data_9AWN
# 
_entry.id   9AWN 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.402 
_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   9AWN         pdb_00009awn 10.2210/pdb9awn/pdb 
WWPDB D_1000282200 ?            ?                   
# 
_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       2025-03-12 
_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                        9AWN 
_pdbx_database_status.recvd_initial_deposition_date   2024-03-05 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 3 
_pdbx_contact_author.email              luismauriciolima@gmail.com 
_pdbx_contact_author.name_first         Luis 
_pdbx_contact_author.name_last          Lima 
_pdbx_contact_author.name_mi            T.R. 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0001-6020-0504 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Lima, L.M.T.R.'    1 0000-0001-6020-0504 
'de Sa Ribeiro, F.' 2 0000-0002-8521-6745 
# 
_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                     'Crystal structure of trypsin at 250 Kelvin with benzamidine' 
_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 'Lima, L.M.T.R.'    1 0000-0001-6020-0504 
primary 'de Sa Ribeiro, F.' 2 0000-0002-8521-6745 
# 
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 'Cationic trypsin' 23324.287 1   3.4.21.4 ? ? ? 
2 non-polymer syn 'CALCIUM ION'      40.078    1   ?        ? ? ? 
3 non-polymer syn BENZAMIDINE        120.152   1   ?        ? ? ? 
4 water       nat water              18.015    180 ?        ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        Beta-trypsin 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNT
LNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNM
FCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN
;
_entity_poly.pdbx_seq_one_letter_code_can   
;IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNT
LNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNM
FCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN
;
_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 'CALCIUM ION' CA  
3 BENZAMIDINE   BEN 
4 water         HOH 
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   ILE n 
1 2   VAL n 
1 3   GLY n 
1 4   GLY n 
1 5   TYR n 
1 6   THR n 
1 7   CYS n 
1 8   GLY n 
1 9   ALA n 
1 10  ASN n 
1 11  THR n 
1 12  VAL n 
1 13  PRO n 
1 14  TYR n 
1 15  GLN n 
1 16  VAL n 
1 17  SER n 
1 18  LEU n 
1 19  ASN n 
1 20  SER n 
1 21  GLY n 
1 22  TYR n 
1 23  HIS n 
1 24  PHE n 
1 25  CYS n 
1 26  GLY n 
1 27  GLY n 
1 28  SER n 
1 29  LEU n 
1 30  ILE n 
1 31  ASN n 
1 32  SER n 
1 33  GLN n 
1 34  TRP n 
1 35  VAL n 
1 36  VAL n 
1 37  SER n 
1 38  ALA n 
1 39  ALA n 
1 40  HIS n 
1 41  CYS n 
1 42  TYR n 
1 43  LYS n 
1 44  SER n 
1 45  GLY n 
1 46  ILE n 
1 47  GLN n 
1 48  VAL n 
1 49  ARG n 
1 50  LEU n 
1 51  GLY n 
1 52  GLU n 
1 53  ASP n 
1 54  ASN n 
1 55  ILE n 
1 56  ASN n 
1 57  VAL n 
1 58  VAL n 
1 59  GLU n 
1 60  GLY n 
1 61  ASN n 
1 62  GLU n 
1 63  GLN n 
1 64  PHE n 
1 65  ILE n 
1 66  SER n 
1 67  ALA n 
1 68  SER n 
1 69  LYS n 
1 70  SER n 
1 71  ILE n 
1 72  VAL n 
1 73  HIS n 
1 74  PRO n 
1 75  SER n 
1 76  TYR n 
1 77  ASN n 
1 78  SER n 
1 79  ASN n 
1 80  THR n 
1 81  LEU n 
1 82  ASN n 
1 83  ASN n 
1 84  ASP n 
1 85  ILE n 
1 86  MET n 
1 87  LEU n 
1 88  ILE n 
1 89  LYS n 
1 90  LEU n 
1 91  LYS n 
1 92  SER n 
1 93  ALA n 
1 94  ALA n 
1 95  SER n 
1 96  LEU n 
1 97  ASN n 
1 98  SER n 
1 99  ARG n 
1 100 VAL n 
1 101 ALA n 
1 102 SER n 
1 103 ILE n 
1 104 SER n 
1 105 LEU n 
1 106 PRO n 
1 107 THR n 
1 108 SER n 
1 109 CYS n 
1 110 ALA n 
1 111 SER n 
1 112 ALA n 
1 113 GLY n 
1 114 THR n 
1 115 GLN n 
1 116 CYS n 
1 117 LEU n 
1 118 ILE n 
1 119 SER n 
1 120 GLY n 
1 121 TRP n 
1 122 GLY n 
1 123 ASN n 
1 124 THR n 
1 125 LYS n 
1 126 SER n 
1 127 SER n 
1 128 GLY n 
1 129 THR n 
1 130 SER n 
1 131 TYR n 
1 132 PRO n 
1 133 ASP n 
1 134 VAL n 
1 135 LEU n 
1 136 LYS n 
1 137 CYS n 
1 138 LEU n 
1 139 LYS n 
1 140 ALA n 
1 141 PRO n 
1 142 ILE n 
1 143 LEU n 
1 144 SER n 
1 145 ASP n 
1 146 SER n 
1 147 SER n 
1 148 CYS n 
1 149 LYS n 
1 150 SER n 
1 151 ALA n 
1 152 TYR n 
1 153 PRO n 
1 154 GLY n 
1 155 GLN n 
1 156 ILE n 
1 157 THR n 
1 158 SER n 
1 159 ASN n 
1 160 MET n 
1 161 PHE n 
1 162 CYS n 
1 163 ALA n 
1 164 GLY n 
1 165 TYR n 
1 166 LEU n 
1 167 GLU n 
1 168 GLY n 
1 169 GLY n 
1 170 LYS n 
1 171 ASP n 
1 172 SER n 
1 173 CYS n 
1 174 GLN n 
1 175 GLY n 
1 176 ASP n 
1 177 SER n 
1 178 GLY n 
1 179 GLY n 
1 180 PRO n 
1 181 VAL n 
1 182 VAL n 
1 183 CYS n 
1 184 SER n 
1 185 GLY n 
1 186 LYS n 
1 187 LEU n 
1 188 GLN n 
1 189 GLY n 
1 190 ILE n 
1 191 VAL n 
1 192 SER n 
1 193 TRP n 
1 194 GLY n 
1 195 SER n 
1 196 GLY n 
1 197 CYS n 
1 198 ALA n 
1 199 GLN n 
1 200 LYS n 
1 201 ASN n 
1 202 LYS n 
1 203 PRO n 
1 204 GLY n 
1 205 VAL n 
1 206 TYR n 
1 207 THR n 
1 208 LYS n 
1 209 VAL n 
1 210 CYS n 
1 211 ASN n 
1 212 TYR n 
1 213 VAL n 
1 214 SER n 
1 215 TRP n 
1 216 ILE n 
1 217 LYS n 
1 218 GLN n 
1 219 THR n 
1 220 ILE n 
1 221 ALA n 
1 222 SER n 
1 223 ASN 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                   223 
_entity_src_gen.gene_src_common_name               cattle 
_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      'Bos taurus' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     9913 
_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      'Bos taurus' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     9913 
_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 
BEN non-polymer         . BENZAMIDINE     ? 'C7 H8 N2'       120.152 
CA  non-polymer         . 'CALCIUM ION'   ? 'Ca 2'           40.078  
CYS 'L-peptide linking' y CYSTEINE        ? 'C3 H7 N O2 S'   121.158 
GLN 'L-peptide linking' y GLUTAMINE       ? 'C5 H10 N2 O3'   146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4'     147.129 
GLY 'peptide linking'   y GLYCINE         ? 'C2 H5 N O2'     75.067  
HIS 'L-peptide linking' y HISTIDINE       ? 'C6 H10 N3 O2 1' 156.162 
HOH non-polymer         . WATER           ? 'H2 O'           18.015  
ILE 'L-peptide linking' y ISOLEUCINE      ? 'C6 H13 N O2'    131.173 
LEU 'L-peptide linking' y LEUCINE         ? 'C6 H13 N O2'    131.173 
LYS 'L-peptide linking' y LYSINE          ? 'C6 H15 N2 O2 1' 147.195 
MET 'L-peptide linking' y METHIONINE      ? 'C5 H11 N O2 S'  149.211 
PHE 'L-peptide linking' y PHENYLALANINE   ? 'C9 H11 N O2'    165.189 
PRO 'L-peptide linking' y PROLINE         ? 'C5 H9 N O2'     115.130 
SER 'L-peptide linking' y SERINE          ? 'C3 H7 N O3'     105.093 
THR 'L-peptide linking' y THREONINE       ? 'C4 H9 N O3'     119.119 
TRP 'L-peptide linking' y TRYPTOPHAN      ? 'C11 H12 N2 O2'  204.225 
TYR 'L-peptide linking' y TYROSINE        ? 'C9 H11 N O3'    181.189 
VAL 'L-peptide linking' y VALINE          ? 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   ILE 1   1   1   ILE ILE A . n 
A 1 2   VAL 2   2   2   VAL VAL A . n 
A 1 3   GLY 3   3   3   GLY GLY A . n 
A 1 4   GLY 4   4   4   GLY GLY A . n 
A 1 5   TYR 5   5   5   TYR TYR A . n 
A 1 6   THR 6   6   6   THR THR A . n 
A 1 7   CYS 7   7   7   CYS CYS A . n 
A 1 8   GLY 8   8   8   GLY GLY A . n 
A 1 9   ALA 9   9   9   ALA ALA A . n 
A 1 10  ASN 10  10  10  ASN ASN A . n 
A 1 11  THR 11  11  11  THR THR A . n 
A 1 12  VAL 12  12  12  VAL VAL A . n 
A 1 13  PRO 13  13  13  PRO PRO A . n 
A 1 14  TYR 14  14  14  TYR TYR A . n 
A 1 15  GLN 15  15  15  GLN GLN A . n 
A 1 16  VAL 16  16  16  VAL VAL A . n 
A 1 17  SER 17  17  17  SER SER A . n 
A 1 18  LEU 18  18  18  LEU LEU A . n 
A 1 19  ASN 19  19  19  ASN ASN A . n 
A 1 20  SER 20  20  20  SER SER A . n 
A 1 21  GLY 21  21  21  GLY GLY A . n 
A 1 22  TYR 22  22  22  TYR TYR A . n 
A 1 23  HIS 23  23  23  HIS HIS A . n 
A 1 24  PHE 24  24  24  PHE PHE A . n 
A 1 25  CYS 25  25  25  CYS CYS A . n 
