148 -11.433 -0.250 1.00 18.37  ? 45  ASN A O   1 
ATOM   349  C  CB  . ASN A 1 45  ? -14.919 -12.093 2.539  1.00 19.23  ? 45  ASN A CB  1 
ATOM   350  C  CG  . ASN A 1 45  ? -14.789 -13.598 2.385  1.00 20.00  ? 45  ASN A CG  1 
ATOM   351  O  OD1 . ASN A 1 45  ? -13.703 -14.115 2.154  1.00 21.01  ? 45  ASN A OD1 1 
ATOM   352  N  ND2 . ASN A 1 45  ? -15.870 -14.328 2.569  1.00 20.09  ? 45  ASN A ND2 1 
ATOM   353  N  N   . ARG A 1 46  ? -12.947 -11.857 -0.436 1.00 20.22  ? 46  ARG A N   1 
ATOM   354  C  CA  . ARG A 1 46  ? -12.974 -12.154 -1.859 1.00 21.42  ? 46  ARG A CA  1 
ATOM   355  C  C   . ARG A 1 46  ? -11.836 -13.099 -2.117 1.00 22.10  ? 46  ARG A C   1 
ATOM   356  O  O   . ARG A 1 46  ? -10.924 -13.160 -1.304 1.00 23.56  ? 46  ARG A O   1 
ATOM   357  C  CB  . ARG A 1 46  ? -12.733 -10.952 -2.786 1.00 21.09  ? 46  ARG A CB  1 
ATOM   358  C  CG  . ARG A 1 46  ? -11.896 -9.822  -2.203 1.00 21.21  ? 46  ARG A CG  1 
ATOM   359  C  CD  . ARG A 1 46  ? -10.375 -9.872  -2.214 1.00 20.77  ? 46  ARG A CD  1 
ATOM   360  N  NE  . ARG A 1 46  ? -9.927  -9.363  -0.914 1.00 20.64  ? 46  ARG A NE  1 
ATOM   361  C  CZ  . ARG A 1 46  ? -8.747  -8.825  -0.620 1.00 20.27  ? 46  ARG A CZ  1 
ATOM   362  N  NH1 . ARG A 1 46  ? -7.855  -8.524  -1.546 1.00 20.19  ? 46  ARG A NH1 1 
ATOM   363  N  NH2 . ARG A 1 46  ? -8.469  -8.592  0.647  1.00 21.07  ? 46  ARG A NH2 1 
ATOM   364  N  N   . VAL A 1 47  ? -11.879 -13.751 -3.275 1.00 22.80  ? 47  VAL A N   1 
ATOM   365  C  CA  . VAL A 1 47  ? -10.800 -14.641 -3.667 1.00 22.27  ? 47  VAL A CA  1 
ATOM   366  C  C   . VAL A 1 47  ? -9.553  -13.807 -3.936 1.00 21.94  ? 47  VAL A C   1 
ATOM   367  O  O   . VAL A 1 47  ? -9.630  -12.777 -4.591 1.00 20.67  ? 47  VAL A O   1 
ATOM   368  C  CB  . VAL A 1 47  ? -11.199 -15.490 -4.884 1.00 22.71  ? 47  VAL A CB  1 
ATOM   369  C  CG1 . VAL A 1 47  ? -10.032 -16.238 -5.488 1.00 22.75  ? 47  VAL A CG1 1 
ATOM   370  C  CG2 . VAL A 1 47  ? -12.306 -16.461 -4.516 1.00 23.55  ? 47  VAL A CG2 1 
ATOM   371  N  N   . VAL A 1 48  ? -8.416  -14.260 -3.384 1.00 22.06  ? 48  VAL A N   1 
ATOM   372  C  CA  . VAL A 1 48  ? -7.118  -13.690 -3.707 1.00 21.08  ? 48  VAL A CA  1 
ATOM   373  C  C   . VAL A 1 48  ? -6.380  -14.623 -4.681 1.00 19.63  ? 48  VAL A C   1 
ATOM   374  O  O   . VAL A 1 48  ? -6.742  -15.779 -4.903 1.00 17.16  ? 48  VAL A O   1 
ATOM   375  C  CB  . VAL A 1 48  ? -6.335  -13.287 -2.432 1.00 21.04  ? 48  VAL A CB  1 
ATOM   376  C  CG1 . VAL A 1 48  ? -6.994  -12.070 -1.796 1.00 20.87  ? 48  VAL A CG1 1 
ATOM   377  C  CG2 . VAL A 1 48  ? -6.170  -14.395 -1.398 1.00 20.49  ? 48  VAL A CG2 1 
ATOM   378  N  N   . PRO A 1 49  ? -5.372  -14.112 -5.410 1.00 20.22  ? 49  PRO A N   1 
ATOM   379  C  CA  . PRO A 1 49  ? -4.789  -14.875 -6.511 1.00 20.99  ? 49  PRO A CA  1 
ATOM   380  C  C   . PRO A 1 49  ? -3.973  -16.132 -6.194 1.00 23.61  ? 49  PRO A C   1 
ATOM   381  O  O   . PRO A 1 49  ? -3.725  -16.896 -7.113 1.00 28.23  ? 49  PRO A O   1 
ATOM   382  C  CB  . PRO A 1 49  ? -3.856  -13.859 -7.178 1.00 20.53  ? 49  PRO A CB  1 
ATOM   383  C  CG  . PRO A 1 49  ? -3.536  -12.852 -6.095 1.00 20.49  ? 49  PRO A CG  1 
ATOM   384  C  CD  . PRO A 1 49  ? -4.791  -12.773 -5.257 1.00 19.66  ? 49  PRO A CD  1 
ATOM   385  N  N   . LYS A 1 50  ? -3.528  -16.364 -4.949 1.00 24.49  ? 50  LYS A N   1 
ATOM   386  C  CA  . LYS A 1 50  ? -2.706  -17.534 -4.666 1.00 26.18  ? 50  LYS A CA  1 
ATOM   387  C  C   . LYS A 1 50  ? -3.272  -18.348 -3.516 1.00 24.30  ? 50  LYS A C   1 
ATOM   388  O  O   . LYS A 1 50  ? -4.000  -17.842 -2.671 1.00 23.62  ? 50  LYS A O   1 
ATOM   389  C  CB  . LYS A 1 50  ? -1.288  -17.178 -4.210 1.00 31.96  ? 50  LYS A CB  1 
ATOM   390  C  CG  . LYS A 1 50  ? -0.444  -16.393 -5.201 1.00 39.74  ? 50  LYS A CG  1 
ATOM   391  C  CD  . LYS A 1 50  ? 0.060   -17.194 -6.394 1.00 47.13  ? 50  LYS A CD  1 
ATOM   392  C  CE  . LYS A 1 50  ? 0.209   -16.345 -7.649 1.00 50.66  ? 50  LYS A CE  1 
ATOM   393  N  NZ  . LYS A 1 50  ? 0.420   -17.171 -8.865 1.00 50.11  ? 50  LYS A NZ  1 
ATOM   394  N  N   . SER A 1 51  ? -2.836  -19.601 -3.471 1.00 23.33  ? 51  SER A N   1 
ATOM   395  C  CA  . SER A 1 51  ? -3.204  -20.532 -2.423 1.00 24.31  ? 51  SER A CA  1 
ATOM   396  C  C   . SER A 1 51  ? -1.940  -21.297 -2.002 1.00 22.53  ? 51  SER A C   1 
ATOM   397  O  O   . SER A 1 51  ? -1.248  -21.822 -2.870 1.00 24.61  ? 51  SER A O   1 
ATOM   398  C  CB  . SER A 1 51  ? -4.286  -21.457 -2.953 1.00 25.96  ? 51  SER A CB  1 
ATOM   399  O  OG  . SER A 1 51  ? -4.982  -22.137 -1.909 1.00 29.50  ? 51  SER A OG  1 
ATOM   400  N  N   . VAL A 1 52  ? -1.631  -21.368 -0.691 1.00 19.38  ? 52  VAL A N   1 
ATOM   401  C  CA  . VAL A 1 52  ? -0.396  -21.985 -0.219 1.00 17.81  ? 52  VAL A CA  1 
ATOM   402  C  C   . VAL A 1 52  ? -0.498  -23.513 -0.280 1.00 17.36  ? 52  VAL A C   1 
ATOM   403  O  O   . VAL A 1 52  ? -1.387  -24.109 0.318  1.00 16.10  ? 52  VAL A O   1 
ATOM   404  C  CB  . VAL A 1 52  ? 0.010   -21.515 1.195  1.00 17.13  ? 52  VAL A CB  1 
ATOM   405  C  CG1 . VAL A 1 52  ? 1.249   -22.250 1.734  1.00 16.34  ? 52  VAL A CG1 1 
ATOM   406  C  CG2 . VAL A 1 52  ? 0.232   -20.013 1.226  1.00 17.29  ? 52  VAL A CG2 1 
ATOM   407  N  N   . PRO A 1 53  ? 0.423   -24.185 -1.014 1.00 17.45  ? 53  PRO A N   1 
ATOM   408  C  CA  . PRO A 1 53  ? 0.493   -25.647 -1.038 1.00 17.12  ? 53  PRO A CA  1 
ATOM   409  C  C   . PRO A 1 53  ? 1.037   -26.286 0.236  1.00 16.59  ? 53  PRO A C   1 
ATOM   410  O  O   . PRO A 1 53  ? 2.124   -25.955 0.682  1.00 15.91  ? 53  PRO A O   1 
ATOM   411  C  CB  . PRO A 1 53  ? 1.474   -25.942 -2.182 1.00 17.05  ? 53  PRO A CB  1 
ATOM   412  C  CG  . PRO A 1 53  ? 2.344   -24.715 -2.253 1.00 17.34  ? 53  PRO A CG  1 
ATOM   413  C  CD  . PRO A 1 53  ? 1.419   -23.567 -1.912 1.00 17.34  ? 53  PRO A CD  1 
ATOM   414  N  N   . VAL A 1 54  ? 0.265   -27.217 0.803  1.00 17.29  ? 54  VAL A N   1 
ATOM   415  C  CA  . VAL A 1 54  ? 0.693   -27.986 1.958  1.00 17.92  ? 54  VAL A CA  1 
ATOM   416  C  C   . VAL A 1 54  ? 0.297   -29.443 1.737  1.00 18.78  ? 54  VAL A C   1 
ATOM   417  O  O   . VAL A 1 54  ? -0.476  -29.745 0.822  1.00 19.78  ? 54  VAL A O   1 
ATOM   418  C  CB  . VAL A 1 54  ? 0.084   -27.445 3.261  1.00 16.96  ? 54  VAL A CB  1 
ATOM   419  C  CG1 . VAL A 1 54  ? 0.405   -25.977 3.432  1.00 17.19  ? 54  VAL A CG1 1 
ATOM   420  C  CG2 . VAL A 1 54  ? -1.416  -27.685 3.313  1.00 16.91  ? 54  VAL A CG2 1 
ATOM   421  N  N   . ASN A 1 55  ? 0.843   -30.326 2.587  1.00 18.02  ? 55  ASN A N   1 
ATOM   422  C  CA  . ASN A 1 55  ? 0.422   -31.715 2.635  1.00 17.73  ? 55  ASN A CA  1 
ATOM   423  C  C   . ASN A 1 55  ? -0.002  -32.071 4.053  1.00 17.11  ? 55  ASN A C   1 
ATOM   424  O  O   . ASN A 1 55  ? 0.497   -31.464 5.004  1.00 17.13  ? 55  ASN A O   1 
ATOM   425  C  CB  . ASN A 1 55  ? 1.527   -32.644 2.152  1.00 18.14  ? 55  ASN A CB  1 
ATOM   426  C  CG  . ASN A 1 55  ? 2.012   -32.244 0.778  1.00 18.55  ? 55  ASN A CG  1 
ATOM   427  O  OD1 . ASN A 1 55  ? 1.236   -32.245 -0.180 1.00 17.56  ? 55  ASN A OD1 1 
ATOM   428  N  ND2 . ASN A 1 55  ? 3.270   -31.834 0.695  1.00 18.69  ? 55  ASN A ND2 1 
ATOM   429  N  N   . ALA A 1 56  ? -0.929  -33.043 4.162  1.00 15.84  ? 56  ALA A N   1 
ATOM   430  C  CA  . ALA A 1 56  ? -1.336  -33.580 5.447  1.00 15.90  ? 56  ALA A CA  1 
ATOM   431  C  C   . ALA A 1 56  ? -0.103  -33.847 6.304  1.00 16.62  ? 56  ALA A C   1 
ATOM   432  O  O   . ALA A 1 56  ? 0.894   -34.365 5.808  1.00 16.19  ? 56  ALA A O   1 
ATOM   433  C  CB  . ALA A 1 56  ? -2.150  -34.822 5.271  1.00 15.75  ? 56  ALA A CB  1 
ATOM   434  N  N   . GLY A 1 57  ? -0.166  -33.425 7.578  1.00 18.26  ? 57  GLY A N   1 
ATOM   435  C  CA  . GLY A 1 57  ? 0.930   -33.606 8.522  1.00 18.84  ? 57  GLY A CA  1 
ATOM   436  C  C   . GLY A 1 57  ? 1.918   -32.433 8.594  1.00 18.31  ? 57  GLY A C   1 
ATOM   437  O  O   . GLY A 1 57  ? 2.778   -32.419 9.472  1.00 20.10  ? 57  GLY A O   1 
ATOM   438  N  N   . ASP A 1 58  ? 1.812   -31.457 7.687  1.00 16.53  ? 58  ASP A N   1 
ATOM   439  C  CA  . ASP A 1 58  ? 2.675   -30.293 7.726  1.00 15.78  ? 58  ASP A CA  1 
ATOM   440  C  C   . ASP A 1 58  ? 2.294   -29.378 8.893  1.00 16.34  ? 58  ASP A C   1 
ATOM   441  O  O   . ASP A 1 58  ? 1.177   -29.417 9.386  1.00 17.43  ? 58  ASP A O   1 
ATOM   442  C  CB  . ASP A 1 58  ? 2.573   -29.543 6.403  1.00 15.51  ? 58  ASP A CB  1 
ATOM   443  C  CG  . ASP A 1 58  ? 3.313   -30.190 5.251  1.00 14.99  ? 58  ASP A CG  1 
ATOM   444  O  OD1 . ASP A 1 58  ? 4.019   -31.200 5.456  1.00 14.69  ? 58  ASP A OD1 1 
ATOM   445  O  OD2 . ASP A 1 58  ? 3.168   -29.671 4.164  1.00 15.11  ? 58  ASP A OD2 1 
ATOM   446  N  N   . THR A 1 59  ? 3.240   -28.547 9.337  1.00 16.62  ? 59  THR A N   1 
ATOM   447  C  CA  . THR A 1 59  ? 2.957   -27.487 10.292 1.00 16.88  ? 59  THR A CA  1 
ATOM   448  C  C   . THR A 1 59  ? 2.723   -26.146 9.572  1.00 16.94  ? 59  THR A C   1 
ATOM   449  O  O   . THR A 1 59  ? 3.614   -25.579 8.937  1.00 16.13  ? 59  THR A O   1 
ATOM   450  C  CB  . THR A 1 59  ? 4.077   -27.384 11.327 1.00 16.64  ? 59  THR A CB  1 
ATOM   451  O  OG1 . THR A 1 59  ? 4.224   -28.622 12.020 1.00 16.06  ? 59  THR A OG1 1 
ATOM   452  C  CG2 . THR A 1 59  ? 3.780   -26.312 12.346 1.00 17.36  ? 59  THR A CG2 1 
ATOM   453  N  N   . LEU A 1 60  ? 1.488   -25.640 9.677  1.00 16.77  ? 60  LEU A N   1 
ATOM   454  C  CA  . LEU A 1 60  ? 1.123   -24.360 9.104  1.00 15.62  ? 60  LEU A CA  1 
ATOM   455  C  C   . LEU A 1 60  ? 1.143   -23.310 10.203 1.00 14.85  ? 60  LEU A C   1 
ATOM   456  O  O   . LEU A 1 60  ? 0.389   -23.429 11.159 1.00 14.64  ? 60  LEU A O   1 
ATOM   457  C  CB  . LEU A 1 60  ? -0.272  -24.481 8.484  1.00 15.62  ? 60  LEU A CB  1 
ATOM   458  C  CG  . LEU A 1 60  ? -0.795  -23.210 7.811  1.00 15.61  ? 60  LEU A CG  1 
ATOM   459  C  CD1 . LEU A 1 60  ? 0.084   -22.813 6.641  1.00 15.81  ? 60  LEU A CD1 1 
ATOM   460  C  CD2 . LEU A 1 60  ? -2.226  -23.389 7.349  1.00 15.53  ? 60  LEU A CD2 1 
ATOM   461  N  N   . THR A 1 61  ? 1.984   -22.286 10.043 1.00 15.21  ? 61  THR A N   1 
ATOM   462  C  CA  . THR A 1 61  ? 2.142   -21.251 11.057 1.00 16.14  ? 61  THR A CA  1 
ATOM   463  C  C   . THR A 1 61  ? 1.617   -19.890 10.580 1.00 16.77  ? 61  THR A C   1 
ATOM   464  O  O   . THR A 1 61  ? 2.009   -19.380 9.526  1.00 15.12  ? 61  THR A O   1 
ATOM   465  C  CB  . THR A 1 61  ? 3.611   -21.123 11.471 1.00 15.48  ? 61  THR A CB  1 
ATOM   466  O  OG1 . THR A 1 61  ? 4.026   -22.445 11.785 1.00 14.77  ? 61  THR A OG1 1 
ATOM   467  C  CG2 . THR A 1 61  ? 3.804   -20.182 12.638 1.00 15.73  ? 61  THR A CG2 1 
ATOM   468  N  N   . PHE A 1 62  ? 0.747   -19.287 11.402 1.00 17.91  ? 62  PHE A N   1 
ATOM   469  C  CA  A PHE A 1 62  ? 0.305   -17.922 11.170 0.50 18.17  ? 62  PHE A CA  1 
ATOM   470  C  CA  B PHE A 1 62  ? 0.304   -17.922 11.171 0.50 18.17  ? 62  PHE A CA  1 
ATOM   471  C  C   . PHE A 1 62  ? 1.249   -16.958 11.879 1.00 17.57  ? 62  PHE A C   1 
ATOM   472  O  O   . PHE A 1 62  ? 1.628   -17.201 13.021 1.00 16.45  ? 62  PHE A O   1 
ATOM   473  C  CB  A PHE A 1 62  ? -1.119  -17.699 11.678 0.50 18.62  ? 62  PHE A CB  1 
ATOM   474  C  CB  B PHE A 1 62  ? -1.116  -17.700 11.686 0.50 18.62  ? 62  PHE A CB  1 
ATOM   475  C  CG  A PHE A 1 62  ? -2.179  -18.510 10.982 0.50 19.30  ? 62  PHE A CG  1 
ATOM   476  C  CG  B PHE A 1 62  ? -2.170  -18.559 11.039 0.50 19.30  ? 62  PHE A CG  1 
ATOM   477  C  CD1 A PHE A 1 62  ? -2.397  -19.827 11.339 0.50 19.78  ? 62  PHE A CD1 1 
ATOM   478  C  CD1 B PHE A 1 62  ? -2.363  -19.861 11.459 0.50 19.81  ? 62  PHE A CD1 1 
ATOM   479  C  CD2 A PHE A 1 62  ? -2.966  -17.955 9.980  0.50 20.35  ? 62  PHE A CD2 1 
ATOM   480  C  CD2 B PHE A 1 62  ? -2.974  -18.062 10.022 0.50 20.39  ? 62  PHE A CD2 1 
ATOM   481  C  CE1 A PHE A 1 62  ? -3.386  -20.572 10.717 0.50 20.57  ? 62  PHE A CE1 1 
ATOM   482  C  CE1 B PHE A 1 62  ? -3.346  -20.649 10.884 0.50 20.58  ? 62  PHE A CE1 1 
ATOM   483  C  CE2 A PHE A 1 62  ? -3.957  -18.700 9.358  0.50 20.92  ? 62  PHE A CE2 1 
ATOM   484  C  CE2 B PHE A 1 62  ? -3.957  -18.851 9.445  0.50 20.99  ? 62  PHE A CE2 1 
ATOM   485  C  CZ  A PHE A 1 62  ? -4.156  -20.013 9.723  0.50 20.92  ? 62  PHE A CZ  1 
ATOM   486  C  CZ  B PHE A 1 62  ? -4.133  -20.148 9.872  0.50 20.94  ? 62  PHE A CZ  1 
ATOM   487  N  N   . GLU A 1 63  ? 1.602   -15.876 11.168 1.00 17.47  ? 63  GLU A N   1 
ATOM   488  C  CA  . GLU A 1 63  ? 2.427   -14.789 11.678 1.00 16.73  ? 63  GLU A CA  1 
ATOM   489  C  C   . GLU A 1 63  ? 1.631   -13.474 11.665 1.00 16.85  ? 63  GLU A C   1 
ATOM   490  O  O   . GLU A 1 63  ? 1.358   -12.898 10.606 1.00 15.86  ? 63  GLU A O   1 
ATOM   491  C  CB  . GLU A 1 63  ? 3.699   -14.636 10.844 1.00 16.30  ? 63  GLU A CB  1 
ATOM   492  C  CG  . GLU A 1 63  ? 4.762   -13.844 11.582 1.00 16.43  ? 63  GLU A CG  1 
ATOM   493  C  CD  . GLU A 1 63  ? 5.890   -13.282 10.734 1.00 15.66  ? 63  GLU A CD  1 
ATOM   494  O  OE1 . GLU A 1 63  ? 6.423   -14.016 9.882  1.00 13.82  ? 63  GLU A OE1 1 
ATOM   495  O  OE2 . GLU A 1 63  ? 6.269   -12.125 10.988 1.00 15.72  ? 63  GLU A OE2 1 
ATOM   496  N  N   . TRP A 1 64  ? 1.295   -13.002 12.876 1.00 17.58  ? 64  TRP A N   1 
ATOM   497  C  CA  . TRP A 1 64  ? 0.573   -11.758 13.105 1.00 17.44  ? 64  TRP A CA  1 
ATOM   498  C  C   . TRP A 1 64  ? 1.559   -10.624 13.410 1.00 17.71  ? 64  TRP A C   1 
ATOM   499  O  O   . TRP A 1 64  ? 2.688   -10.876 13.855 1.00 17.55  ? 64  TRP A O   1 
ATOM   500  C  CB  . TRP A 1 64  ? -0.430  -11.918 14.256 1.00 17.06  ? 64  TRP A CB  1 
ATOM   501  C  CG  . TRP A 1 64  ? -1.532  -12.918 14.069 1.00 16.97  ? 64  TRP A CG  1 
ATOM   502  C  CD1 . TRP A 1 64  ? -1.465  -14.270 14.247 1.00 16.76  ? 64  TRP A CD1 1 
ATOM   503  C  CD2 . TRP A 1 64  ? -2.898  -12.632 13.725 1.00 16.77  ? 64  TRP A CD2 1 
ATOM   504  N  NE1 . TRP A 1 64  ? -2.684  -14.835 14.007 1.00 16.51  ? 64  TRP A NE1 1 
ATOM   505  C  CE2 . TRP A 1 64  ? -3.585  -13.857 13.698 1.00 16.40  ? 64  TRP A CE2 1 
ATOM   506  C  CE3 . TRP A 1 64  ? -3.612  -11.457 13.469 1.00 17.36  ? 64  TRP A CE3 1 
ATOM   507  C  CZ2 . TRP A 1 64  ? -4.942  -13.941 13.424 1.00 16.38  ? 64  TRP A CZ2 1 
ATOM   508  C  CZ3 . TRP A 1 64  ? -4.947  -11.539 13.158 1.00 16.92  ? 64  TRP A CZ3 1 
ATOM   509  C  CH2 . TRP A 1 64  ? -5.601  -12.766 13.152 1.00 16.89  ? 64  TRP A CH2 1 
ATOM   510  N  N   . TYR A 1 65  ? 1.088   -9.387  13.161 1.00 17.64  ? 65  TYR A N   1 
ATOM   511  C  CA  . TYR A 1 65  ? 1.811   -8.145  13.418 1.00 17.23  ? 65  TYR A CA  1 
ATOM   512  C  C   . TYR A 1 65  ? 0.810   -7.025  13.738 1.00 17.53  ? 65  TYR A C   1 
ATOM   513  O  O   . TYR A 1 65  ? -0.388  -7.164  13.457 1.00 16.47  ? 65  TYR A O   1 
ATOM   514  C  CB  . TYR A 1 65  ? 2.680   -7.777  12.204 1.00 17.22  ? 65  TYR A CB  1 
ATOM   515  C  CG  . TYR A 1 65  ? 1.931   -7.235  11.003 1.00 16.75  ? 65  TYR A CG  1 
ATOM   516  C  CD1 . TYR A 1 65  ? 1.132   -8.067  10.233 1.00 16.26  ? 65  TYR A CD1 1 
ATOM   517  C  CD2 . TYR A 1 65  ? 1.970   -5.882  10.660 1.00 15.87  ? 65  TYR A CD2 1 
ATOM   518  C  CE1 . TYR A 1 65  ? 0.400   -7.575  9.159  1.00 16.20  ? 65  TYR A CE1 1 
ATOM   519  C  CE2 . TYR A 1 65  ? 1.244   -5.374  9.588  1.00 15.26  ? 65  TYR A CE2 1 
ATOM   520  C  CZ  . TYR A 1 65  ? 0.459   -6.229  8.831  1.00 15.58  ? 65  TYR A CZ  1 
ATOM   521  O  OH  . TYR A 1 65  ? -0.275  -5.815  7.745  1.00 14.25  ? 65  TYR A OH  1 
ATOM   522  N  N   . HIS A 1 66  ? 1.318   -5.904  14.295 1.00 18.61  ? 66  HIS A N   1 
ATOM   523  C  CA  . HIS A 1 66  ? 0.506   -4.751  14.675 1.00 18.80  ? 66  HIS A CA  1 
ATOM   524  C  C   . HIS A 1 66  ? 0.557   -3.696  13.567 1.00 18.09  ? 66  HIS A C   1 
ATOM   525  O  O   . HIS A 1 66  ? -0.449  -3.419  12.920 1.00 15.75  ? 66  HIS A O   1 
ATOM   526  C  CB  . HIS A 1 66  ? 0.941   -4.222  16.049 1.00 20.52  ? 66  HIS A CB  1 
ATOM   527  C  CG  . HIS A 1 66  ? 0.265   -2.960  16.515 1.00 22.58  ? 66  HIS A CG  1 
ATOM   528  N  ND1 . HIS A 1 66  ? 0.824   -2.155  17.486 1.00 22.70  ? 66  HIS A ND1 1 
ATOM   529  C  CD2 . HIS A 1 66  ? -0.885  -2.355  16.159 1.00 22.80  ? 66  HIS A CD2 1 
ATOM   530  C  CE1 . HIS A 1 66  ? 0.049   -1.102  17.679 1.00 23.33  ? 66  HIS A CE1 1 
ATOM   531  N  NE2 . HIS A 1 66  ? -1.003  -1.210  16.893 1.00 23.01  ? 66  HIS A NE2 1 
ATOM   532  N  N   . ASN A 1 67  ? 1.740   -3.111  13.352 1.00 19.47  ? 67  ASN A N   1 
ATOM   533  C  CA  . ASN A 1 67  ? 1.915   -2.059  12.350 1.00 20.30  ? 67  ASN A CA  1 
ATOM   534  C  C   . ASN A 1 67  ? 2.990   -2.441  11.345 1.00 19.57  ? 67  ASN A C   1 
ATOM   535  O  O   . ASN A 1 67  ? 2.849   -2.135  10.161 1.00 19.90  ? 67  ASN A O   1 
ATOM   536  C  CB  . ASN A 1 67  ? 2.321   -0.704  12.938 1.00 21.38  ? 67  ASN A CB  1 
ATOM   537  C  CG  . ASN A 1 67  ? 1.303   -0.147  13.910 1.00 22.53  ? 67  ASN A CG  1 
ATOM   538  O  OD1 . ASN A 1 67  ? 1.584   0.026   15.092 1.00 23.69  ? 67  ASN A OD1 1 
ATOM   539  N  ND2 . ASN A 1 67  ? 0.107   0.125   13.420 1.00 23.50  ? 67  ASN A ND2 1 
ATOM   540  N  N   . THR A 1 68  ? 4.054   -3.086  11.846 1.00 19.23  ? 68  THR A N   1 
ATOM   541  C  CA  . THR A 1 68  ? 5.138   -3.605  11.020 1.00 19.19  ? 68  THR A CA  1 
ATOM   542  C  C   . THR A 1 68  ? 5.569   -4.980  11.540 1.00 18.03  ? 68  THR A C   1 
ATOM   543  O  O   . THR A 1 68  ? 5.359   -5.315  12.706 1.00 18.26  ? 68  THR A O   1 
ATOM   544  C  CB  . THR A 1 68  ? 6.306   -2.606  10.951 1.00 19.30  ? 68  THR A CB  1 
ATOM   545  O  OG1 . THR A 1 68  ? 6.666   -2.200  12.277 1.00 20.63  ? 68  THR A OG1 1 
ATOM   546  C  CG2 . THR A 1 68  ? 5.954   -1.364  10.165 1.00 18.86  ? 68  THR A CG2 1 
ATOM   547  N  N   . ARG A 1 69  ? 6.208   -5.752  10.661 1.00 16.35  ? 69  ARG A N   1 
ATOM   548  C  CA  . ARG A 1 69  ? 6.486   -7.153  10.905 1.00 16.22  ? 69  ARG A CA  1 
ATOM   549  C  C   . ARG A 1 69  ? 7.361   -7.315  12.151 1.00 16.64  ? 69  ARG A C   1 
ATOM   550  O  O   . ARG A 1 69  ? 8.267   -6.523  12.323 1.00 17.31  ? 69  ARG A O   1 
ATOM   551  C  CB  . ARG A 1 69  ? 7.167   -7.716  9.658  1.00 16.16  ? 69  ARG A CB  1 
ATOM   552  C  CG  . ARG A 1 69  ? 7.197   -9.230  9.649  1.00 16.90  ? 69  ARG A CG  1 
ATOM   553  C  CD  . ARG A 1 69  ? 7.954   -9.859  8.506  1.00 16.94  ? 69  ARG A CD  1 
ATOM   554  N  NE  . ARG A 1 69  ? 7.887   -11.300 8.683  1.00 17.08  ? 69  ARG A NE  1 
ATOM   555  C  CZ  . ARG A 1 69  ? 8.554   -12.167 7.942  1.00 18.39  ? 69  ARG A CZ  1 
ATOM   556  N  NH1 . ARG A 1 69  ? 8.421   -13.466 8.122  1.00 19.81  ? 69  ARG A NH1 1 
ATOM   557  N  NH2 . ARG A 1 69  ? 9.351   -11.739 6.991  1.00 18.79  ? 69  ARG A NH2 1 
ATOM   558  N  N   . ASP A 1 70  ? 7.080   -8.308  13.019 1.00 16.75  ? 70  ASP A N   1 
ATOM   559  C  CA  . ASP A 1 70  ? 7.858   -8.573  14.231 1.00 17.57  ? 70  ASP A CA  1 
ATOM   560  C  C   . ASP A 1 70  ? 7.893   -7.339  15.148 1.00 18.40  ? 70  ASP A C   1 
ATOM   561  O  O   . ASP A 1 70  ? 8.918   -7.058  15.756 1.00 18.53  ? 70  ASP A O   1 
ATOM   562  C  CB  . ASP A 1 70  ? 9.283   -9.067  13.889 1.00 17.02  ? 70  ASP A CB  1 
ATOM   563  C  CG  . ASP A 1 70  ? 9.927   -10.010 14.904 1.00 16.71  ? 70  ASP A CG  1 
ATOM   564  O  OD1 . ASP A 1 70  ? 9.334   -10.217 15.956 1.00 17.29  ? 70  ASP A OD1 1 
ATOM   565  O  OD2 . ASP A 1 70  ? 11.013  -10.561 14.630 1.00 16.15  ? 70  ASP A OD2 1 
ATOM   566  N  N   . ASP A 1 71  ? 6.792   -6.584  15.248 1.00 19.22  ? 71  ASP A N   1 
ATOM   567  C  CA  . ASP A 1 71  ? 6.719   -5.466  16.184 1.00 20.12  ? 71  ASP A CA  1 
ATOM   568  C  C   . ASP A 1 71  ? 6.120   -5.975  17.497 1.00 19.71  ? 71  ASP A C   1 
ATOM   569  O  O   . ASP A 1 71  ? 6.336   -7.130  17.839 1.00 18.87  ? 71  ASP A O   1 
ATOM   570  C  CB  . ASP A 1 71  ? 5.994   -4.251  15.576 1.00 20.95  ? 71  ASP A CB  1 
ATOM   571  C  CG  . ASP A 1 71  ? 4.504   -4.381  15.262 1.00 21.03  ? 71  ASP A CG  1 
ATOM   572  O  OD1 . ASP A 1 71  ? 3.943   -5.504  15.377 1.00 20.05  ? 71  ASP A OD1 1 
ATOM   573  O  OD2 . ASP A 1 71  ? 3.907   -3.344  14.900 1.00 20.46  ? 71  ASP A OD2 1 
ATOM   574  N  N   . ASP A 1 72  ? 5.379   -5.115  18.214 1.00 20.68  ? 72  ASP A N   1 
ATOM   575  C  CA  . ASP A 1 72  ? 4.762   -5.459  19.490 1.00 22.49  ? 72  ASP A CA  1 
ATOM   576  C  C   . ASP A 1 72  ? 3.631   -6.474  19.296 1.00 23.51  ? 72  ASP A C   1 
ATOM   577  O  O   . ASP A 1 72  ? 3.155   -7.028  20.287 1.00 26.12  ? 72  ASP A O   1 
ATOM   578  C  CB  . ASP A 1 72  ? 4.305   -4.209  20.264 1.00 22.61  ? 72  ASP A CB  1 
ATOM   579  C  CG  . ASP A 1 72  ? 3.318   -3.324  19.527 1.00 23.23  ? 72  ASP A CG  1 
ATOM   580  O  OD1 . ASP A 1 72  ? 3.534   -3.091  18.338 1.00 26.20  ? 72  ASP A OD1 1 
ATOM   581  O  OD2 . ASP A 1 72  ? 2.352   -2.870  20.153 1.00 25.00  ? 72  ASP A OD2 1 
ATOM   582  N  N   . ILE A 1 73  ? 3.186   -6.689  18.042 1.00 23.56  ? 73  ILE A N   1 
ATOM   583  C  CA  . ILE A 1 73  ? 2.283   -7.768  17.643 1.00 23.20  ? 73  ILE A CA  1 
ATOM   584  C  C   . ILE A 1 73  ? 0.831   -7.367  17.891 1.00 22.48  ? 73  ILE A C   1 
ATOM   585  O  O   . ILE A 1 73  ? 0.013   -7.409  16.977 1.00 21.31  ? 73  ILE A O   1 
ATOM   586  C  CB  . ILE A 1 73  ? 2.622   -9.113  18.329 1.00 24.32  ? 73  ILE A CB  1 
ATOM   587  C  CG1 . ILE A 1 73  ? 4.067   -9.552  18.061 1.00 24.05  ? 73  ILE A CG1 1 
ATOM   588  C  CG2 . ILE A 1 73  ? 1.633   -10.202 17.927 1.00 24.57  ? 73  ILE A CG2 1 
ATOM   589  C  CD1 . ILE A 1 73  ? 4.463   -9.554  16.596 1.00 24.02  ? 73  ILE A CD1 1 
ATOM   590  N  N   . ILE A 1 74  ? 0.536   -7.026  19.151 1.00 23.05  ? 74  ILE A N   1 
ATOM   591  C  CA  . ILE A 1 74  ? -0.798  -6.688  19.623 1.00 22.88  ? 74  ILE A CA  1 
ATOM   592  C  C   . ILE A 1 74  ? -0.662  -6.186  21.065 1.00 23.00  ? 74  ILE A C   1 
ATOM   593  O  O   . ILE A 1 74  ? 0.194   -6.687  21.799 1.00 23.28  ? 74  ILE A O   1 
ATOM   594  C  CB  . ILE A 1 74  ? -1.723  -7.918  19.512 1.00 22.39  ? 74  ILE A CB  1 
ATOM   595  C  CG1 . ILE A 1 74  ? -3.184  -7.549  19.751 1.00 22.26  ? 74  ILE A CG1 1 
ATOM   596  C  CG2 . ILE A 1 74  ? -1.262  -9.033  20.443 1.00 22.84  ? 74  ILE A CG2 1 
ATOM   597  C  CD1 . ILE A 1 74  ? -4.067  -8.740  20.004 1.00 22.18  ? 74  ILE A CD1 1 
ATOM   598  N  N   . ALA A 1 75  ? -1.485  -5.196  21.454 1.00 23.28  ? 75  ALA A N   1 
ATOM   599  C  CA  . ALA A 1 75  ? -1.377  -4.557  22.757 1.00 23.62  ? 75  ALA A CA  1 
ATOM   600  C  C   . ALA A 1 75  ? -1.637  -5.597  23.845 1.00 26.18  ? 75  ALA A C   1 
ATOM   601  O  O   . ALA A 1 75  ? -2.465  -6.501  23.636 1.00 25.63  ? 75  ALA A O   1 
ATOM   602  C  CB  . ALA A 1 75  ? -2.352  -3.421  22.854 1.00 22.49  ? 75  ALA A CB  1 
ATOM   603  N  N   A SER A 1 76  ? -0.930  -5.454  24.984 0.50 27.17  ? 76  SER A N   1 
ATOM   604  N  N   B SER A 1 76  ? -0.930  -5.455  24.984 0.50 27.16  ? 76  SER A N   1 
ATOM   605  C  CA  A SER A 1 76  ? -0.956  -6.435  26.063 0.50 27.55  ? 76  SER A CA  1 
ATOM   606  C  CA  B SER A 1 76  ? -0.957  -6.437  26.063 0.50 27.51  ? 76  SER A CA  1 
ATOM   607  C  C   A SER A 1 76  ? -2.316  -6.423  26.749 0.50 26.98  ? 76  SER A C   1 
ATOM   608  C  C   B SER A 1 76  ? -2.317  -6.423  26.749 0.50 26.97  ? 76  SER A C   1 
ATOM   609  O  O   A SER A 1 76  ? -2.689  -7.411  27.381 0.50 27.29  ? 76  SER A O   1 
ATOM   610  O  O   B SER A 1 76  ? -2.689  -7.410  27.382 0.50 27.28  ? 76  SER A O   1 
ATOM   611  C  CB  A SER A 1 76  ? 0.116   -6.200  27.096 0.50 28.75  ? 76  SER A CB  1 
ATOM   612  C  CB  B SER A 1 76  ? 0.116   -6.204  27.094 0.50 28.69  ? 76  SER A CB  1 
ATOM   613  O  OG  A SER A 1 76  ? 1.118   -5.322  26.620 0.50 31.17  ? 76  SER A OG  1 
ATOM   614  O  OG  B SER A 1 76  ? 1.137   -5.355  26.604 0.50 31.14  ? 76  SER A OG  1 
ATOM   615  N  N   . SER A 1 77  ? -3.022  -5.286  26.636 1.00 26.21  ? 77  SER A N   1 
ATOM   616  C  CA  . SER A 1 77  ? -4.363  -5.129  27.177 1.00 25.24  ? 77  SER A CA  1 
ATOM   617  C  C   . SER A 1 77  ? -5.329  -6.151  26.587 1.00 24.59  ? 77  SER A C   1 
ATOM   618  O  O   . SER A 1 77  ? -6.256  -6.542  27.281 1.00 26.10  ? 77  SER A O   1 
ATOM   619  C  CB  . SER A 1 77  ? -4.869  -3.745  26.955 1.00 24.33  ? 77  SER A CB  1 
ATOM   620  O  OG  . SER A 1 77  ? -5.078  -3.498  25.576 1.00 26.07  ? 77  SER A OG  1 
ATOM   621  N  N   . HIS A 1 78  ? -5.053  -6.621  25.356 1.00 24.25  ? 78  HIS A N   1 
ATOM   622  C  CA  . HIS A 1 78  ? -5.946  -7.471  24.581 1.00 23.07  ? 78  HIS A CA  1 
ATOM   623  C  C   . HIS A 1 78  ? -5.915  -8.942  25.017 1.00 21.52  ? 78  HIS A C   1 
ATOM   624  O  O   . HIS A 1 78  ? -6.121  -9.820  24.194 1.00 21.36  ? 78  HIS A O   1 
ATOM   625  C  CB  . HIS A 1 78  ? -5.598  -7.336  23.091 1.00 22.51  ? 78  HIS A CB  1 
ATOM   626  C  CG  . HIS A 1 78  ? -5.946  -6.011  22.490 1.00 23.00  ? 78  HIS A CG  1 
ATOM   627  N  ND1 . HIS A 1 78  ? -5.840  -4.825  23.178 1.00 24.80  ? 78  HIS A ND1 1 
ATOM   628  C  CD2 . HIS A 1 78  ? -6.435  -5.672  21.284 1.00 23.37  ? 78  HIS A CD2 1 
ATOM   629  C  CE1 . HIS A 1 78  ? -6.217  -3.818  22.394 1.00 24.76  ? 78  HIS A CE1 1 
ATOM   630  N  NE2 . HIS A 1 78  ? -6.574  -4.307  21.234 1.00 22.91  ? 78  HIS A NE2 1 
ATOM   631  N  N   . HIS A 1 79  ? -5.718  -9.231  26.306 1.00 21.10  ? 79  HIS A N   1 
ATOM   632  C  CA  . HIS A 1 79  ? -5.781  -10.596 26.818 1.00 22.27  ? 79  HIS A CA  1 
ATOM   633  C  C   . HIS A 1 79  ? -6.988  -11.345 26.238 1.00 20.42  ? 79  HIS A C   1 
ATOM   634  O  O   . HIS A 1 79  ? -8.091  -10.810 26.220 1.00 19.45  ? 79  HIS A O   1 
ATOM   635  C  CB  . HIS A 1 79  ? -5.889  -10.575 28.348 1.00 24.06  ? 79  HIS A CB  1 
ATOM   636  C  CG  . HIS A 1 79  ? -4.782  -9.811  29.004 1.00 27.18  ? 79  HIS A CG  1 
ATOM   637  N  ND1 . HIS A 1 79  ? -3.497  -10.303 29.149 1.00 30.19  ? 79  HIS A ND1 1 
ATOM   638  C  CD2 . HIS A 1 79  ? -4.779  -8.578  29.545 1.00 27.84  ? 79  HIS A CD2 1 
ATOM   639  C  CE1 . HIS A 1 79  ? -2.748  -9.388  29.752 1.00 29.84  ? 79  HIS A CE1 1 
ATOM   640  N  NE2 . HIS A 1 79  ? -3.507  -8.326  29.991 1.00 28.38  ? 79  HIS A NE2 1 
ATOM   641  N  N   . GLY A 1 80  ? -6.783  -12.581 25.751 1.00 19.10  ? 80  GLY A N   1 
ATOM   642  C  CA  . GLY A 1 80  ? -7.896  -13.410 25.311 1.00 17.91  ? 80  GLY A CA  1 
ATOM   643  C  C   . GLY A 1 80  ? -7.485  -14.735 24.661 1.00 17.17  ? 80  GLY A C   1 
ATOM   644  O  O   . GLY A 1 80  ? -6.312  -15.115 24.631 1.00 16.79  ? 80  GLY A O   1 
ATOM   645  N  N   . PRO A 1 81  ? -8.474  -15.502 24.142 1.00 16.80  ? 81  PRO A N   1 
ATOM   646  C  CA  . PRO A 1 81  ? -8.230  -16.798 23.508 1.00 16.60  ? 81  PRO A CA  1 
ATOM   647  C  C   . PRO A 1 81  ? -7.927  -16.713 22.024 1.00 16.02  ? 81  PRO A C   1 
ATOM   648  O  O   . PRO A 1 81  ? -8.180  -15.684 21.424 1.00 15.92  ? 81  PRO A O   1 
ATOM   649  C  CB  . PRO A 1 81  ? -9.575  -17.520 23.718 1.00 16.48  ? 81  PRO A CB  1 
ATOM   650  C  CG  . PRO A 1 81  ? -10.576 -16.412 23.580 1.00 16.15  ? 81  PRO A CG  1 
ATOM   651  C  CD  . PRO A 1 81  ? -9.913  -15.220 24.242 1.00 16.23  ? 81  PRO A CD  1 
ATOM   652  N  N   . ILE A 1 82  ? -7.422  -17.826 21.468 1.00 17.15  ? 82  ILE A N   1 
ATOM   653  C  CA  . ILE A 1 82  ? -7.063  -17.958 20.060 1.00 17.70  ? 82  ILE A CA  1 
ATOM   654  C  C   . ILE A 1 82  ? -7.561  -19.300 19.532 1.00 17.13  ? 82  ILE A C   1 
ATOM   655  O  O   . ILE A 1 82  ? -7.356  -20.321 20.170 1.00 18.29  ? 82  ILE A O   1 
ATOM   656  C  CB  . ILE A 1 82  ? -5.537  -17.844 19.845 1.00 18.39  ? 82  ILE A CB  1 
ATOM   657  C  CG1 . ILE A 1 82  ? -5.010  -16.448 20.214 1.00 18.56  ? 82  ILE A CG1 1 
ATOM   658  C  CG2 . ILE A 1 82  ? -5.163  -18.255 18.412 1.00 18.19  ? 82  ILE A CG2 1 
ATOM   659  C  CD1 . ILE A 1 82  ? -3.506  -16.275 20.059 1.00 18.41  ? 82  ILE A CD1 1 
ATOM   660  N  N   . ALA A 1 83  ? -8.145  -19.293 18.332 1.00 17.38  ? 83  ALA A N   1 
ATOM   661  C  CA  . ALA A 1 83  ? -8.685  -20.503 17.730 1.00 18.26  ? 83  ALA A CA  1 
ATOM   662  C  C   . ALA A 1 83  ? -8.370  -20.536 16.232 1.00 17.70  ? 83  ALA A C   1 
ATOM   663  O  O   . ALA A 1 83  ? -8.061  -19.502 15.627 1.00 16.65  ? 83  ALA A O   1 
ATOM   664  C  CB  . ALA A 1 83  ? -10.181 -20.590 17.987 1.00 18.41  ? 83  ALA A CB  1 
ATOM   665  N  N   . VAL A 1 84  ? -8.441  -21.740 15.649 1.00 16.39  ? 84  VAL A N   1 
ATOM   666  C  CA  . VAL A 1 84  ? -8.294  -21.885 14.209 1.00 17.02  ? 84  VAL A CA  1 
ATOM   667  C  C   . VAL A 1 84  ? -9.406  -22.812 13.713 1.00 16.78  ? 84  VAL A C   1 
ATOM   668  O  O   . VAL A 1 84  ? -9.653  -23.864 14.296 1.00 16.92  ? 84  VAL A O   1 
ATOM   669  C  CB  . VAL A 1 84  ? -6.887  -22.387 13.792 1.00 16.92  ? 84  VAL A CB  1 
ATOM   670  C  CG1 . VAL A 1 84  ? -6.746  -22.511 12.281 1.00 16.66  ? 84  VAL A CG1 1 
ATOM   671  C  CG2 . VAL A 1 84  ? -5.758  -21.516 14.328 1.00 16.61  ? 84  VAL A CG2 1 
ATOM   672  N  N   . TYR A 1 85  ? -10.069 -22.395 12.632 1.00 17.12  ? 85  TYR A N   1 
ATOM   673  C  CA  . TYR A 1 85  ? -11.087 -23.193 11.963 1.00 17.95  ? 85  TYR A CA  1 
ATOM   674  C  C   . TYR A 1 85  ? -10.650 -23.455 10.520 1.00 18.32  ? 85  TYR A C   1 
ATOM   675  O  O   . TYR A 1 85  ? -9.815  -22.738 9.983  1.00 18.33  ? 85  TYR A O   1 
ATOM   676  C  CB  . TYR A 1 85  ? -12.465 -22.502 11.960 1.00 17.69  ? 85  TYR A CB  1 
ATOM   677  C  CG  . TYR A 1 85  ? -13.070 -22.162 13.309 1.00 17.24  ? 85  TYR A CG  1 
ATOM   678  C  CD1 . TYR A 1 85  ? -12.685 -21.034 14.022 1.00 16.40  ? 85  TYR A CD1 1 
ATOM   679  C  CD2 . TYR A 1 85  ? -14.049 -22.967 13.875 1.00 17.50  ? 85  TYR A CD2 1 
ATOM   680  C  CE1 . TYR A 1 85  ? -13.255 -20.719 15.245 1.00 16.44  ? 85  TYR A CE1 1 
ATOM   681  C  CE2 . TYR A 1 85  ? -14.626 -22.676 15.104 1.00 17.17  ? 85  TYR A CE2 1 
ATOM   682  C  CZ  . TYR A 1 85  ? -14.221 -21.549 15.791 1.00 17.01  ? 85  TYR A CZ  1 
ATOM   683  O  OH  . TYR A 1 85  ? -14.796 -21.270 16.988 1.00 16.38  ? 85  TYR A OH  1 
ATOM   684  N  N   . ILE A 1 86  ? -11.281 -24.459 9.895  1.00 19.38  ? 86  ILE A N   1 
ATOM   685  C  CA  . ILE A 1 86  ? -11.064 -24.835 8.502  1.00 19.84  ? 86  ILE A CA  1 
ATOM   686  C  C   . ILE A 1 86  ? -12.421 -25.010 7.826  1.00 17.92  ? 86  ILE A C   1 
ATOM   687  O  O   . ILE A 1 86  ? -13.360 -25.470 8.471  1.00 18.35  ? 86  ILE A O   1 
ATOM   688  C  CB  . ILE A 1 86  ? -10.223 -26.133 8.399  1.00 21.19  ? 86  ILE A CB  1 
ATOM   689  C  CG1 . ILE A 1 86  ? -9.862  -26.479 6.950  1.00 22.28  ? 86  ILE A CG1 1 
ATOM   690  C  CG2 . ILE A 1 86  ? -10.917 -27.309 9.068  1.00 21.15  ? 86  ILE A CG2 1 
ATOM   691  C  CD1 . ILE A 1 86  ? -8.956  -27.683 6.810  1.00 22.94  ? 86  ILE A CD1 1 
ATOM   692  N  N   . ALA A 1 87  ? -12.497 -24.692 6.530  1.00 16.73  ? 87  ALA A N   1 
ATOM   693  C  CA  . ALA A 1 87  ? -13.664 -25.019 5.724  1.00 17.11  ? 87  ALA A CA  1 
ATOM   694  C  C   . ALA A 1 87  ? -13.310 -25.128 4.233  1.00 18.26  ? 87  ALA A C   1 
ATOM   695  O  O   . ALA A 1 87  ? -12.375 -24.497 3.729  1.00 17.56  ? 87  ALA A O   1 
ATOM   696  C  CB  . ALA A 1 87  ? -14.733 -23.985 5.958  1.00 16.99  ? 87  ALA A CB  1 
ATOM   697  N  N   . PRO A 1 88  ? -14.050 -25.929 3.433  1.00 20.22  ? 88  PRO A N   1 
ATOM   698  C  CA  . PRO A 1 88  ? -13.763 -26.018 1.995  1.00 21.22  ? 88  PRO A CA  1 
ATOM   699  C  C   . PRO A 1 88  ? -13.870 -24.649 1.328  1.00 22.69  ? 88  PRO A C   1 
ATOM   700  O  O   . PRO A 1 88  ? -14.779 -23.859 1.613  1.00 21.35  ? 88  PRO A O   1 
ATOM   701  C  CB  . PRO A 1 88  ? -14.826 -26.991 1.456  1.00 20.14  ? 88  PRO A CB  1 
ATOM   702  C  CG  . PRO A 1 88  ? -15.291 -27.762 2.689  1.00 19.76  ? 88  PRO A CG  1 
ATOM   703  C  CD  . PRO A 1 88  ? -15.156 -26.808 3.858  1.00 19.82  ? 88  PRO A CD  1 
ATOM   704  N  N   . ALA A 1 89  ? -12.954 -24.379 0.406  1.00 24.09  ? 89  ALA A N   1 
ATOM   705  C  CA  . ALA A 1 89  ? -12.909 -23.063 -0.217 1.00 25.61  ? 89  ALA A CA  1 
ATOM   706  C  C   . ALA A 1 89  ? -14.209 -22.737 -0.960 1.00 24.32  ? 89  ALA A C   1 
ATOM   707  O  O   . ALA A 1 89  ? -14.566 -21.568 -1.108 1.00 21.39  ? 89  ALA A O   1 
ATOM   708  C  CB  . ALA A 1 89  ? -11.724 -23.001 -1.146 1.00 26.80  ? 89  ALA A CB  1 
ATOM   709  N  N   . ALA A 1 90  ? -14.880 -23.792 -1.440 1.00 26.44  ? 90  ALA A N   1 
ATOM   710  C  CA  . ALA A 1 90  ? -16.030 -23.694 -2.328 1.00 28.14  ? 90  ALA A CA  1 
ATOM   711  C  C   . ALA A 1 90  ? -17.238 -23.090 -1.606 1.00 29.19  ? 90  ALA A C   1 
ATOM   712  O  O   . ALA A 1 90  ? -18.020 -22.381 -2.230 1.00 31.13  ? 90  ALA A O   1 
ATOM   713  C  CB  . ALA A 1 90  ? -16.341 -25.067 -2.881 1.00 27.50  ? 90  ALA A CB  1 
ATOM   714  N  N   . SER A 1 91  ? -17.356 -23.360 -0.297 1.00 28.12  ? 91  SER A N   1 
ATOM   715  C  CA  . SER A 1 91  ? -18.369 -22.783 0.577  1.00 27.49  ? 91  SER A CA  1 
ATOM   716  C  C   . SER A 1 91  ? -18.279 -21.263 0.657  1.00 27.14  ? 91  SER A C   1 
ATOM   717  O  O   . SER A 1 91  ? -19.290 -20.603 0.859  1.00 28.77  ? 91  SER A O   1 
ATOM   718  C  CB  . SER A 1 91  ? -18.217 -23.338 1.959  1.00 29.52  ? 91  SER A CB  1 
ATOM   719  O  OG  . SER A 1 91  ? -17.008 -22.862 2.549  1.00 31.82  ? 91  SER A OG  1 
ATOM   720  N  N   . ASN A 1 92  ? -17.055 -20.733 0.591  1.00 26.57  ? 92  ASN A N   1 
ATOM   721  C  CA  . ASN A 1 92  ? -16.788 -19.325 0.845  1.00 26.97  ? 92  ASN A CA  1 
ATOM   722  C  C   . ASN A 1 92  ? -17.101 -18.988 2.307  1.00 24.80  ? 92  ASN A C   1 
ATOM   723  O  O   . ASN A 1 92  ? -17.313 -17.825 2.632  1.00 23.56  ? 92  ASN A O   1 
ATOM   724  C  CB  . ASN A 1 92  ? -17.516 -18.410 -0.149 1.00 25.39  ? 92  ASN A CB  1 
ATOM   725  C  CG  . ASN A 1 92  ? -17.106 -16.955 -0.015 1.00 24.52  ? 92  ASN A CG  1 
ATOM   726  O  OD1 . ASN A 1 92  ? -15.934 -16.619 0.139  1.00 21.80  ? 92  ASN A OD1 1 
ATOM   727  N  ND2 . ASN A 1 92  ? -18.085 -16.070 -0.044 1.00 25.86  ? 92  ASN A ND2 1 
ATOM   728  N  N   . GLY A 1 93  ? -17.083 -20.007 3.178  1.00 22.85  ? 93  GLY A N   1 
ATOM   729  C  CA  . GLY A 1 93  ? -17.362 -19.836 4.597  1.00 23.67  ? 93  GLY A CA  1 
ATOM   730  C  C   . GLY A 1 93  ? -18.846 -19.666 4.932  1.00 23.79  ? 93  GLY A C   1 
ATOM   731  O  O   . GLY A 1 93  ? -19.188 -19.316 6.066  1.00 21.99  ? 93  GLY A O   1 
ATOM   732  N  N   . GLN A 1 94  ? -19.715 -19.944 3.951  1.00 25.66  ? 94  GLN A N   1 
ATOM   733  C  CA  . GLN A 1 94  ? -21.159 -19.891 4.130  1.00 26.59  ? 94  GLN A CA  1 
ATOM   734  C  C   . GLN A 1 94  ? -21.640 -21.250 4.612  1.00 24.79  ? 94  GLN A C   1 
ATOM   735  O  O   . GLN A 1 94  ? -21.032 -22.244 4.251  1.00 26.00  ? 94  GLN A O   1 
ATOM   736  C  CB  . GLN A 1 94  ? -21.827 -19.556 2.803  1.00 27.11  ? 94  GLN A CB  1 
ATOM   737  C  CG  . GLN A 1 94  ? -21.216 -18.354 2.099  1.00 28.19  ? 94  GLN A CG  1 
ATOM   738  C  CD  . GLN A 1 94  ? -21.214 -17.129 2.972  1.00 29.81  ? 94  GLN A CD  1 
ATOM   739  O  OE1 . GLN A 1 94  ? -20.180 -16.490 3.162  1.00 33.29  ? 94  GLN A OE1 1 
ATOM   740  N  NE2 . GLN A 1 94  ? -22.380 -16.787 3.501  1.00 29.38  ? 94  GLN A NE2 1 
ATOM   741  N  N   . GLY A 1 95  ? -22.696 -21.292 5.425  1.00 23.91  ? 95  GLY A N   1 
ATOM   742  C  CA  . GLY A 1 95  ? -23.245 -22.563 5.886  1.00 26.93  ? 95  GLY A CA  1 
ATOM   743  C  C   . GLY A 1 95  ? -22.477 -23.121 7.081  1.00 29.69  ? 95  GLY A C   1 
ATOM   744  O  O   . GLY A 1 95  ? -21.600 -22.436 7.594  1.00 34.27  ? 95  GLY A O   1 
ATOM   745  N  N   . ASN A 1 96  ? -22.804 -24.353 7.506  1.00 31.89  ? 96  ASN A N   1 
ATOM   746  C  CA  A ASN A 1 96  ? -22.244 -24.948 8.714  0.50 33.71  ? 96  ASN A CA  1 
ATOM   747  C  CA  B ASN A 1 96  ? -22.244 -24.951 8.714  0.50 33.78  ? 96  ASN A CA  1 
ATOM   748  C  C   . ASN A 1 96  ? -20.960 -25.702 8.373  1.00 33.13  ? 96  ASN A C   1 
ATOM   749  O  O   . ASN A 1 96  ? -20.879 -26.926 8.513  1.00 31.82  ? 96  ASN A O   1 
ATOM   750  C  CB  A ASN A 1 96  ? -23.284 -25.821 9.419  0.50 36.43  ? 96  ASN A CB  1 
ATOM   751  C  CB  B ASN A 1 96  ? -23.259 -25.859 9.413  0.50 36.60  ? 96  ASN A CB  1 
ATOM   752  C  CG  A ASN A 1 96  ? -24.511 -25.020 9.801  0.50 39.66  ? 96  ASN A CG  1 
ATOM   753  C  CG  B ASN A 1 96  ? -24.542 -25.127 9.744  0.50 39.99  ? 96  ASN A CG  1 
ATOM   754  O  OD1 A ASN A 1 96  ? -25.057 -24.283 8.976  0.50 40.31  ? 96  ASN A OD1 1 
ATOM   755  O  OD1 B ASN A 1 96  ? -24.597 -24.346 10.694 0.50 41.91  ? 96  ASN A OD1 1 
ATOM   756  N  ND2 A ASN A 1 96  ? -24.914 -25.114 11.061 0.50 40.15  ? 96  ASN A ND2 1 
ATOM   757  N  ND2 B ASN A 1 96  ? -25.572 -25.356 8.946  0.50 40.17  ? 96  ASN A ND2 1 
ATOM   758  N  N   . VAL A 1 97  ? -19.938 -24.928 7.993  1.00 32.37  ? 97  VAL A N   1 
ATOM   759  C  CA  . VAL A 1 97  ? -18.769 -25.455 7.320  1.00 29.59  ? 97  VAL A CA  1 
ATOM   760  C  C   . VAL A 1 97  ? -17.518 -25.418 8.191  1.00 27.68  ? 97  VAL A C   1 
ATOM   761  O  O   . VAL A 1 97  ? -16.574 -26.116 7.851  1.00 29.56  ? 97  VAL A O   1 
ATOM   762  C  CB  . VAL A 1 97  ? -18.556 -24.697 6.003  1.00 29.32  ? 97  VAL A CB  1 
ATOM   763  C  CG1 . VAL A 1 97  ? -19.638 -25.061 4.999  1.00 28.81  ? 97  VAL A CG1 1 
ATOM   764  C  CG2 . VAL A 1 97  ? -18.508 -23.193 6.227  1.00 30.26  ? 97  VAL A CG2 1 
ATOM   765  N  N   . TRP A 1 98  ? -17.518 -24.687 9.315  1.00 24.91  ? 98  TRP A N   1 