A 1 26  GLY 26  26  26  GLY GLY A . n 
A 1 27  GLY 27  27  27  GLY GLY A . n 
A 1 28  SER 28  28  28  SER SER A . n 
A 1 29  LEU 29  29  29  LEU LEU A . n 
A 1 30  ILE 30  30  30  ILE ILE A . n 
A 1 31  ASN 31  31  31  ASN ASN A . n 
A 1 32  SER 32  32  32  SER SER A . n 
A 1 33  GLN 33  33  33  GLN GLN A . n 
A 1 34  TRP 34  34  34  TRP TRP A . n 
A 1 35  VAL 35  35  35  VAL VAL A . n 
A 1 36  VAL 36  36  36  VAL VAL A . n 
A 1 37  SER 37  37  37  SER SER A . n 
A 1 38  ALA 38  38  38  ALA ALA A . n 
A 1 39  ALA 39  39  39  ALA ALA A . n 
A 1 40  HIS 40  40  40  HIS HIS A . n 
A 1 41  CYS 41  41  41  CYS CYS A . n 
A 1 42  TYR 42  42  42  TYR TYR A . n 
A 1 43  LYS 43  43  43  LYS LYS A . n 
A 1 44  SER 44  44  44  SER SER A . n 
A 1 45  GLY 45  45  45  GLY GLY A . n 
A 1 46  ILE 46  46  46  ILE ILE A . n 
A 1 47  GLN 47  47  47  GLN GLN A . n 
A 1 48  VAL 48  48  48  VAL VAL A . n 
A 1 49  ARG 49  49  49  ARG ARG A . n 
A 1 50  LEU 50  50  50  LEU LEU A . n 
A 1 51  GLY 51  51  51  GLY GLY A . n 
A 1 52  GLU 52  52  52  GLU GLU A . n 
A 1 53  ASP 53  53  53  ASP ASP A . n 
A 1 54  ASN 54  54  54  ASN ASN A . n 
A 1 55  ILE 55  55  55  ILE ILE A . n 
A 1 56  ASN 56  56  56  ASN ASN A . n 
A 1 57  VAL 57  57  57  VAL VAL A . n 
A 1 58  VAL 58  58  58  VAL VAL A . n 
A 1 59  GLU 59  59  59  GLU GLU A . n 
A 1 60  GLY 60  60  60  GLY GLY A . n 
A 1 61  ASN 61  61  61  ASN ASN A . n 
A 1 62  GLU 62  62  62  GLU GLU A . n 
A 1 63  GLN 63  63  63  GLN GLN A . n 
A 1 64  PHE 64  64  64  PHE PHE A . n 
A 1 65  ILE 65  65  65  ILE ILE A . n 
A 1 66  SER 66  66  66  SER SER A . n 
A 1 67  ALA 67  67  67  ALA ALA A . n 
A 1 68  SER 68  68  68  SER SER A . n 
A 1 69  LYS 69  69  69  LYS LYS A . n 
A 1 70  SER 70  70  70  SER SER A . n 
A 1 71  ILE 71  71  71  ILE ILE A . n 
A 1 72  VAL 72  72  72  VAL VAL A . n 
A 1 73  HIS 73  73  73  HIS HIS A . n 
A 1 74  PRO 74  74  74  PRO PRO A . n 
A 1 75  SER 75  75  75  SER SER A . n 
A 1 76  TYR 76  76  76  TYR TYR A . n 
A 1 77  ASN 77  77  77  ASN ASN A . n 
A 1 78  SER 78  78  78  SER SER A . n 
A 1 79  ASN 79  79  79  ASN ASN A . n 
A 1 80  THR 80  80  80  THR THR A . n 
A 1 81  LEU 81  81  81  LEU LEU A . n 
A 1 82  ASN 82  82  82  ASN ASN A . n 
A 1 83  ASN 83  83  83  ASN ASN A . n 
A 1 84  ASP 84  84  84  ASP ASP A . n 
A 1 85  ILE 85  85  85  ILE ILE A . n 
A 1 86  MET 86  86  86  MET MET A . n 
A 1 87  LEU 87  87  87  LEU LEU A . n 
A 1 88  ILE 88  88  88  ILE ILE A . n 
A 1 89  LYS 89  89  89  LYS LYS A . n 
A 1 90  LEU 90  90  90  LEU LEU A . n 
A 1 91  LYS 91  91  91  LYS LYS A . n 
A 1 92  SER 92  92  92  SER SER A . n 
A 1 93  ALA 93  93  93  ALA ALA A . n 
A 1 94  ALA 94  94  94  ALA ALA A . n 
A 1 95  SER 95  95  95  SER SER A . n 
A 1 96  LEU 96  96  96  LEU LEU A . n 
A 1 97  ASN 97  97  97  ASN ASN A . n 
A 1 98  SER 98  98  98  SER SER A . n 
A 1 99  ARG 99  99  99  ARG ARG A . n 
A 1 100 VAL 100 100 100 VAL VAL A . n 
A 1 101 ALA 101 101 101 ALA ALA A . n 
A 1 102 SER 102 102 102 SER SER A . n 
A 1 103 ILE 103 103 103 ILE ILE A . n 
A 1 104 SER 104 104 104 SER SER A . n 
A 1 105 LEU 105 105 105 LEU LEU A . n 
A 1 106 PRO 106 106 106 PRO PRO A . n 
A 1 107 THR 107 107 107 THR THR A . n 
A 1 108 SER 108 108 108 SER SER A . n 
A 1 109 CYS 109 109 109 CYS CYS A . n 
A 1 110 ALA 110 110 110 ALA ALA A . n 
A 1 111 SER 111 111 111 SER SER A . n 
A 1 112 ALA 112 112 112 ALA ALA A . n 
A 1 113 GLY 113 113 113 GLY GLY A . n 
A 1 114 THR 114 114 114 THR THR A . n 
A 1 115 GLN 115 115 115 GLN GLN A . n 
A 1 116 CYS 116 116 116 CYS CYS A . n 
A 1 117 LEU 117 117 117 LEU LEU A . n 
A 1 118 ILE 118 118 118 ILE ILE A . n 
A 1 119 SER 119 119 119 SER SER A . n 
A 1 120 GLY 120 120 120 GLY GLY A . n 
A 1 121 TRP 121 121 121 TRP TRP A . n 
A 1 122 GLY 122 122 122 GLY GLY A . n 
A 1 123 ASN 123 123 123 ASN ASN A . n 
A 1 124 THR 124 124 124 THR THR A . n 
A 1 125 LYS 125 125 125 LYS LYS A . n 
A 1 126 SER 126 126 126 SER SER A . n 
A 1 127 SER 127 127 127 SER SER A . n 
A 1 128 GLY 128 128 128 GLY GLY A . n 
A 1 129 THR 129 129 129 THR THR A . n 
A 1 130 SER 130 130 130 SER SER A . n 
A 1 131 TYR 131 131 131 TYR TYR A . n 
A 1 132 PRO 132 132 132 PRO PRO A . n 
A 1 133 ASP 133 133 133 ASP ASP A . n 
A 1 134 VAL 134 134 134 VAL VAL A . n 
A 1 135 LEU 135 135 135 LEU LEU A . n 
A 1 136 LYS 136 136 136 LYS LYS A . n 
A 1 137 CYS 137 137 137 CYS CYS A . n 
A 1 138 LEU 138 138 138 LEU LEU A . n 
A 1 139 LYS 139 139 139 LYS LYS A . n 
A 1 140 ALA 140 140 140 ALA ALA A . n 
A 1 141 PRO 141 141 141 PRO PRO A . n 
A 1 142 ILE 142 142 142 ILE ILE A . n 
A 1 143 LEU 143 143 143 LEU LEU A . n 
A 1 144 SER 144 144 144 SER SER A . n 
A 1 145 ASP 145 145 145 ASP ASP A . n 
A 1 146 SER 146 146 146 SER SER A . n 
A 1 147 SER 147 147 147 SER SER A . n 
A 1 148 CYS 148 148 148 CYS CYS A . n 
A 1 149 LYS 149 149 149 LYS LYS A . n 
A 1 150 SER 150 150 150 SER SER A . n 
A 1 151 ALA 151 151 151 ALA ALA A . n 
A 1 152 TYR 152 152 152 TYR TYR A . n 
A 1 153 PRO 153 153 153 PRO PRO A . n 
A 1 154 GLY 154 154 154 GLY GLY A . n 
A 1 155 GLN 155 155 155 GLN GLN A . n 
A 1 156 ILE 156 156 156 ILE ILE A . n 
A 1 157 THR 157 157 157 THR THR A . n 
A 1 158 SER 158 158 158 SER SER A . n 
A 1 159 ASN 159 159 159 ASN ASN A . n 
A 1 160 MET 160 160 160 MET MET A . n 
A 1 161 PHE 161 161 161 PHE PHE A . n 
A 1 162 CYS 162 162 162 CYS CYS A . n 
A 1 163 ALA 163 163 163 ALA ALA A . n 
A 1 164 GLY 164 164 164 GLY GLY A . n 
A 1 165 TYR 165 165 165 TYR TYR A . n 
A 1 166 LEU 166 166 166 LEU LEU A . n 
A 1 167 GLU 167 167 167 GLU GLU A . n 
A 1 168 GLY 168 168 168 GLY GLY A . n 
A 1 169 GLY 169 169 169 GLY GLY A . n 
A 1 170 LYS 170 170 170 LYS LYS A . n 
A 1 171 ASP 171 171 171 ASP ASP A . n 
A 1 172 SER 172 172 172 SER SER A . n 
A 1 173 CYS 173 173 173 CYS CYS A . n 
A 1 174 GLN 174 174 174 GLN GLN A . n 
A 1 175 GLY 175 175 175 GLY GLY A . n 
A 1 176 ASP 176 176 176 ASP ASP A . n 
A 1 177 SER 177 177 177 SER SER A . n 
A 1 178 GLY 178 178 178 GLY GLY A . n 
A 1 179 GLY 179 179 179 GLY GLY A . n 
A 1 180 PRO 180 180 180 PRO PRO A . n 
A 1 181 VAL 181 181 181 VAL VAL A . n 
A 1 182 VAL 182 182 182 VAL VAL A . n 
A 1 183 CYS 183 183 183 CYS CYS A . n 
A 1 184 SER 184 184 184 SER SER A . n 
A 1 185 GLY 185 185 185 GLY GLY A . n 
A 1 186 LYS 186 186 186 LYS LYS A . n 
A 1 187 LEU 187 187 187 LEU LEU A . n 
A 1 188 GLN 188 188 188 GLN GLN A . n 
A 1 189 GLY 189 189 189 GLY GLY A . n 
A 1 190 ILE 190 190 190 ILE ILE A . n 
A 1 191 VAL 191 191 191 VAL VAL A . n 
A 1 192 SER 192 192 192 SER SER A . n 
A 1 193 TRP 193 193 193 TRP TRP A . n 
A 1 194 GLY 194 194 194 GLY GLY A . n 
A 1 195 SER 195 195 195 SER SER A . n 
A 1 196 GLY 196 196 196 GLY GLY A . n 
A 1 197 CYS 197 197 197 CYS CYS A . n 
A 1 198 ALA 198 198 198 ALA ALA A . n 
A 1 199 GLN 199 199 199 GLN GLN A . n 
A 1 200 LYS 200 200 200 LYS LYS A . n 
A 1 201 ASN 201 201 201 ASN ASN A . n 
A 1 202 LYS 202 202 202 LYS LYS A . n 
A 1 203 PRO 203 203 203 PRO PRO A . n 
A 1 204 GLY 204 204 204 GLY GLY A . n 
A 1 205 VAL 205 205 205 VAL VAL A . n 
A 1 206 TYR 206 206 206 TYR TYR A . n 
A 1 207 THR 207 207 207 THR THR A . n 
A 1 208 LYS 208 208 208 LYS LYS A . n 
A 1 209 VAL 209 209 209 VAL VAL A . n 
A 1 210 CYS 210 210 210 CYS CYS A . n 
A 1 211 ASN 211 211 211 ASN ASN A . n 
A 1 212 TYR 212 212 212 TYR TYR A . n 
A 1 213 VAL 213 213 213 VAL VAL A . n 
A 1 214 SER 214 214 214 SER SER A . n 
A 1 215 TRP 215 215 215 TRP TRP A . n 
A 1 216 ILE 216 216 216 ILE ILE A . n 
A 1 217 LYS 217 217 217 LYS LYS A . n 
A 1 218 GLN 218 218 218 GLN GLN A . n 
A 1 219 THR 219 219 219 THR THR A . n 
A 1 220 ILE 220 220 220 ILE ILE A . n 
A 1 221 ALA 221 221 221 ALA ALA A . n 
A 1 222 SER 222 222 222 SER SER A . n 
A 1 223 ASN 223 223 223 ASN ASN 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 BEN ? ? BEN ? ? 'SUBJECT OF INVESTIGATION' ? 