ATOM   766  C  CA  . TRP A 1 98  ? -16.270 -24.379 10.002 1.00 23.08  ? 98  TRP A CA  1 
ATOM   767  C  C   . TRP A 1 98  ? -15.954 -25.401 11.085 1.00 22.45  ? 98  TRP A C   1 
ATOM   768  O  O   . TRP A 1 98  ? -16.598 -25.428 12.131 1.00 24.43  ? 98  TRP A O   1 
ATOM   769  C  CB  . TRP A 1 98  ? -16.286 -22.957 10.579 1.00 22.31  ? 98  TRP A CB  1 
ATOM   770  C  CG  . TRP A 1 98  ? -16.296 -21.902 9.518  1.00 21.23  ? 98  TRP A CG  1 
ATOM   771  C  CD1 . TRP A 1 98  ? -17.376 -21.194 9.093  1.00 20.52  ? 98  TRP A CD1 1 
ATOM   772  C  CD2 . TRP A 1 98  ? -15.187 -21.449 8.714  1.00 20.97  ? 98  TRP A CD2 1 
ATOM   773  N  NE1 . TRP A 1 98  ? -17.018 -20.330 8.091  1.00 20.18  ? 98  TRP A NE1 1 
ATOM   774  C  CE2 . TRP A 1 98  ? -15.682 -20.455 7.842  1.00 19.62  ? 98  TRP A CE2 1 
ATOM   775  C  CE3 . TRP A 1 98  ? -13.821 -21.747 8.675  1.00 20.55  ? 98  TRP A CE3 1 
ATOM   776  C  CZ2 . TRP A 1 98  ? -14.876 -19.778 6.933  1.00 19.26  ? 98  TRP A CZ2 1 
ATOM   777  C  CZ3 . TRP A 1 98  ? -13.022 -21.072 7.775  1.00 20.59  ? 98  TRP A CZ3 1 
ATOM   778  C  CH2 . TRP A 1 98  ? -13.544 -20.107 6.912  1.00 19.92  ? 98  TRP A CH2 1 
ATOM   779  N  N   . VAL A 1 99  ? -14.888 -26.172 10.862 1.00 20.61  ? 99  VAL A N   1 
ATOM   780  C  CA  . VAL A 1 99  ? -14.440 -27.143 11.839 1.00 19.39  ? 99  VAL A CA  1 
ATOM   781  C  C   . VAL A 1 99  ? -13.271 -26.558 12.621 1.00 20.33  ? 99  VAL A C   1 
ATOM   782  O  O   . VAL A 1 99  ? -12.412 -25.925 12.026 1.00 20.22  ? 99  VAL A O   1 
ATOM   783  C  CB  . VAL A 1 99  ? -14.067 -28.437 11.107 1.00 18.58  ? 99  VAL A CB  1 
ATOM   784  C  CG1 . VAL A 1 99  ? -13.520 -29.504 12.051 1.00 18.07  ? 99  VAL A CG1 1 
ATOM   785  C  CG2 . VAL A 1 99  ? -15.260 -28.942 10.305 1.00 18.38  ? 99  VAL A CG2 1 
ATOM   786  N  N   . LYS A 1 100 ? -13.229 -26.782 13.945 1.00 21.38  ? 100 LYS A N   1 
ATOM   787  C  CA  . LYS A 1 100 ? -12.184 -26.203 14.783 1.00 21.46  ? 100 LYS A CA  1 
ATOM   788  C  C   . LYS A 1 100 ? -10.987 -27.148 14.878 1.00 22.12  ? 100 LYS A C   1 
ATOM   789  O  O   . LYS A 1 100 ? -11.150 -28.320 15.183 1.00 22.48  ? 100 LYS A O   1 
ATOM   790  C  CB  . LYS A 1 100 ? -12.710 -25.888 16.185 1.00 20.87  ? 100 LYS A CB  1 
ATOM   791  C  CG  . LYS A 1 100 ? -11.684 -25.249 17.117 1.00 21.53  ? 100 LYS A CG  1 
ATOM   792  C  CD  . LYS A 1 100 ? -12.212 -24.871 18.495 1.00 21.25  ? 100 LYS A CD  1 
ATOM   793  C  CE  . LYS A 1 100 ? -13.226 -23.744 18.467 1.00 21.09  ? 100 LYS A CE  1 
ATOM   794  N  NZ  . LYS A 1 100 ? -13.539 -23.262 19.830 1.00 21.28  ? 100 LYS A NZ  1 
ATOM   795  N  N   . LEU A 1 101 ? -9.781  -26.615 14.662 1.00 23.17  ? 101 LEU A N   1 
ATOM   796  C  CA  . LEU A 1 101 ? -8.564  -27.421 14.665 1.00 25.28  ? 101 LEU A CA  1 
ATOM   797  C  C   . LEU A 1 101 ? -7.691  -27.093 15.871 1.00 24.67  ? 101 LEU A C   1 
ATOM   798  O  O   . LEU A 1 101 ? -6.714  -27.787 16.131 1.00 25.44  ? 101 LEU A O   1 
ATOM   799  C  CB  . LEU A 1 101 ? -7.770  -27.164 13.375 1.00 25.75  ? 101 LEU A CB  1 
ATOM   800  C  CG  . LEU A 1 101 ? -8.460  -27.602 12.085 1.00 25.66  ? 101 LEU A CG  1 
ATOM   801  C  CD1 . LEU A 1 101 ? -7.540  -27.457 10.879 1.00 25.69  ? 101 LEU A CD1 1 
ATOM   802  C  CD2 . LEU A 1 101 ? -8.955  -29.033 12.217 1.00 26.05  ? 101 LEU A CD2 1 
ATOM   803  N  N   . PHE A 1 102 ? -8.036  -26.021 16.586 1.00 25.27  ? 102 PHE A N   1 
ATOM   804  C  CA  . PHE A 1 102 ? -7.187  -25.525 17.655 1.00 24.16  ? 102 PHE A CA  1 
ATOM   805  C  C   . PHE A 1 102 ? -7.998  -24.631 18.605 1.00 23.12  ? 102 PHE A C   1 
ATOM   806  O  O   . PHE A 1 102 ? -8.909  -23.928 18.178 1.00 23.23  ? 102 PHE A O   1 
ATOM   807  C  CB  . PHE A 1 102 ? -5.982  -24.815 17.028 1.00 21.92  ? 102 PHE A CB  1 
ATOM   808  C  CG  . PHE A 1 102 ? -5.031  -24.225 18.035 1.00 21.04  ? 102 PHE A CG  1 
ATOM   809  C  CD1 . PHE A 1 102 ? -4.116  -25.021 18.691 1.00 20.40  ? 102 PHE A CD1 1 
ATOM   810  C  CD2 . PHE A 1 102 ? -5.089  -22.877 18.356 1.00 21.74  ? 102 PHE A CD2 1 
ATOM   811  C  CE1 . PHE A 1 102 ? -3.252  -24.472 19.622 1.00 22.10  ? 102 PHE A CE1 1 
ATOM   812  C  CE2 . PHE A 1 102 ? -4.222  -22.324 19.287 1.00 22.93  ? 102 PHE A CE2 1 
ATOM   813  C  CZ  . PHE A 1 102 ? -3.308  -23.124 19.926 1.00 23.23  ? 102 PHE A CZ  1 
ATOM   814  N  N   . GLU A 1 103 ? -7.654  -24.673 19.898 1.00 21.96  ? 103 GLU A N   1 
ATOM   815  C  CA  . GLU A 1 103 ? -8.175  -23.752 20.895 1.00 21.40  ? 103 GLU A CA  1 
ATOM   816  C  C   . GLU A 1 103 ? -7.126  -23.568 21.977 1.00 20.81  ? 103 GLU A C   1 
ATOM   817  O  O   . GLU A 1 103 ? -6.597  -24.557 22.470 1.00 22.38  ? 103 GLU A O   1 
ATOM   818  C  CB  . GLU A 1 103 ? -9.427  -24.302 21.590 1.00 21.02  ? 103 GLU A CB  1 
ATOM   819  C  CG  . GLU A 1 103 ? -10.062 -23.329 22.570 1.00 20.18  ? 103 GLU A CG  1 
ATOM   820  C  CD  . GLU A 1 103 ? -10.660 -22.089 21.919 1.00 20.50  ? 103 GLU A CD  1 
ATOM   821  O  OE1 . GLU A 1 103 ? -10.337 -20.945 22.376 1.00 19.86  ? 103 GLU A OE1 1 
ATOM   822  O  OE2 . GLU A 1 103 ? -11.436 -22.269 20.934 1.00 18.67  ? 103 GLU A OE2 1 
ATOM   823  N  N   . ASP A 1 104 ? -6.868  -22.321 22.362 1.00 19.66  ? 104 ASP A N   1 
ATOM   824  C  CA  A ASP A 1 104 ? -6.036  -22.038 23.517 0.50 19.76  ? 104 ASP A CA  1 
ATOM   825  C  CA  B ASP A 1 104 ? -6.036  -22.038 23.517 0.50 19.80  ? 104 ASP A CA  1 
ATOM   826  C  C   . ASP A 1 104 ? -6.590  -20.787 24.183 1.00 20.62  ? 104 ASP A C   1 
ATOM   827  O  O   . ASP A 1 104 ? -6.730  -19.763 23.513 1.00 21.79  ? 104 ASP A O   1 
ATOM   828  C  CB  A ASP A 1 104 ? -4.570  -21.865 23.115 0.50 19.19  ? 104 ASP A CB  1 
ATOM   829  C  CB  B ASP A 1 104 ? -4.569  -21.868 23.114 0.50 19.28  ? 104 ASP A CB  1 
ATOM   830  C  CG  A ASP A 1 104 ? -3.613  -21.727 24.286 0.50 18.76  ? 104 ASP A CG  1 
ATOM   831  C  CG  B ASP A 1 104 ? -3.608  -21.748 24.283 0.50 18.91  ? 104 ASP A CG  1 
ATOM   832  O  OD1 A ASP A 1 104 ? -3.959  -21.037 25.257 0.50 19.38  ? 104 ASP A OD1 1 
ATOM   833  O  OD1 B ASP A 1 104 ? -3.907  -20.996 25.223 0.50 19.57  ? 104 ASP A OD1 1 
ATOM   834  O  OD2 A ASP A 1 104 ? -2.518  -22.287 24.206 0.50 18.80  ? 104 ASP A OD2 1 
ATOM   835  O  OD2 B ASP A 1 104 ? -2.558  -22.391 24.234 0.50 19.06  ? 104 ASP A OD2 1 
ATOM   836  N  N   . ALA A 1 105 ? -6.901  -20.888 25.488 1.00 21.30  ? 105 ALA A N   1 
ATOM   837  C  CA  . ALA A 1 105 ? -7.406  -19.750 26.254 1.00 23.38  ? 105 ALA A CA  1 
ATOM   838  C  C   . ALA A 1 105 ? -6.364  -19.268 27.269 1.00 24.87  ? 105 ALA A C   1 
ATOM   839  O  O   . ALA A 1 105 ? -5.681  -18.267 27.039 1.00 22.65  ? 105 ALA A O   1 
ATOM   840  C  CB  . ALA A 1 105 ? -8.726  -20.103 26.907 1.00 22.20  ? 105 ALA A CB  1 
ATOM   841  N  N   . TYR A 1 106 ? -6.219  -20.042 28.357 1.00 30.20  ? 106 TYR A N   1 
ATOM   842  C  CA  . TYR A 1 106 ? -5.362  -19.710 29.492 1.00 33.44  ? 106 TYR A CA  1 
ATOM   843  C  C   . TYR A 1 106 ? -4.550  -20.943 29.909 1.00 32.92  ? 106 TYR A C   1 
ATOM   844  O  O   . TYR A 1 106 ? -5.100  -22.022 30.066 1.00 32.14  ? 106 TYR A O   1 
ATOM   845  C  CB  . TYR A 1 106 ? -6.235  -19.176 30.640 1.00 32.44  ? 106 TYR A CB  1 
ATOM   846  C  CG  . TYR A 1 106 ? -5.482  -18.536 31.777 1.00 30.31  ? 106 TYR A CG  1 
ATOM   847  C  CD1 . TYR A 1 106 ? -4.900  -17.279 31.650 1.00 31.30  ? 106 TYR A CD1 1 
ATOM   848  C  CD2 . TYR A 1 106 ? -5.326  -19.197 32.978 1.00 30.25  ? 106 TYR A CD2 1 
ATOM   849  C  CE1 . TYR A 1 106 ? -4.205  -16.681 32.693 1.00 30.32  ? 106 TYR A CE1 1 
ATOM   850  C  CE2 . TYR A 1 106 ? -4.633  -18.617 34.033 1.00 32.67  ? 106 TYR A CE2 1 
ATOM   851  C  CZ  . TYR A 1 106 ? -4.074  -17.356 33.894 1.00 32.06  ? 106 TYR A CZ  1 
ATOM   852  O  OH  . TYR A 1 106 ? -3.399  -16.812 34.961 1.00 32.79  ? 106 TYR A OH  1 
ATOM   853  N  N   . ASN A 1 107 ? -3.232  -20.791 30.066 1.00 36.81  ? 107 ASN A N   1 
ATOM   854  C  CA  . ASN A 1 107 ? -2.367  -21.854 30.564 1.00 38.32  ? 107 ASN A CA  1 
ATOM   855  C  C   . ASN A 1 107 ? -2.200  -21.628 32.060 1.00 40.36  ? 107 ASN A C   1 
ATOM   856  O  O   . ASN A 1 107 ? -1.598  -20.630 32.474 1.00 35.20  ? 107 ASN A O   1 
ATOM   857  C  CB  . ASN A 1 107 ? -1.019  -21.867 29.833 1.00 40.93  ? 107 ASN A CB  1 
ATOM   858  C  CG  . ASN A 1 107 ? -0.024  -22.911 30.305 1.00 45.63  ? 107 ASN A CG  1 
ATOM   859  O  OD1 . ASN A 1 107 ? 0.638   -22.743 31.328 1.00 50.81  ? 107 ASN A OD1 1 
ATOM   860  N  ND2 . ASN A 1 107 ? 0.161   -23.957 29.517 1.00 46.81  ? 107 ASN A ND2 1 
ATOM   861  N  N   . VAL A 1 108 ? -2.740  -22.561 32.856 1.00 44.81  ? 108 VAL A N   1 
ATOM   862  C  CA  . VAL A 1 108 ? -2.813  -22.377 34.301 1.00 47.09  ? 108 VAL A CA  1 
ATOM   863  C  C   . VAL A 1 108 ? -1.407  -22.222 34.877 1.00 44.13  ? 108 VAL A C   1 
ATOM   864  O  O   . VAL A 1 108 ? -1.192  -21.368 35.743 1.00 41.25  ? 108 VAL A O   1 
ATOM   865  C  CB  . VAL A 1 108 ? -3.542  -23.522 35.034 1.00 49.70  ? 108 VAL A CB  1 
ATOM   866  C  CG1 . VAL A 1 108 ? -3.996  -23.027 36.406 1.00 49.12  ? 108 VAL A CG1 1 
ATOM   867  C  CG2 . VAL A 1 108 ? -4.696  -24.134 34.225 1.00 48.44  ? 108 VAL A CG2 1 
ATOM   868  N  N   . THR A 1 109 ? -0.489  -23.070 34.387 1.00 42.25  ? 109 THR A N   1 
ATOM   869  C  CA  . THR A 1 109 ? 0.869   -23.154 34.891 1.00 44.85  ? 109 THR A CA  1 
ATOM   870  C  C   . THR A 1 109 ? 1.557   -21.807 34.787 1.00 47.74  ? 109 THR A C   1 
ATOM   871  O  O   . THR A 1 109 ? 1.954   -21.230 35.793 1.00 47.74  ? 109 THR A O   1 
ATOM   872  C  CB  . THR A 1 109 ? 1.696   -24.155 34.088 1.00 48.52  ? 109 THR A CB  1 
ATOM   873  O  OG1 . THR A 1 109 ? 0.981   -25.383 34.193 1.00 50.26  ? 109 THR A OG1 1 
ATOM   874  C  CG2 . THR A 1 109 ? 3.122   -24.264 34.583 1.00 49.98  ? 109 THR A CG2 1 
ATOM   875  N  N   . ASN A 1 110 ? 1.674   -21.315 33.554 1.00 51.91  ? 110 ASN A N   1 
ATOM   876  C  CA  . ASN A 1 110 ? 2.397   -20.083 33.303 1.00 55.70  ? 110 ASN A CA  1 
ATOM   877  C  C   . ASN A 1 110 ? 1.531   -18.870 33.619 1.00 48.98  ? 110 ASN A C   1 
ATOM   878  O  O   . ASN A 1 110 ? 2.040   -17.748 33.624 1.00 48.17  ? 110 ASN A O   1 
ATOM   879  C  CB  . ASN A 1 110 ? 2.894   -19.987 31.864 1.00 62.35  ? 110 ASN A CB  1 
ATOM   880  C  CG  . ASN A 1 110 ? 4.193   -20.724 31.651 1.00 71.06  ? 110 ASN A CG  1 
ATOM   881  O  OD1 . ASN A 1 110 ? 4.473   -21.751 32.276 1.00 69.22  ? 110 ASN A OD1 1 
ATOM   882  N  ND2 . ASN A 1 110 ? 4.977   -20.190 30.739 1.00 79.89  ? 110 ASN A ND2 1 
ATOM   883  N  N   . SER A 1 111 ? 0.232   -19.086 33.863 1.00 43.56  ? 111 SER A N   1 
ATOM   884  C  CA  . SER A 1 111 ? -0.669  -17.979 34.157 1.00 45.53  ? 111 SER A CA  1 
ATOM   885  C  C   . SER A 1 111 ? -0.637  -16.944 33.025 1.00 41.41  ? 111 SER A C   1 
ATOM   886  O  O   . SER A 1 111 ? -0.432  -15.751 33.255 1.00 36.47  ? 111 SER A O   1 
ATOM   887  C  CB  . SER A 1 111 ? -0.351  -17.354 35.503 1.00 44.20  ? 111 SER A CB  1 
ATOM   888  O  OG  . SER A 1 111 ? -0.591  -18.288 36.538 1.00 45.33  ? 111 SER A OG  1 
ATOM   889  N  N   . THR A 1 112 ? -0.837  -17.436 31.793 1.00 37.69  ? 112 THR A N   1 
ATOM   890  C  CA  . THR A 1 112 ? -0.716  -16.633 30.590 1.00 34.05  ? 112 THR A CA  1 
ATOM   891  C  C   . THR A 1 112 ? -1.898  -16.943 29.671 1.00 30.28  ? 112 THR A C   1 
ATOM   892  O  O   . THR A 1 112 ? -2.248  -18.110 29.469 1.00 25.58  ? 112 THR A O   1 
ATOM   893  C  CB  . THR A 1 112 ? 0.635   -16.849 29.873 1.00 34.48  ? 112 THR A CB  1 
ATOM   894  O  OG1 . THR A 1 112 ? 0.942   -18.232 29.669 1.00 31.46  ? 112 THR A OG1 1 
ATOM   895  C  CG2 . THR A 1 112 ? 1.793   -16.200 30.605 1.00 33.75  ? 112 THR A CG2 1 
ATOM   896  N  N   . TRP A 1 113 ? -2.492  -15.874 29.124 1.00 25.28  ? 113 TRP A N   1 
ATOM   897  C  CA  . TRP A 1 113 ? -3.452  -15.999 28.042 1.00 24.94  ? 113 TRP A CA  1 
ATOM   898  C  C   . TRP A 1 113 ? -2.737  -16.360 26.737 1.00 25.24  ? 113 TRP A C   1 
ATOM   899  O  O   . TRP A 1 113 ? -1.531  -16.124 26.572 1.00 22.33  ? 113 TRP A O   1 
ATOM   900  C  CB  . TRP A 1 113 ? -4.241  -14.695 27.875 1.00 25.94  ? 113 TRP A CB  1 
ATOM   901  C  CG  . TRP A 1 113 ? -5.202  -14.384 28.982 1.00 24.99  ? 113 TRP A CG  1 
ATOM   902  C  CD1 . TRP A 1 113 ? -4.974  -13.613 30.085 1.00 22.90  ? 113 TRP A CD1 1 
ATOM   903  C  CD2 . TRP A 1 113 ? -6.573  -14.809 29.058 1.00 24.67  ? 113 TRP A CD2 1 
ATOM   904  N  NE1 . TRP A 1 113 ? -6.094  -13.580 30.865 1.00 23.58  ? 113 TRP A NE1 1 
ATOM   905  C  CE2 . TRP A 1 113 ? -7.096  -14.287 30.255 1.00 24.39  ? 113 TRP A CE2 1 
ATOM   906  C  CE3 . TRP A 1 113 ? -7.404  -15.588 28.241 1.00 26.20  ? 113 TRP A CE3 1 
ATOM   907  C  CZ2 . TRP A 1 113 ? -8.421  -14.502 30.635 1.00 25.77  ? 113 TRP A CZ2 1 
ATOM   908  C  CZ3 . TRP A 1 113 ? -8.708  -15.816 28.626 1.00 25.77  ? 113 TRP A CZ3 1 
ATOM   909  C  CH2 . TRP A 1 113 ? -9.212  -15.269 29.806 1.00 25.53  ? 113 TRP A CH2 1 
ATOM   910  N  N   . ALA A 1 114 ? -3.519  -16.923 25.804 1.00 25.23  ? 114 ALA A N   1 
ATOM   911  C  CA  . ALA A 1 114 ? -3.026  -17.251 24.475 1.00 25.48  ? 114 ALA A CA  1 
ATOM   912  C  C   . ALA A 1 114 ? -2.376  -16.019 23.836 1.00 24.51  ? 114 ALA A C   1 
ATOM   913  O  O   . ALA A 1 114 ? -1.234  -16.081 23.383 1.00 26.15  ? 114 ALA A O   1 
ATOM   914  C  CB  . ALA A 1 114 ? -4.148  -17.828 23.636 1.00 24.09  ? 114 ALA A CB  1 
ATOM   915  N  N   . VAL A 1 115 ? -3.092  -14.895 23.845 1.00 22.61  ? 115 VAL A N   1 
ATOM   916  C  CA  . VAL A 1 115 ? -2.594  -13.635 23.305 1.00 23.66  ? 115 VAL A CA  1 
ATOM   917  C  C   . VAL A 1 115 ? -1.221  -13.250 23.885 1.00 24.50  ? 115 VAL A C   1 
ATOM   918  O  O   . VAL A 1 115 ? -0.334  -12.779 23.162 1.00 24.20  ? 115 VAL A O   1 
ATOM   919  C  CB  . VAL A 1 115 ? -3.633  -12.518 23.547 1.00 22.67  ? 115 VAL A CB  1 
ATOM   920  C  CG1 . VAL A 1 115 ? -3.048  -11.132 23.326 1.00 22.86  ? 115 VAL A CG1 1 
ATOM   921  C  CG2 . VAL A 1 115 ? -4.878  -12.712 22.694 1.00 22.36  ? 115 VAL A CG2 1 
ATOM   922  N  N   . ASP A 1 116 ? -1.076  -13.390 25.210 1.00 25.87  ? 116 ASP A N   1 
ATOM   923  C  CA  . ASP A 1 116 ? 0.109   -12.971 25.939 1.00 24.72  ? 116 ASP A CA  1 
ATOM   924  C  C   . ASP A 1 116 ? 1.323   -13.674 25.348 1.00 22.86  ? 116 ASP A C   1 
ATOM   925  O  O   . ASP A 1 116 ? 2.347   -13.042 25.135 1.00 22.40  ? 116 ASP A O   1 
ATOM   926  C  CB  . ASP A 1 116 ? -0.049  -13.298 27.427 1.00 26.84  ? 116 ASP A CB  1 
ATOM   927  C  CG  . ASP A 1 116 ? -1.174  -12.558 28.132 1.00 29.47  ? 116 ASP A CG  1 
ATOM   928  O  OD1 . ASP A 1 116 ? -1.717  -11.619 27.554 1.00 35.09  ? 116 ASP A OD1 1 
ATOM   929  O  OD2 . ASP A 1 116 ? -1.493  -12.923 29.261 1.00 33.77  ? 116 ASP A OD2 1 
ATOM   930  N  N   . ARG A 1 117 ? 1.152   -14.971 25.061 1.00 23.14  ? 117 ARG A N   1 
ATOM   931  C  CA  . ARG A 1 117 ? 2.187   -15.860 24.542 1.00 24.14  ? 117 ARG A CA  1 
ATOM   932  C  C   . ARG A 1 117 ? 2.400   -15.692 23.035 1.00 22.09  ? 117 ARG A C   1 
ATOM   933  O  O   . ARG A 1 117 ? 3.490   -15.975 22.543 1.00 22.03  ? 117 ARG A O   1 
ATOM   934  C  CB  . ARG A 1 117 ? 1.826   -17.329 24.826 1.00 24.23  ? 117 ARG A CB  1 
ATOM   935  C  CG  . ARG A 1 117 ? 2.085   -17.742 26.267 1.00 23.99  ? 117 ARG A CG  1 
ATOM   936  C  CD  . ARG A 1 117 ? 1.693   -19.155 26.655 1.00 23.25  ? 117 ARG A CD  1 
ATOM   937  N  NE  . ARG A 1 117 ? 0.315   -19.225 27.125 1.00 22.21  ? 117 ARG A NE  1 
ATOM   938  C  CZ  . ARG A 1 117 ? -0.681  -19.803 26.454 1.00 21.34  ? 117 ARG A CZ  1 
ATOM   939  N  NH1 . ARG A 1 117 ? -1.922  -19.720 26.907 1.00 21.21  ? 117 ARG A NH1 1 
ATOM   940  N  NH2 . ARG A 1 117 ? -0.442  -20.435 25.314 1.00 19.98  ? 117 ARG A NH2 1 
ATOM   941  N  N   . LEU A 1 118 ? 1.353   -15.281 22.311 1.00 20.69  ? 118 LEU A N   1 
ATOM   942  C  CA  . LEU A 1 118 ? 1.490   -14.907 20.914 1.00 20.04  ? 118 LEU A CA  1 
ATOM   943  C  C   . LEU A 1 118 ? 2.464   -13.744 20.764 1.00 18.64  ? 118 LEU A C   1 
ATOM   944  O  O   . LEU A 1 118 ? 3.234   -13.707 19.818 1.00 18.60  ? 118 LEU A O   1 
ATOM   945  C  CB  . LEU A 1 118 ? 0.124   -14.545 20.332 1.00 20.03  ? 118 LEU A CB  1 
ATOM   946  C  CG  . LEU A 1 118 ? 0.121   -14.357 18.818 1.00 20.78  ? 118 LEU A CG  1 
ATOM   947  C  CD1 . LEU A 1 118 ? 0.247   -15.694 18.091 1.00 20.76  ? 118 LEU A CD1 1 
ATOM   948  C  CD2 . LEU A 1 118 ? -1.118  -13.601 18.360 1.00 20.72  ? 118 LEU A CD2 1 
ATOM   949  N  N   . ILE A 1 119 ? 2.461   -12.812 21.712 1.00 19.36  ? 119 ILE A N   1 
ATOM   950  C  CA  . ILE A 1 119 ? 3.452   -11.741 21.719 1.00 20.12  ? 119 ILE A CA  1 
ATOM   951  C  C   . ILE A 1 119 ? 4.867   -12.317 21.886 1.00 20.45  ? 119 ILE A C   1 
ATOM   952  O  O   . ILE A 1 119 ? 5.785   -11.980 21.147 1.00 19.25  ? 119 ILE A O   1 
ATOM   953  C  CB  . ILE A 1 119 ? 3.108   -10.706 22.808 1.00 18.80  ? 119 ILE A CB  1 
ATOM   954  C  CG1 . ILE A 1 119 ? 1.685   -10.168 22.605 1.00 19.61  ? 119 ILE A CG1 1 
ATOM   955  C  CG2 . ILE A 1 119 ? 4.162   -9.604  22.838 1.00 17.78  ? 119 ILE A CG2 1 
ATOM   956  C  CD1 . ILE A 1 119 ? 1.162   -9.234  23.691 1.00 19.31  ? 119 ILE A CD1 1 
ATOM   957  N  N   . THR A 1 120 ? 5.040   -13.206 22.862 1.00 22.21  ? 120 THR A N   1 
ATOM   958  C  CA  . THR A 1 120 ? 6.329   -13.816 23.141 1.00 23.63  ? 120 THR A CA  1 
ATOM   959  C  C   . THR A 1 120 ? 6.841   -14.642 21.955 1.00 22.99  ? 120 THR A C   1 
ATOM   960  O  O   . THR A 1 120 ? 8.056   -14.775 21.779 1.00 22.32  ? 120 THR A O   1 
ATOM   961  C  CB  . THR A 1 120 ? 6.205   -14.700 24.385 1.00 25.42  ? 120 THR A CB  1 
ATOM   962  O  OG1 . THR A 1 120 ? 5.403   -14.009 25.341 1.00 25.02  ? 120 THR A OG1 1 
ATOM   963  C  CG2 . THR A 1 120 ? 7.552   -15.041 24.977 1.00 27.47  ? 120 THR A CG2 1 
ATOM   964  N  N   . ALA A 1 121 ? 5.908   -15.209 21.167 1.00 21.93  ? 121 ALA A N   1 
ATOM   965  C  CA  . ALA A 1 121 ? 6.226   -16.045 20.017 1.00 21.48  ? 121 ALA A CA  1 
ATOM   966  C  C   . ALA A 1 121 ? 6.369   -15.230 18.731 1.00 20.00  ? 121 ALA A C   1 
ATOM   967  O  O   . ALA A 1 121 ? 6.338   -15.810 17.654 1.00 18.61  ? 121 ALA A O   1 
ATOM   968  C  CB  . ALA A 1 121 ? 5.145   -17.079 19.841 1.00 21.81  ? 121 ALA A CB  1 
ATOM   969  N  N   . HIS A 1 122 ? 6.505   -13.902 18.855 1.00 20.36  ? 122 HIS A N   1 
ATOM   970  C  CA  . HIS A 1 122 ? 6.686   -12.986 17.733 1.00 20.77  ? 122 HIS A CA  1 
ATOM   971  C  C   . HIS A 1 122 ? 5.541   -13.139 16.733 1.00 19.69  ? 122 HIS A C   1 
ATOM   972  O  O   . HIS A 1 122 ? 5.759   -13.159 15.523 1.00 22.16  ? 122 HIS A O   1 
ATOM   973  C  CB  . HIS A 1 122 ? 8.054   -13.175 17.060 1.00 21.57  ? 122 HIS A CB  1 
ATOM   974  C  CG  . HIS A 1 122 ? 9.234   -12.949 17.947 1.00 22.43  ? 122 HIS A CG  1 