2 CA  ? ? CA  ? ? '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 CA  1   301 224 CA  CA  A . 
C 3 BEN 1   302 225 BEN BEN A . 
D 4 HOH 1   401 176 HOH HOH A . 
D 4 HOH 2   402 122 HOH HOH A . 
D 4 HOH 3   403 48  HOH HOH A . 
D 4 HOH 4   404 68  HOH HOH A . 
D 4 HOH 5   405 113 HOH HOH A . 
D 4 HOH 6   406 155 HOH HOH A . 
D 4 HOH 7   407 1   HOH HOH A . 
D 4 HOH 8   408 67  HOH HOH A . 
D 4 HOH 9   409 38  HOH HOH A . 
D 4 HOH 10  410 112 HOH HOH A . 
D 4 HOH 11  411 50  HOH HOH A . 
D 4 HOH 12  412 3   HOH HOH A . 
D 4 HOH 13  413 58  HOH HOH A . 
D 4 HOH 14  414 152 HOH HOH A . 
D 4 HOH 15  415 118 HOH HOH A . 
D 4 HOH 16  416 37  HOH HOH A . 
D 4 HOH 17  417 119 HOH HOH A . 
D 4 HOH 18  418 145 HOH HOH A . 
D 4 HOH 19  419 11  HOH HOH A . 
D 4 HOH 20  420 7   HOH HOH A . 
D 4 HOH 21  421 42  HOH HOH A . 
D 4 HOH 22  422 131 HOH HOH A . 
D 4 HOH 23  423 154 HOH HOH A . 
D 4 HOH 24  424 120 HOH HOH A . 
D 4 HOH 25  425 43  HOH HOH A . 
D 4 HOH 26  426 92  HOH HOH A . 
D 4 HOH 27  427 22  HOH HOH A . 
D 4 HOH 28  428 128 HOH HOH A . 
D 4 HOH 29  429 135 HOH HOH A . 
D 4 HOH 30  430 74  HOH HOH A . 
D 4 HOH 31  431 15  HOH HOH A . 
D 4 HOH 32  432 35  HOH HOH A . 
D 4 HOH 33  433 52  HOH HOH A . 
D 4 HOH 34  434 18  HOH HOH A . 
D 4 HOH 35  435 136 HOH HOH A . 
D 4 HOH 36  436 17  HOH HOH A . 
D 4 HOH 37  437 41  HOH HOH A . 
D 4 HOH 38  438 33  HOH HOH A . 
D 4 HOH 39  439 40  HOH HOH A . 
D 4 HOH 40  440 137 HOH HOH A . 
D 4 HOH 41  441 69  HOH HOH A . 
D 4 HOH 42  442 81  HOH HOH A . 
D 4 HOH 43  443 53  HOH HOH A . 
D 4 HOH 44  444 161 HOH HOH A . 
D 4 HOH 45  445 47  HOH HOH A . 
D 4 HOH 46  446 153 HOH HOH A . 
D 4 HOH 47  447 94  HOH HOH A . 
D 4 HOH 48  448 49  HOH HOH A . 
D 4 HOH 49  449 76  HOH HOH A . 
D 4 HOH 50  450 32  HOH HOH A . 
D 4 HOH 51  451 102 HOH HOH A . 
D 4 HOH 52  452 4   HOH HOH A . 
D 4 HOH 53  453 66  HOH HOH A . 
D 4 HOH 54  454 70  HOH HOH A . 
D 4 HOH 55  455 9   HOH HOH A . 
D 4 HOH 56  456 19  HOH HOH A . 
D 4 HOH 57  457 55  HOH HOH A . 
D 4 HOH 58  458 93  HOH HOH A . 
D 4 HOH 59  459 127 HOH HOH A . 
D 4 HOH 60  460 147 HOH HOH A . 
D 4 HOH 61  461 45  HOH HOH A . 
D 4 HOH 62  462 59  HOH HOH A . 
D 4 HOH 63  463 89  HOH HOH A . 
D 4 HOH 64  464 25  HOH HOH A . 
D 4 HOH 65  465 150 HOH HOH A . 
D 4 HOH 66  466 149 HOH HOH A . 
D 4 HOH 67  467 88  HOH HOH A . 
D 4 HOH 68  468 21  HOH HOH A . 
D 4 HOH 69  469 111 HOH HOH A . 
D 4 HOH 70  470 101 HOH HOH A . 
D 4 HOH 71  471 28  HOH HOH A . 
D 4 HOH 72  472 86  HOH HOH A . 
D 4 HOH 73  473 26  HOH HOH A . 
D 4 HOH 74  474 54  HOH HOH A . 
D 4 HOH 75  475 100 HOH HOH A . 
D 4 HOH 76  476 34  HOH HOH A . 
D 4 HOH 77  477 107 HOH HOH A . 
D 4 HOH 78  478 8   HOH HOH A . 
D 4 HOH 79  479 5   HOH HOH A . 
D 4 HOH 80  480 158 HOH HOH A . 
D 4 HOH 81  481 16  HOH HOH A . 
D 4 HOH 82  482 110 HOH HOH A . 
D 4 HOH 83  483 79  HOH HOH A . 
D 4 HOH 84  484 148 HOH HOH A . 
D 4 HOH 85  485 60  HOH HOH A . 
D 4 HOH 86  486 46  HOH HOH A . 
D 4 HOH 87  487 78  HOH HOH A . 
D 4 HOH 88  488 159 HOH HOH A . 
D 4 HOH 89  489 10  HOH HOH A . 
D 4 HOH 90  490 71  HOH HOH A . 
D 4 HOH 91  491 39  HOH HOH A . 
D 4 HOH 92  492 95  HOH HOH A . 
D 4 HOH 93  493 73  HOH HOH A . 
D 4 HOH 94  494 178 HOH HOH A . 
D 4 HOH 95  495 85  HOH HOH A . 
D 4 HOH 96  496 24  HOH HOH A . 
D 4 HOH 97  497 13  HOH HOH A . 
D 4 HOH 98  498 106 HOH HOH A . 
D 4 HOH 99  499 143 HOH HOH A . 
D 4 HOH 100 500 6   HOH HOH A . 
D 4 HOH 101 501 20  HOH HOH A . 
D 4 HOH 102 502 30  HOH HOH A . 
D 4 HOH 103 503 104 HOH HOH A . 
D 4 HOH 104 504 23  HOH HOH A . 
D 4 HOH 105 505 62  HOH HOH A . 
D 4 HOH 106 506 44  HOH HOH A . 
D 4 HOH 107 507 51  HOH HOH A . 
D 4 HOH 108 508 2   HOH HOH A . 
D 4 HOH 109 509 125 HOH HOH A . 
D 4 HOH 110 510 64  HOH HOH A . 
D 4 HOH 111 511 14  HOH HOH A . 
D 4 HOH 112 512 12  HOH HOH A . 
D 4 HOH 113 513 142 HOH HOH A . 
D 4 HOH 114 514 72  HOH HOH A . 
D 4 HOH 115 515 109 HOH HOH A . 
D 4 HOH 116 516 56  HOH HOH A . 
D 4 HOH 117 517 157 HOH HOH A . 
D 4 HOH 118 518 29  HOH HOH A . 
D 4 HOH 119 519 123 HOH HOH A . 
D 4 HOH 120 520 121 HOH HOH A . 
D 4 HOH 121 521 124 HOH HOH A . 
D 4 HOH 122 522 132 HOH HOH A . 
D 4 HOH 123 523 151 HOH HOH A . 
D 4 HOH 124 524 75  HOH HOH A . 
D 4 HOH 125 525 103 HOH HOH A . 
D 4 HOH 126 526 108 HOH HOH A . 
D 4 HOH 127 527 97  HOH HOH A . 
D 4 HOH 128 528 63  HOH HOH A . 
D 4 HOH 129 529 61  HOH HOH A . 
D 4 HOH 130 530 116 HOH HOH A . 
D 4 HOH 131 531 129 HOH HOH A . 
D 4 HOH 132 532 27  HOH HOH A . 
D 4 HOH 133 533 87  HOH HOH A . 
D 4 HOH 134 534 31  HOH HOH A . 
D 4 HOH 135 535 130 HOH HOH A . 
D 4 HOH 136 536 144 HOH HOH A . 
D 4 HOH 137 537 65  HOH HOH A . 
D 4 HOH 138 538 133 HOH HOH A . 
D 4 HOH 139 539 156 HOH HOH A . 
D 4 HOH 140 540 115 HOH HOH A . 
D 4 HOH 141 541 105 HOH HOH A . 
D 4 HOH 142 542 126 HOH HOH A . 
D 4 HOH 143 543 146 HOH HOH A . 
D 4 HOH 144 544 82  HOH HOH A . 
D 4 HOH 145 545 36  HOH HOH A . 
D 4 HOH 146 546 114 HOH HOH A . 
D 4 HOH 147 547 140 HOH HOH A . 
D 4 HOH 148 548 167 HOH HOH A . 
D 4 HOH 149 549 57  HOH HOH A . 
D 4 HOH 150 550 175 HOH HOH A . 
D 4 HOH 151 551 99  HOH HOH A . 
D 4 HOH 152 552 77  HOH HOH A . 
D 4 HOH 153 553 80  HOH HOH A . 
D 4 HOH 154 554 139 HOH HOH A . 
D 4 HOH 155 555 90  HOH HOH A . 
D 4 HOH 156 556 134 HOH HOH A . 
D 4 HOH 157 557 180 HOH HOH A . 
D 4 HOH 158 558 141 HOH HOH A . 
D 4 HOH 159 559 168 HOH HOH A . 
D 4 HOH 160 560 164 HOH HOH A . 
D 4 HOH 161 561 117 HOH HOH A . 
D 4 HOH 162 562 163 HOH HOH A . 
D 4 HOH 163 563 172 HOH HOH A . 
D 4 HOH 164 564 177 HOH HOH A . 
D 4 HOH 165 565 91  HOH HOH A . 
D 4 HOH 166 566 166 HOH HOH A . 
D 4 HOH 167 567 179 HOH HOH A . 
D 4 HOH 168 568 84  HOH HOH A . 
D 4 HOH 169 569 162 HOH HOH A . 
D 4 HOH 170 570 96  HOH HOH A . 
D 4 HOH 171 571 174 HOH HOH A . 
D 4 HOH 172 572 165 HOH HOH A . 
D 4 HOH 173 573 98  HOH HOH A . 
D 4 HOH 174 574 170 HOH HOH A . 
D 4 HOH 175 575 169 HOH HOH A . 
D 4 HOH 176 576 83  HOH HOH A . 
D 4 HOH 177 577 160 HOH HOH A . 
D 4 HOH 178 578 138 HOH HOH A . 
D 4 HOH 179 579 173 HOH HOH A . 
D 4 HOH 180 580 171 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 ? ? ? 5.8.0352 1 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? SAINT  ? ? ? .        2 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? SCALA  ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? MOLREP ? ? ? .        4 
# 
_cell.angle_alpha                  90.000 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.000 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.000 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9AWN 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     53.884 
_cell.length_a_esd                 ? 
_cell.length_b                     56.774 
_cell.length_b_esd                 ? 
_cell.length_c                     66.223 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        4 
_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                         9AWN 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                19 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 21 21 21' 
_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                   9AWN 
_exptl.crystals_number            1 
_exptl.details                    ? 
_exptl.method                     'X-RAY DIFFRACTION' 
_exptl.method_details             ? 
# 
_exptl_crystal.colour                       ? 
_exptl_crystal.density_diffrn               ? 