ATOM   975  N  ND1 . HIS A 1 122 ? 10.149  -11.939 17.723 1.00 23.96  ? 122 HIS A ND1 1 
ATOM   976  C  CD2 . HIS A 1 122 ? 9.669   -13.620 19.028 1.00 21.90  ? 122 HIS A CD2 1 
ATOM   977  C  CE1 . HIS A 1 122 ? 11.097  -11.993 18.653 1.00 23.77  ? 122 HIS A CE1 1 
ATOM   978  N  NE2 . HIS A 1 122 ? 10.816  -13.005 19.460 1.00 22.34  ? 122 HIS A NE2 1 
ATOM   979  N  N   . GLY A 1 123 ? 4.319   -13.287 17.248 1.00 17.74  ? 123 GLY A N   1 
ATOM   980  C  CA  . GLY A 1 123 ? 3.135   -13.318 16.403 1.00 17.41  ? 123 GLY A CA  1 
ATOM   981  C  C   . GLY A 1 123 ? 2.799   -14.697 15.825 1.00 16.45  ? 123 GLY A C   1 
ATOM   982  O  O   . GLY A 1 123 ? 1.829   -14.821 15.089 1.00 15.88  ? 123 GLY A O   1 
ATOM   983  N  N   . GLN A 1 124 ? 3.545   -15.742 16.194 1.00 16.02  ? 124 GLN A N   1 
ATOM   984  C  CA  . GLN A 1 124 ? 3.440   -17.021 15.516 1.00 15.74  ? 124 GLN A CA  1 
ATOM   985  C  C   . GLN A 1 124 ? 2.667   -18.047 16.346 1.00 15.63  ? 124 GLN A C   1 
ATOM   986  O  O   . GLN A 1 124 ? 2.952   -18.260 17.521 1.00 15.47  ? 124 GLN A O   1 
ATOM   987  C  CB  . GLN A 1 124 ? 4.842   -17.517 15.184 1.00 15.97  ? 124 GLN A CB  1 
ATOM   988  C  CG  . GLN A 1 124 ? 5.467   -16.757 14.035 1.00 16.26  ? 124 GLN A CG  1 
ATOM   989  C  CD  . GLN A 1 124 ? 6.909   -17.142 13.818 1.00 16.96  ? 124 GLN A CD  1 
ATOM   990  O  OE1 . GLN A 1 124 ? 7.301   -18.296 14.031 1.00 16.06  ? 124 GLN A OE1 1 
ATOM   991  N  NE2 . GLN A 1 124 ? 7.706   -16.156 13.411 1.00 17.40  ? 124 GLN A NE2 1 
ATOM   992  N  N   . HIS A 1 125 ? 1.704   -18.714 15.698 1.00 16.10  ? 125 HIS A N   1 
ATOM   993  C  CA  . HIS A 1 125 ? 1.031   -19.881 16.260 1.00 16.62  ? 125 HIS A CA  1 
ATOM   994  C  C   . HIS A 1 125 ? 0.711   -20.833 15.115 1.00 15.85  ? 125 HIS A C   1 
ATOM   995  O  O   . HIS A 1 125 ? 0.557   -20.370 13.986 1.00 15.78  ? 125 HIS A O   1 
ATOM   996  C  CB  . HIS A 1 125 ? -0.242  -19.468 17.014 1.00 16.97  ? 125 HIS A CB  1 
ATOM   997  C  CG  . HIS A 1 125 ? -1.408  -19.076 16.143 1.00 16.51  ? 125 HIS A CG  1 
ATOM   998  N  ND1 . HIS A 1 125 ? -1.727  -17.779 15.795 1.00 15.80  ? 125 HIS A ND1 1 
ATOM   999  C  CD2 . HIS A 1 125 ? -2.319  -19.842 15.536 1.00 16.05  ? 125 HIS A CD2 1 
ATOM   1000 C  CE1 . HIS A 1 125 ? -2.810  -17.787 15.031 1.00 15.64  ? 125 HIS A CE1 1 
ATOM   1001 N  NE2 . HIS A 1 125 ? -3.186  -19.023 14.866 1.00 15.63  ? 125 HIS A NE2 1 
ATOM   1002 N  N   . SER A 1 126 ? 0.616   -22.138 15.400 1.00 15.83  ? 126 SER A N   1 
ATOM   1003 C  CA  . SER A 1 126 ? 0.611   -23.127 14.323 1.00 16.24  ? 126 SER A CA  1 
ATOM   1004 C  C   . SER A 1 126 ? -0.469  -24.183 14.536 1.00 16.39  ? 126 SER A C   1 
ATOM   1005 O  O   . SER A 1 126 ? -0.979  -24.352 15.650 1.00 15.68  ? 126 SER A O   1 
ATOM   1006 C  CB  . SER A 1 126 ? 1.965   -23.791 14.138 1.00 15.94  ? 126 SER A CB  1 
ATOM   1007 O  OG  . SER A 1 126 ? 3.039   -22.856 14.203 1.00 16.64  ? 126 SER A OG  1 
ATOM   1008 N  N   . VAL A 1 127 ? -0.798  -24.863 13.425 1.00 16.47  ? 127 VAL A N   1 
ATOM   1009 C  CA  . VAL A 1 127 ? -1.660  -26.034 13.402 1.00 17.41  ? 127 VAL A CA  1 
ATOM   1010 C  C   . VAL A 1 127 ? -1.022  -27.073 12.486 1.00 18.55  ? 127 VAL A C   1 
ATOM   1011 O  O   . VAL A 1 127 ? -0.262  -26.729 11.574 1.00 18.74  ? 127 VAL A O   1 
ATOM   1012 C  CB  . VAL A 1 127 ? -3.092  -25.741 12.902 1.00 17.76  ? 127 VAL A CB  1 
ATOM   1013 C  CG1 . VAL A 1 127 ? -3.911  -24.895 13.860 1.00 17.99  ? 127 VAL A CG1 1 
ATOM   1014 C  CG2 . VAL A 1 127 ? -3.081  -25.113 11.521 1.00 18.81  ? 127 VAL A CG2 1 
ATOM   1015 N  N   . VAL A 1 128 ? -1.411  -28.336 12.695 1.00 19.03  ? 128 VAL A N   1 
ATOM   1016 C  CA  . VAL A 1 128 ? -0.930  -29.430 11.874 1.00 19.65  ? 128 VAL A CA  1 
ATOM   1017 C  C   . VAL A 1 128 ? -2.039  -29.820 10.903 1.00 20.48  ? 128 VAL A C   1 
ATOM   1018 O  O   . VAL A 1 128 ? -3.170  -30.032 11.315 1.00 19.95  ? 128 VAL A O   1 
ATOM   1019 C  CB  . VAL A 1 128 ? -0.468  -30.621 12.728 1.00 19.78  ? 128 VAL A CB  1 
ATOM   1020 C  CG1 . VAL A 1 128 ? 0.176   -31.676 11.859 1.00 20.26  ? 128 VAL A CG1 1 
ATOM   1021 C  CG2 . VAL A 1 128 ? 0.491   -30.195 13.826 1.00 19.96  ? 128 VAL A CG2 1 
ATOM   1022 N  N   . VAL A 1 129 ? -1.688  -29.916 9.616  1.00 21.52  ? 129 VAL A N   1 
ATOM   1023 C  CA  . VAL A 1 129 ? -2.653  -30.098 8.553  1.00 22.96  ? 129 VAL A CA  1 
ATOM   1024 C  C   . VAL A 1 129 ? -3.274  -31.480 8.716  1.00 25.38  ? 129 VAL A C   1 
ATOM   1025 O  O   . VAL A 1 129 ? -2.553  -32.476 8.686  1.00 28.98  ? 129 VAL A O   1 
ATOM   1026 C  CB  . VAL A 1 129 ? -1.988  -29.952 7.171  1.00 23.16  ? 129 VAL A CB  1 
ATOM   1027 C  CG1 . VAL A 1 129 ? -2.967  -30.199 6.033  1.00 22.85  ? 129 VAL A CG1 1 
ATOM   1028 C  CG2 . VAL A 1 129 ? -1.338  -28.592 7.004  1.00 24.70  ? 129 VAL A CG2 1 
ATOM   1029 N  N   . PRO A 1 130 ? -4.615  -31.583 8.858  1.00 25.77  ? 130 PRO A N   1 
ATOM   1030 C  CA  . PRO A 1 130 ? -5.286  -32.871 9.064  1.00 27.27  ? 130 PRO A CA  1 
ATOM   1031 C  C   . PRO A 1 130 ? -5.468  -33.678 7.775  1.00 26.60  ? 130 PRO A C   1 
ATOM   1032 O  O   . PRO A 1 130 ? -5.418  -33.102 6.700  1.00 28.99  ? 130 PRO A O   1 
ATOM   1033 C  CB  . PRO A 1 130 ? -6.633  -32.423 9.652  1.00 26.69  ? 130 PRO A CB  1 
ATOM   1034 C  CG  . PRO A 1 130 ? -6.904  -31.144 8.932  1.00 25.97  ? 130 PRO A CG  1 
ATOM   1035 C  CD  . PRO A 1 130 ? -5.558  -30.459 8.845  1.00 25.50  ? 130 PRO A CD  1 
ATOM   1036 N  N   . HIS A 1 131 ? -5.691  -35.000 7.900  1.00 26.24  ? 131 HIS A N   1 
ATOM   1037 C  CA  . HIS A 1 131 ? -5.797  -35.921 6.776  1.00 24.68  ? 131 HIS A CA  1 
ATOM   1038 C  C   . HIS A 1 131 ? -7.177  -35.863 6.119  1.00 22.90  ? 131 HIS A C   1 
ATOM   1039 O  O   . HIS A 1 131 ? -7.952  -36.789 6.276  1.00 21.15  ? 131 HIS A O   1 
ATOM   1040 C  CB  . HIS A 1 131 ? -5.518  -37.353 7.245  1.00 26.59  ? 131 HIS A CB  1 
ATOM   1041 C  CG  . HIS A 1 131 ? -4.126  -37.559 7.761  1.00 30.57  ? 131 HIS A CG  1 
ATOM   1042 N  ND1 . HIS A 1 131 ? -3.067  -37.995 6.981  1.00 32.44  ? 131 HIS A ND1 1 
ATOM   1043 C  CD2 . HIS A 1 131 ? -3.628  -37.354 8.980  1.00 32.46  ? 131 HIS A CD2 1 
ATOM   1044 C  CE1 . HIS A 1 131 ? -1.966  -38.034 7.706  1.00 33.11  ? 131 HIS A CE1 1 
ATOM   1045 N  NE2 . HIS A 1 131 ? -2.286  -37.662 8.933  1.00 35.76  ? 131 HIS A NE2 1 
ATOM   1046 N  N   . VAL A 1 132 ? -7.449  -34.797 5.350  1.00 22.79  ? 132 VAL A N   1 
ATOM   1047 C  CA  . VAL A 1 132 ? -8.748  -34.541 4.741  1.00 22.50  ? 132 VAL A CA  1 
ATOM   1048 C  C   . VAL A 1 132 ? -8.604  -34.649 3.224  1.00 22.10  ? 132 VAL A C   1 
ATOM   1049 O  O   . VAL A 1 132 ? -7.508  -34.853 2.711  1.00 23.60  ? 132 VAL A O   1 
ATOM   1050 C  CB  . VAL A 1 132 ? -9.318  -33.163 5.151  1.00 23.42  ? 132 VAL A CB  1 
ATOM   1051 C  CG1 . VAL A 1 132 ? -9.525  -33.046 6.650  1.00 23.67  ? 132 VAL A CG1 1 
ATOM   1052 C  CG2 . VAL A 1 132 ? -8.467  -32.000 4.664  1.00 24.02  ? 132 VAL A CG2 1 
ATOM   1053 N  N   . ALA A 1 133 ? -9.721  -34.531 2.510  1.00 21.75  ? 133 ALA A N   1 
ATOM   1054 C  CA  . ALA A 1 133 ? -9.720  -34.680 1.065  1.00 22.77  ? 133 ALA A CA  1 
ATOM   1055 C  C   . ALA A 1 133 ? -8.830  -33.626 0.436  1.00 22.75  ? 133 ALA A C   1 
ATOM   1056 O  O   . ALA A 1 133 ? -8.997  -32.452 0.721  1.00 23.70  ? 133 ALA A O   1 
ATOM   1057 C  CB  . ALA A 1 133 ? -11.108 -34.518 0.518  1.00 23.35  ? 133 ALA A CB  1 
ATOM   1058 N  N   . PRO A 1 134 ? -7.899  -33.992 -0.465 1.00 24.56  ? 134 PRO A N   1 
ATOM   1059 C  CA  . PRO A 1 134 ? -7.117  -32.990 -1.186 1.00 25.82  ? 134 PRO A CA  1 
ATOM   1060 C  C   . PRO A 1 134 ? -8.032  -31.995 -1.889 1.00 27.02  ? 134 PRO A C   1 
ATOM   1061 O  O   . PRO A 1 134 ? -9.060  -32.380 -2.445 1.00 29.47  ? 134 PRO A O   1 
ATOM   1062 C  CB  . PRO A 1 134 ? -6.277  -33.799 -2.185 1.00 25.70  ? 134 PRO A CB  1 
ATOM   1063 C  CG  . PRO A 1 134 ? -6.197  -35.186 -1.561 1.00 25.70  ? 134 PRO A CG  1 
ATOM   1064 C  CD  . PRO A 1 134 ? -7.495  -35.366 -0.793 1.00 25.71  ? 134 PRO A CD  1 
ATOM   1065 N  N   . GLY A 1 135 ? -7.644  -30.717 -1.832 1.00 27.89  ? 135 GLY A N   1 
ATOM   1066 C  CA  . GLY A 1 135 ? -8.354  -29.642 -2.510 1.00 25.96  ? 135 GLY A CA  1 
ATOM   1067 C  C   . GLY A 1 135 ? -8.080  -28.303 -1.831 1.00 23.51  ? 135 GLY A C   1 
ATOM   1068 O  O   . GLY A 1 135 ? -7.198  -28.210 -0.985 1.00 21.18  ? 135 GLY A O   1 
ATOM   1069 N  N   . ASP A 1 136 ? -8.889  -27.301 -2.190 1.00 23.35  ? 136 ASP A N   1 
ATOM   1070 C  CA  . ASP A 1 136 ? -8.765  -25.939 -1.689 1.00 22.92  ? 136 ASP A CA  1 
ATOM   1071 C  C   . ASP A 1 136 ? -9.558  -25.748 -0.386 1.00 21.68  ? 136 ASP A C   1 
ATOM   1072 O  O   . ASP A 1 136 ? -10.674 -26.228 -0.207 1.00 22.41  ? 136 ASP A O   1 
ATOM   1073 C  CB  . ASP A 1 136 ? -9.139  -24.958 -2.800 1.00 22.57  ? 136 ASP A CB  1 
ATOM   1074 C  CG  . ASP A 1 136 ? -8.199  -25.033 -3.996 1.00 24.43  ? 136 ASP A CG  1 
ATOM   1075 O  OD1 . ASP A 1 136 ? -7.078  -25.579 -3.854 1.00 27.44  ? 136 ASP A OD1 1 
ATOM   1076 O  OD2 . ASP A 1 136 ? -8.590  -24.565 -5.070 1.00 25.18  ? 136 ASP A OD2 1 
ATOM   1077 N  N   . TYR A 1 137 ? -8.937  -25.031 0.547  1.00 20.92  ? 137 TYR A N   1 
ATOM   1078 C  CA  . TYR A 1 137 ? -9.499  -24.789 1.858  1.00 19.80  ? 137 TYR A CA  1 
ATOM   1079 C  C   . TYR A 1 137 ? -9.304  -23.318 2.237  1.00 19.17  ? 137 TYR A C   1 
ATOM   1080 O  O   . TYR A 1 137 ? -8.432  -22.627 1.683  1.00 18.18  ? 137 TYR A O   1 
ATOM   1081 C  CB  . TYR A 1 137 ? -8.867  -25.759 2.859  1.00 19.77  ? 137 TYR A CB  1 
ATOM   1082 C  CG  . TYR A 1 137 ? -9.325  -27.177 2.663  1.00 21.16  ? 137 TYR A CG  1 
ATOM   1083 C  CD1 . TYR A 1 137 ? -8.702  -28.008 1.751  1.00 21.86  ? 137 TYR A CD1 1 
ATOM   1084 C  CD2 . TYR A 1 137 ? -10.402 -27.686 3.374  1.00 22.96  ? 137 TYR A CD2 1 
ATOM   1085 C  CE1 . TYR A 1 137 ? -9.137  -29.310 1.544  1.00 22.90  ? 137 TYR A CE1 1 
ATOM   1086 C  CE2 . TYR A 1 137 ? -10.855 -28.984 3.181  1.00 24.10  ? 137 TYR A CE2 1 
ATOM   1087 C  CZ  . TYR A 1 137 ? -10.213 -29.804 2.265  1.00 24.10  ? 137 TYR A CZ  1 
ATOM   1088 O  OH  . TYR A 1 137 ? -10.658 -31.088 2.065  1.00 24.12  ? 137 TYR A OH  1 
ATOM   1089 N  N   . LEU A 1 138 ? -10.159 -22.849 3.168  1.00 17.70  ? 138 LEU A N   1 
ATOM   1090 C  CA  . LEU A 1 138 ? -9.888  -21.652 3.952  1.00 17.06  ? 138 LEU A CA  1 
ATOM   1091 C  C   . LEU A 1 138 ? -9.596  -22.053 5.398  1.00 17.53  ? 138 LEU A C   1 
ATOM   1092 O  O   . LEU A 1 138 ? -10.354 -22.827 5.986  1.00 16.85  ? 138 LEU A O   1 
ATOM   1093 C  CB  . LEU A 1 138 ? -11.087 -20.713 3.882  1.00 16.40  ? 138 LEU A CB  1 
ATOM   1094 C  CG  . LEU A 1 138 ? -11.517 -20.331 2.473  1.00 16.50  ? 138 LEU A CG  1 
ATOM   1095 C  CD1 . LEU A 1 138 ? -12.907 -19.715 2.502  1.00 17.10  ? 138 LEU A CD1 1 
ATOM   1096 C  CD2 . LEU A 1 138 ? -10.521 -19.378 1.828  1.00 16.30  ? 138 LEU A CD2 1 
ATOM   1097 N  N   . PHE A 1 139 ? -8.461  -21.557 5.933  1.00 18.12  ? 139 PHE A N   1 
ATOM   1098 C  CA  . PHE A 1 139 ? -8.147  -21.637 7.358  1.00 18.19  ? 139 PHE A CA  1 
ATOM   1099 C  C   . PHE A 1 139 ? -8.380  -20.250 7.960  1.00 17.79  ? 139 PHE A C   1 
ATOM   1100 O  O   . PHE A 1 139 ? -7.776  -19.274 7.496  1.00 16.44  ? 139 PHE A O   1 
ATOM   1101 C  CB  . PHE A 1 139 ? -6.710  -22.102 7.638  1.00 18.05  ? 139 PHE A CB  1 
ATOM   1102 C  CG  . PHE A 1 139 ? -6.402  -23.535 7.288  1.00 18.55  ? 139 PHE A CG  1 
ATOM   1103 C  CD1 . PHE A 1 139 ? -6.646  -24.025 6.019  1.00 18.84  ? 139 PHE A CD1 1 
ATOM   1104 C  CD2 . PHE A 1 139 ? -5.843  -24.397 8.226  1.00 20.99  ? 139 PHE A CD2 1 
ATOM   1105 C  CE1 . PHE A 1 139 ? -6.363  -25.345 5.704  1.00 19.53  ? 139 PHE A CE1 1 
ATOM   1106 C  CE2 . PHE A 1 139 ? -5.539  -25.717 7.907  1.00 20.57  ? 139 PHE A CE2 1 
ATOM   1107 C  CZ  . PHE A 1 139 ? -5.804  -26.187 6.644  1.00 20.01  ? 139 PHE A CZ  1 
ATOM   1108 N  N   . ARG A 1 140 ? -9.276  -20.201 8.972  1.00 17.23  ? 140 ARG A N   1 
ATOM   1109 C  CA  . ARG A 1 140 ? -9.709  -18.981 9.640  1.00 15.90  ? 140 ARG A CA  1 
ATOM   1110 C  C   . ARG A 1 140 ? -9.066  -18.909 11.033 1.00 14.84  ? 140 ARG A C   1 
ATOM   1111 O  O   . ARG A 1 140 ? -9.382  -19.688 11.919 1.00 13.11  ? 140 ARG A O   1 
ATOM   1112 C  CB  . ARG A 1 140 ? -11.236 -19.010 9.642  1.00 15.58  ? 140 ARG A CB  1 
ATOM   1113 C  CG  . ARG A 1 140 ? -11.921 -17.820 10.290 1.00 15.39  ? 140 ARG A CG  1 
ATOM   1114 C  CD  . ARG A 1 140 ? -13.409 -18.097 10.416 1.00 15.28  ? 140 ARG A CD  1 
ATOM   1115 N  NE  . ARG A 1 140 ? -14.179 -17.022 11.020 1.00 15.30  ? 140 ARG A NE  1 
ATOM   1116 C  CZ  . ARG A 1 140 ? -14.238 -16.789 12.319 1.00 15.82  ? 140 ARG A CZ  1 
ATOM   1117 N  NH1 . ARG A 1 140 ? -13.661 -17.631 13.147 1.00 16.68  ? 140 ARG A NH1 1 
ATOM   1118 N  NH2 . ARG A 1 140 ? -14.892 -15.745 12.795 1.00 16.28  ? 140 ARG A NH2 1 
ATOM   1119 N  N   . ALA A 1 141 ? -8.090  -18.010 11.189 1.00 14.84  ? 141 ALA A N   1 
ATOM   1120 C  CA  . ALA A 1 141 ? -7.492  -17.720 12.485 1.00 15.51  ? 141 ALA A CA  1 
ATOM   1121 C  C   . ALA A 1 141 ? -8.270  -16.599 13.164 1.00 15.36  ? 141 ALA A C   1 
ATOM   1122 O  O   . ALA A 1 141 ? -8.570  -15.584 12.534 1.00 15.83  ? 141 ALA A O   1 
ATOM   1123 C  CB  . ALA A 1 141 ? -6.048  -17.311 12.324 1.00 15.94  ? 141 ALA A CB  1 
ATOM   1124 N  N   . GLU A 1 142 ? -8.569  -16.786 14.454 1.00 15.44  ? 142 GLU A N   1 
ATOM   1125 C  CA  . GLU A 1 142 ? -9.427  -15.882 15.206 1.00 15.22  ? 142 GLU A CA  1 
ATOM   1126 C  C   . GLU A 1 142 ? -8.832  -15.619 16.589 1.00 15.87  ? 142 GLU A C   1 
ATOM   1127 O  O   . GLU A 1 142 ? -8.621  -16.550 17.389 1.00 14.10  ? 142 GLU A O   1 
ATOM   1128 C  CB  . GLU A 1 142 ? -10.824 -16.496 15.305 1.00 14.61  ? 142 GLU A CB  1 
ATOM   1129 C  CG  . GLU A 1 142 ? -11.839 -15.704 16.117 1.00 13.75  ? 142 GLU A CG  1 
ATOM   1130 C  CD  . GLU A 1 142 ? -13.076 -16.522 16.456 1.00 12.79  ? 142 GLU A CD  1 
ATOM   1131 O  OE1 . GLU A 1 142 ? -13.060 -17.238 17.473 1.00 12.16  ? 142 GLU A OE1 1 
ATOM   1132 O  OE2 . GLU A 1 142 ? -14.030 -16.480 15.666 1.00 12.21  ? 142 GLU A OE2 1 
ATOM   1133 N  N   . ILE A 1 143 ? -8.600  -14.321 16.844 1.00 16.96  ? 143 ILE A N   1 
ATOM   1134 C  CA  . ILE A 1 143 ? -8.229  -13.830 18.163 1.00 18.18  ? 143 ILE A CA  1 
ATOM   1135 C  C   . ILE A 1 143 ? -9.405  -13.062 18.752 1.00 17.67  ? 143 ILE A C   1 
ATOM   1136 O  O   . ILE A 1 143 ? -9.912  -12.125 18.131 1.00 17.58  ? 143 ILE A O   1 
ATOM   1137 C  CB  . ILE A 1 143 ? -6.977  -12.931 18.093 1.00 19.44  ? 143 ILE A CB  1 
ATOM   1138 C  CG1 . ILE A 1 143 ? -5.847  -13.618 17.320 1.00 20.13  ? 143 ILE A CG1 1 
ATOM   1139 C  CG2 . ILE A 1 143 ? -6.540  -12.497 19.491 1.00 19.58  ? 143 ILE A CG2 1 
ATOM   1140 C  CD1 . ILE A 1 143 ? -4.606  -12.775 17.128 1.00 20.02  ? 143 ILE A CD1 1 
ATOM   1141 N  N   . ILE A 1 144 ? -9.785  -13.442 19.972 1.00 17.50  ? 144 ILE A N   1 
ATOM   1142 C  CA  . ILE A 1 144 ? -10.782 -12.705 20.726 1.00 18.30  ? 144 ILE A CA  1 
ATOM   1143 C  C   . ILE A 1 144 ? -10.103 -11.899 21.834 1.00 18.88  ? 144 ILE A C   1 
ATOM   1144 O  O   . ILE A 1 144 ? -9.459  -12.444 22.716 1.00 19.26  ? 144 ILE A O   1 
ATOM   1145 C  CB  . ILE A 1 144 ? -11.841 -13.673 21.281 1.00 18.29  ? 144 ILE A CB  1 
ATOM   1146 C  CG1 . ILE A 1 144 ? -12.350 -14.622 20.194 1.00 17.89  ? 144 ILE A CG1 1 
ATOM   1147 C  CG2 . ILE A 1 144 ? -12.967 -12.893 21.932 1.00 19.03  ? 144 ILE A CG2 1 
ATOM   1148 C  CD1 . ILE A 1 144 ? -13.481 -15.540 20.609 1.00 17.79  ? 144 ILE A CD1 1 
ATOM   1149 N  N   . ALA A 1 145 ? -10.244 -10.575 21.795 1.00 20.68  ? 145 ALA A N   1 
ATOM   1150 C  CA  . ALA A 1 145 ? -9.678  -9.721  22.831 1.00 20.06  ? 145 ALA A CA  1 
ATOM   1151 C  C   . ALA A 1 145 ? -10.813 -9.260  23.737 1.00 20.56  ? 145 ALA A C   1 
ATOM   1152 O  O   . ALA A 1 145 ? -11.823 -8.756  23.238 1.00 20.00  ? 145 ALA A O   1 
ATOM   1153 C  CB  . ALA A 1 145 ? -8.936  -8.566  22.208 1.00 19.49  ? 145 ALA A CB  1 
ATOM   1154 N  N   . LEU A 1 146 ? -10.636 -9.473  25.054 1.00 22.19  ? 146 LEU A N   1 
ATOM   1155 C  CA  . LEU A 1 146 ? -11.733 -9.449  26.021 1.00 23.25  ? 146 LEU A CA  1 
ATOM   1156 C  C   . LEU A 1 146 ? -11.733 -8.184  26.883 1.00 23.47  ? 146 LEU A C   1 
ATOM   1157 O  O   . LEU A 1 146 ? -12.518 -8.070  27.821 1.00 24.77  ? 146 LEU A O   1 
ATOM   1158 C  CB  . LEU A 1 146 ? -11.616 -10.682 26.920 1.00 22.71  ? 146 LEU A CB  1 
ATOM   1159 C  CG  . LEU A 1 146 ? -11.728 -12.023 26.204 1.00 24.20  ? 146 LEU A CG  1 
ATOM   1160 C  CD1 . LEU A 1 146 ? -11.497 -13.183 27.169 1.00 25.28  ? 146 LEU A CD1 1 
ATOM   1161 C  CD2 . LEU A 1 146 ? -13.085 -12.164 25.546 1.00 24.38  ? 146 LEU A CD2 1 
ATOM   1162 N  N   . HIS A 1 147 ? -10.875 -7.214  26.566 1.00 23.95  ? 147 HIS A N   1 
ATOM   1163 C  CA  . HIS A 1 147 ? -10.686 -6.068  27.444 1.00 23.92  ? 147 HIS A CA  1 
ATOM   1164 C  C   . HIS A 1 147 ? -11.921 -5.148  27.484 1.00 23.98  ? 147 HIS A C   1 
ATOM   1165 O  O   . HIS A 1 147 ? -11.991 -4.265  28.329 1.00 24.15  ? 147 HIS A O   1 
ATOM   1166 C  CB  . HIS A 1 147 ? -9.379  -5.353  27.078 1.00 23.25  ? 147 HIS A CB  1 
ATOM   1167 C  CG  . HIS A 1 147 ? -9.345  -4.823  25.685 1.00 22.97  ? 147 HIS A CG  1 
ATOM   1168 N  ND1 . HIS A 1 147 ? -9.156  -5.662  24.611 1.00 22.49  ? 147 HIS A ND1 1 
ATOM   1169 C  CD2 . HIS A 1 147 ? -9.456  -3.583  25.181 1.00 22.62  ? 147 HIS A CD2 1 
ATOM   1170 C  CE1 . HIS A 1 147 ? -9.161  -4.941  23.496 1.00 22.85  ? 147 HIS A CE1 1 
ATOM   1171 N  NE2 . HIS A 1 147 ? -9.316  -3.678  23.817 1.00 22.23  ? 147 HIS A NE2 1 
ATOM   1172 N  N   . GLU A 1 148 ? -12.922 -5.339  26.619 1.00 23.23  ? 148 GLU A N   1 
ATOM   1173 C  CA  . GLU A 1 148 ? -14.141 -4.556  26.754 1.00 23.76  ? 148 GLU A CA  1 
ATOM   1174 C  C   . GLU A 1 148 ? -15.358 -5.474  26.669 1.00 23.60  ? 148 GLU A C   1 
ATOM   1175 O  O   . GLU A 1 148 ? -16.435 -5.028  26.277 1.00 23.17  ? 148 GLU A O   1 
ATOM   1176 C  CB  . GLU A 1 148 ? -14.165 -3.439  25.702 1.00 25.49  ? 148 GLU A CB  1 
ATOM   1177 C  CG  . GLU A 1 148 ? -12.992 -2.455  25.795 1.00 26.09  ? 148 GLU A CG  1 
ATOM   1178 C  CD  . GLU A 1 148 ? -12.996 -1.277  24.825 1.00 26.27  ? 148 GLU A CD  1 
ATOM   1179 O  OE1 . GLU A 1 148 ? -12.141 -0.377  25.029 1.00 26.87  ? 148 GLU A OE1 1 
ATOM   1180 O  OE2 . GLU A 1 148 ? -13.831 -1.259  23.866 1.00 22.00  ? 148 GLU A OE2 1 
ATOM   1181 N  N   . ALA A 1 149 ? -15.196 -6.734  27.110 1.00 24.00  ? 149 ALA A N   1 
ATOM   1182 C  CA  . ALA A 1 149 ? -16.192 -7.780  26.897 1.00 24.00  ? 149 ALA A CA  1 
ATOM   1183 C  C   . ALA A 1 149 ? -17.101 -7.983  28.117 1.00 25.10  ? 149 ALA A C   1 