_exptl_crystal.density_Matthews             2.17 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          43.36 
_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              9.4 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.2 M Potassium phosphate dibasic, 20% w/v Polyethylene glycol 3,350.' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            298 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     250 
_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                     CMOS 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'BRUKER PHOTON 100' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-11-07 
_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             LAUE 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.54184 
_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                      'ROTATING ANODE' 
_diffrn_source.target                      ? 
_diffrn_source.type                        'BRUKER TURBO X-RAY SOURCE' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.54184 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   ? 
_diffrn_source.pdbx_synchrotron_site       ? 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9AWN 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.484 
_reflns.d_resolution_low                               23.494 
_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                                     32789 
_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                           95.61 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                10 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          8.96 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                ? 
_reflns.pdbx_Rpim_I_all                                ? 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       ? 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.822 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              ? 
_reflns.pdbx_Rmerge_I_all                              ? 
_reflns.pdbx_Rsym_value                                ? 
_reflns.pdbx_CC_split_method                           ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_1_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_2_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[1]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[2]   ? 
_reflns.pdbx_aniso_diffraction_limit_axis_3_ortho[3]   ? 
_reflns.pdbx_aniso_diffraction_limit_1                 ? 
_reflns.pdbx_aniso_diffraction_limit_2                 ? 
_reflns.pdbx_aniso_diffraction_limit_3                 ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_1_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_2_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[1]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[2]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvector_3_ortho[3]     ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_1               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_2               ? 
_reflns.pdbx_aniso_B_tensor_eigenvalue_3               ? 
_reflns.pdbx_orthogonalization_convention              ? 
_reflns.pdbx_percent_possible_ellipsoidal              ? 
_reflns.pdbx_percent_possible_spherical                ? 
_reflns.pdbx_percent_possible_ellipsoidal_anomalous    ? 
_reflns.pdbx_percent_possible_spherical_anomalous      ? 
_reflns.pdbx_redundancy_anomalous                      ? 
_reflns.pdbx_CC_half_anomalous                         ? 
_reflns.pdbx_absDiff_over_sigma_anomalous              ? 
_reflns.pdbx_percent_possible_anomalous                ? 
_reflns.pdbx_observed_signal_threshold                 ? 
_reflns.pdbx_signal_type                               ? 
_reflns.pdbx_signal_details                            ? 
_reflns.pdbx_signal_software_id                        ? 
# 
_reflns_shell.d_res_high                                    1.5 
_reflns_shell.d_res_low                                     23.49 
_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                             1670 
_reflns_shell.percent_possible_obs                          ? 
_reflns_shell.Rmerge_F_all                                  ? 
_reflns_shell.Rmerge_F_obs                                  ? 
_reflns_shell.meanI_over_sigI_gt                            ? 
_reflns_shell.meanI_over_uI_all                             ? 
_reflns_shell.meanI_over_uI_gt                              ? 
_reflns_shell.number_measured_gt                            ? 
_reflns_shell.number_unique_gt                              ? 
_reflns_shell.percent_possible_gt                           ? 
_reflns_shell.Rmerge_F_gt                                   ? 
_reflns_shell.Rmerge_I_gt                                   ? 
_reflns_shell.pdbx_redundancy                               ? 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     ? 
_reflns_shell.pdbx_Rrim_I_all                               ? 
_reflns_shell.pdbx_Rpim_I_all                               ? 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.822 
_reflns_shell.pdbx_CC_star                                  ? 
_reflns_shell.pdbx_R_split                                  ? 
_reflns_shell.percent_possible_all                          ? 
_reflns_shell.Rmerge_I_all                                  ? 
_reflns_shell.Rmerge_I_obs                                  ? 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            0.003 
_refine.aniso_B[1][2]                            0.000 
_refine.aniso_B[1][3]                            -0.000 
_refine.aniso_B[2][2]                            0.016 
_refine.aniso_B[2][3]                            0.000 
_refine.aniso_B[3][3]                            -0.019 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               13.223 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.927 
_refine.correlation_coeff_Fo_to_Fc_free          0.913 
_refine.details                                  'Hydrogens have been added in their riding positions' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9AWN 
_refine.pdbx_refine_id                           'X-RAY DIFFRACTION' 
_refine.ls_abs_structure_details                 ? 
_refine.ls_abs_structure_Flack                   ? 
_refine.ls_abs_structure_Flack_esd               ? 
_refine.ls_abs_structure_Rogers                  ? 
_refine.ls_abs_structure_Rogers_esd              ? 
_refine.ls_d_res_high                            1.484 
_refine.ls_d_res_low                             23.494 
_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                     32789 
_refine.ls_number_reflns_R_free                  1670 
_refine.ls_number_reflns_R_work                  31119 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    95.614 
_refine.ls_percent_reflns_R_free                 5.093 
_refine.ls_R_factor_all                          0.224 
_refine.ls_R_factor_obs                          ? 
_refine.ls_R_factor_R_free                       0.2554 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.2221 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'MASK BULK SOLVENT' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ? 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.094 
_refine.pdbx_overall_ESU_R_Free                  0.095 
_refine.pdbx_solvent_vdw_probe_radii             1.200 
_refine.pdbx_solvent_ion_probe_radii             0.800 
_refine.pdbx_solvent_shrinkage_radii             0.800 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             2.609 
_refine.overall_SU_ML                            0.084 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        1629 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         10 
_refine_hist.number_atoms_solvent             180 
_refine_hist.number_atoms_total               1819 
_refine_hist.d_res_high                       1.484 
_refine_hist.d_res_low                        23.494 
# 
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' ? 0.009  0.011  1675 ? r_bond_refined_d               ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.016  1484 ? r_bond_other_d                 ? ? 
'X-RAY DIFFRACTION' ? 1.538  1.620  2275 ? r_angle_refined_deg            ? ? 
'X-RAY DIFFRACTION' ? 0.556  1.552  3479 ? r_angle_other_deg              ? ? 
'X-RAY DIFFRACTION' ? 7.079  5.000  222  ? r_dihedral_angle_1_deg         ? ? 
'X-RAY DIFFRACTION' ? 11.679 10.000 2    ? r_dihedral_angle_2_deg         ? ? 
'X-RAY DIFFRACTION' ? 1.173  5.000  1    ? r_dihedral_angle_other_2_deg   ? ? 
'X-RAY DIFFRACTION' ? 12.693 10.000 269  ? r_dihedral_angle_3_deg         ? ? 
'X-RAY DIFFRACTION' ? 17.377 10.000 58   ? r_dihedral_angle_6_deg         ? ? 
'X-RAY DIFFRACTION' ? 0.076  0.200  254  ? r_chiral_restr                 ? ? 
'X-RAY DIFFRACTION' ? 0.010  0.020  1898 ? r_gen_planes_refined           ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  310  ? r_gen_planes_other             ? ? 
'X-RAY DIFFRACTION' ? 0.209  0.200  300  ? r_nbd_refined                  ? ? 
'X-RAY DIFFRACTION' ? 0.211  0.200  1456 ? r_symmetry_nbd_other           ? ? 
'X-RAY DIFFRACTION' ? 0.181  0.200  865  ? r_nbtor_refined                ? ? 
'X-RAY DIFFRACTION' ? 0.088  0.200  997  ? r_symmetry_nbtor_other         ? ? 
'X-RAY DIFFRACTION' ? 0.224  0.200  145  ? r_xyhbond_nbd_refined          ? ? 
'X-RAY DIFFRACTION' ? 0.003  0.200  1    ? r_symmetry_xyhbond_nbd_other   ? ? 
'X-RAY DIFFRACTION' ? 0.159  0.200  4    ? r_metal_ion_refined            ? ? 
'X-RAY DIFFRACTION' ? 0.200  0.200  9    ? r_symmetry_nbd_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.207  0.200  28   ? r_nbd_other                    ? ? 
'X-RAY DIFFRACTION' ? 0.157  0.200  14   ? r_symmetry_xyhbond_nbd_refined ? ? 
'X-RAY DIFFRACTION' ? 1.281  1.274  891  ? r_mcbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 1.281  1.274  891  ? r_mcbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 1.949  1.908  1112 ? r_mcangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 1.949  1.908  1113 ? r_mcangle_other                ? ? 
'X-RAY DIFFRACTION' ? 2.094  1.456  784  ? r_scbond_it                    ? ? 
'X-RAY DIFFRACTION' ? 2.092  1.456  785  ? r_scbond_other                 ? ? 
'X-RAY DIFFRACTION' ? 3.133  2.083  1163 ? r_scangle_it                   ? ? 
'X-RAY DIFFRACTION' ? 3.132  2.083  1163 ? r_scangle_other                ? ? 
'X-RAY DIFFRACTION' ? 6.791  21.574 1955 ? r_lrange_it                    ? ? 
'X-RAY DIFFRACTION' ? 6.511  19.323 1899 ? r_lrange_other                 ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.484 1.522  2479 . 90  1635 69.5845  . 0.531 . . 0.528 . . . . . 0.544 . 20 . 0.472 0.450 0.567 
'X-RAY DIFFRACTION' 1.522 1.564  2434 . 136 2120 92.6869  . 0.492 . . 0.494 . . . . . 0.483 . 20 . 0.733 0.801 0.465 
'X-RAY DIFFRACTION' 1.564 1.609  2362 . 113 2155 96.0203  . 0.476 . . 0.476 . . . . . 0.438 . 20 . 0.739 0.776 0.471 
'X-RAY DIFFRACTION' 1.609 1.658  2296 . 101 2104 96.0366  . 0.411 . . 0.409 . . . . . 0.371 . 20 . 0.794 0.687 0.470 
'X-RAY DIFFRACTION' 1.658 1.713  2236 . 105 2000 94.1413  . 0.368 . . 0.370 . . . . . 0.322 . 20 . 0.847 0.880 0.333 
'X-RAY DIFFRACTION' 1.713 1.772  2147 . 84  1932 93.8985  . 0.307 . . 0.306 . . . . . 0.251 . 20 . 0.905 0.872 0.323 
'X-RAY DIFFRACTION' 1.772 1.839  2084 . 98  1894 95.5854  . 0.262 . . 0.258 . . . . . 0.206 . 20 . 0.942 0.903 0.333 
'X-RAY DIFFRACTION' 1.839 1.913  2013 . 110 1891 99.4039  . 0.222 . . 0.222 . . . . . 0.177 . 20 . 0.960 0.963 0.222 
'X-RAY DIFFRACTION' 1.913 1.998  1934 . 97  1837 100.0000 . 0.180 . . 0.179 . . . . . 0.152 . 20 . 0.977 0.975 0.196 
'X-RAY DIFFRACTION' 1.998 2.095  1850 . 99  1751 100.0000 . 0.168 . . 0.165 . . . . . 0.143 . 20 . 0.983 0.974 0.216 
'X-RAY DIFFRACTION' 2.095 2.207  1760 . 86  1674 100.0000 . 0.155 . . 0.153 . . . . . 0.136 . 20 . 0.985 0.978 0.197 
'X-RAY DIFFRACTION' 2.207 2.340  1684 . 87  1597 100.0000 . 0.158 . . 0.154 . . . . . 0.138 . 20 . 0.985 0.972 0.229 
'X-RAY DIFFRACTION' 2.340 2.499  1578 . 95  1483 100.0000 . 0.168 . . 0.166 . . . . . 0.150 . 20 . 0.982 0.971 0.205 
'X-RAY DIFFRACTION' 2.499 2.697  1490 . 75  1415 100.0000 . 0.180 . . 0.177 . . . . . 0.158 . 20 . 0.980 0.959 0.253 
'X-RAY DIFFRACTION' 2.697 2.951  1354 . 62  1292 100.0000 . 0.170 . . 0.167 . . . . . 0.158 . 20 . 0.982 0.964 0.235 
'X-RAY DIFFRACTION' 2.951 3.292  1254 . 46  1208 100.0000 . 0.157 . . 0.156 . . . . . 0.150 . 20 . 0.984 0.979 0.185 
'X-RAY DIFFRACTION' 3.292 3.789  1108 . 49  1058 99.9097  . 0.149 . . 0.147 . . . . . 0.146 . 20 . 0.986 0.979 0.180 
'X-RAY DIFFRACTION' 3.789 4.611  961  . 64  897  100.0000 . 0.142 . . 0.140 . . . . . 0.144 . 20 . 0.988 0.983 0.165 
'X-RAY DIFFRACTION' 4.611 6.399  765  . 56  708  99.8693  . 0.183 . . 0.179 . . . . . 0.183 . 20 . 0.983 0.977 0.227 
'X-RAY DIFFRACTION' 6.399 23.494 485  . 17  468  100.0000 . 0.203 . . 0.204 . . . . . 0.216 . 20 . 0.969 0.978 0.187 
# 
_struct.entry_id                     9AWN 
_struct.title                        'Crystal structure of trypsin at 250 Kelvin with benzamidine' 
_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        9AWN 
_struct_keywords.text            'Inhibitor, Benzamidine, Complex, x-ray., HYDROLASE' 
_struct_keywords.pdbx_keywords   HYDROLASE 
# 
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 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    TRY1_BOVIN 
_struct_ref.pdbx_db_accession          P00760 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;IVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNT
LNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNM
FCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN
;
_struct_ref.pdbx_align_begin           24 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              9AWN 
_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                 223 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             P00760 
_struct_ref_seq.db_align_beg                  24 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  246 
_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       223 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_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 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1 AA1 ALA A 38  ? TYR A 42  ? ALA A 38  TYR A 42  5 ? 5  
HELX_P HELX_P2 AA2 SER A 144 ? TYR A 152 ? SER A 144 TYR A 152 1 ? 9  
HELX_P HELX_P3 AA3 TYR A 212 ? ALA A 221 ? TYR A 212 ALA A 221 1 ? 10 
# 
_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 7   SG  ? ? ? 1_555 A CYS 137 SG ? ? A CYS 7   A CYS 137 1_555 ? ? ? ? ? ? ? 2.014 ? ? 
disulf2 disulf ? ? A CYS 25  SG  ? ? ? 1_555 A CYS 41  SG ? ? A CYS 25  A CYS 41  1_555 ? ? ? ? ? ? ? 2.044 ? ? 
disulf3 disulf ? ? A CYS 109 SG  ? ? ? 1_555 A CYS 210 SG ? ? A CYS 109 A CYS 210 1_555 ? ? ? ? ? ? ? 2.020 ? ? 
disulf4 disulf ? ? A CYS 116 SG  ? ? ? 1_555 A CYS 183 SG ? ? A CYS 116 A CYS 183 1_555 ? ? ? ? ? ? ? 2.048 ? ? 
disulf5 disulf ? ? A CYS 148 SG  ? ? ? 1_555 A CYS 162 SG ? ? A CYS 148 A CYS 162 1_555 ? ? ? ? ? ? ? 2.017 ? ? 
disulf6 disulf ? ? A CYS 173 SG  ? ? ? 1_555 A CYS 197 SG ? ? A CYS 173 A CYS 197 1_555 ? ? ? ? ? ? ? 2.027 ? ? 
metalc1 metalc ? ? A GLU 52  OE1 ? ? ? 1_555 B CA  .   CA ? ? A GLU 52  A CA  301 1_555 ? ? ? ? ? ? ? 2.202 ? ? 
metalc2 metalc ? ? A ASN 54  O   ? ? ? 1_555 B CA  .   CA ? ? A ASN 54  A CA  301 1_555 ? ? ? ? ? ? ? 2.337 ? ? 
metalc3 metalc ? ? A VAL 57  O   ? ? ? 1_555 B CA  .   CA ? ? A VAL 57  A CA  301 1_555 ? ? ? ? ? ? ? 2.281 ? ? 
metalc4 metalc ? ? A GLU 62  OE2 ? ? ? 1_555 B CA  .   CA ? ? A GLU 62  A CA  301 1_555 ? ? ? ? ? ? ? 2.254 ? ? 
# 
loop_
_struct_conn_type.id 
_struct_conn_type.criteria 
_struct_conn_type.reference 
disulf ? ? 
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 OE1 ? A GLU 52 ? A GLU 52 ? 1_555 CA ? B CA . ? A CA 301 ? 1_555 O   ? A ASN 54 ? A ASN 54 ? 1_555 92.4  ? 
2 OE1 ? A GLU 52 ? A GLU 52 ? 1_555 CA ? B CA . ? A CA 301 ? 1_555 O   ? A VAL 57 ? A VAL 57 ? 1_555 164.0 ? 
3 O   ? A ASN 54 ? A ASN 54 ? 1_555 CA ? B CA . ? A CA 301 ? 1_555 O   ? A VAL 57 ? A VAL 57 ? 1_555 81.2  ? 
4 OE1 ? A GLU 52 ? A GLU 52 ? 1_555 CA ? B CA . ? A CA 301 ? 1_555 OE2 ? A GLU 62 ? A GLU 62 ? 1_555 98.5  ? 
5 O   ? A ASN 54 ? A ASN 54 ? 1_555 CA ? B CA . ? A CA 301 ? 1_555 OE2 ? A GLU 62 ? A GLU 62 ? 1_555 162.2 ? 
6 O   ? A VAL 57 ? A VAL 57 ? 1_555 CA ? B CA . ? A CA 301 ? 1_555 OE2 ? A GLU 62 ? A GLU 62 ? 1_555 91.6  ? 
# 
loop_
_pdbx_modification_feature.ordinal 
_pdbx_modification_feature.label_comp_id 
_pdbx_modification_feature.label_asym_id 
_pdbx_modification_feature.label_seq_id 
_pdbx_modification_feature.label_alt_id 
_pdbx_modification_feature.modified_residue_label_comp_id 
_pdbx_modification_feature.modified_residue_label_asym_id 
_pdbx_modification_feature.modified_residue_label_seq_id 
_pdbx_modification_feature.modified_residue_label_alt_id 
_pdbx_modification_feature.auth_comp_id 
_pdbx_modification_feature.auth_asym_id 
_pdbx_modification_feature.auth_seq_id 
_pdbx_modification_feature.PDB_ins_code 
_pdbx_modification_feature.symmetry 
_pdbx_modification_feature.modified_residue_auth_comp_id 
_pdbx_modification_feature.modified_residue_auth_asym_id 
_pdbx_modification_feature.modified_residue_auth_seq_id 
_pdbx_modification_feature.modified_residue_PDB_ins_code 
_pdbx_modification_feature.modified_residue_symmetry 
_pdbx_modification_feature.comp_id_linking_atom 
_pdbx_modification_feature.modified_residue_id_linking_atom 
_pdbx_modification_feature.modified_residue_id 
_pdbx_modification_feature.ref_pcm_id 
_pdbx_modification_feature.ref_comp_id 
_pdbx_modification_feature.type 
_pdbx_modification_feature.category 
1 CYS A 7   ? CYS A 137 ? CYS A 7   ? 1_555 CYS A 137 ? 1_555 SG SG . . . None 'Disulfide bridge' 
2 CYS A 25  ? CYS A 41  ? CYS A 25  ? 1_555 CYS A 41  ? 1_555 SG SG . . . None 'Disulfide bridge' 
3 CYS A 109 ? CYS A 210 ? CYS A 109 ? 1_555 CYS A 210 ? 1_555 SG SG . . . None 'Disulfide bridge' 
4 CYS A 116 ? CYS A 183 ? CYS A 116 ? 1_555 CYS A 183 ? 1_555 SG SG . . . None 'Disulfide bridge' 
5 CYS A 148 ? CYS A 162 ? CYS A 148 ? 1_555 CYS A 162 ? 1_555 SG SG . . . None 'Disulfide bridge' 
6 CYS A 173 ? CYS A 197 ? CYS A 173 ? 1_555 CYS A 197 ? 1_555 SG SG . . . None 'Disulfide bridge' 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 7 ? 
AA2 ? 7 ? 
# 
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 
AA1 5 6 ? anti-parallel 
AA1 6 7 ? anti-parallel 
AA2 1 2 ? anti-parallel 
AA2 2 3 ? anti-parallel 
AA2 3 4 ? anti-parallel 
AA2 4 5 ? anti-parallel 
AA2 5 6 ? anti-parallel 
AA2 6 7 ? 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 TYR A 5   ? THR A 6   ? TYR A 5   THR A 6   
AA1 2 LYS A 136 ? PRO A 141 ? LYS A 136 PRO A 141 
AA1 3 GLN A 115 ? GLY A 120 ? GLN A 115 GLY A 120 
AA1 4 PRO A 180 ? CYS A 183 ? PRO A 180 CYS A 183 
AA1 5 LYS A 186 ? TRP A 193 ? LYS A 186 TRP A 193 
AA1 6 GLY A 204 ? LYS A 208 ? GLY A 204 LYS A 208 
AA1 7 MET A 160 ? ALA A 163 ? MET A 160 ALA A 163 
AA2 1 GLN A 15  ? ASN A 19  ? GLN A 15  ASN A 19  
AA2 2 HIS A 23  ? ASN A 31  ? HIS A 23  ASN A 31  
AA2 3 TRP A 34  ? SER A 37  ? TRP A 34  SER A 37  
AA2 4 MET A 86  ? LEU A 90  ? MET A 86  LEU A 90  
AA2 5 GLN A 63  ? VAL A 72  ? GLN A 63  VAL A 72  
AA2 6 GLN A 47  ? LEU A 50  ? GLN A 47  LEU A 50  
AA2 7 GLN A 15  ? ASN A 19  ? GLN A 15  ASN A 19  
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 N TYR A 5   ? N TYR A 5   O CYS A 137 ? O CYS A 137 
AA1 2 3 O ALA A 140 ? O ALA A 140 N CYS A 116 ? N CYS A 116 
AA1 3 4 N LEU A 117 ? N LEU A 117 O VAL A 182 ? O VAL A 182 
AA1 4 5 N CYS A 183 ? N CYS A 183 O LYS A 186 ? O LYS A 186 
AA1 5 6 N TRP A 193 ? N TRP A 193 O VAL A 205 ? O VAL A 205 
AA1 6 7 O TYR A 206 ? O TYR A 206 N PHE A 161 ? N PHE A 161 
AA2 1 2 N LEU A 18  ? N LEU A 18  O CYS A 25  ? O CYS A 25  
AA2 2 3 N SER A 28  ? N SER A 28  O VAL A 36  ? O VAL A 36  
AA2 3 4 N VAL A 35  ? N VAL A 35  O ILE A 88  ? O ILE A 88  
AA2 4 5 O LEU A 87  ? O LEU A 87  N ILE A 71  ? N ILE A 71  
AA2 5 6 O GLN A 63  ? O GLN A 63  N LEU A 50  ? N LEU A 50  
AA2 6 7 O GLN A 47  ? O GLN A 47  N ASN A 19  ? N ASN A 19  
# 
_pdbx_entry_details.entry_id                   9AWN 
_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_close_contact.id 
_pdbx_validate_close_contact.PDB_model_num 
_pdbx_validate_close_contact.auth_atom_id_1 
_pdbx_validate_close_contact.auth_asym_id_1 
_pdbx_validate_close_contact.auth_comp_id_1 
_pdbx_validate_close_contact.auth_seq_id_1 
_pdbx_validate_close_contact.PDB_ins_code_1 
_pdbx_validate_close_contact.label_alt_id_1 
_pdbx_validate_close_contact.auth_atom_id_2 
_pdbx_validate_close_contact.auth_asym_id_2 
_pdbx_validate_close_contact.auth_comp_id_2 
_pdbx_validate_close_contact.auth_seq_id_2 
_pdbx_validate_close_contact.PDB_ins_code_2 
_pdbx_validate_close_contact.label_alt_id_2 
_pdbx_validate_close_contact.dist 
1 1 O A HOH 432 ? ? O A HOH 544 ? ? 2.04 
2 1 O A HOH 437 ? ? O A HOH 543 ? ? 2.08 
3 1 O A HOH 553 ? ? O A HOH 569 ? ? 2.09 
4 1 O A HOH 567 ? ? O A HOH 570 ? ? 2.15 
5 1 O A HOH 501 ? ? O A HOH 530 ? ? 2.16 
6 1 O A HOH 562 ? ? O A HOH 571 ? ? 2.19 
# 
_pdbx_validate_symm_contact.id                1 
_pdbx_validate_symm_contact.PDB_model_num     1 
_pdbx_validate_symm_contact.auth_atom_id_1    O 
_pdbx_validate_symm_contact.auth_asym_id_1    A 
_pdbx_validate_symm_contact.auth_comp_id_1    HOH 
_pdbx_validate_symm_contact.auth_seq_id_1     426 
_pdbx_validate_symm_contact.PDB_ins_code_1    ? 