ATOM   1184 O  O   . ALA A 1 149 ? -17.925 -8.894  28.138 1.00 23.29  ? 149 ALA A O   1 
ATOM   1185 C  CB  . ALA A 1 149 ? -15.497 -9.062  26.495 1.00 22.70  ? 149 ALA A CB  1 
ATOM   1186 N  N   . ASP A 1 150 ? -16.984 -7.112  29.123 1.00 28.00  ? 150 ASP A N   1 
ATOM   1187 C  CA  . ASP A 1 150 ? -17.944 -7.070  30.214 1.00 31.40  ? 150 ASP A CA  1 
ATOM   1188 C  C   . ASP A 1 150 ? -19.274 -6.506  29.709 1.00 30.40  ? 150 ASP A C   1 
ATOM   1189 O  O   . ASP A 1 150 ? -20.275 -6.659  30.402 1.00 35.00  ? 150 ASP A O   1 
ATOM   1190 C  CB  . ASP A 1 150 ? -17.409 -6.266  31.408 1.00 38.43  ? 150 ASP A CB  1 
ATOM   1191 C  CG  . ASP A 1 150 ? -17.081 -4.796  31.131 1.00 44.89  ? 150 ASP A CG  1 
ATOM   1192 O  OD1 . ASP A 1 150 ? -18.014 -4.037  30.742 1.00 49.36  ? 150 ASP A OD1 1 
ATOM   1193 O  OD2 . ASP A 1 150 ? -15.904 -4.397  31.341 1.00 42.27  ? 150 ASP A OD2 1 
ATOM   1194 N  N   . SER A 1 151 ? -19.257 -5.818  28.546 1.00 27.29  ? 151 SER A N   1 
ATOM   1195 C  CA  . SER A 1 151 ? -20.451 -5.365  27.836 1.00 24.86  ? 151 SER A CA  1 
ATOM   1196 C  C   . SER A 1 151 ? -20.641 -6.199  26.576 1.00 22.09  ? 151 SER A C   1 
ATOM   1197 O  O   . SER A 1 151 ? -19.705 -6.850  26.140 1.00 19.92  ? 151 SER A O   1 
ATOM   1198 C  CB  . SER A 1 151 ? -20.377 -3.899  27.429 1.00 24.96  ? 151 SER A CB  1 
ATOM   1199 O  OG  . SER A 1 151 ? -20.355 -3.021  28.543 1.00 24.79  ? 151 SER A OG  1 
ATOM   1200 N  N   . LEU A 1 152 ? -21.833 -6.071  25.972 1.00 21.23  ? 152 LEU A N   1 
ATOM   1201 C  CA  . LEU A 1 152 ? -22.168 -6.655  24.682 1.00 19.34  ? 152 LEU A CA  1 
ATOM   1202 C  C   . LEU A 1 152 ? -22.322 -5.558  23.636 1.00 18.25  ? 152 LEU A C   1 
ATOM   1203 O  O   . LEU A 1 152 ? -23.014 -4.588  23.900 1.00 18.77  ? 152 LEU A O   1 
ATOM   1204 C  CB  . LEU A 1 152 ? -23.487 -7.417  24.801 1.00 19.79  ? 152 LEU A CB  1 
ATOM   1205 C  CG  . LEU A 1 152 ? -23.529 -8.576  25.800 1.00 21.41  ? 152 LEU A CG  1 
ATOM   1206 C  CD1 . LEU A 1 152 ? -24.968 -8.848  26.238 1.00 21.16  ? 152 LEU A CD1 1 
ATOM   1207 C  CD2 . LEU A 1 152 ? -22.928 -9.856  25.210 1.00 22.26  ? 152 LEU A CD2 1 
ATOM   1208 N  N   . TYR A 1 153 ? -21.736 -5.770  22.445 1.00 17.81  ? 153 TYR A N   1 
ATOM   1209 C  CA  . TYR A 1 153 ? -21.820 -4.891  21.278 1.00 17.87  ? 153 TYR A CA  1 
ATOM   1210 C  C   . TYR A 1 153 ? -23.270 -4.646  20.840 1.00 17.08  ? 153 TYR A C   1 
ATOM   1211 O  O   . TYR A 1 153 ? -23.564 -3.568  20.341 1.00 15.57  ? 153 TYR A O   1 
ATOM   1212 C  CB  . TYR A 1 153 ? -20.950 -5.435  20.120 1.00 17.94  ? 153 TYR A CB  1 
ATOM   1213 C  CG  . TYR A 1 153 ? -21.086 -4.663  18.832 1.00 17.80  ? 153 TYR A CG  1 
ATOM   1214 C  CD1 . TYR A 1 153 ? -22.147 -4.891  17.966 1.00 17.62  ? 153 TYR A CD1 1 
ATOM   1215 C  CD2 . TYR A 1 153 ? -20.215 -3.626  18.535 1.00 18.02  ? 153 TYR A CD2 1 
ATOM   1216 C  CE1 . TYR A 1 153 ? -22.315 -4.142  16.816 1.00 17.72  ? 153 TYR A CE1 1 
ATOM   1217 C  CE2 . TYR A 1 153 ? -20.367 -2.863  17.390 1.00 17.61  ? 153 TYR A CE2 1 
ATOM   1218 C  CZ  . TYR A 1 153 ? -21.427 -3.123  16.538 1.00 18.44  ? 153 TYR A CZ  1 
ATOM   1219 O  OH  . TYR A 1 153 ? -21.620 -2.359  15.427 1.00 20.24  ? 153 TYR A OH  1 
ATOM   1220 N  N   . SER A 1 154 ? -24.171 -5.624  21.044 1.00 18.71  ? 154 SER A N   1 
ATOM   1221 C  CA  . SER A 1 154 ? -25.582 -5.515  20.673 1.00 19.69  ? 154 SER A CA  1 
ATOM   1222 C  C   . SER A 1 154 ? -26.287 -4.512  21.578 1.00 22.02  ? 154 SER A C   1 
ATOM   1223 O  O   . SER A 1 154 ? -27.211 -3.848  21.132 1.00 23.00  ? 154 SER A O   1 
ATOM   1224 C  CB  . SER A 1 154 ? -26.318 -6.837  20.727 1.00 17.99  ? 154 SER A CB  1 
ATOM   1225 O  OG  . SER A 1 154 ? -26.254 -7.405  22.025 1.00 16.78  ? 154 SER A OG  1 
ATOM   1226 N  N   . GLN A 1 155 ? -25.851 -4.435  22.845 1.00 23.64  ? 155 GLN A N   1 
ATOM   1227 C  CA  A GLN A 1 155 ? -26.407 -3.492  23.801 0.50 24.45  ? 155 GLN A CA  1 
ATOM   1228 C  CA  B GLN A 1 155 ? -26.406 -3.492  23.801 0.50 24.64  ? 155 GLN A CA  1 
ATOM   1229 C  C   . GLN A 1 155 ? -25.625 -2.177  23.749 1.00 24.18  ? 155 GLN A C   1 
ATOM   1230 O  O   . GLN A 1 155 ? -26.215 -1.115  23.935 1.00 24.40  ? 155 GLN A O   1 
ATOM   1231 C  CB  A GLN A 1 155 ? -26.395 -4.076  25.219 0.50 25.85  ? 155 GLN A CB  1 
ATOM   1232 C  CB  B GLN A 1 155 ? -26.393 -4.085  25.215 0.50 26.32  ? 155 GLN A CB  1 
ATOM   1233 C  CG  A GLN A 1 155 ? -27.051 -5.448  25.359 0.50 27.08  ? 155 GLN A CG  1 
ATOM   1234 C  CG  B GLN A 1 155 ? -27.073 -5.445  25.335 0.50 27.82  ? 155 GLN A CG  1 
ATOM   1235 C  CD  A GLN A 1 155 ? -28.335 -5.598  24.576 0.50 29.28  ? 155 GLN A CD  1 
ATOM   1236 C  CD  B GLN A 1 155 ? -28.350 -5.543  24.534 0.50 30.38  ? 155 GLN A CD  1 
ATOM   1237 O  OE1 A GLN A 1 155 ? -29.287 -4.838  24.734 0.50 30.94  ? 155 GLN A OE1 1 
ATOM   1238 O  OE1 B GLN A 1 155 ? -28.454 -6.312  23.581 0.50 32.39  ? 155 GLN A OE1 1 
ATOM   1239 N  NE2 A GLN A 1 155 ? -28.371 -6.591  23.703 0.50 30.38  ? 155 GLN A NE2 1 
ATOM   1240 N  NE2 B GLN A 1 155 ? -29.340 -4.749  24.902 0.50 31.75  ? 155 GLN A NE2 1 
ATOM   1241 N  N   . ASN A 1 156 ? -24.297 -2.249  23.501 1.00 21.70  ? 156 ASN A N   1 
ATOM   1242 C  CA  . ASN A 1 156 ? -23.430 -1.074  23.524 1.00 20.44  ? 156 ASN A CA  1 
ATOM   1243 C  C   . ASN A 1 156 ? -22.367 -1.153  22.440 1.00 20.54  ? 156 ASN A C   1 
ATOM   1244 O  O   . ASN A 1 156 ? -21.319 -1.761  22.629 1.00 20.58  ? 156 ASN A O   1 
ATOM   1245 C  CB  . ASN A 1 156 ? -22.713 -0.894  24.863 1.00 20.15  ? 156 ASN A CB  1 
ATOM   1246 C  CG  . ASN A 1 156 ? -21.892 0.376   24.963 1.00 19.97  ? 156 ASN A CG  1 
ATOM   1247 O  OD1 . ASN A 1 156 ? -21.720 1.122   24.004 1.00 18.77  ? 156 ASN A OD1 1 
ATOM   1248 N  ND2 . ASN A 1 156 ? -21.369 0.636   26.146 1.00 21.79  ? 156 ASN A ND2 1 
ATOM   1249 N  N   . PRO A 1 157 ? -22.569 -0.463  21.300 1.00 22.66  ? 157 PRO A N   1 
ATOM   1250 C  CA  . PRO A 1 157 ? -21.709 -0.635  20.128 1.00 22.05  ? 157 PRO A CA  1 
ATOM   1251 C  C   . PRO A 1 157 ? -20.299 -0.074  20.269 1.00 20.84  ? 157 PRO A C   1 
ATOM   1252 O  O   . PRO A 1 157 ? -19.455 -0.371  19.429 1.00 21.65  ? 157 PRO A O   1 
ATOM   1253 C  CB  . PRO A 1 157 ? -22.438 0.090   18.981 1.00 22.04  ? 157 PRO A CB  1 
ATOM   1254 C  CG  . PRO A 1 157 ? -23.812 0.459   19.533 1.00 22.59  ? 157 PRO A CG  1 
ATOM   1255 C  CD  . PRO A 1 157 ? -23.670 0.479   21.044 1.00 23.41  ? 157 PRO A CD  1 
ATOM   1256 N  N   . ILE A 1 158 ? -20.016 0.678   21.334 1.00 19.96  ? 158 ILE A N   1 
ATOM   1257 C  CA  . ILE A 1 158 ? -18.659 1.177   21.505 1.00 21.72  ? 158 ILE A CA  1 
ATOM   1258 C  C   . ILE A 1 158 ? -17.882 0.284   22.462 1.00 20.96  ? 158 ILE A C   1 
ATOM   1259 O  O   . ILE A 1 158 ? -16.770 0.634   22.838 1.00 21.02  ? 158 ILE A O   1 
ATOM   1260 C  CB  . ILE A 1 158 ? -18.601 2.674   21.892 1.00 22.74  ? 158 ILE A CB  1 
ATOM   1261 C  CG1 . ILE A 1 158 ? -19.013 2.949   23.336 1.00 23.53  ? 158 ILE A CG1 1 
ATOM   1262 C  CG2 . ILE A 1 158 ? -19.407 3.516   20.903 1.00 22.76  ? 158 ILE A CG2 1 
ATOM   1263 C  CD1 . ILE A 1 158 ? -19.324 4.410   23.582 1.00 24.27  ? 158 ILE A CD1 1 
ATOM   1264 N  N   . ARG A 1 159 ? -18.429 -0.901  22.764 1.00 21.09  ? 159 ARG A N   1 
ATOM   1265 C  CA  . ARG A 1 159 ? -17.748 -1.879  23.599 1.00 20.75  ? 159 ARG A CA  1 
ATOM   1266 C  C   . ARG A 1 159 ? -17.933 -3.312  23.078 1.00 18.44  ? 159 ARG A C   1 
ATOM   1267 O  O   . ARG A 1 159 ? -18.449 -3.564  21.988 1.00 16.76  ? 159 ARG A O   1 
ATOM   1268 C  CB  . ARG A 1 159 ? -18.301 -1.739  25.023 1.00 22.59  ? 159 ARG A CB  1 
ATOM   1269 C  CG  . ARG A 1 159 ? -17.746 -0.554  25.802 1.00 24.08  ? 159 ARG A CG  1 
ATOM   1270 C  CD  . ARG A 1 159 ? -18.286 -0.539  27.228 1.00 24.97  ? 159 ARG A CD  1 
ATOM   1271 N  NE  . ARG A 1 159 ? -17.627 -1.500  28.107 1.00 25.13  ? 159 ARG A NE  1 
ATOM   1272 C  CZ  . ARG A 1 159 ? -16.354 -1.415  28.490 1.00 24.70  ? 159 ARG A CZ  1 
ATOM   1273 N  NH1 . ARG A 1 159 ? -15.638 -0.352  28.156 1.00 24.18  ? 159 ARG A NH1 1 
ATOM   1274 N  NH2 . ARG A 1 159 ? -15.803 -2.389  29.198 1.00 23.97  ? 159 ARG A NH2 1 
ATOM   1275 N  N   . GLY A 1 160 ? -17.482 -4.267  23.893 1.00 17.88  ? 160 GLY A N   1 
ATOM   1276 C  CA  . GLY A 1 160 ? -17.713 -5.682  23.663 1.00 17.52  ? 160 GLY A CA  1 
ATOM   1277 C  C   . GLY A 1 160 ? -16.454 -6.414  23.191 1.00 17.99  ? 160 GLY A C   1 
ATOM   1278 O  O   . GLY A 1 160 ? -15.395 -5.813  22.962 1.00 18.97  ? 160 GLY A O   1 
ATOM   1279 N  N   . ALA A 1 161 ? -16.586 -7.735  23.061 1.00 17.47  ? 161 ALA A N   1 
ATOM   1280 C  CA  . ALA A 1 161 ? -15.523 -8.591  22.565 1.00 18.14  ? 161 ALA A CA  1 
ATOM   1281 C  C   . ALA A 1 161 ? -15.044 -8.123  21.195 1.00 16.76  ? 161 ALA A C   1 
ATOM   1282 O  O   . ALA A 1 161 ? -15.830 -7.653  20.377 1.00 16.26  ? 161 ALA A O   1 
ATOM   1283 C  CB  . ALA A 1 161 ? -16.030 -10.005 22.493 1.00 18.67  ? 161 ALA A CB  1 
ATOM   1284 N  N   . GLN A 1 162 ? -13.756 -8.305  20.951 1.00 16.48  ? 162 GLN A N   1 
ATOM   1285 C  CA  . GLN A 1 162 ? -13.149 -7.842  19.714 1.00 18.26  ? 162 GLN A CA  1 
ATOM   1286 C  C   . GLN A 1 162 ? -12.600 -9.044  18.948 1.00 18.61  ? 162 GLN A C   1 
ATOM   1287 O  O   . GLN A 1 162 ? -11.790 -9.798  19.495 1.00 19.57  ? 162 GLN A O   1 
ATOM   1288 C  CB  . GLN A 1 162 ? -12.031 -6.832  20.010 1.00 18.57  ? 162 GLN A CB  1 
ATOM   1289 C  CG  . GLN A 1 162 ? -12.531 -5.424  20.311 1.00 18.74  ? 162 GLN A CG  1 
ATOM   1290 C  CD  . GLN A 1 162 ? -11.443 -4.452  20.708 1.00 19.29  ? 162 GLN A CD  1 
ATOM   1291 O  OE1 . GLN A 1 162 ? -10.255 -4.670  20.495 1.00 21.51  ? 162 GLN A OE1 1 
ATOM   1292 N  NE2 . GLN A 1 162 ? -11.845 -3.336  21.279 1.00 19.30  ? 162 GLN A NE2 1 
ATOM   1293 N  N   . PHE A 1 163 ? -13.005 -9.197  17.681 1.00 17.35  ? 163 PHE A N   1 
ATOM   1294 C  CA  . PHE A 1 163 ? -12.509 -10.301 16.866 1.00 17.88  ? 163 PHE A CA  1 
ATOM   1295 C  C   . PHE A 1 163 ? -11.503 -9.814  15.830 1.00 16.29  ? 163 PHE A C   1 
ATOM   1296 O  O   . PHE A 1 163 ? -11.832 -8.934  15.031 1.00 16.53  ? 163 PHE A O   1 
ATOM   1297 C  CB  . PHE A 1 163 ? -13.668 -11.037 16.183 1.00 17.89  ? 163 PHE A CB  1 
ATOM   1298 C  CG  . PHE A 1 163 ? -14.659 -11.516 17.201 1.00 18.10  ? 163 PHE A CG  1 
ATOM   1299 C  CD1 . PHE A 1 163 ? -15.589 -10.644 17.743 1.00 17.89  ? 163 PHE A CD1 1 
ATOM   1300 C  CD2 . PHE A 1 163 ? -14.573 -12.798 17.710 1.00 18.10  ? 163 PHE A CD2 1 
ATOM   1301 C  CE1 . PHE A 1 163 ? -16.467 -11.066 18.726 1.00 17.68  ? 163 PHE A CE1 1 
ATOM   1302 C  CE2 . PHE A 1 163 ? -15.450 -13.217 18.693 1.00 17.90  ? 163 PHE A CE2 1 
ATOM   1303 C  CZ  . PHE A 1 163 ? -16.393 -12.349 19.202 1.00 17.84  ? 163 PHE A CZ  1 
ATOM   1304 N  N   . TYR A 1 164 ? -10.316 -10.442 15.848 1.00 15.04  ? 164 TYR A N   1 
ATOM   1305 C  CA  . TYR A 1 164 ? -9.292  -10.276 14.818 1.00 14.45  ? 164 TYR A CA  1 
ATOM   1306 C  C   . TYR A 1 164 ? -9.234  -11.563 13.990 1.00 14.80  ? 164 TYR A C   1 
ATOM   1307 O  O   . TYR A 1 164 ? -8.761  -12.590 14.474 1.00 14.66  ? 164 TYR A O   1 
ATOM   1308 C  CB  . TYR A 1 164 ? -7.963  -9.853  15.459 1.00 13.76  ? 164 TYR A CB  1 
ATOM   1309 C  CG  . TYR A 1 164 ? -8.110  -8.580  16.244 1.00 13.16  ? 164 TYR A CG  1 
ATOM   1310 C  CD1 . TYR A 1 164 ? -8.033  -7.351  15.632 1.00 13.21  ? 164 TYR A CD1 1 
ATOM   1311 C  CD2 . TYR A 1 164 ? -8.440  -8.603  17.585 1.00 13.74  ? 164 TYR A CD2 1 
ATOM   1312 C  CE1 . TYR A 1 164 ? -8.253  -6.177  16.333 1.00 13.56  ? 164 TYR A CE1 1 
ATOM   1313 C  CE2 . TYR A 1 164 ? -8.659  -7.439  18.310 1.00 14.13  ? 164 TYR A CE2 1 
ATOM   1314 C  CZ  . TYR A 1 164 ? -8.583  -6.216  17.675 1.00 13.90  ? 164 TYR A CZ  1 
ATOM   1315 O  OH  . TYR A 1 164 ? -8.823  -5.064  18.378 1.00 14.04  ? 164 TYR A OH  1 
ATOM   1316 N  N   . ILE A 1 165 ? -9.758  -11.483 12.754 1.00 15.22  ? 165 ILE A N   1 
ATOM   1317 C  CA  . ILE A 1 165 ? -10.128 -12.634 11.949 1.00 16.07  ? 165 ILE A CA  1 
ATOM   1318 C  C   . ILE A 1 165 ? -9.380  -12.578 10.624 1.00 16.01  ? 165 ILE A C   1 
ATOM   1319 O  O   . ILE A 1 165 ? -9.443  -11.568 9.940  1.00 15.12  ? 165 ILE A O   1 
ATOM   1320 C  CB  . ILE A 1 165 ? -11.644 -12.633 11.700 1.00 16.87  ? 165 ILE A CB  1 
ATOM   1321 C  CG1 . ILE A 1 165 ? -12.437 -12.793 12.992 1.00 17.60  ? 165 ILE A CG1 1 
ATOM   1322 C  CG2 . ILE A 1 165 ? -12.032 -13.703 10.692 1.00 17.35  ? 165 ILE A CG2 1 
ATOM   1323 C  CD1 . ILE A 1 165 ? -13.892 -12.381 12.828 1.00 18.34  ? 165 ILE A CD1 1 
ATOM   1324 N  N   . SER A 1 166 ? -8.706  -13.678 10.266 1.00 17.08  ? 166 SER A N   1 
ATOM   1325 C  CA  . SER A 1 166 ? -7.886  -13.718 9.063  1.00 19.41  ? 166 SER A CA  1 
ATOM   1326 C  C   . SER A 1 166 ? -8.003  -15.082 8.388  1.00 19.76  ? 166 SER A C   1 
ATOM   1327 O  O   . SER A 1 166 ? -7.649  -16.102 8.985  1.00 20.36  ? 166 SER A O   1 
ATOM   1328 C  CB  . SER A 1 166 ? -6.424  -13.383 9.338  1.00 19.53  ? 166 SER A CB  1 
ATOM   1329 O  OG  . SER A 1 166 ? -5.650  -13.463 8.139  1.00 19.82  ? 166 SER A OG  1 
ATOM   1330 N  N   . CYS A 1 167 ? -8.450  -15.065 7.121  1.00 19.78  ? 167 CYS A N   1 
ATOM   1331 C  CA  . CYS A 1 167 ? -8.638  -16.273 6.330  1.00 18.63  ? 167 CYS A CA  1 
ATOM   1332 C  C   . CYS A 1 167 ? -7.524  -16.450 5.303  1.00 16.97  ? 167 CYS A C   1 
ATOM   1333 O  O   . CYS A 1 167 ? -7.251  -15.549 4.505  1.00 16.70  ? 167 CYS A O   1 
ATOM   1334 C  CB  . CYS A 1 167 ? -9.961  -16.227 5.599  1.00 18.90  ? 167 CYS A CB  1 
ATOM   1335 S  SG  . CYS A 1 167 ? -11.353 -16.523 6.707  1.00 21.87  ? 167 CYS A SG  1 
ATOM   1336 N  N   . ALA A 1 168 ? -6.914  -17.637 5.321  1.00 15.35  ? 168 ALA A N   1 
ATOM   1337 C  CA  . ALA A 1 168 ? -5.794  -17.940 4.450  1.00 14.69  ? 168 ALA A CA  1 
ATOM   1338 C  C   . ALA A 1 168 ? -6.198  -19.002 3.423  1.00 14.48  ? 168 ALA A C   1 
ATOM   1339 O  O   . ALA A 1 168 ? -6.853  -19.997 3.745  1.00 13.49  ? 168 ALA A O   1 
ATOM   1340 C  CB  . ALA A 1 168 ? -4.617  -18.356 5.294  1.00 14.36  ? 168 ALA A CB  1 
ATOM   1341 N  N   . GLN A 1 169 ? -5.817  -18.755 2.165  1.00 14.95  ? 169 GLN A N   1 
ATOM   1342 C  CA  . GLN A 1 169 ? -6.089  -19.681 1.076  1.00 15.53  ? 169 GLN A CA  1 
ATOM   1343 C  C   . GLN A 1 169 ? -4.977  -20.742 1.043  1.00 15.90  ? 169 GLN A C   1 
ATOM   1344 O  O   . GLN A 1 169 ? -3.809  -20.440 0.802  1.00 15.13  ? 169 GLN A O   1 
ATOM   1345 C  CB  . GLN A 1 169 ? -6.262  -18.906 -0.239 1.00 14.98  ? 169 GLN A CB  1 
ATOM   1346 C  CG  . GLN A 1 169 ? -7.555  -18.105 -0.310 1.00 14.75  ? 169 GLN A CG  1 
ATOM   1347 C  CD  . GLN A 1 169 ? -7.809  -17.345 -1.596 1.00 14.57  ? 169 GLN A CD  1 
ATOM   1348 O  OE1 . GLN A 1 169 ? -8.795  -16.633 -1.737 1.00 14.74  ? 169 GLN A OE1 1 
ATOM   1349 N  NE2 . GLN A 1 169 ? -6.923  -17.458 -2.562 1.00 14.79  ? 169 GLN A NE2 1 
ATOM   1350 N  N   . ILE A 1 170 ? -5.380  -21.988 1.311  1.00 16.81  ? 170 ILE A N   1 
ATOM   1351 C  CA  . ILE A 1 170 ? -4.493  -23.121 1.498  1.00 17.81  ? 170 ILE A CA  1 
ATOM   1352 C  C   . ILE A 1 170 ? -4.959  -24.250 0.586  1.00 18.75  ? 170 ILE A C   1 
ATOM   1353 O  O   . ILE A 1 170 ? -6.126  -24.635 0.657  1.00 16.87  ? 170 ILE A O   1 
ATOM   1354 C  CB  . ILE A 1 170 ? -4.533  -23.595 2.966  1.00 18.47  ? 170 ILE A CB  1 
ATOM   1355 C  CG1 . ILE A 1 170 ? -4.120  -22.501 3.950  1.00 17.98  ? 170 ILE A CG1 1 
ATOM   1356 C  CG2 . ILE A 1 170 ? -3.703  -24.864 3.162  1.00 19.36  ? 170 ILE A CG2 1 
ATOM   1357 C  CD1 . ILE A 1 170 ? -2.668  -22.147 3.888  1.00 18.21  ? 170 ILE A CD1 1 
ATOM   1358 N  N   . THR A 1 171 ? -4.026  -24.792 -0.223 1.00 20.29  ? 171 THR A N   1 
ATOM   1359 C  CA  . THR A 1 171 ? -4.274  -25.966 -1.058 1.00 20.13  ? 171 THR A CA  1 
ATOM   1360 C  C   . THR A 1 171 ? -3.580  -27.190 -0.454 1.00 18.77  ? 171 THR A C   1 
ATOM   1361 O  O   . THR A 1 171 ? -2.366  -27.266 -0.396 1.00 18.47  ? 171 THR A O   1 
ATOM   1362 C  CB  . THR A 1 171 ? -3.869  -25.700 -2.517 1.00 20.26  ? 171 THR A CB  1 
ATOM   1363 O  OG1 . THR A 1 171 ? -4.679  -24.648 -3.041 1.00 20.55  ? 171 THR A OG1 1 
ATOM   1364 C  CG2 . THR A 1 171 ? -4.042  -26.900 -3.414 1.00 20.26  ? 171 THR A CG2 1 
ATOM   1365 N  N   . ILE A 1 172 ? -4.375  -28.145 0.026  1.00 19.99  ? 172 ILE A N   1 
ATOM   1366 C  CA  . ILE A 1 172 ? -3.888  -29.432 0.493  1.00 20.83  ? 172 ILE A CA  1 
ATOM   1367 C  C   . ILE A 1 172 ? -3.720  -30.328 -0.736 1.00 24.82  ? 172 ILE A C   1 
ATOM   1368 O  O   . ILE A 1 172 ? -4.675  -30.519 -1.502 1.00 29.99  ? 172 ILE A O   1 
ATOM   1369 C  CB  . ILE A 1 172 ? -4.871  -30.010 1.530  1.00 19.18  ? 172 ILE A CB  1 
ATOM   1370 C  CG1 . ILE A 1 172 ? -5.018  -29.066 2.722  1.00 19.15  ? 172 ILE A CG1 1 
ATOM   1371 C  CG2 . ILE A 1 172 ? -4.457  -31.396 1.971  1.00 18.87  ? 172 ILE A CG2 1 
ATOM   1372 C  CD1 . ILE A 1 172 ? -5.862  -29.603 3.846  1.00 19.65  ? 172 ILE A CD1 1 
ATOM   1373 N  N   . ASN A 1 173 ? -2.492  -30.837 -0.951 1.00 25.99  ? 173 ASN A N   1 
ATOM   1374 C  CA  . ASN A 1 173 ? -2.186  -31.659 -2.123 1.00 24.65  ? 173 ASN A CA  1 
ATOM   1375 C  C   . ASN A 1 173 ? -2.143  -33.147 -1.757 1.00 24.35  ? 173 ASN A C   1 
ATOM   1376 O  O   . ASN A 1 173 ? -2.896  -33.923 -2.346 1.00 27.06  ? 173 ASN A O   1 
ATOM   1377 C  CB  . ASN A 1 173 ? -0.900  -31.225 -2.830 1.00 22.71  ? 173 ASN A CB  1 
ATOM   1378 C  CG  . ASN A 1 173 ? -1.098  -29.950 -3.614 1.00 22.11  ? 173 ASN A CG  1 
ATOM   1379 O  OD1 . ASN A 1 173 ? -1.986  -29.871 -4.453 1.00 21.43  ? 173 ASN A OD1 1 
ATOM   1380 N  ND2 . ASN A 1 173 ? -0.307  -28.932 -3.327 1.00 21.94  ? 173 ASN A ND2 1 
ATOM   1381 N  N   . SER A 1 174 ? -1.297  -33.534 -0.782 1.00 22.33  ? 174 SER A N   1 
ATOM   1382 C  CA  A SER A 1 174 ? -1.104  -34.931 -0.433 0.50 21.55  ? 174 SER A CA  1 
ATOM   1383 C  CA  B SER A 1 174 ? -1.099  -34.933 -0.426 0.50 21.56  ? 174 SER A CA  1 
ATOM   1384 C  C   . SER A 1 174 ? -1.774  -35.247 0.905  1.00 21.81  ? 174 SER A C   1 
ATOM   1385 O  O   . SER A 1 174 ? -1.339  -34.751 1.943  1.00 19.74  ? 174 SER A O   1 
ATOM   1386 C  CB  A SER A 1 174 ? 0.362   -35.271 -0.416 0.50 20.95  ? 174 SER A CB  1 
ATOM   1387 C  CB  B SER A 1 174 ? 0.358   -35.304 -0.349 0.50 20.99  ? 174 SER A CB  1 
ATOM   1388 O  OG  A SER A 1 174 ? 0.567   -36.600 0.024  0.50 20.30  ? 174 SER A OG  1 
ATOM   1389 O  OG  B SER A 1 174 ? 0.972   -35.243 -1.618 0.50 20.31  ? 174 SER A OG  1 
ATOM   1390 N  N   . SER A 1 175 ? -2.809  -36.112 0.843  1.00 23.88  ? 175 SER A N   1 
ATOM   1391 C  CA  . SER A 1 175 ? -3.542  -36.616 1.995  1.00 25.29  ? 175 SER A CA  1 
ATOM   1392 C  C   . SER A 1 175 ? -4.207  -37.945 1.639  1.00 26.96  ? 175 SER A C   1 
ATOM   1393 O  O   . SER A 1 175 ? -4.854  -38.034 0.597  1.00 27.88  ? 175 SER A O   1 
ATOM   1394 C  CB  . SER A 1 175 ? -4.600  -35.615 2.420  1.00 25.44  ? 175 SER A CB  1 
ATOM   1395 O  OG  . SER A 1 175 ? -5.110  -35.915 3.708  1.00 23.82  ? 175 SER A OG  1 
ATOM   1396 N  N   . ASP A 1 176 ? -4.128  -38.934 2.548  1.00 27.87  ? 176 ASP A N   1 
ATOM   1397 C  CA  . ASP A 1 176 ? -4.868  -40.185 2.412  1.00 27.43  ? 176 ASP A CA  1 
ATOM   1398 C  C   . ASP A 1 176 ? -6.389  -40.008 2.617  1.00 29.44  ? 176 ASP A C   1 
ATOM   1399 O  O   . ASP A 1 176 ? -7.142  -40.896 2.220  1.00 36.45  ? 176 ASP A O   1 
ATOM   1400 C  CB  . ASP A 1 176 ? -4.267  -41.256 3.326  1.00 26.32  ? 176 ASP A CB  1 
ATOM   1401 C  CG  . ASP A 1 176 ? -4.375  -40.969 4.810  1.00 29.86  ? 176 ASP A CG  1 
ATOM   1402 O  OD1 . ASP A 1 176 ? -5.197  -40.122 5.188  1.00 31.08  ? 176 ASP A OD1 1 
ATOM   1403 O  OD2 . ASP A 1 176 ? -3.633  -41.597 5.585  1.00 34.71  ? 176 ASP A OD2 1 
ATOM   1404 N  N   . ASP A 1 177 ? -6.854  -38.886 3.208  1.00 25.88  ? 177 ASP A N   1 
ATOM   1405 C  CA  . ASP A 1 177 ? -8.264  -38.622 3.482  1.00 24.26  ? 177 ASP A CA  1 
ATOM   1406 C  C   . ASP A 1 177 ? -8.841  -39.661 4.450  1.00 22.86  ? 177 ASP A C   1 
ATOM   1407 O  O   . ASP A 1 177 ? -9.992  -40.090 4.336  1.00 19.98  ? 177 ASP A O   1 
ATOM   1408 C  CB  . ASP A 1 177 ? -9.081  -38.536 2.194  1.00 25.69  ? 177 ASP A CB  1 
ATOM   1409 C  CG  . ASP A 1 177 ? -10.473 -37.958 2.375  1.00 28.35  ? 177 ASP A CG  1 
ATOM   1410 O  OD1 . ASP A 1 177 ? -10.681 -37.252 3.384  1.00 29.06  ? 177 ASP A OD1 1 
ATOM   1411 O  OD2 . ASP A 1 177 ? -11.355 -38.250 1.518  1.00 31.84  ? 177 ASP A OD2 1 
ATOM   1412 N  N   . SER A 1 178 ? -8.033  -40.014 5.447  1.00 23.32  ? 178 SER A N   1 
ATOM   1413 C  CA  . SER A 1 178 ? -8.426  -40.961 6.477  1.00 26.35  ? 178 SER A CA  1 
ATOM   1414 C  C   . SER A 1 178 ? -9.319  -40.325 7.561  1.00 27.03  ? 178 SER A C   1 
ATOM   1415 O  O   . SER A 1 178 ? -10.059 -41.024 8.255  1.00 24.74  ? 178 SER A O   1 
ATOM   1416 C  CB  . SER A 1 178 ? -7.176  -41.608 7.059  1.00 27.06  ? 178 SER A CB  1 
ATOM   1417 O  OG  . SER A 1 178 ? -6.339  -40.678 7.742  1.00 27.43  ? 178 SER A OG  1 
ATOM   1418 N  N   . THR A 1 179 ? -9.209  -38.998 7.750  1.00 28.00  ? 179 THR A N   1 
ATOM   1419 C  CA  . THR A 1 179 ? -10.085 -38.228 8.620  1.00 25.44  ? 179 THR A CA  1 
ATOM   1420 C  C   . THR A 1 179 ? -10.822 -37.216 7.750  1.00 22.95  ? 179 THR A C   1 
ATOM   1421 O  O   . THR A 1 179 ? -10.439 -36.060 7.721  1.00 20.37  ? 179 THR A O   1 
ATOM   1422 C  CB  . THR A 1 179 ? -9.302  -37.540 9.752  1.00 25.91  ? 179 THR A CB  1 
ATOM   1423 O  OG1 . THR A 1 179 ? -8.228  -36.772 9.207  1.00 28.03  ? 179 THR A OG1 1 
ATOM   1424 C  CG2 . THR A 1 179 ? -8.713  -38.502 10.762 1.00 26.22  ? 179 THR A CG2 1 
ATOM   1425 N  N   . PRO A 1 180 ? -11.852 -37.630 6.974  1.00 25.06  ? 180 PRO A N   1 
ATOM   1426 C  CA  . PRO A 1 180 ? -12.620 -36.725 6.116  1.00 26.02  ? 180 PRO A CA  1 
ATOM   1427 C  C   . PRO A 1 180 ? -13.360 -35.689 6.947  1.00 26.97  ? 180 PRO A C   1 
ATOM   1428 O  O   . PRO A 1 180 ? -13.826 -36.000 8.044  1.00 24.07  ? 180 PRO A O   1 
ATOM   1429 C  CB  . PRO A 1 180 ? -13.659 -37.601 5.381  1.00 25.02  ? 180 PRO A CB  1 
ATOM   1430 C  CG  . PRO A 1 180 ? -13.145 -39.021 5.557  1.00 25.13  ? 180 PRO A CG  1 
ATOM   1431 C  CD  . PRO A 1 180 ? -12.354 -39.009 6.857  1.00 26.25  ? 180 PRO A CD  1 
ATOM   1432 N  N   . LEU A 1 181 ? -13.481 -34.486 6.373  1.00 29.85  ? 181 LEU A N   1 
ATOM   1433 C  CA  . LEU A 1 181 ? -13.896 -33.310 7.113  1.00 31.37  ? 181 LEU A CA  1 
ATOM   1434 C  C   . LEU A 1 181 ? -15.379 -33.398 7.465  1.00 32.23  ? 181 LEU A C   1 
ATOM   1435 O  O   . LEU A 1 181 ? -16.236 -33.560 6.590  1.00 29.92  ? 181 LEU A O   1 
ATOM   1436 C  CB  . LEU A 1 181 ? -13.590 -32.049 6.303  1.00 31.37  ? 181 LEU A CB  1 
ATOM   1437 C  CG  . LEU A 1 181 ? -13.669 -30.766 7.128  1.00 32.44  ? 181 LEU A CG  1 
ATOM   1438 C  CD1 . LEU A 1 181 ? -12.464 -30.634 8.038  1.00 32.05  ? 181 LEU A CD1 1 
ATOM   1439 C  CD2 . LEU A 1 181 ? -13.792 -29.552 6.235  1.00 34.74  ? 181 LEU A CD2 1 
ATOM   1440 N  N   . PRO A 1 182 ? -15.714 -33.282 8.776  1.00 35.82  ? 182 PRO A N   1 
ATOM   1441 C  CA  . PRO A 1 182 ? -17.099 -33.374 9.234  1.00 35.18  ? 182 PRO A CA  1 
ATOM   1442 C  C   . PRO A 1 182 ? -17.846 -32.066 8.989  1.00 36.65  ? 182 PRO A C   1 
ATOM   1443 O  O   . PRO A 1 182 ? -17.333 -31.153 8.328  1.00 34.96  ? 182 PRO A O   1 
ATOM   1444 C  CB  . PRO A 1 182 ? -16.950 -33.690 10.743 1.00 33.74  ? 182 PRO A CB  1 
ATOM   1445 C  CG  . PRO A 1 182 ? -15.655 -33.006 11.145 1.00 33.22  ? 182 PRO A CG  1 
ATOM   1446 C  CD  . PRO A 1 182 ? -14.776 -33.079 9.904  1.00 35.19  ? 182 PRO A CD  1 
ATOM   1447 N  N   A ALA A 1 183 ? -19.072 -32.009 9.526  0.50 38.00  ? 183 ALA A N   1 
ATOM   1448 N  N   B ALA A 1 183 ? -19.072 -32.009 9.526  0.50 38.00  ? 183 ALA A N   1 
ATOM   1449 C  CA  A ALA A 1 183 ? -19.874 -30.798 9.565  0.50 36.93  ? 183 ALA A CA  1 
ATOM   1450 C  CA  B ALA A 1 183 ? -19.874 -30.798 9.565  0.50 36.93  ? 183 ALA A CA  1 
ATOM   1451 C  C   A ALA A 1 183 ? -19.273 -29.811 10.561 0.50 34.62  ? 183 ALA A C   1 
ATOM   1452 C  C   B ALA A 1 183 ? -19.273 -29.811 10.561 0.50 34.62  ? 183 ALA A C   1 
ATOM   1453 O  O   A ALA A 1 183 ? -18.665 -30.195 11.561 0.50 30.89  ? 183 ALA A O   1 
ATOM   1454 O  O   B ALA A 1 183 ? -18.665 -30.195 11.561 0.50 30.89  ? 183 ALA A O   1 
ATOM   1455 C  CB  A ALA A 1 183 ? -21.297 -31.140 9.943  0.50 37.90  ? 183 ALA A CB  1 
ATOM   1456 C  CB  B ALA A 1 183 ? -21.297 -31.140 9.943  0.50 37.90  ? 183 ALA A CB  1 
ATOM   1457 N  N   A GLY A 1 184 ? -19.468 -28.526 10.276 0.50 34.71  ? 184 GLY A N   1 
ATOM   1458 N  N   B GLY A 1 184 ? -19.468 -28.526 10.276 0.50 34.71  ? 184 GLY A N   1 
ATOM   1459 C  CA  A GLY A 1 184 ? -18.969 -27.487 11.157 0.50 35.98  ? 184 GLY A CA  1 
ATOM   1460 C  CA  B GLY A 1 184 ? -18.969 -27.487 11.157 0.50 35.98  ? 184 GLY A CA  1 
ATOM   1461 C  C   A GLY A 1 184 ? -20.070 -26.510 11.554 0.50 35.48  ? 184 GLY A C   1 
ATOM   1462 C  C   B GLY A 1 184 ? -20.070 -26.510 11.554 0.50 35.48  ? 184 GLY A C   1 
ATOM   1463 O  O   A GLY A 1 184 ? -21.248 -26.757 11.296 0.50 35.85  ? 184 GLY A O   1 
ATOM   1464 O  O   B GLY A 1 184 ? -21.248 -26.757 11.296 0.50 35.85  ? 184 GLY A O   1 
ATOM   1465 N  N   . VAL A 1 185 ? -19.654 -25.398 12.167 1.00 33.34  ? 185 VAL A N   1 
ATOM   1466 C  CA  . VAL A 1 185 ? -20.562 -24.348 12.576 1.00 31.22  ? 185 VAL A CA  1 
ATOM   1467 C  C   . VAL A 1 185 ? -20.488 -23.201 11.572 1.00 28.00  ? 185 VAL A C   1 
ATOM   1468 O  O   . VAL A 1 185 ? -19.526 -23.113 10.801 1.00 24.22  ? 185 VAL A O   1 
ATOM   1469 C  CB  . VAL A 1 185 ? -20.222 -23.858 13.991 1.00 33.06  ? 185 VAL A CB  1 
ATOM   1470 C  CG1 . VAL A 1 185 ? -20.270 -24.997 14.992 1.00 33.90  ? 185 VAL A CG1 1 
ATOM   1471 C  CG2 . VAL A 1 185 ? -18.880 -23.134 14.030 1.00 33.81  ? 185 VAL A CG2 1 
ATOM   1472 N  N   . PRO A 1 186 ? -21.500 -22.287 11.592 1.00 25.26  ? 186 PRO A N   1 
ATOM   1473 C  CA  . PRO A 1 186 ? -21.512 -21.078 10.764 1.00 23.02  ? 186 PRO A CA  1 
ATOM   1474 C  C   . PRO A 1 186 ? -20.900 -19.863 11.464 1.00 21.09  ? 186 PRO A C   1 
ATOM   1475 O  O   . PRO A 1 186 ? -20.968 -19.731 12.692 1.00 18.87  ? 186 PRO A O   1 
ATOM   1476 C  CB  . PRO A 1 186 ? -23.013 -20.851 10.556 1.00 22.72  ? 186 PRO A CB  1 
ATOM   1477 C  CG  . PRO A 1 186 ? -23.607 -21.254 11.901 1.00 23.34  ? 186 PRO A CG  1 
ATOM   1478 C  CD  . PRO A 1 186 ? -22.703 -22.349 12.444 1.00 24.26  ? 186 PRO A CD  1 
ATOM   1479 N  N   . PHE A 1 187 ? -20.270 -19.016 10.642 1.00 19.64  ? 187 PHE A N   1 
ATOM   1480 C  CA  . PHE A 1 187 ? -19.787 -17.698 11.019 1.00 19.11  ? 187 PHE A CA  1 
ATOM   1481 C  C   . PHE A 1 187 ? -20.224 -16.753 9.908  1.00 18.15  ? 187 PHE A C   1 
ATOM   1482 O  O   . PHE A 1 187 ? -19.870 -16.991 8.763  1.00 18.42  ? 187 PHE A O   1 
ATOM   1483 C  CB  . PHE A 1 187 ? -18.260 -17.656 11.187 1.00 18.99  ? 187 PHE A CB  1 
ATOM   1484 C  CG  . PHE A 1 187 ? -17.733 -18.270 12.461 1.00 19.77  ? 187 PHE A CG  1 
ATOM   1485 C  CD1 . PHE A 1 187 ? -17.968 -17.666 13.686 1.00 21.18  ? 187 PHE A CD1 1 
ATOM   1486 C  CD2 . PHE A 1 187 ? -17.002 -19.449 12.446 1.00 21.25  ? 187 PHE A CD2 1 
ATOM   1487 C  CE1 . PHE A 1 187 ? -17.502 -18.224 14.871 1.00 21.50  ? 187 PHE A CE1 1 
ATOM   1488 C  CE2 . PHE A 1 187 ? -16.531 -20.013 13.626 1.00 22.18  ? 187 PHE A CE2 1 
ATOM   1489 C  CZ  . PHE A 1 187 ? -16.781 -19.398 14.840 1.00 22.65  ? 187 PHE A CZ  1 
ATOM   1490 N  N   . PRO A 1 188 ? -21.040 -15.704 10.166 1.00 16.71  ? 188 PRO A N   1 
ATOM   1491 C  CA  . PRO A 1 188 ? -21.673 -15.468 11.469 1.00 16.85  ? 188 PRO A CA  1 
ATOM   1492 C  C   . PRO A 1 188 ? -22.598 -16.615 11.862 1.00 17.66  ? 188 PRO A C   1 
ATOM   1493 O  O   . PRO A 1 188 ? -23.092 -17.316 10.986 1.00 21.13  ? 188 PRO A O   1 
ATOM   1494 C  CB  . PRO A 1 188 ? -22.505 -14.196 11.232 1.00 16.06  ? 188 PRO A CB  1 
ATOM   1495 C  CG  . PRO A 1 188 ? -22.686 -14.135 9.732  1.00 15.92  ? 188 PRO A CG  1 
ATOM   1496 C  CD  . PRO A 1 188 ? -21.394 -14.681 9.180  1.00 16.11  ? 188 PRO A CD  1 
ATOM   1497 N  N   . GLY A 1 189 ? -22.811 -16.827 13.158 1.00 16.90  ? 189 GLY A N   1 
ATOM   1498 C  CA  . GLY A 1 189 ? -23.885 -17.700 13.592 1.00 16.45  ? 189 GLY A CA  1 
ATOM   1499 C  C   . GLY A 1 189 ? -23.554 -18.448 14.876 1.00 17.21  ? 189 GLY A C   1 
ATOM   1500 O  O   . GLY A 1 189 ? -24.381 -18.541 15.767 1.00 18.83  ? 189 GLY A O   1 
ATOM   1501 N  N   . ALA A 1 190 ? -22.354 -19.023 14.953 1.00 18.12  ? 190 ALA A N   1 
ATOM   1502 C  CA  . ALA A 1 190 ? -21.974 -19.897 16.055 1.00 17.28  ? 190 ALA A CA  1 
ATOM   1503 C  C   . ALA A 1 190 ? -21.782 -19.139 17.367 1.00 17.41  ? 190 ALA A C   1 
ATOM   1504 O  O   . ALA A 1 190 ? -21.774 -19.781 18.413 1.00 17.38  ? 190 ALA A O   1 
ATOM   1505 C  CB  . ALA A 1 190 ? -20.711 -20.651 15.695 1.00 16.99  ? 190 ALA A CB  1 
ATOM   1506 N  N   . TYR A 1 191 ? -21.551 -17.811 17.308 1.00 18.25  ? 191 TYR A N   1 
ATOM   1507 C  CA  . TYR A 1 191 ? -21.385 -16.979 18.496 1.00 18.98  ? 191 TYR A CA  1 
ATOM   1508 C  C   . TYR A 1 191 ? -22.597 -16.049 18.674 1.00 19.37  ? 191 TYR A C   1 
ATOM   1509 O  O   . TYR A 1 191 ? -22.995 -15.309 17.757 1.00 17.35  ? 191 TYR A O   1 
ATOM   1510 C  CB  . TYR A 1 191 ? -20.087 -16.166 18.410 1.00 20.56  ? 191 TYR A CB  1 
ATOM   1511 C  CG  . TYR A 1 191 ? -18.761 -16.904 18.327 1.00 21.18  ? 191 TYR A CG  1 
ATOM   1512 C  CD1 . TYR A 1 191 ? -18.626 -18.270 18.536 1.00 22.50  ? 191 TYR A CD1 1 
ATOM   1513 C  CD2 . TYR A 1 191 ? -17.601 -16.214 18.010 1.00 20.06  ? 191 TYR A CD2 1 
ATOM   1514 C  CE1 . TYR A 1 191 ? -17.386 -18.906 18.459 1.00 21.85  ? 191 TYR A CE1 1 
ATOM   1515 C  CE2 . TYR A 1 191 ? -16.362 -16.835 17.940 1.00 20.09  ? 191 TYR A CE2 1 
ATOM   1516 C  CZ  . TYR A 1 191 ? -16.242 -18.188 18.159 1.00 19.62  ? 191 TYR A CZ  1 
ATOM   1517 O  OH  . TYR A 1 191 ? -14.999 -18.757 18.061 1.00 17.53  ? 191 TYR A OH  1 
ATOM   1518 N  N   . THR A 1 192 ? -23.226 -16.130 19.859 1.00 21.31  ? 192 THR A N   1 
ATOM   1519 C  CA  . THR A 1 192 ? -24.316 -15.232 20.235 1.00 23.96  ? 192 THR A CA  1 
ATOM   1520 C  C   . THR A 1 192 ? -24.016 -14.613 21.600 1.00 25.54  ? 192 THR A C   1 
ATOM   1521 O  O   . THR A 1 192 ? -23.032 -14.997 22.238 1.00 24.38  ? 192 THR A O   1 
ATOM   1522 C  CB  . THR A 1 192 ? -25.680 -15.936 20.323 1.00 24.69  ? 192 THR A CB  1 
ATOM   1523 O  OG1 . THR A 1 192 ? -25.613 -16.875 21.407 1.00 23.06  ? 192 THR A OG1 1 
ATOM   1524 C  CG2 . THR A 1 192 ? -26.106 -16.570 19.016 1.00 23.59  ? 192 THR A CG2 1 
ATOM   1525 N  N   . ASP A 1 193 ? -24.895 -13.692 22.043 1.00 26.47  ? 193 ASP A N   1 
ATOM   1526 C  CA  . ASP A 1 193 ? -24.687 -12.932 23.270 1.00 27.35  ? 193 ASP A CA  1 
ATOM   1527 C  C   . ASP A 1 193 ? -24.628 -13.841 24.495 1.00 26.66  ? 193 ASP A C   1 
ATOM   1528 O  O   . ASP A 1 193 ? -24.001 -13.501 25.506 1.00 26.25  ? 193 ASP A O   1 
ATOM   1529 C  CB  . ASP A 1 193 ? -25.804 -11.912 23.502 1.00 29.00  ? 193 ASP A CB  1 
ATOM   1530 C  CG  . ASP A 1 193 ? -25.906 -10.829 22.446 1.00 28.72  ? 193 ASP A CG  1 
ATOM   1531 O  OD1 . ASP A 1 193 ? -25.227 -10.960 21.407 1.00 30.82  ? 193 ASP A OD1 1 
ATOM   1532 O  OD2 . ASP A 1 193 ? -26.673 -9.874  22.674 1.00 26.95  ? 193 ASP A OD2 1 
ATOM   1533 N  N   . SER A 1 194 ? -25.318 -14.980 24.377 1.00 27.75  ? 194 SER A N   1 
ATOM   1534 C  CA  . SER A 1 194 ? -25.455 -15.978 25.430 1.00 26.89  ? 194 SER A CA  1 
ATOM   1535 C  C   . SER A 1 194 ? -24.263 -16.943 25.462 1.00 25.11  ? 194 SER A C   1 
ATOM   1536 O  O   . SER A 1 194 ? -24.003 -17.566 26.497 1.00 23.54  ? 194 SER A O   1 
ATOM   1537 C  CB  . SER A 1 194 ? -26.766 -16.693 25.215 1.00 26.84  ? 194 SER A CB  1 
ATOM   1538 O  OG  . SER A 1 194 ? -27.209 -16.497 23.866 1.00 27.06  ? 194 SER A OG  1 
ATOM   1539 N  N   . THR A 1 195 ? -23.534 -17.049 24.335 1.00 23.12  ? 195 THR A N   1 
ATOM   1540 C  CA  . THR A 1 195 ? -22.473 -18.032 24.188 1.00 21.53  ? 195 THR A CA  1 
ATOM   1541 C  C   . THR A 1 195 ? -21.408 -17.811 25.258 1.00 21.09  ? 195 THR A C   1 
ATOM   1542 O  O   . THR A 1 195 ? -20.920 -16.700 25.448 1.00 21.86  ? 195 THR A O   1 
ATOM   1543 C  CB  . THR A 1 195 ? -21.840 -18.016 22.789 1.00 20.08  ? 195 THR A CB  1 
ATOM   1544 O  OG1 . THR A 1 195 ? -22.855 -17.994 21.783 1.00 17.85  ? 195 THR A OG1 1 
ATOM   1545 C  CG2 . THR A 1 195 ? -20.933 -19.209 22.584 1.00 19.73  ? 195 THR A CG2 1 
ATOM   1546 N  N   . PRO A 1 196 ? -21.026 -18.860 26.017 1.00 22.52  ? 196 PRO A N   1 
ATOM   1547 C  CA  . PRO A 1 196 ? -19.971 -18.729 27.022 1.00 22.66  ? 196 PRO A CA  1 
ATOM   1548 C  C   . PRO A 1 196 ? -18.706 -18.256 26.332 1.00 23.32  ? 196 PRO A C   1 
ATOM   1549 O  O   . PRO A 1 196 ? -18.381 -18.743 25.251 1.00 24.00  ? 196 PRO A O   1 
ATOM   1550 C  CB  . PRO A 1 196 ? -19.775 -20.145 27.574 1.00 21.98  ? 196 PRO A CB  1 
ATOM   1551 C  CG  . PRO A 1 196 ? -21.098 -20.828 27.267 1.00 22.24  ? 196 PRO A CG  1 
ATOM   1552 C  CD  . PRO A 1 196 ? -21.575 -20.226 25.962 1.00 22.37  ? 196 PRO A CD  1 
ATOM   1553 N  N   . GLY A 1 197 ? -18.023 -17.295 26.947 1.00 22.75  ? 197 GLY A N   1 
ATOM   1554 C  CA  . GLY A 1 197 ? -16.792 -16.786 26.365 1.00 22.61  ? 197 GLY A CA  1 
ATOM   1555 C  C   . GLY A 1 197 ? -16.968 -15.410 25.725 1.00 21.28  ? 197 GLY A C   1 
ATOM   1556 O  O   . GLY A 1 197 ? -16.010 -14.646 25.684 1.00 20.92  ? 197 GLY A O   1 
ATOM   1557 N  N   . ILE A 1 198 ? -18.187 -15.079 25.273 1.00 20.07  ? 198 ILE A N   1 
ATOM   1558 C  CA  . ILE A 1 198 ? -18.436 -13.806 24.609 1.00 21.03  ? 198 ILE A CA  1 
ATOM   1559 C  C   . ILE A 1 198 ? -18.534 -12.658 25.620 1.00 21.37  ? 198 ILE A C   1 
ATOM   1560 O  O   . ILE A 1 198 ? -17.978 -11.579 25.408 1.00 18.84  ? 198 ILE A O   1 
ATOM   1561 C  CB  . ILE A 1 198 ? -19.694 -13.935 23.735 1.00 21.76  ? 198 ILE A CB  1 
ATOM   1562 C  CG1 . ILE A 1 198 ? -19.495 -15.002 22.646 1.00 22.61  ? 198 ILE A CG1 1 
ATOM   1563 C  CG2 . ILE A 1 198 ? -20.132 -12.591 23.162 1.00 20.85  ? 198 ILE A CG2 1 
ATOM   1564 C  CD1 . ILE A 1 198 ? -18.384 -14.708 21.643 1.00 22.33  ? 198 ILE A CD1 1 
ATOM   1565 N  N   . GLN A 1 199 ? -19.250 -12.884 26.723 1.00 23.22  ? 199 GLN A N   1 
ATOM   1566 C  CA  . GLN A 1 199 ? -19.291 -11.893 27.777 1.00 25.76  ? 199 GLN A CA  1 
ATOM   1567 C  C   . GLN A 1 199 ? -18.504 -12.401 28.986 1.00 25.22  ? 199 GLN A C   1 
ATOM   1568 O  O   . GLN A 1 199 ? -18.732 -13.506 29.465 1.00 26.58  ? 199 GLN A O   1 
ATOM   1569 C  CB  . GLN A 1 199 ? -20.736 -11.523 28.097 1.00 27.90  ? 199 GLN A CB  1 
ATOM   1570 C  CG  . GLN A 1 199 ? -20.831 -10.271 28.963 1.00 30.96  ? 199 GLN A CG  1 
ATOM   1571 C  CD  . GLN A 1 199 ? -22.220 -9.974  29.485 1.00 32.05  ? 199 GLN A CD  1 
ATOM   1572 O  OE1 . GLN A 1 199 ? -23.211 -10.600 29.107 1.00 29.91  ? 199 GLN A OE1 1 
ATOM   1573 N  NE2 . GLN A 1 199 ? -22.294 -8.988  30.364 1.00 34.36  ? 199 GLN A NE2 1 
ATOM   1574 N  N   . PHE A 1 200 ? -17.588 -11.563 29.480 1.00 23.83  ? 200 PHE A N   1 
ATOM   1575 C  CA  . PHE A 1 200 ? -16.669 -11.951 30.526 1.00 24.97  ? 200 PHE A CA  1 
ATOM   1576 C  C   . PHE A 1 200 ? -15.960 -10.713 31.066 1.00 26.50  ? 200 PHE A C   1 
ATOM   1577 O  O   . PHE A 1 200 ? -15.719 -9.740  30.345 1.00 25.53  ? 200 PHE A O   1 
ATOM   1578 C  CB  . PHE A 1 200 ? -15.657 -12.963 29.985 1.00 27.26  ? 200 PHE A CB  1 
ATOM   1579 C  CG  . PHE A 1 200 ? -14.910 -13.722 31.050 1.00 28.59  ? 200 PHE A CG  1 
ATOM   1580 C  CD1 . PHE A 1 200 ? -15.478 -14.842 31.648 1.00 27.60  ? 200 PHE A CD1 1 
ATOM   1581 C  CD2 . PHE A 1 200 ? -13.656 -13.298 31.472 1.00 29.18  ? 200 PHE A CD2 1 
ATOM   1582 C  CE1 . PHE A 1 200 ? -14.798 -15.524 32.646 1.00 27.63  ? 200 PHE A CE1 1 
ATOM   1583 C  CE2 . PHE A 1 200 ? -12.972 -13.993 32.460 1.00 30.17  ? 200 PHE A CE2 1 
ATOM   1584 C  CZ  . PHE A 1 200 ? -13.550 -15.099 33.052 1.00 29.21  ? 200 PHE A CZ  1 
ATOM   1585 N  N   . ASN A 1 201 ? -15.617 -10.766 32.354 1.00 28.10  ? 201 ASN A N   1 
ATOM   1586 C  CA  . ASN A 1 201 ? -14.929 -9.667  33.003 1.00 29.36  ? 201 ASN A CA  1 
ATOM   1587 C  C   . ASN A 1 201 ? -13.575 -10.163 33.499 1.00 30.05  ? 201 ASN A C   1 
ATOM   1588 O  O   . ASN A 1 201 ? -13.543 -10.873 34.497 1.00 30.32  ? 201 ASN A O   1 
ATOM   1589 C  CB  . ASN A 1 201 ? -15.792 -9.078  34.119 1.00 29.40  ? 201 ASN A CB  1 
ATOM   1590 C  CG  . ASN A 1 201 ? -15.192 -7.839  34.748 1.00 28.67  ? 201 ASN A CG  1 
ATOM   1591 O  OD1 . ASN A 1 201 ? -14.004 -7.540  34.583 1.00 28.77  ? 201 ASN A OD1 1 
ATOM   1592 N  ND2 . ASN A 1 201 ? -16.017 -7.122  35.488 1.00 27.63  ? 201 ASN A ND2 1 
ATOM   1593 N  N   . ILE A 1 202 ? -12.486 -9.764  32.811 1.00 30.98  ? 202 ILE A N   1 
ATOM   1594 C  CA  . ILE A 1 202 ? -11.149 -10.295 33.050 1.00 32.07  ? 202 ILE A CA  1 
ATOM   1595 C  C   . ILE A 1 202 ? -10.454 -9.528  34.166 1.00 34.99  ? 202 ILE A C   1 
ATOM   1596 O  O   . ILE A 1 202 ? -9.285  -9.797  34.426 1.00 34.72  ? 202 ILE A O   1 
ATOM   1597 C  CB  . ILE A 1 202 ? -10.270 -10.209 31.791 1.00 31.99  ? 202 ILE A CB  1 
ATOM   1598 C  CG1 . ILE A 1 202 ? -9.930  -8.756  31.435 1.00 32.77  ? 202 ILE A CG1 1 
ATOM   1599 C  CG2 . ILE A 1 202 ? -10.921 -10.941 30.636 1.00 32.80  ? 202 ILE A CG2 1 
ATOM   1600 C  CD1 . ILE A 1 202 ? -8.746  -8.583  30.476 1.00 31.71  ? 202 ILE A CD1 1 
ATOM   1601 N  N   . TYR A 1 203 ? -11.148 -8.528  34.733 1.00 38.00  ? 203 TYR A N   1 