_pdbx_validate_symm_contact.label_alt_id_1    ? 
_pdbx_validate_symm_contact.site_symmetry_1   1_555 
_pdbx_validate_symm_contact.auth_atom_id_2    O 
_pdbx_validate_symm_contact.auth_asym_id_2    A 
_pdbx_validate_symm_contact.auth_comp_id_2    HOH 
_pdbx_validate_symm_contact.auth_seq_id_2     525 
_pdbx_validate_symm_contact.PDB_ins_code_2    ? 
_pdbx_validate_symm_contact.label_alt_id_2    ? 
_pdbx_validate_symm_contact.site_symmetry_2   4_545 
_pdbx_validate_symm_contact.dist              2.15 
# 
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 ASP A 53  ? ? -118.23 -78.95  
2 1 ASN A 97  ? ? -148.05 -156.59 
3 1 SER A 127 ? ? -124.28 -55.96  
# 
_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                       580 
_pdbx_distant_solvent_atoms.PDB_ins_code                      ? 
_pdbx_distant_solvent_atoms.neighbor_macromolecule_distance   6.39 
_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  
BEN C1   C  Y N 74  
BEN C2   C  Y N 75  
BEN C3   C  Y N 76  
BEN C4   C  Y N 77  
BEN C5   C  Y N 78  
BEN C6   C  Y N 79  
BEN C    C  N N 80  
BEN N1   N  N N 81  
BEN N2   N  N N 82  
BEN H2   H  N N 83  
BEN H3   H  N N 84  
BEN H4   H  N N 85  
BEN H5   H  N N 86  
BEN H6   H  N N 87  
BEN HN1  H  N N 88  
BEN HN21 H  N N 89  
BEN HN22 H  N N 90  
CA  CA   CA N N 91  
CYS N    N  N N 92  
CYS CA   C  N R 93  
CYS C    C  N N 94  
CYS O    O  N N 95  
CYS CB   C  N N 96  
CYS SG   S  N N 97  
CYS OXT  O  N N 98  
CYS H    H  N N 99  
CYS H2   H  N N 100 
CYS HA   H  N N 101 
CYS HB2  H  N N 102 
CYS HB3  H  N N 103 
CYS HG   H  N N 104 
CYS HXT  H  N N 105 
GLN N    N  N N 106 
GLN CA   C  N S 107 
GLN C    C  N N 108 
GLN O    O  N N 109 
GLN CB   C  N N 110 
GLN CG   C  N N 111 
GLN CD   C  N N 112 
GLN OE1  O  N N 113 
GLN NE2  N  N N 114 
GLN OXT  O  N N 115 
GLN H    H  N N 116 
GLN H2   H  N N 117 
GLN HA   H  N N 118 
GLN HB2  H  N N 119 
GLN HB3  H  N N 120 
GLN HG2  H  N N 121 
GLN HG3  H  N N 122 
GLN HE21 H  N N 123 
GLN HE22 H  N N 124 
GLN HXT  H  N N 125 
GLU N    N  N N 126 
GLU CA   C  N S 127 
GLU C    C  N N 128 
GLU O    O  N N 129 
GLU CB   C  N N 130 
GLU CG   C  N N 131 
GLU CD   C  N N 132 
GLU OE1  O  N N 133 
GLU OE2  O  N N 134 
GLU OXT  O  N N 135 
GLU H    H  N N 136 
GLU H2   H  N N 137 
GLU HA   H  N N 138 
GLU HB2  H  N N 139 
GLU HB3  H  N N 140 
GLU HG2  H  N N 141 
GLU HG3  H  N N 142 
GLU HE2  H  N N 143 
GLU HXT  H  N N 144 
GLY N    N  N N 145 
GLY CA   C  N N 146 
GLY C    C  N N 147 
GLY O    O  N N 148 
GLY OXT  O  N N 149 
GLY H    H  N N 150 
GLY H2   H  N N 151 
GLY HA2  H  N N 152 
GLY HA3  H  N N 153 
GLY HXT  H  N N 154 
HIS N    N  N N 155 
HIS CA   C  N S 156 
HIS C    C  N N 157 
HIS O    O  N N 158 
HIS CB   C  N N 159 
HIS CG   C  Y N 160 
HIS ND1  N  Y N 161 
HIS CD2  C  Y N 162 
HIS CE1  C  Y N 163 
HIS NE2  N  Y N 164 
HIS OXT  O  N N 165 
HIS H    H  N N 166 
HIS H2   H  N N 167 
HIS HA   H  N N 168 
HIS HB2  H  N N 169 
HIS HB3  H  N N 170 
HIS HD1  H  N N 171 
HIS HD2  H  N N 172 
HIS HE1  H  N N 173 
HIS HE2  H  N N 174 
HIS HXT  H  N N 175 
HOH O    O  N N 176 
HOH H1   H  N N 177 
HOH H2   H  N N 178 
ILE N    N  N N 179 
ILE CA   C  N S 180 
ILE C    C  N N 181 
ILE O    O  N N 182 
ILE CB   C  N S 183 
ILE CG1  C  N N 184 
ILE CG2  C  N N 185 
ILE CD1  C  N N 186 
ILE OXT  O  N N 187 
ILE H    H  N N 188 
ILE H2   H  N N 189 
ILE HA   H  N N 190 
ILE HB   H  N N 191 
ILE HG12 H  N N 192 
ILE HG13 H  N N 193 
ILE HG21 H  N N 194 
ILE HG22 H  N N 195 
ILE HG23 H  N N 196 
ILE HD11 H  N N 197 
ILE HD12 H  N N 198 
ILE HD13 H  N N 199 
ILE HXT  H  N N 200 
LEU N    N  N N 201 
LEU CA   C  N S 202 
LEU C    C  N N 203 
LEU O    O  N N 204 
LEU CB   C  N N 205 
LEU CG   C  N N 206 
LEU CD1  C  N N 207 
LEU CD2  C  N N 208 
LEU OXT  O  N N 209 
LEU H    H  N N 210 
LEU H2   H  N N 211 
LEU HA   H  N N 212 
LEU HB2  H  N N 213 
LEU HB3  H  N N 214 
LEU HG   H  N N 215 
LEU HD11 H  N N 216 
LEU HD12 H  N N 217 
LEU HD13 H  N N 218 
LEU HD21 H  N N 219 
LEU HD22 H  N N 220 
LEU HD23 H  N N 221 
LEU HXT  H  N N 222 
LYS N    N  N N 223 
LYS CA   C  N S 224 
LYS C    C  N N 225 
LYS O    O  N N 226 
LYS CB   C  N N 227 
LYS CG   C  N N 228 
LYS CD   C  N N 229 
LYS CE   C  N N 230 
LYS NZ   N  N N 231 
LYS OXT  O  N N 232 
LYS H    H  N N 233 
LYS H2   H  N N 234 
LYS HA   H  N N 235 
LYS HB2  H  N N 236 
LYS HB3  H  N N 237 
LYS HG2  H  N N 238 
LYS HG3  H  N N 239 
LYS HD2  H  N N 240 
LYS HD3  H  N N 241 
LYS HE2  H  N N 242 
LYS HE3  H  N N 243 
LYS HZ1  H  N N 244 
LYS HZ2  H  N N 245 
LYS HZ3  H  N N 246 
LYS HXT  H  N N 247 
MET N    N  N N 248 
MET CA   C  N S 249 
MET C    C  N N 250 
MET O    O  N N 251 
MET CB   C  N N 252 
MET CG   C  N N 253 
MET SD   S  N N 254 
MET CE   C  N N 255 
MET OXT  O  N N 256 
MET H    H  N N 257 
MET H2   H  N N 258 
MET HA   H  N N 259 
MET HB2  H  N N 260 
MET HB3  H  N N 261 
MET HG2  H  N N 262 
MET HG3  H  N N 263 
MET HE1  H  N N 264 
MET HE2  H  N N 265 
MET HE3  H  N N 266 
MET HXT  H  N N 267 
PHE N    N  N N 268 
PHE CA   C  N S 269 
PHE C    C  N N 270 
PHE O    O  N N 271 
PHE CB   C  N N 272 
PHE CG   C  Y N 273 
PHE CD1  C  Y N 274 
PHE CD2  C  Y N 275 
PHE CE1  C  Y N 276 
PHE CE2  C  Y N 277 
PHE CZ   C  Y N 278 
PHE OXT  O  N N 279 
PHE H    H  N N 280 
PHE H2   H  N N 281 
PHE HA   H  N N 282 
PHE HB2  H  N N 283 
PHE HB3  H  N N 284 
PHE HD1  H  N N 285 
PHE HD2  H  N N 286 
PHE HE1  H  N N 287 
PHE HE2  H  N N 288 
PHE HZ   H  N N 289 
PHE HXT  H  N N 290 
PRO N    N  N N 291 
PRO CA   C  N S 292 
PRO C    C  N N 293 
PRO O    O  N N 294 
PRO CB   C  N N 295 
PRO CG   C  N N 296 
PRO CD   C  N N 297 
PRO OXT  O  N N 298 
PRO H    H  N N 299 
PRO HA   H  N N 300 
PRO HB2  H  N N 301 
PRO HB3  H  N N 302 
PRO HG2  H  N N 303 
PRO HG3  H  N N 304 
PRO HD2  H  N N 305 
PRO HD3  H  N N 306 
PRO HXT  H  N N 307 
SER N    N  N N 308 
SER CA   C  N S 309 
SER C    C  N N 310 
SER O    O  N N 311 
SER CB   C  N N 312 
SER OG   O  N N 313 
SER OXT  O  N N 314 
SER H    H  N N 315 
SER H2   H  N N 316 
SER HA   H  N N 317 
SER HB2  H  N N 318 
SER HB3  H  N N 319 
SER HG   H  N N 320 
SER HXT  H  N N 321 
THR N    N  N N 322 
THR CA   C  N S 323 
THR C    C  N N 324 
THR O    O  N N 325 
THR CB   C  N R 326 
THR OG1  O  N N 327 
THR CG2  C  N N 328 
THR OXT  O  N N 329 
THR H    H  N N 330 
THR H2   H  N N 331 
THR HA   H  N N 332 
THR HB   H  N N 333 
THR HG1  H  N N 334 
THR HG21 H  N N 335 
THR HG22 H  N N 336 
THR HG23 H  N N 337 
THR HXT  H  N N 338 
TRP N    N  N N 339 
TRP CA   C  N S 340 
TRP C    C  N N 341 
TRP O    O  N N 342 
TRP CB   C  N N 343 
TRP CG   C  Y N 344 
TRP CD1  C  Y N 345 
TRP CD2  C  Y N 346 
TRP NE1  N  Y N 347 
TRP CE2  C  Y N 348 
TRP CE3  C  Y N 349 
TRP CZ2  C  Y N 350 
TRP CZ3  C  Y N 351 
TRP CH2  C  Y N 352 
TRP OXT  O  N N 353 
TRP H    H  N N 354 
TRP H2   H  N N 355 
TRP HA   H  N N 356 
TRP HB2  H  N N 357 
TRP HB3  H  N N 358 
TRP HD1  H  N N 359 
TRP HE1  H  N N 360 
TRP HE3  H  N N 361 
TRP HZ2  H  N N 362 
TRP HZ3  H  N N 363 
TRP HH2  H  N N 364 
TRP HXT  H  N N 365 
TYR N    N  N N 366 
TYR CA   C  N S 367 
TYR C    C  N N 368 
TYR O    O  N N 369 
TYR CB   C  N N 370 
TYR CG   C  Y N 371 
TYR CD1  C  Y N 372 
TYR CD2  C  Y N 373 