ATOM   1602 C  CA  . TYR A 1 203 ? -10.627 -7.694  35.807 1.00 38.44  ? 203 TYR A CA  1 
ATOM   1603 C  C   . TYR A 1 203 ? -11.073 -8.223  37.166 1.00 40.24  ? 203 TYR A C   1 
ATOM   1604 O  O   . TYR A 1 203 ? -10.421 -7.923  38.152 1.00 39.71  ? 203 TYR A O   1 
ATOM   1605 C  CB  . TYR A 1 203 ? -11.071 -6.245  35.596 1.00 37.52  ? 203 TYR A CB  1 
ATOM   1606 C  CG  . TYR A 1 203 ? -10.718 -5.747  34.216 1.00 40.67  ? 203 TYR A CG  1 
ATOM   1607 C  CD1 . TYR A 1 203 ? -9.389  -5.701  33.808 1.00 40.57  ? 203 TYR A CD1 1 
ATOM   1608 C  CD2 . TYR A 1 203 ? -11.693 -5.398  33.289 1.00 39.84  ? 203 TYR A CD2 1 
ATOM   1609 C  CE1 . TYR A 1 203 ? -9.030  -5.282  32.536 1.00 36.83  ? 203 TYR A CE1 1 
ATOM   1610 C  CE2 . TYR A 1 203 ? -11.352 -4.980  32.010 1.00 37.71  ? 203 TYR A CE2 1 
ATOM   1611 C  CZ  . TYR A 1 203 ? -10.018 -4.935  31.635 1.00 35.78  ? 203 TYR A CZ  1 
ATOM   1612 O  OH  . TYR A 1 203 ? -9.622  -4.555  30.394 1.00 32.28  ? 203 TYR A OH  1 
ATOM   1613 N  N   . THR A 1 204 ? -12.168 -9.002  37.210 1.00 44.92  ? 204 THR A N   1 
ATOM   1614 C  CA  . THR A 1 204 ? -12.760 -9.478  38.457 1.00 46.68  ? 204 THR A CA  1 
ATOM   1615 C  C   . THR A 1 204 ? -12.826 -11.010 38.471 1.00 47.37  ? 204 THR A C   1 
ATOM   1616 O  O   . THR A 1 204 ? -12.408 -11.625 39.438 1.00 53.24  ? 204 THR A O   1 
ATOM   1617 C  CB  . THR A 1 204 ? -14.137 -8.849  38.738 1.00 46.02  ? 204 THR A CB  1 
ATOM   1618 O  OG1 . THR A 1 204 ? -15.150 -9.458  37.928 1.00 44.31  ? 204 THR A OG1 1 
ATOM   1619 C  CG2 . THR A 1 204 ? -14.140 -7.348  38.543 1.00 47.36  ? 204 THR A CG2 1 
ATOM   1620 N  N   . THR A 1 205 ? -13.340 -11.637 37.411 1.00 46.13  ? 205 THR A N   1 
ATOM   1621 C  CA  . THR A 1 205 ? -13.410 -13.092 37.346 1.00 43.89  ? 205 THR A CA  1 
ATOM   1622 C  C   . THR A 1 205 ? -12.014 -13.700 37.154 1.00 42.15  ? 205 THR A C   1 
ATOM   1623 O  O   . THR A 1 205 ? -11.191 -13.164 36.422 1.00 39.54  ? 205 THR A O   1 
ATOM   1624 C  CB  . THR A 1 205 ? -14.396 -13.498 36.246 1.00 39.08  ? 205 THR A CB  1 
ATOM   1625 O  OG1 . THR A 1 205 ? -15.517 -12.632 36.426 1.00 34.70  ? 205 THR A OG1 1 
ATOM   1626 C  CG2 . THR A 1 205 ? -14.789 -14.953 36.304 1.00 37.45  ? 205 THR A CG2 1 
ATOM   1627 N  N   . PRO A 1 206 ? -11.673 -14.834 37.811 1.00 46.49  ? 206 PRO A N   1 
ATOM   1628 C  CA  . PRO A 1 206 ? -10.386 -15.488 37.583 1.00 44.56  ? 206 PRO A CA  1 
ATOM   1629 C  C   . PRO A 1 206 ? -10.345 -16.179 36.220 1.00 42.34  ? 206 PRO A C   1 
ATOM   1630 O  O   . PRO A 1 206 ? -11.321 -16.803 35.784 1.00 40.07  ? 206 PRO A O   1 
ATOM   1631 C  CB  . PRO A 1 206 ? -10.279 -16.520 38.723 1.00 45.45  ? 206 PRO A CB  1 
ATOM   1632 C  CG  . PRO A 1 206 ? -11.389 -16.162 39.691 1.00 44.60  ? 206 PRO A CG  1 
ATOM   1633 C  CD  . PRO A 1 206 ? -12.469 -15.559 38.817 1.00 46.69  ? 206 PRO A CD  1 
ATOM   1634 N  N   . ALA A 1 207 ? -9.177  -16.085 35.578 1.00 40.48  ? 207 ALA A N   1 
ATOM   1635 C  CA  . ALA A 1 207 ? -8.952  -16.608 34.238 1.00 43.11  ? 207 ALA A CA  1 
ATOM   1636 C  C   . ALA A 1 207 ? -9.121  -18.136 34.186 1.00 41.52  ? 207 ALA A C   1 
ATOM   1637 O  O   . ALA A 1 207 ? -9.498  -18.735 33.164 1.00 39.12  ? 207 ALA A O   1 
ATOM   1638 C  CB  . ALA A 1 207 ? -7.580  -16.143 33.796 1.00 45.51  ? 207 ALA A CB  1 
ATOM   1639 N  N   . THR A 1 208 ? -8.881  -18.762 35.340 1.00 44.21  ? 208 THR A N   1 
ATOM   1640 C  CA  . THR A 1 208 ? -9.065  -20.189 35.534 1.00 42.86  ? 208 THR A CA  1 
ATOM   1641 C  C   . THR A 1 208 ? -10.528 -20.591 35.402 1.00 37.46  ? 208 THR A C   1 
ATOM   1642 O  O   . THR A 1 208 ? -10.785 -21.771 35.237 1.00 34.55  ? 208 THR A O   1 
ATOM   1643 C  CB  . THR A 1 208 ? -8.499  -20.582 36.898 1.00 45.18  ? 208 THR A CB  1 
ATOM   1644 O  OG1 . THR A 1 208 ? -9.065  -19.653 37.825 1.00 47.35  ? 208 THR A OG1 1 
ATOM   1645 C  CG2 . THR A 1 208 ? -6.983  -20.532 36.928 1.00 44.33  ? 208 THR A CG2 1 
ATOM   1646 N  N   . SER A 1 209 ? -11.455 -19.618 35.460 1.00 38.91  ? 209 SER A N   1 
ATOM   1647 C  CA  . SER A 1 209 ? -12.873 -19.873 35.228 1.00 37.23  ? 209 SER A CA  1 
ATOM   1648 C  C   . SER A 1 209 ? -13.295 -19.541 33.796 1.00 33.41  ? 209 SER A C   1 
ATOM   1649 O  O   . SER A 1 209 ? -14.468 -19.695 33.481 1.00 31.94  ? 209 SER A O   1 
ATOM   1650 C  CB  . SER A 1 209 ? -13.760 -19.121 36.201 1.00 37.23  ? 209 SER A CB  1 
ATOM   1651 O  OG  . SER A 1 209 ? -13.171 -19.037 37.484 1.00 40.63  ? 209 SER A OG  1 
ATOM   1652 N  N   . TYR A 1 210 ? -12.391 -19.074 32.925 1.00 30.57  ? 210 TYR A N   1 
ATOM   1653 C  CA  . TYR A 1 210 ? -12.847 -18.668 31.605 1.00 28.89  ? 210 TYR A CA  1 
ATOM   1654 C  C   . TYR A 1 210 ? -13.153 -19.900 30.762 1.00 29.88  ? 210 TYR A C   1 
ATOM   1655 O  O   . TYR A 1 210 ? -12.343 -20.809 30.685 1.00 30.71  ? 210 TYR A O   1 
ATOM   1656 C  CB  . TYR A 1 210 ? -11.828 -17.802 30.864 1.00 28.05  ? 210 TYR A CB  1 
ATOM   1657 C  CG  . TYR A 1 210 ? -12.286 -17.367 29.488 1.00 27.88  ? 210 TYR A CG  1 
ATOM   1658 C  CD1 . TYR A 1 210 ? -13.220 -16.357 29.330 1.00 26.78  ? 210 TYR A CD1 1 
ATOM   1659 C  CD2 . TYR A 1 210 ? -11.827 -17.983 28.333 1.00 27.55  ? 210 TYR A CD2 1 
ATOM   1660 C  CE1 . TYR A 1 210 ? -13.662 -15.948 28.081 1.00 25.17  ? 210 TYR A CE1 1 
ATOM   1661 C  CE2 . TYR A 1 210 ? -12.272 -17.592 27.076 1.00 26.03  ? 210 TYR A CE2 1 
ATOM   1662 C  CZ  . TYR A 1 210 ? -13.193 -16.569 26.947 1.00 23.46  ? 210 TYR A CZ  1 
ATOM   1663 O  OH  . TYR A 1 210 ? -13.645 -16.138 25.734 1.00 20.04  ? 210 TYR A OH  1 
ATOM   1664 N  N   . VAL A 1 211 ? -14.311 -19.908 30.102 1.00 32.00  ? 211 VAL A N   1 
ATOM   1665 C  CA  . VAL A 1 211 ? -14.626 -20.927 29.115 1.00 33.59  ? 211 VAL A CA  1 
ATOM   1666 C  C   . VAL A 1 211 ? -14.725 -20.236 27.762 1.00 31.36  ? 211 VAL A C   1 
ATOM   1667 O  O   . VAL A 1 211 ? -15.475 -19.272 27.611 1.00 32.65  ? 211 VAL A O   1 
ATOM   1668 C  CB  . VAL A 1 211 ? -15.918 -21.697 29.480 1.00 38.59  ? 211 VAL A CB  1 
ATOM   1669 C  CG1 . VAL A 1 211 ? -16.464 -22.575 28.344 1.00 37.26  ? 211 VAL A CG1 1 
ATOM   1670 C  CG2 . VAL A 1 211 ? -15.709 -22.514 30.750 1.00 37.63  ? 211 VAL A CG2 1 
ATOM   1671 N  N   . ALA A 1 212 ? -13.923 -20.741 26.821 1.00 31.24  ? 212 ALA A N   1 
ATOM   1672 C  CA  . ALA A 1 212 ? -13.870 -20.258 25.453 1.00 29.77  ? 212 ALA A CA  1 
ATOM   1673 C  C   . ALA A 1 212 ? -15.147 -20.653 24.717 1.00 28.88  ? 212 ALA A C   1 
ATOM   1674 O  O   . ALA A 1 212 ? -15.790 -21.645 25.055 1.00 26.38  ? 212 ALA A O   1 
ATOM   1675 C  CB  . ALA A 1 212 ? -12.645 -20.810 24.760 1.00 29.21  ? 212 ALA A CB  1 
ATOM   1676 N  N   . PRO A 1 213 ? -15.579 -19.851 23.716 1.00 30.60  ? 213 PRO A N   1 
ATOM   1677 C  CA  . PRO A 1 213 ? -16.784 -20.171 22.947 1.00 31.05  ? 213 PRO A CA  1 
ATOM   1678 C  C   . PRO A 1 213 ? -16.658 -21.534 22.279 1.00 31.36  ? 213 PRO A C   1 
ATOM   1679 O  O   . PRO A 1 213 ? -15.625 -21.853 21.707 1.00 31.41  ? 213 PRO A O   1 
ATOM   1680 C  CB  . PRO A 1 213 ? -16.879 -19.026 21.927 1.00 30.48  ? 213 PRO A CB  1 
ATOM   1681 C  CG  . PRO A 1 213 ? -16.128 -17.877 22.595 1.00 30.38  ? 213 PRO A CG  1 
ATOM   1682 C  CD  . PRO A 1 213 ? -14.993 -18.553 23.332 1.00 30.11  ? 213 PRO A CD  1 
ATOM   1683 N  N   . PRO A 1 214 ? -17.674 -22.412 22.395 1.00 35.80  ? 214 PRO A N   1 
ATOM   1684 C  CA  . PRO A 1 214 ? -17.756 -23.609 21.560 1.00 32.86  ? 214 PRO A CA  1 
ATOM   1685 C  C   . PRO A 1 214 ? -17.874 -23.171 20.106 1.00 29.16  ? 214 PRO A C   1 
ATOM   1686 O  O   . PRO A 1 214 ? -18.210 -22.016 19.850 1.00 26.45  ? 214 PRO A O   1 
ATOM   1687 C  CB  . PRO A 1 214 ? -19.019 -24.337 22.055 1.00 34.63  ? 214 PRO A CB  1 
ATOM   1688 C  CG  . PRO A 1 214 ? -19.258 -23.781 23.444 1.00 36.56  ? 214 PRO A CG  1 
ATOM   1689 C  CD  . PRO A 1 214 ? -18.774 -22.344 23.372 1.00 38.98  ? 214 PRO A CD  1 
ATOM   1690 N  N   . PRO A 1 215 ? -17.665 -24.075 19.120 1.00 28.11  ? 215 PRO A N   1 
ATOM   1691 C  CA  . PRO A 1 215 ? -17.642 -25.523 19.335 1.00 27.82  ? 215 PRO A CA  1 
ATOM   1692 C  C   . PRO A 1 215 ? -16.348 -26.076 19.902 1.00 29.85  ? 215 PRO A C   1 
ATOM   1693 O  O   . PRO A 1 215 ? -15.368 -25.356 20.081 1.00 34.97  ? 215 PRO A O   1 
ATOM   1694 C  CB  . PRO A 1 215 ? -17.760 -26.093 17.925 1.00 28.54  ? 215 PRO A CB  1 
ATOM   1695 C  CG  . PRO A 1 215 ? -17.061 -25.072 17.075 1.00 30.25  ? 215 PRO A CG  1 
ATOM   1696 C  CD  . PRO A 1 215 ? -17.397 -23.737 17.717 1.00 30.14  ? 215 PRO A CD  1 
ATOM   1697 N  N   . SER A 1 216 ? -16.334 -27.370 20.194 1.00 28.10  ? 216 SER A N   1 
ATOM   1698 C  CA  . SER A 1 216 ? -15.098 -27.930 20.702 1.00 26.86  ? 216 SER A CA  1 
ATOM   1699 C  C   . SER A 1 216 ? -14.224 -28.307 19.504 1.00 24.11  ? 216 SER A C   1 
ATOM   1700 O  O   . SER A 1 216 ? -14.662 -28.224 18.361 1.00 22.50  ? 216 SER A O   1 
ATOM   1701 C  CB  . SER A 1 216 ? -15.377 -29.075 21.622 1.00 26.94  ? 216 SER A CB  1 
ATOM   1702 O  OG  . SER A 1 216 ? -15.800 -30.185 20.860 1.00 28.78  ? 216 SER A OG  1 
ATOM   1703 N  N   . VAL A 1 217 ? -12.986 -28.711 19.785 1.00 22.65  ? 217 VAL A N   1 
ATOM   1704 C  CA  . VAL A 1 217 ? -12.031 -29.099 18.763 1.00 22.09  ? 217 VAL A CA  1 
ATOM   1705 C  C   . VAL A 1 217 ? -12.330 -30.514 18.290 1.00 22.35  ? 217 VAL A C   1 
ATOM   1706 O  O   . VAL A 1 217 ? -12.477 -31.419 19.101 1.00 24.73  ? 217 VAL A O   1 
ATOM   1707 C  CB  . VAL A 1 217 ? -10.599 -29.029 19.315 1.00 21.58  ? 217 VAL A CB  1 
ATOM   1708 C  CG1 . VAL A 1 217 ? -9.609  -29.678 18.366 1.00 21.95  ? 217 VAL A CG1 1 
ATOM   1709 C  CG2 . VAL A 1 217 ? -10.194 -27.598 19.625 1.00 21.30  ? 217 VAL A CG2 1 
ATOM   1710 N  N   . TRP A 1 218 ? -12.321 -30.693 16.975 1.00 22.65  ? 218 TRP A N   1 
ATOM   1711 C  CA  . TRP A 1 218 ? -12.520 -31.975 16.311 1.00 26.61  ? 218 TRP A CA  1 
ATOM   1712 C  C   . TRP A 1 218 ? -11.429 -33.017 16.630 1.00 29.20  ? 218 TRP A C   1 
ATOM   1713 O  O   . TRP A 1 218 ? -10.245 -32.700 16.728 1.00 28.93  ? 218 TRP A O   1 
ATOM   1714 C  CB  . TRP A 1 218 ? -12.585 -31.654 14.820 1.00 27.48  ? 218 TRP A CB  1 
ATOM   1715 C  CG  . TRP A 1 218 ? -12.673 -32.815 13.892 1.00 29.97  ? 218 TRP A CG  1 
ATOM   1716 C  CD1 . TRP A 1 218 ? -13.508 -33.880 14.001 1.00 33.14  ? 218 TRP A CD1 1 
ATOM   1717 C  CD2 . TRP A 1 218 ? -11.960 -32.970 12.653 1.00 30.65  ? 218 TRP A CD2 1 
ATOM   1718 N  NE1 . TRP A 1 218 ? -13.360 -34.693 12.912 1.00 35.61  ? 218 TRP A NE1 1 
ATOM   1719 C  CE2 . TRP A 1 218 ? -12.422 -34.164 12.066 1.00 31.97  ? 218 TRP A CE2 1 
ATOM   1720 C  CE3 . TRP A 1 218 ? -10.986 -32.221 11.979 1.00 29.67  ? 218 TRP A CE3 1 
ATOM   1721 C  CZ2 . TRP A 1 218 ? -11.931 -34.636 10.848 1.00 30.58  ? 218 TRP A CZ2 1 
ATOM   1722 C  CZ3 . TRP A 1 218 ? -10.498 -32.683 10.776 1.00 29.59  ? 218 TRP A CZ3 1 
ATOM   1723 C  CH2 . TRP A 1 218 ? -10.969 -33.875 10.221 1.00 31.59  ? 218 TRP A CH2 1 
ATOM   1724 N  N   . SER A 1 219 ? -11.848 -34.282 16.786 1.00 30.36  ? 219 SER A N   1 
ATOM   1725 C  CA  . SER A 1 219 ? -10.967 -35.424 16.985 1.00 30.66  ? 219 SER A CA  1 
ATOM   1726 C  C   . SER A 1 219 ? -9.948  -35.554 15.852 1.00 31.23  ? 219 SER A C   1 
ATOM   1727 O  O   . SER A 1 219 ? -8.796  -35.914 16.098 1.00 33.93  ? 219 SER A O   1 
ATOM   1728 C  CB  . SER A 1 219 ? -11.794 -36.669 17.053 1.00 32.05  ? 219 SER A CB  1 
ATOM   1729 O  OG  . SER A 1 219 ? -12.725 -36.679 15.977 1.00 31.29  ? 219 SER A OG  1 
ATOM   1730 N  N   . GLY A 1 220 ? -10.381 -35.265 14.616 1.00 29.27  ? 220 GLY A N   1 
ATOM   1731 C  CA  . GLY A 1 220 ? -9.504  -35.302 13.451 1.00 30.92  ? 220 GLY A CA  1 
ATOM   1732 C  C   . GLY A 1 220 ? -8.321  -34.319 13.475 1.00 31.39  ? 220 GLY A C   1 
ATOM   1733 O  O   . GLY A 1 220 ? -7.435  -34.392 12.617 1.00 32.18  ? 220 GLY A O   1 
ATOM   1734 N  N   . ALA A 1 221 ? -8.307  -33.387 14.440 1.00 32.08  ? 221 ALA A N   1 
ATOM   1735 C  CA  . ALA A 1 221 ? -7.225  -32.423 14.583 1.00 31.10  ? 221 ALA A CA  1 
ATOM   1736 C  C   . ALA A 1 221 ? -5.971  -33.125 15.101 1.00 31.29  ? 221 ALA A C   1 
ATOM   1737 O  O   . ALA A 1 221 ? -6.063  -34.043 15.928 1.00 30.55  ? 221 ALA A O   1 
ATOM   1738 C  CB  . ALA A 1 221 ? -7.630  -31.287 15.493 1.00 31.74  ? 221 ALA A CB  1 
ATOM   1739 N  N   . LEU A 1 222 ? -4.824  -32.684 14.556 1.00 28.63  ? 222 LEU A N   1 
ATOM   1740 C  CA  . LEU A 1 222 ? -3.532  -33.274 14.829 1.00 27.61  ? 222 LEU A CA  1 
ATOM   1741 C  C   . LEU A 1 222 ? -2.701  -32.332 15.692 1.00 28.08  ? 222 LEU A C   1 
ATOM   1742 O  O   . LEU A 1 222 ? -1.542  -32.639 15.967 1.00 29.15  ? 222 LEU A O   1 
ATOM   1743 C  CB  . LEU A 1 222 ? -2.834  -33.559 13.503 1.00 28.81  ? 222 LEU A CB  1 
ATOM   1744 C  CG  . LEU A 1 222 ? -3.552  -34.539 12.576 1.00 31.24  ? 222 LEU A CG  1 
ATOM   1745 C  CD1 . LEU A 1 222 ? -2.772  -34.746 11.289 1.00 31.84  ? 222 LEU A CD1 1 
ATOM   1746 C  CD2 . LEU A 1 222 ? -3.754  -35.876 13.252 1.00 33.18  ? 222 LEU A CD2 1 
ATOM   1747 N  N   . GLY A 1 223 ? -3.295  -31.199 16.103 1.00 26.86  ? 223 GLY A N   1 
ATOM   1748 C  CA  . GLY A 1 223 ? -2.763  -30.390 17.192 1.00 26.47  ? 223 GLY A CA  1 
ATOM   1749 C  C   . GLY A 1 223 ? -2.083  -29.114 16.705 1.00 24.93  ? 223 GLY A C   1 
ATOM   1750 O  O   . GLY A 1 223 ? -2.179  -28.781 15.529 1.00 23.13  ? 223 GLY A O   1 
ATOM   1751 N  N   . GLY A 1 224 ? -1.405  -28.415 17.631 1.00 24.38  ? 224 GLY A N   1 
ATOM   1752 C  CA  . GLY A 1 224 ? -0.691  -27.184 17.321 1.00 24.85  ? 224 GLY A CA  1 
ATOM   1753 C  C   . GLY A 1 224 ? -0.229  -26.444 18.579 1.00 25.17  ? 224 GLY A C   1 
ATOM   1754 O  O   . GLY A 1 224 ? -0.349  -26.960 19.675 1.00 26.94  ? 224 GLY A O   1 
ATOM   1755 N  N   . SER A 1 225 ? 0.250   -25.203 18.431 1.00 24.79  ? 225 SER A N   1 
ATOM   1756 C  CA  . SER A 1 225 ? 0.888   -24.498 19.530 1.00 23.19  ? 225 SER A CA  1 
ATOM   1757 C  C   . SER A 1 225 ? 0.954   -22.995 19.258 1.00 21.96  ? 225 SER A C   1 
ATOM   1758 O  O   . SER A 1 225 ? 0.733   -22.550 18.135 1.00 25.52  ? 225 SER A O   1 
ATOM   1759 C  CB  . SER A 1 225 ? 2.260   -25.043 19.718 1.00 23.97  ? 225 SER A CB  1 
ATOM   1760 O  OG  . SER A 1 225 ? 3.030   -24.786 18.546 1.00 26.66  ? 225 SER A OG  1 
ATOM   1761 N  N   . ILE A 1 226 ? 1.288   -22.225 20.294 1.00 19.17  ? 226 ILE A N   1 
ATOM   1762 C  CA  . ILE A 1 226 ? 1.669   -20.840 20.133 1.00 18.89  ? 226 ILE A CA  1 
ATOM   1763 C  C   . ILE A 1 226 ? 3.148   -20.803 20.453 1.00 20.37  ? 226 ILE A C   1 
ATOM   1764 O  O   . ILE A 1 226 ? 3.510   -21.104 21.575 1.00 21.15  ? 226 ILE A O   1 
ATOM   1765 C  CB  . ILE A 1 226 ? 0.837   -19.933 21.065 1.00 18.65  ? 226 ILE A CB  1 
ATOM   1766 C  CG1 . ILE A 1 226 ? -0.648  -20.001 20.697 1.00 18.78  ? 226 ILE A CG1 1 
ATOM   1767 C  CG2 . ILE A 1 226 ? 1.354   -18.493 21.094 1.00 18.08  ? 226 ILE A CG2 1 
ATOM   1768 C  CD1 . ILE A 1 226 ? -1.574  -19.627 21.813 1.00 18.84  ? 226 ILE A CD1 1 
ATOM   1769 N  N   . ALA A 1 227 ? 3.987   -20.528 19.449 1.00 22.43  ? 227 ALA A N   1 
ATOM   1770 C  CA  . ALA A 1 227 ? 5.438   -20.562 19.614 1.00 21.92  ? 227 ALA A CA  1 
ATOM   1771 C  C   . ALA A 1 227 ? 6.115   -20.206 18.294 1.00 21.67  ? 227 ALA A C   1 
ATOM   1772 O  O   . ALA A 1 227 ? 5.637   -20.569 17.221 1.00 22.74  ? 227 ALA A O   1 
ATOM   1773 C  CB  . ALA A 1 227 ? 5.904   -21.916 20.092 1.00 21.35  ? 227 ALA A CB  1 
ATOM   1774 N  N   . GLN A 1 228 ? 7.233   -19.488 18.405 1.00 20.79  ? 228 GLN A N   1 
ATOM   1775 C  CA  . GLN A 1 228 ? 7.997   -19.069 17.251 1.00 20.86  ? 228 GLN A CA  1 
ATOM   1776 C  C   . GLN A 1 228 ? 8.585   -20.306 16.580 1.00 21.88  ? 228 GLN A C   1 
ATOM   1777 O  O   . GLN A 1 228 ? 9.249   -21.091 17.248 1.00 23.13  ? 228 GLN A O   1 
ATOM   1778 C  CB  . GLN A 1 228 ? 9.096   -18.128 17.738 1.00 21.52  ? 228 GLN A CB  1 
ATOM   1779 C  CG  . GLN A 1 228 ? 9.650   -17.232 16.648 1.00 22.48  ? 228 GLN A CG  1 
ATOM   1780 C  CD  . GLN A 1 228 ? 10.800  -16.379 17.128 1.00 22.76  ? 228 GLN A CD  1 
ATOM   1781 O  OE1 . GLN A 1 228 ? 11.297  -16.536 18.242 1.00 22.76  ? 228 GLN A OE1 1 
ATOM   1782 N  NE2 . GLN A 1 228 ? 11.250  -15.480 16.267 1.00 22.89  ? 228 GLN A NE2 1 
ATOM   1783 N  N   . VAL A 1 229 ? 8.335   -20.496 15.275 1.00 21.90  ? 229 VAL A N   1 
ATOM   1784 C  CA  . VAL A 1 229 ? 8.976   -21.577 14.546 1.00 21.24  ? 229 VAL A CA  1 
ATOM   1785 C  C   . VAL A 1 229 ? 10.005  -21.003 13.569 1.00 20.95  ? 229 VAL A C   1 
ATOM   1786 O  O   . VAL A 1 229 ? 10.760  -21.769 12.963 1.00 20.66  ? 229 VAL A O   1 
ATOM   1787 C  CB  . VAL A 1 229 ? 7.948   -22.488 13.836 1.00 21.93  ? 229 VAL A CB  1 
ATOM   1788 C  CG1 . VAL A 1 229 ? 6.676   -22.680 14.652 1.00 21.50  ? 229 VAL A CG1 1 
ATOM   1789 C  CG2 . VAL A 1 229 ? 7.602   -21.992 12.446 1.00 23.55  ? 229 VAL A CG2 1 
ATOM   1790 N  N   . GLY A 1 230 ? 10.018  -19.665 13.416 1.00 21.39  ? 230 GLY A N   1 
ATOM   1791 C  CA  . GLY A 1 230 ? 10.846  -18.979 12.425 1.00 20.66  ? 230 GLY A CA  1 
ATOM   1792 C  C   . GLY A 1 230 ? 11.320  -17.608 12.900 1.00 19.64  ? 230 GLY A C   1 
ATOM   1793 O  O   . GLY A 1 230 ? 10.610  -16.940 13.634 1.00 19.15  ? 230 GLY A O   1 
ATOM   1794 N  N   . ASP A 1 231 ? 12.528  -17.207 12.478 1.00 20.32  ? 231 ASP A N   1 
ATOM   1795 C  CA  . ASP A 1 231 ? 13.113  -15.907 12.799 1.00 19.86  ? 231 ASP A CA  1 
ATOM   1796 C  C   . ASP A 1 231 ? 13.070  -14.994 11.571 1.00 20.55  ? 231 ASP A C   1 
ATOM   1797 O  O   . ASP A 1 231 ? 13.840  -15.181 10.627 1.00 21.14  ? 231 ASP A O   1 
ATOM   1798 C  CB  . ASP A 1 231 ? 14.558  -16.055 13.293 1.00 18.50  ? 231 ASP A CB  1 
ATOM   1799 C  CG  . ASP A 1 231 ? 15.169  -14.798 13.893 1.00 18.53  ? 231 ASP A CG  1 
ATOM   1800 O  OD1 . ASP A 1 231 ? 14.497  -13.767 13.922 1.00 18.95  ? 231 ASP A OD1 1 
ATOM   1801 O  OD2 . ASP A 1 231 ? 16.320  -14.863 14.331 1.00 18.55  ? 231 ASP A OD2 1 
ATOM   1802 N  N   . ALA A 1 232 ? 12.193  -13.984 11.617 1.00 21.32  ? 232 ALA A N   1 
ATOM   1803 C  CA  . ALA A 1 232 ? 12.004  -13.063 10.500 1.00 23.01  ? 232 ALA A CA  1 
ATOM   1804 C  C   . ALA A 1 232 ? 13.153  -12.061 10.352 1.00 23.87  ? 232 ALA A C   1 
ATOM   1805 O  O   . ALA A 1 232 ? 13.317  -11.511 9.274  1.00 23.15  ? 232 ALA A O   1 
ATOM   1806 C  CB  . ALA A 1 232 ? 10.684  -12.333 10.627 1.00 22.61  ? 232 ALA A CB  1 
ATOM   1807 N  N   . SER A 1 233 ? 13.941  -11.802 11.402 1.00 26.88  ? 233 SER A N   1 
ATOM   1808 C  CA  . SER A 1 233 ? 15.101  -10.927 11.260 1.00 29.72  ? 233 SER A CA  1 
ATOM   1809 C  C   . SER A 1 233 ? 16.169  -11.570 10.375 1.00 30.12  ? 233 SER A C   1 
ATOM   1810 O  O   . SER A 1 233 ? 16.973  -10.853 9.795  1.00 26.99  ? 233 SER A O   1 