TYR CE1  C  Y N 374 
TYR CE2  C  Y N 375 
TYR CZ   C  Y N 376 
TYR OH   O  N N 377 
TYR OXT  O  N N 378 
TYR H    H  N N 379 
TYR H2   H  N N 380 
TYR HA   H  N N 381 
TYR HB2  H  N N 382 
TYR HB3  H  N N 383 
TYR HD1  H  N N 384 
TYR HD2  H  N N 385 
TYR HE1  H  N N 386 
TYR HE2  H  N N 387 
TYR HH   H  N N 388 
TYR HXT  H  N N 389 
VAL N    N  N N 390 
VAL CA   C  N S 391 
VAL C    C  N N 392 
VAL O    O  N N 393 
VAL CB   C  N N 394 
VAL CG1  C  N N 395 
VAL CG2  C  N N 396 
VAL OXT  O  N N 397 
VAL H    H  N N 398 
VAL H2   H  N N 399 
VAL HA   H  N N 400 
VAL HB   H  N N 401 
VAL HG11 H  N N 402 
VAL HG12 H  N N 403 
VAL HG13 H  N N 404 
VAL HG21 H  N N 405 
VAL HG22 H  N N 406 
VAL HG23 H  N N 407 
VAL HXT  H  N N 408 
# 
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  
BEN C1  C2   doub Y N 70  
BEN C1  C6   sing Y N 71  
BEN C1  C    sing N N 72  
BEN C2  C3   sing Y N 73  
BEN C2  H2   sing N N 74  
BEN C3  C4   doub Y N 75  
BEN C3  H3   sing N N 76  
BEN C4  C5   sing Y N 77  
BEN C4  H4   sing N N 78  
BEN C5  C6   doub Y N 79  
BEN C5  H5   sing N N 80  
BEN C6  H6   sing N N 81  
BEN C   N1   doub N E 82  
BEN C   N2   sing N N 83  
BEN N1  HN1  sing N N 84  
BEN N2  HN21 sing N N 85  
BEN N2  HN22 sing N N 86  
CYS N   CA   sing N N 87  
CYS N   H    sing N N 88  
CYS N   H2   sing N N 89  
CYS CA  C    sing N N 90  
CYS CA  CB   sing N N 91  
CYS CA  HA   sing N N 92  
CYS C   O    doub N N 93  
CYS C   OXT  sing N N 94  
CYS CB  SG   sing N N 95  
CYS CB  HB2  sing N N 96  
CYS CB  HB3  sing N N 97  
CYS SG  HG   sing N N 98  
CYS OXT HXT  sing N N 99  
GLN N   CA   sing N N 100 
GLN N   H    sing N N 101 
GLN N   H2   sing N N 102 
GLN CA  C    sing N N 103 
GLN CA  CB   sing N N 104 
GLN CA  HA   sing N N 105 
GLN C   O    doub N N 106 
GLN C   OXT  sing N N 107 
GLN CB  CG   sing N N 108 
GLN CB  HB2  sing N N 109 
GLN CB  HB3  sing N N 110 
GLN CG  CD   sing N N 111 
GLN CG  HG2  sing N N 112 
GLN CG  HG3  sing N N 113 
GLN CD  OE1  doub N N 114 
GLN CD  NE2  sing N N 115 
GLN NE2 HE21 sing N N 116 
GLN NE2 HE22 sing N N 117 
GLN OXT HXT  sing N N 118 
GLU N   CA   sing N N 119 
GLU N   H    sing N N 120 
GLU N   H2   sing N N 121 
GLU CA  C    sing N N 122 
GLU CA  CB   sing N N 123 
GLU CA  HA   sing N N 124 
GLU C   O    doub N N 125 
GLU C   OXT  sing N N 126 
GLU CB  CG   sing N N 127 
GLU CB  HB2  sing N N 128 
GLU CB  HB3  sing N N 129 
GLU CG  CD   sing N N 130 
GLU CG  HG2  sing N N 131 
GLU CG  HG3  sing N N 132 
GLU CD  OE1  doub N N 133 
GLU CD  OE2  sing N N 134 
GLU OE2 HE2  sing N N 135 
GLU OXT HXT  sing N N 136 
GLY N   CA   sing N N 137 
GLY N   H    sing N N 138 
GLY N   H2   sing N N 139 
GLY CA  C    sing N N 140 
GLY CA  HA2  sing N N 141 
GLY CA  HA3  sing N N 142 
GLY C   O    doub N N 143 
GLY C   OXT  sing N N 144 
GLY OXT HXT  sing N N 145 
HIS N   CA   sing N N 146 
HIS N   H    sing N N 147 
HIS N   H2   sing N N 148 
HIS CA  C    sing N N 149 
HIS CA  CB   sing N N 150 
HIS CA  HA   sing N N 151 
HIS C   O    doub N N 152 
HIS C   OXT  sing N N 153 
HIS CB  CG   sing N N 154 
HIS CB  HB2  sing N N 155 
HIS CB  HB3  sing N N 156 
HIS CG  ND1  sing Y N 157 
HIS CG  CD2  doub Y N 158 
HIS ND1 CE1  doub Y N 159 
HIS ND1 HD1  sing N N 160 
HIS CD2 NE2  sing Y N 161 
HIS CD2 HD2  sing N N 162 
HIS CE1 NE2  sing Y N 163 
HIS CE1 HE1  sing N N 164 
HIS NE2 HE2  sing N N 165 
HIS OXT HXT  sing N N 166 
HOH O   H1   sing N N 167 
HOH O   H2   sing N N 168 
ILE N   CA   sing N N 169 
ILE N   H    sing N N 170 
ILE N   H2   sing N N 171 
ILE CA  C    sing N N 172 
ILE CA  CB   sing N N 173 
ILE CA  HA   sing N N 174 
ILE C   O    doub N N 175 
ILE C   OXT  sing N N 176 
ILE CB  CG1  sing N N 177 
ILE CB  CG2  sing N N 178 
ILE CB  HB   sing N N 179 
ILE CG1 CD1  sing N N 180 
ILE CG1 HG12 sing N N 181 
ILE CG1 HG13 sing N N 182 
ILE CG2 HG21 sing N N 183 
ILE CG2 HG22 sing N N 184 
ILE CG2 HG23 sing N N 185 
ILE CD1 HD11 sing N N 186 
ILE CD1 HD12 sing N N 187 
ILE CD1 HD13 sing N N 188 
ILE OXT HXT  sing N N 189 
LEU N   CA   sing N N 190 
LEU N   H    sing N N 191 
LEU N   H2   sing N N 192 
LEU CA  C    sing N N 193 
LEU CA  CB   sing N N 194 
LEU CA  HA   sing N N 195 
LEU C   O    doub N N 196 
LEU C   OXT  sing N N 197 
LEU CB  CG   sing N N 198 
LEU CB  HB2  sing N N 199 
LEU CB  HB3  sing N N 200 
LEU CG  CD1  sing N N 201 
LEU CG  CD2  sing N N 202 
LEU CG  HG   sing N N 203 
LEU CD1 HD11 sing N N 204 
LEU CD1 HD12 sing N N 205 
LEU CD1 HD13 sing N N 206 
LEU CD2 HD21 sing N N 207 
LEU CD2 HD22 sing N N 208 
LEU CD2 HD23 sing N N 209 
LEU OXT HXT  sing N N 210 
LYS N   CA   sing N N 211 
LYS N   H    sing N N 212 
LYS N   H2   sing N N 213 
LYS CA  C    sing N N 214 
LYS CA  CB   sing N N 215 
LYS CA  HA   sing N N 216 
LYS C   O    doub N N 217 
LYS C   OXT  sing N N 218 
LYS CB  CG   sing N N 219 
LYS CB  HB2  sing N N 220 
LYS CB  HB3  sing N N 221 
LYS CG  CD   sing N N 222 
LYS CG  HG2  sing N N 223 
LYS CG  HG3  sing N N 224 
LYS CD  CE   sing N N 225 
LYS CD  HD2  sing N N 226 
LYS CD  HD3  sing N N 227 
LYS CE  NZ   sing N N 228 
LYS CE  HE2  sing N N 229 
LYS CE  HE3  sing N N 230 
LYS NZ  HZ1  sing N N 231 
LYS NZ  HZ2  sing N N 232 
LYS NZ  HZ3  sing N N 233 
LYS OXT HXT  sing N N 234 
MET N   CA   sing N N 235 
MET N   H    sing N N 236 
MET N   H2   sing N N 237 
MET CA  C    sing N N 238 
MET CA  CB   sing N N 239 
MET CA  HA   sing N N 240 
MET C   O    doub N N 241 
MET C   OXT  sing N N 242 
MET CB  CG   sing N N 243 
MET CB  HB2  sing N N 244 
MET CB  HB3  sing N N 245 
MET CG  SD   sing N N 246 
MET CG  HG2  sing N N 247 
MET CG  HG3  sing N N 248 
MET SD  CE   sing N N 249 
MET CE  HE1  sing N N 250 
MET CE  HE2  sing N N 251 
MET CE  HE3  sing N N 252 
MET OXT HXT  sing N N 253 
PHE N   CA   sing N N 254 
PHE N   H    sing N N 255 
PHE N   H2   sing N N 256 
PHE CA  C    sing N N 257 
PHE CA  CB   sing N N 258 
PHE CA  HA   sing N N 259 
PHE C   O    doub N N 260 
PHE C   OXT  sing N N 261 
PHE CB  CG   sing N N 262 
PHE CB  HB2  sing N N 263 
PHE CB  HB3  sing N N 264 
PHE CG  CD1  doub Y N 265 
PHE CG  CD2  sing Y N 266 
PHE CD1 CE1  sing Y N 267 
PHE CD1 HD1  sing N N 268 
PHE CD2 CE2  doub Y N 269 
PHE CD2 HD2  sing N N 270 
PHE CE1 CZ   doub Y N 271 
PHE CE1 HE1  sing N N 272 
PHE CE2 CZ   sing Y N 273 
PHE CE2 HE2  sing N N 274 
PHE CZ  HZ   sing N N 275 
PHE OXT HXT  sing N N 276 
PRO N   CA   sing N N 277 
PRO N   CD   sing N N 278 
PRO N   H    sing N N 279 
PRO CA  C    sing N N 280 
PRO CA  CB   sing N N 281 
PRO CA  HA   sing N N 282 
PRO C   O    doub N N 283 
PRO C   OXT  sing N N 284 
PRO CB  CG   sing N N 285 
PRO CB  HB2  sing N N 286 
PRO CB  HB3  sing N N 287 
PRO CG  CD   sing N N 288 
PRO CG  HG2  sing N N 289 
PRO CG  HG3  sing N N 290 
PRO CD  HD2  sing N N 291 
PRO CD  HD3  sing N N 292 
PRO OXT HXT  sing N N 293 
SER N   CA   sing N N 294 
SER N   H    sing N N 295 
SER N   H2   sing N N 296 
SER CA  C    sing N N 297 
SER CA  CB   sing N N 298 
SER CA  HA   sing N N 299 
SER C   O    doub N N 300 
SER C   OXT  sing N N 301 
SER CB  OG   sing N N 302 
SER CB  HB2  sing N N 303 
SER CB  HB3  sing N N 304 
SER OG  HG   sing N N 305 
SER OXT HXT  sing N N 306 
THR N   CA   sing N N 307 
THR N   H    sing N N 308 