ATOM   1811 C  CB  . SER A 1 233 ? 15.699  -10.497 12.586 1.00 30.12  ? 233 SER A CB  1 
ATOM   1812 O  OG  . SER A 1 233 ? 15.225  -11.309 13.655 1.00 31.65  ? 233 SER A OG  1 
ATOM   1813 N  N   . LEU A 1 234 ? 16.164  -12.908 10.255 1.00 33.38  ? 234 LEU A N   1 
ATOM   1814 C  CA  . LEU A 1 234 ? 17.147  -13.602 9.438  1.00 35.50  ? 234 LEU A CA  1 
ATOM   1815 C  C   . LEU A 1 234 ? 16.969  -13.287 7.956  1.00 40.08  ? 234 LEU A C   1 
ATOM   1816 O  O   . LEU A 1 234 ? 17.850  -13.610 7.168  1.00 41.75  ? 234 LEU A O   1 
ATOM   1817 C  CB  . LEU A 1 234 ? 17.058  -15.111 9.683  1.00 36.01  ? 234 LEU A CB  1 
ATOM   1818 C  CG  . LEU A 1 234 ? 17.626  -15.607 11.020 1.00 36.05  ? 234 LEU A CG  1 
ATOM   1819 C  CD1 . LEU A 1 234 ? 17.764  -17.124 11.004 1.00 36.61  ? 234 LEU A CD1 1 
ATOM   1820 C  CD2 . LEU A 1 234 ? 18.956  -14.945 11.379 1.00 32.66  ? 234 LEU A CD2 1 
ATOM   1821 N  N   . GLU A 1 235 ? 15.869  -12.617 7.578  1.00 48.55  ? 235 GLU A N   1 
ATOM   1822 C  CA  . GLU A 1 235 ? 15.559  -12.334 6.174  1.00 50.38  ? 235 GLU A CA  1 
ATOM   1823 C  C   . GLU A 1 235 ? 16.050  -10.936 5.729  1.00 42.84  ? 235 GLU A C   1 
ATOM   1824 O  O   . GLU A 1 235 ? 16.630  -10.218 6.567  1.00 41.22  ? 235 GLU A O   1 
ATOM   1825 C  CB  . GLU A 1 235 ? 14.055  -12.540 5.943  1.00 46.83  ? 235 GLU A CB  1 
ATOM   1826 C  CG  . GLU A 1 235 ? 13.599  -13.945 6.326  1.00 44.04  ? 235 GLU A CG  1 
ATOM   1827 C  CD  . GLU A 1 235 ? 12.164  -14.226 5.948  1.00 37.51  ? 235 GLU A CD  1 
ATOM   1828 O  OE1 . GLU A 1 235 ? 11.683  -15.306 6.257  1.00 33.55  ? 235 GLU A OE1 1 
ATOM   1829 O  OE2 . GLU A 1 235 ? 11.555  -13.352 5.341  1.00 35.41  ? 235 GLU A OE2 1 
ATOM   1830 O  OXT . GLU A 1 235 ? 15.864  -10.621 4.534  1.00 38.29  ? 235 GLU A OXT 1 
HETATM 1831 CU CU  . CU  B 2 .   ? -6.831  -3.310  19.461 1.00 21.89  2 301 CU  A CU  1 
HETATM 1832 C  C1  . NAG C 3 .   ? -24.666 -5.958  12.435 1.00 39.44  ? 302 NAG A C1  1 
HETATM 1833 C  C2  . NAG C 3 .   ? -25.349 -4.594  12.322 1.00 41.46  ? 302 NAG A C2  1 
HETATM 1834 C  C3  . NAG C 3 .   ? -26.722 -4.661  11.655 1.00 41.58  ? 302 NAG A C3  1 
HETATM 1835 C  C4  . NAG C 3 .   ? -26.804 -5.624  10.479 1.00 43.20  ? 302 NAG A C4  1 
HETATM 1836 C  C5  . NAG C 3 .   ? -26.035 -6.923  10.711 1.00 43.97  ? 302 NAG A C5  1 
HETATM 1837 C  C6  . NAG C 3 .   ? -25.897 -7.740  9.433  1.00 39.55  ? 302 NAG A C6  1 
HETATM 1838 C  C7  . NAG C 3 .   ? -24.839 -2.840  13.917 1.00 34.02  ? 302 NAG A C7  1 
HETATM 1839 C  C8  . NAG C 3 .   ? -25.197 -2.212  15.230 1.00 32.51  ? 302 NAG A C8  1 
HETATM 1840 N  N2  . NAG C 3 .   ? -25.466 -3.976  13.625 1.00 37.48  ? 302 NAG A N2  1 
HETATM 1841 O  O3  . NAG C 3 .   ? -26.998 -3.352  11.189 1.00 41.14  ? 302 NAG A O3  1 
HETATM 1842 O  O4  . NAG C 3 .   ? -28.175 -5.965  10.342 1.00 42.27  ? 302 NAG A O4  1 
HETATM 1843 O  O5  . NAG C 3 .   ? -24.701 -6.648  11.196 1.00 43.97  ? 302 NAG A O5  1 
HETATM 1844 O  O6  . NAG C 3 .   ? -24.924 -7.189  8.520  1.00 32.84  ? 302 NAG A O6  1 
HETATM 1845 O  O7  . NAG C 3 .   ? -24.031 -2.339  13.139 1.00 31.15  ? 302 NAG A O7  1 
HETATM 1846 C  C1  . CIT D 4 .   ? -4.077  0.756   17.747 1.00 49.42  ? 303 CIT A C1  1 
HETATM 1847 O  O1  . CIT D 4 .   ? -4.249  1.296   16.637 1.00 40.17  ? 303 CIT A O1  1 
HETATM 1848 O  O2  . CIT D 4 .   ? -3.026  0.136   18.050 1.00 48.28  ? 303 CIT A O2  1 
HETATM 1849 C  C2  . CIT D 4 .   ? -5.217  0.882   18.760 1.00 52.01  ? 303 CIT A C2  1 
HETATM 1850 C  C3  . CIT D 4 .   ? -5.151  0.031   20.047 1.00 54.05  ? 303 CIT A C3  1 
HETATM 1851 O  O7  . CIT D 4 .   ? -4.598  -1.251  19.763 1.00 48.85  ? 303 CIT A O7  1 
HETATM 1852 C  C4  . CIT D 4 .   ? -4.289  0.792   21.074 1.00 57.30  ? 303 CIT A C4  1 
HETATM 1853 C  C5  . CIT D 4 .   ? -4.117  0.193   22.468 1.00 57.56  ? 303 CIT A C5  1 
HETATM 1854 O  O3  . CIT D 4 .   ? -2.955  -0.013  22.853 1.00 59.08  ? 303 CIT A O3  1 
HETATM 1855 O  O4  . CIT D 4 .   ? -5.121  -0.023  23.190 1.00 59.07  ? 303 CIT A O4  1 
HETATM 1856 C  C6  . CIT D 4 .   ? -6.592  -0.110  20.618 1.00 52.22  ? 303 CIT A C6  1 
HETATM 1857 O  O5  . CIT D 4 .   ? -7.315  0.911   20.593 1.00 47.61  ? 303 CIT A O5  1 
HETATM 1858 O  O6  . CIT D 4 .   ? -6.935  -1.224  21.079 1.00 51.69  ? 303 CIT A O6  1 
HETATM 1859 C  C1  . PGE E 5 .   ? -1.058  -4.238  -1.660 1.00 66.95  ? 304 PGE A C1  1 
HETATM 1860 O  O1  . PGE E 5 .   ? -0.565  -4.607  -0.376 1.00 57.32  ? 304 PGE A O1  1 
HETATM 1861 C  C2  . PGE E 5 .   ? -1.735  -5.394  -2.364 1.00 73.30  ? 304 PGE A C2  1 
HETATM 1862 O  O2  . PGE E 5 .   ? -2.066  -5.044  -3.710 1.00 76.79  ? 304 PGE A O2  1 
HETATM 1863 C  C3  . PGE E 5 .   ? -2.942  -5.964  -4.363 1.00 71.48  ? 304 PGE A C3  1 
HETATM 1864 C  C4  . PGE E 5 .   ? -2.150  -6.960  -5.154 1.00 67.82  ? 304 PGE A C4  1 
HETATM 1865 O  O4  . PGE E 5 .   ? -4.798  -8.943  -7.462 1.00 54.96  ? 304 PGE A O4  1 
HETATM 1866 C  C6  . PGE E 5 .   ? -4.474  -8.682  -6.101 1.00 62.88  ? 304 PGE A C6  1 
HETATM 1867 C  C5  . PGE E 5 .   ? -3.057  -9.107  -5.756 1.00 65.20  ? 304 PGE A C5  1 
HETATM 1868 O  O3  . PGE E 5 .   ? -2.483  -8.284  -4.738 1.00 69.11  ? 304 PGE A O3  1 
HETATM 1869 C  C1  . PGE F 5 .   ? -19.656 -9.027  24.177 1.00 52.42  ? 305 PGE A C1  1 
HETATM 1870 O  O1  . PGE F 5 .   ? -18.396 -9.429  24.683 1.00 48.82  ? 305 PGE A O1  1 
HETATM 1871 C  C2  . PGE F 5 .   ? -19.667 -8.685  22.692 1.00 54.93  ? 305 PGE A C2  1 
HETATM 1872 O  O2  . PGE F 5 .   ? -20.932 -8.145  22.283 1.00 65.45  ? 305 PGE A O2  1 
HETATM 1873 C  C3  . PGE F 5 .   ? -21.857 -9.109  21.759 1.00 76.45  ? 305 PGE A C3  1 
HETATM 1874 C  C4  . PGE F 5 .   ? -22.973 -8.459  20.941 1.00 73.81  ? 305 PGE A C4  1 
HETATM 1875 O  O4  . PGE F 5 .   ? -24.824 -7.212  17.162 1.00 63.38  ? 305 PGE A O4  1 
HETATM 1876 C  C6  . PGE F 5 .   ? -23.793 -8.155  17.411 1.00 64.54  ? 305 PGE A C6  1 
HETATM 1877 C  C5  . PGE F 5 .   ? -23.929 -8.854  18.744 1.00 69.39  ? 305 PGE A C5  1 
HETATM 1878 O  O3  . PGE F 5 .   ? -22.757 -8.651  19.536 1.00 83.29  ? 305 PGE A O3  1 
HETATM 1879 C  C1  . NAG G 3 .   ? 6.222   -20.776 30.448 1.00 98.86  ? 306 NAG A C1  1 
HETATM 1880 C  C2  . NAG G 3 .   ? 6.168   -21.543 29.121 1.00 106.88 ? 306 NAG A C2  1 
HETATM 1881 C  C3  . NAG G 3 .   ? 7.585   -22.015 28.812 1.00 100.84 ? 306 NAG A C3  1 
HETATM 1882 C  C4  . NAG G 3 .   ? 8.570   -20.845 28.864 1.00 96.59  ? 306 NAG A C4  1 
HETATM 1883 C  C5  . NAG G 3 .   ? 8.509   -20.099 30.199 1.00 87.85  ? 306 NAG A C5  1 
HETATM 1884 C  C6  . NAG G 3 .   ? 9.336   -18.832 30.196 1.00 73.78  ? 306 NAG A C6  1 
HETATM 1885 C  C7  . NAG G 3 .   ? 4.260   -22.901 28.176 1.00 89.72  ? 306 NAG A C7  1 
HETATM 1886 C  C8  . NAG G 3 .   ? 4.372   -22.221 26.840 1.00 77.61  ? 306 NAG A C8  1 
HETATM 1887 N  N2  . NAG G 3 .   ? 5.236   -22.664 29.073 1.00 107.63 ? 306 NAG A N2  1 
HETATM 1888 O  O3  . NAG G 3 .   ? 7.580   -22.651 27.540 1.00 92.49  ? 306 NAG A O3  1 
HETATM 1889 O  O4  . NAG G 3 .   ? 9.898   -21.340 28.725 1.00 90.56  ? 306 NAG A O4  1 
HETATM 1890 O  O5  . NAG G 3 .   ? 7.155   -19.705 30.499 1.00 93.79  ? 306 NAG A O5  1 
HETATM 1891 O  O6  . NAG G 3 .   ? 8.934   -17.969 31.244 1.00 66.64  ? 306 NAG A O6  1 
HETATM 1892 O  O7  . NAG G 3 .   ? 3.330   -23.662 28.440 1.00 81.76  ? 306 NAG A O7  1 
HETATM 1893 O  O   . HOH H 6 .   ? -0.308  0.349   11.055 1.00 15.17  ? 401 HOH A O   1 
HETATM 1894 O  O   . HOH H 6 .   ? -1.998  -38.889 4.997  1.00 20.99  ? 402 HOH A O   1 
HETATM 1895 O  O   . HOH H 6 .   ? -7.412  0.773   23.415 1.00 21.09  ? 403 HOH A O   1 
HETATM 1896 O  O   . HOH H 6 .   ? -14.917 -3.516  22.231 1.00 13.36  ? 404 HOH A O   1 
HETATM 1897 O  O   . HOH H 6 .   ? -2.897  -6.169  31.152 1.00 19.79  ? 405 HOH A O   1 
HETATM 1898 O  O   . HOH H 6 .   ? 1.647   -26.001 29.697 1.00 24.56  ? 406 HOH A O   1 
HETATM 1899 O  O   . HOH H 6 .   ? -5.336  -30.223 12.645 1.00 11.37  ? 407 HOH A O   1 
HETATM 1900 O  O   . HOH H 6 .   ? -13.053 -6.699  24.122 1.00 7.32   ? 408 HOH A O   1 
HETATM 1901 O  O   . HOH H 6 .   ? -25.973 -10.754 18.972 1.00 33.42  ? 409 HOH A O   1 
HETATM 1902 O  O   . HOH H 6 .   ? 4.246   -24.536 0.818  1.00 15.43  ? 410 HOH A O   1 
HETATM 1903 O  O   . HOH H 6 .   ? -0.436  -9.552  26.756 1.00 15.89  ? 411 HOH A O   1 
HETATM 1904 O  O   . HOH H 6 .   ? -8.876  -5.493  1.955  1.00 14.83  ? 412 HOH A O   1 
HETATM 1905 O  O   . HOH H 6 .   ? -25.003 -2.436  18.511 1.00 27.07  ? 413 HOH A O   1 
HETATM 1906 O  O   . HOH H 6 .   ? -4.710  -28.709 14.771 1.00 25.09  ? 414 HOH A O   1 
HETATM 1907 O  O   . HOH H 6 .   ? -11.803 -19.217 21.117 1.00 5.96   ? 415 HOH A O   1 
HETATM 1908 O  O   . HOH H 6 .   ? 0.916   -7.487  -0.899 1.00 10.60  ? 416 HOH A O   1 
HETATM 1909 O  O   . HOH H 6 .   ? -13.525 -8.305  30.428 1.00 10.64  ? 417 HOH A O   1 
HETATM 1910 O  O   . HOH H 6 .   ? -20.017 -14.101 5.349  1.00 3.32   ? 418 HOH A O   1 
HETATM 1911 O  O   . HOH H 6 .   ? -13.961 -1.264  18.656 1.00 16.43  ? 419 HOH A O   1 
HETATM 1912 O  O   . HOH H 6 .   ? 7.315   -12.737 13.441 1.00 14.10  ? 420 HOH A O   1 
HETATM 1913 O  O   . HOH H 6 .   ? -8.902  -6.010  10.781 1.00 5.45   ? 421 HOH A O   1 
HETATM 1914 O  O   . HOH H 6 .   ? 8.451   -3.975  13.061 1.00 25.27  ? 422 HOH A O   1 
HETATM 1915 O  O   . HOH H 6 .   ? 14.077  -18.593 10.846 1.00 12.57  ? 423 HOH A O   1 
HETATM 1916 O  O   . HOH H 6 .   ? -0.826  -3.246  8.035  1.00 4.35   ? 424 HOH A O   1 
HETATM 1917 O  O   . HOH H 6 .   ? -16.198 -12.168 5.749  1.00 13.19  ? 425 HOH A O   1 
HETATM 1918 O  O   . HOH H 6 .   ? -2.528  -22.436 16.623 1.00 17.54  ? 426 HOH A O   1 
HETATM 1919 O  O   . HOH H 6 .   ? 7.536   -10.041 20.675 1.00 19.16  ? 427 HOH A O   1 
HETATM 1920 O  O   . HOH H 6 .   ? 3.497   -22.565 16.803 1.00 15.47  ? 428 HOH A O   1 
HETATM 1921 O  O   . HOH H 6 .   ? -9.483  -1.435  21.819 1.00 20.47  ? 429 HOH A O   1 
HETATM 1922 O  O   . HOH H 6 .   ? 7.716   -9.579  17.974 1.00 20.01  ? 430 HOH A O   1 
HETATM 1923 O  O   . HOH H 6 .   ? -9.495  -12.640 6.043  1.00 9.05   ? 431 HOH A O   1 
HETATM 1924 O  O   . HOH H 6 .   ? -21.396 -19.818 8.095  1.00 14.24  ? 432 HOH A O   1 
HETATM 1925 O  O   . HOH H 6 .   ? -6.395  -12.339 33.220 1.00 31.01  ? 433 HOH A O   1 
HETATM 1926 O  O   . HOH H 6 .   ? -13.940 -4.464  11.553 1.00 19.70  ? 434 HOH A O   1 
HETATM 1927 O  O   . HOH H 6 .   ? -14.503 -18.912 -1.534 1.00 37.60  ? 435 HOH A O   1 
HETATM 1928 O  O   . HOH H 6 .   ? 4.867   -32.477 3.240  1.00 9.43   ? 436 HOH A O   1 
HETATM 1929 O  O   . HOH H 6 .   ? -3.634  -9.450  6.519  1.00 4.66   ? 437 HOH A O   1 
HETATM 1930 O  O   . HOH H 6 .   ? -14.044 -20.433 20.019 1.00 10.29  ? 438 HOH A O   1 
HETATM 1931 O  O   . HOH H 6 .   ? -7.286  -8.571  11.858 1.00 10.39  ? 439 HOH A O   1 
HETATM 1932 O  O   . HOH H 6 .   ? -7.333  -9.877  9.646  1.00 21.55  ? 440 HOH A O   1 
HETATM 1933 O  O   . HOH H 6 .   ? 5.560   -23.942 9.959  1.00 0.50   ? 441 HOH A O   1 
HETATM 1934 O  O   . HOH H 6 .   ? -3.519  -2.183  6.848  1.00 32.53  ? 442 HOH A O   1 
HETATM 1935 O  O   . HOH H 6 .   ? -14.004 -5.775  29.923 1.00 34.59  ? 443 HOH A O   1 
HETATM 1936 O  O   . HOH H 6 .   ? 3.607   -34.111 6.143  1.00 12.42  ? 444 HOH A O   1 
HETATM 1937 O  O   . HOH H 6 .   ? -1.468  -2.288  10.635 1.00 10.01  ? 445 HOH A O   1 
HETATM 1938 O  O   . HOH H 6 .   ? -10.797 -17.387 19.023 1.00 8.33   ? 446 HOH A O   1 
HETATM 1939 O  O   . HOH H 6 .   ? 4.305   -28.708 14.777 1.00 10.60  ? 447 HOH A O   1 
HETATM 1940 O  O   . HOH H 6 .   ? -18.548 -8.356  20.151 1.00 11.87  ? 448 HOH A O   1 
HETATM 1941 O  O   . HOH H 6 .   ? -4.225  -14.216 35.404 1.00 21.58  ? 449 HOH A O   1 
HETATM 1942 O  O   . HOH H 6 .   ? -0.612  -26.522 -4.651 1.00 21.39  ? 450 HOH A O   1 
HETATM 1943 O  O   . HOH H 6 .   ? 3.487   -28.257 -0.046 1.00 3.44   ? 451 HOH A O   1 
HETATM 1944 O  O   . HOH H 6 .   ? 4.949   -28.890 2.179  1.00 8.74   ? 452 HOH A O   1 
HETATM 1945 O  O   . HOH H 6 .   ? -5.100  -10.739 8.201  1.00 10.23  ? 453 HOH A O   1 
HETATM 1946 O  O   . HOH H 6 .   ? -11.808 -5.129  10.107 1.00 10.13  ? 454 HOH A O   1 
HETATM 1947 O  O   . HOH H 6 .   ? 4.987   -10.100 12.404 1.00 9.42   ? 455 HOH A O   1 
HETATM 1948 O  O   . HOH H 6 .   ? -18.160 -4.894  13.790 1.00 2.68   ? 456 HOH A O   1 
HETATM 1949 O  O   . HOH H 6 .   ? -0.971  -23.624 22.305 1.00 19.33  ? 457 HOH A O   1 
HETATM 1950 O  O   . HOH H 6 .   ? -21.580 -15.297 15.337 1.00 15.18  ? 458 HOH A O   1 
HETATM 1951 O  O   . HOH H 6 .   ? 2.653   -21.126 24.248 1.00 13.34  ? 459 HOH A O   1 
HETATM 1952 O  O   . HOH H 6 .   ? -30.461 -3.107  22.860 1.00 31.03  ? 460 HOH A O   1 
HETATM 1953 O  O   . HOH H 6 .   ? 12.627  -21.228 10.935 1.00 10.32  ? 461 HOH A O   1 
HETATM 1954 O  O   . HOH H 6 .   ? -2.487  -6.833  6.338  1.00 4.43   ? 462 HOH A O   1 
HETATM 1955 O  O   . HOH H 6 .   ? -7.654  1.948   7.036  1.00 12.62  ? 463 HOH A O   1 
HETATM 1956 O  O   . HOH H 6 .   ? -13.297 -31.993 2.502  1.00 15.99  ? 464 HOH A O   1 
HETATM 1957 O  O   . HOH H 6 .   ? -16.853 -12.859 33.829 1.00 19.06  ? 465 HOH A O   1 
HETATM 1958 O  O   . HOH H 6 .   ? -2.557  0.314   14.474 1.00 10.98  ? 466 HOH A O   1 
HETATM 1959 O  O   . HOH H 6 .   ? -14.148 1.042   21.796 1.00 17.43  ? 467 HOH A O   1 
HETATM 1960 O  O   . HOH H 6 .   ? -2.683  -3.727  19.214 1.00 5.53   ? 468 HOH A O   1 
HETATM 1961 O  O   . HOH H 6 .   ? -17.251 -4.873  2.895  1.00 22.12  ? 469 HOH A O   1 
HETATM 1962 O  O   . HOH H 6 .   ? 8.183   -25.894 3.643  1.00 4.74   ? 470 HOH A O   1 
HETATM 1963 O  O   . HOH H 6 .   ? 1.895   -29.701 -1.366 1.00 5.59   ? 471 HOH A O   1 
HETATM 1964 O  O   . HOH H 6 .   ? 13.420  -12.935 16.471 1.00 10.08  ? 472 HOH A O   1 
HETATM 1965 O  O   . HOH H 6 .   ? -10.641 -3.435  8.202  1.00 28.26  ? 473 HOH A O   1 
HETATM 1966 O  O   . HOH H 6 .   ? -10.905 -9.309  5.121  1.00 10.93  ? 474 HOH A O   1 
HETATM 1967 O  O   . HOH H 6 .   ? -11.749 -11.910 -6.376 1.00 33.21  ? 475 HOH A O   1 
HETATM 1968 O  O   . HOH H 6 .   ? -12.221 -28.865 22.590 1.00 16.50  ? 476 HOH A O   1 
HETATM 1969 O  O   . HOH H 6 .   ? 10.350  -13.517 13.832 1.00 17.04  ? 477 HOH A O   1 
HETATM 1970 O  O   . HOH H 6 .   ? -7.840  -22.050 -1.117 1.00 16.44  ? 478 HOH A O   1 
HETATM 1971 O  O   . HOH H 6 .   ? -6.129  -27.107 20.531 1.00 13.83  ? 479 HOH A O   1 
HETATM 1972 O  O   . HOH H 6 .   ? -6.969  -14.752 37.021 1.00 23.22  ? 480 HOH A O   1 
HETATM 1973 O  O   . HOH H 6 .   ? -18.591 -5.076  5.452  1.00 22.63  ? 481 HOH A O   1 
HETATM 1974 O  O   . HOH H 6 .   ? 8.158   -12.116 1.058  1.00 3.25   ? 482 HOH A O   1 
HETATM 1975 O  O   . HOH H 6 .   ? -2.251  -23.139 27.101 1.00 15.62  ? 483 HOH A O   1 
HETATM 1976 O  O   . HOH H 6 .   ? -4.052  -1.235  10.197 1.00 9.30   ? 484 HOH A O   1 
HETATM 1977 O  O   . HOH H 6 .   ? -6.429  -9.283  33.638 1.00 18.53  ? 485 HOH A O   1 
HETATM 1978 O  O   . HOH H 6 .   ? -6.518  -17.681 36.914 1.00 34.30  ? 486 HOH A O   1 
HETATM 1979 O  O   . HOH H 6 .   ? -10.129 1.731   19.766 1.00 16.32  ? 487 HOH A O   1 
HETATM 1980 O  O   . HOH H 6 .   ? -13.571 -26.435 -2.208 1.00 19.32  ? 488 HOH A O   1 
HETATM 1981 O  O   . HOH H 6 .   ? 5.217   -15.060 7.158  1.00 31.32  ? 489 HOH A O   1 
HETATM 1982 O  O   . HOH H 6 .   ? -16.799 -9.192  3.649  1.00 12.41  ? 490 HOH A O   1 
HETATM 1983 O  O   . HOH H 6 .   ? -28.852 -4.123  27.860 1.00 14.41  ? 491 HOH A O   1 
HETATM 1984 O  O   . HOH H 6 .   ? -19.191 -7.651  33.113 1.00 18.35  ? 492 HOH A O   1 
HETATM 1985 O  O   . HOH H 6 .   ? -1.389  2.403   16.304 1.00 13.73  ? 493 HOH A O   1 
HETATM 1986 O  O   . HOH H 6 .   ? -0.474  1.697   18.850 1.00 22.73  ? 494 HOH A O   1 
HETATM 1987 O  O   . HOH H 6 .   ? -10.543 -0.268  27.683 1.00 9.35   ? 495 HOH A O   1 
HETATM 1988 O  O   . HOH H 6 .   ? -6.900  -28.083 -5.675 1.00 18.54  ? 496 HOH A O   1 
HETATM 1989 O  O   . HOH H 6 .   ? -16.686 -5.215  11.291 1.00 31.10  ? 497 HOH A O   1 
HETATM 1990 O  O   . HOH H 6 .   ? -15.772 -15.339 -2.687 1.00 23.96  ? 498 HOH A O   1 
HETATM 1991 O  O   . HOH H 6 .   ? 8.801   -23.925 1.462  1.00 15.99  ? 499 HOH A O   1 
HETATM 1992 O  O   . HOH H 6 .   ? -4.517  -4.013  2.501  1.00 14.34  ? 500 HOH A O   1 
HETATM 1993 O  O   . HOH H 6 .   ? 10.690  -24.854 13.508 1.00 17.50  ? 501 HOH A O   1 
HETATM 1994 O  O   . HOH H 6 .   ? 2.416   -27.028 16.435 1.00 4.64   ? 502 HOH A O   1 
HETATM 1995 O  O   . HOH H 6 .   ? -11.241 -28.294 -4.044 1.00 16.58  ? 503 HOH A O   1 
HETATM 1996 O  O   . HOH H 6 .   ? 9.312   -29.002 4.608  1.00 14.21  ? 504 HOH A O   1 
HETATM 1997 O  O   . HOH H 6 .   ? -2.216  -1.942  25.991 1.00 7.55   ? 505 HOH A O   1 
HETATM 1998 O  O   . HOH H 6 .   ? -7.148  -18.347 -6.920 1.00 11.49  ? 506 HOH A O   1 
HETATM 1999 O  O   . HOH H 6 .   ? -1.573  -20.795 -6.304 1.00 9.17   ? 507 HOH A O   1 
HETATM 2000 O  O   . HOH H 6 .   ? -21.501 -20.659 -1.634 1.00 20.54  ? 508 HOH A O   1 
HETATM 2001 O  O   . HOH H 6 .   ? -18.209 -12.095 3.455  1.00 11.93  ? 509 HOH A O   1 
HETATM 2002 O  O   . HOH H 6 .   ? -0.820  -1.474  20.334 1.00 31.59  ? 510 HOH A O   1 
HETATM 2003 O  O   . HOH H 6 .   ? -3.400  0.878   11.663 1.00 11.54  ? 511 HOH A O   1 
HETATM 2004 O  O   . HOH H 6 .   ? -27.711 -9.040  17.712 1.00 10.30  ? 512 HOH A O   1 
HETATM 2005 O  O   . HOH H 6 .   ? -3.729  0.162   3.640  1.00 13.70  ? 513 HOH A O   1 
HETATM 2006 O  O   . HOH H 6 .   ? -9.512  -20.061 -2.291 1.00 7.26   ? 514 HOH A O   1 
HETATM 2007 O  O   . HOH H 6 .   ? 5.955   -32.228 -1.671 1.00 19.81  ? 515 HOH A O   1 
HETATM 2008 O  O   . HOH H 6 .   ? -11.653 0.591   15.312 1.00 32.48  ? 516 HOH A O   1 
HETATM 2009 O  O   . HOH H 6 .   ? 1.114   -6.930  -3.852 1.00 18.54  ? 517 HOH A O   1 
HETATM 2010 O  O   . HOH H 6 .   ? 13.383  -25.216 8.335  1.00 17.21  ? 518 HOH A O   1 
HETATM 2011 O  O   . HOH H 6 .   ? -15.764 -13.409 40.180 1.00 15.40  ? 519 HOH A O   1 
HETATM 2012 O  O   . HOH H 6 .   ? -12.641 -1.475  7.766  1.00 9.62   ? 520 HOH A O   1 
HETATM 2013 O  O   . HOH H 6 .   ? -11.390 -22.029 -4.063 1.00 17.24  ? 521 HOH A O   1 
HETATM 2014 O  O   . HOH H 6 .   ? -8.385  -11.584 38.740 1.00 28.98  ? 522 HOH A O   1 
HETATM 2015 O  O   . HOH H 6 .   ? 14.602  -11.490 18.586 1.00 21.28  ? 523 HOH A O   1 
HETATM 2016 O  O   . HOH H 6 .   ? 7.400   -30.499 1.070  1.00 15.55  ? 524 HOH A O   1 
HETATM 2017 O  O   . HOH H 6 .   ? -28.365 -0.263  8.328  1.00 27.98  ? 525 HOH A O   1 
HETATM 2018 O  O   . HOH H 6 .   ? -12.141 -20.089 -5.473 1.00 16.14  ? 526 HOH A O   1 
HETATM 2019 O  O   . HOH H 6 .   ? -11.124 -19.290 -7.508 1.00 19.25  ? 527 HOH A O   1 
# 