THR N   H2   sing N N 309 
THR CA  C    sing N N 310 
THR CA  CB   sing N N 311 
THR CA  HA   sing N N 312 
THR C   O    doub N N 313 
THR C   OXT  sing N N 314 
THR CB  OG1  sing N N 315 
THR CB  CG2  sing N N 316 
THR CB  HB   sing N N 317 
THR OG1 HG1  sing N N 318 
THR CG2 HG21 sing N N 319 
THR CG2 HG22 sing N N 320 
THR CG2 HG23 sing N N 321 
THR OXT HXT  sing N N 322 
TRP N   CA   sing N N 323 
TRP N   H    sing N N 324 
TRP N   H2   sing N N 325 
TRP CA  C    sing N N 326 
TRP CA  CB   sing N N 327 
TRP CA  HA   sing N N 328 
TRP C   O    doub N N 329 
TRP C   OXT  sing N N 330 
TRP CB  CG   sing N N 331 
TRP CB  HB2  sing N N 332 
TRP CB  HB3  sing N N 333 
TRP CG  CD1  doub Y N 334 
TRP CG  CD2  sing Y N 335 
TRP CD1 NE1  sing Y N 336 
TRP CD1 HD1  sing N N 337 
TRP CD2 CE2  doub Y N 338 
TRP CD2 CE3  sing Y N 339 
TRP NE1 CE2  sing Y N 340 
TRP NE1 HE1  sing N N 341 
TRP CE2 CZ2  sing Y N 342 
TRP CE3 CZ3  doub Y N 343 
TRP CE3 HE3  sing N N 344 
TRP CZ2 CH2  doub Y N 345 
TRP CZ2 HZ2  sing N N 346 
TRP CZ3 CH2  sing Y N 347 
TRP CZ3 HZ3  sing N N 348 
TRP CH2 HH2  sing N N 349 
TRP OXT HXT  sing N N 350 
TYR N   CA   sing N N 351 
TYR N   H    sing N N 352 
TYR N   H2   sing N N 353 
TYR CA  C    sing N N 354 
TYR CA  CB   sing N N 355 
TYR CA  HA   sing N N 356 
TYR C   O    doub N N 357 
TYR C   OXT  sing N N 358 
TYR CB  CG   sing N N 359 
TYR CB  HB2  sing N N 360 
TYR CB  HB3  sing N N 361 
TYR CG  CD1  doub Y N 362 
TYR CG  CD2  sing Y N 363 
TYR CD1 CE1  sing Y N 364 
TYR CD1 HD1  sing N N 365 
TYR CD2 CE2  doub Y N 366 
TYR CD2 HD2  sing N N 367 
TYR CE1 CZ   doub Y N 368 
TYR CE1 HE1  sing N N 369 
TYR CE2 CZ   sing Y N 370 
TYR CE2 HE2  sing N N 371 
TYR CZ  OH   sing N N 372 
TYR OH  HH   sing N N 373 
TYR OXT HXT  sing N N 374 
VAL N   CA   sing N N 375 
VAL N   H    sing N N 376 
VAL N   H2   sing N N 377 
VAL CA  C    sing N N 378 
VAL CA  CB   sing N N 379 
VAL CA  HA   sing N N 380 
VAL C   O    doub N N 381 
VAL C   OXT  sing N N 382 
VAL CB  CG1  sing N N 383 
VAL CB  CG2  sing N N 384 
VAL CB  HB   sing N N 385 
VAL CG1 HG11 sing N N 386 
VAL CG1 HG12 sing N N 387 
VAL CG1 HG13 sing N N 388 
VAL CG2 HG21 sing N N 389 
VAL CG2 HG22 sing N N 390 
VAL CG2 HG23 sing N N 391 
VAL OXT HXT  sing N N 392 
# 
_pdbx_audit_support.funding_organization   'Brazilian National Council for Scientific and Technological Development (CNPq)' 
_pdbx_audit_support.country                Brazil 
_pdbx_audit_support.grant_number           ? 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   ? 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   1s0r 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9AWN 
_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]   0.018558 
_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]   0.017614 
_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]   0.015100 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
_atom_type.pdbx_scat_Z 
_atom_type.pdbx_N_electrons 
_atom_type.scat_Cromer_Mann_a1 
_atom_type.scat_Cromer_Mann_b1 
_atom_type.scat_Cromer_Mann_a2 
_atom_type.scat_Cromer_Mann_b2 
_atom_type.scat_Cromer_Mann_a3 
_atom_type.scat_Cromer_Mann_b3 
_atom_type.scat_Cromer_Mann_a4 
_atom_type.scat_Cromer_Mann_b4 
_atom_type.scat_Cromer_Mann_c 
C  6  6  2.310  20.844 1.020 10.208 1.589 0.569  0.865 51.651  0.216   
CA 20 20 8.627  10.442 7.387 0.660  1.590 85.748 1.021 178.437 1.375   
H  1  1  0.493  10.511 0.323 26.126 0.140 3.142  0.041 57.800  0.003   
N  7  7  12.222 0.006  3.135 9.893  2.014 28.997 1.167 0.583   -11.538 
O  8  8  3.049  13.277 2.287 5.701  1.546 0.324  0.867 32.909  0.251   
S  16 16 6.905  1.468  5.203 22.215 1.438 0.254  1.586 56.172  0.867   
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
_atom_site.calc_flag 
ATOM   1    N  N   . ILE A 1 1   ? 8.246   -20.004 12.927  1.000 8.732  0 1   ILE A N   1 ? 
ATOM   2    C  CA  . ILE A 1 1   ? 8.249   -20.977 14.067  1.000 9.696  0 1   ILE A CA  1 ? 
ATOM   3    C  C   . ILE A 1 1   ? 9.528   -20.773 14.875  1.000 9.638  0 1   ILE A C   1 ? 
ATOM   4    O  O   . ILE A 1 1   ? 10.618  -20.913 14.329  1.000 10.082 0 1   ILE A O   1 ? 
ATOM   5    C  CB  . ILE A 1 1   ? 8.232   -22.431 13.543  1.000 10.048 0 1   ILE A CB  1 ? 
ATOM   6    C  CG1 . ILE A 1 1   ? 7.034   -22.723 12.643  1.000 10.158 0 1   ILE A CG1 1 ? 
ATOM   7    C  CG2 . ILE A 1 1   ? 8.310   -23.423 14.698  1.000 9.737  0 1   ILE A CG2 1 ? 
ATOM   8    C  CD1 . ILE A 1 1   ? 5.707   -22.760 13.343  1.000 11.041 0 1   ILE A CD1 1 ? 
ATOM   9    N  N   . VAL A 1 2   ? 9.366   -20.534 16.172  1.000 9.176  0 2   VAL A N   1 ? 
ATOM   10   C  CA  . VAL A 1 2   ? 10.470  -20.367 17.103  1.000 10.529 0 2   VAL A CA  1 ? 
ATOM   11   C  C   . VAL A 1 2   ? 10.636  -21.667 17.869  1.000 10.807 0 2   VAL A C   1 ? 
ATOM   12   O  O   . VAL A 1 2   ? 9.654   -22.200 18.395  1.000 10.372 0 2   VAL A O   1 ? 
ATOM   13   C  CB  . VAL A 1 2   ? 10.180  -19.214 18.077  1.000 11.476 0 2   VAL A CB  1 ? 
ATOM   14   C  CG1 . VAL A 1 2   ? 11.333  -19.019 19.043  1.000 11.891 0 2   VAL A CG1 1 ? 
ATOM   15   C  CG2 . VAL A 1 2   ? 9.792   -17.918 17.376  1.000 11.273 0 2   VAL A CG2 1 ? 
ATOM   16   N  N   . GLY A 1 3   ? 11.885  -22.164 17.920  1.000 11.407 0 3   GLY A N   1 ? 
ATOM   17   C  CA  . GLY A 1 3   ? 12.232  -23.308 18.745  1.000 11.747 0 3   GLY A CA  1 ? 
ATOM   18   C  C   . GLY A 1 3   ? 11.719  -24.633 18.192  1.000 11.442 0 3   GLY A C   1 ? 
ATOM   19   O  O   . GLY A 1 3   ? 11.523  -25.594 18.933  1.000 11.568 0 3   GLY A O   1 ? 
ATOM   20   N  N   . GLY A 1 4   ? 11.490  -24.683 16.880  1.000 11.700 0 4   GLY A N   1 ? 
ATOM   21   C  CA  . GLY A 1 4   ? 10.995  -25.881 16.239  1.000 12.243 0 4   GLY A CA  1 ? 
ATOM   22   C  C   . GLY A 1 4   ? 12.132  -26.605 15.544  1.000 13.258 0 4   GLY A C   1 ? 
ATOM   23   O  O   . GLY A 1 4   ? 13.281  -26.480 15.955  1.000 15.959 0 4   GLY A O   1 ? 
ATOM   24   N  N   . TYR A 1 5   ? 11.814  -27.315 14.474  1.000 11.230 0 5   TYR A N   1 ? 
ATOM   25   C  CA  . TYR A 1 5   ? 12.748  -28.173 13.798  1.000 11.690 0 5   TYR A CA  1 ? 
ATOM   26   C  C   . TYR A 1 5   ? 12.408  -28.148 12.311  1.000 11.901 0 5   TYR A C   1 ? 
ATOM   27   O  O   . TYR A 1 5   ? 11.275  -27.822 11.930  1.000 10.605 0 5   TYR A O   1 ? 
ATOM   28   C  CB  . TYR A 1 5   ? 12.691  -29.605 14.341  1.000 11.595 0 5   TYR A CB  1 ? 
ATOM   29   C  CG  . TYR A 1 5   ? 11.390  -30.348 14.209  1.000 11.171 0 5   TYR A CG  1 ? 
ATOM   30   C  CD1 . TYR A 1 5   ? 10.335  -30.075 15.072  1.000 11.297 0 5   TYR A CD1 1 ? 
ATOM   31   C  CD2 . TYR A 1 5   ? 11.187  -31.281 13.210  1.000 10.024 0 5   TYR A CD2 1 ? 
ATOM   32   C  CE1 . TYR A 1 5   ? 9.132   -30.737 14.965  1.000 10.793 0 5   TYR A CE1 1 ? 
ATOM   33   C  CE2 . TYR A 1 5   ? 9.977   -31.939 13.086  1.000 10.336 0 5   TYR A CE2 1 ? 
ATOM   34   C  CZ  . TYR A 1 5   ? 8.937   -31.636 13.942  1.000 10.813 0 5   TYR A CZ  1 ? 
ATOM   35   O  OH  . TYR A 1 5   ? 7.743   -32.303 13.877  1.000 11.958 0 5   TYR A OH  1 ? 
ATOM   36   N  N   . THR A 1 6   ? 13.398  -28.484 11.494  1.000 11.295 0 6   THR A N   1 ? 
ATOM   37   C  CA  . THR A 1 6   ? 13.183  -28.655 10.060  1.000 12.214 0 6   THR A CA  1 ? 
ATOM   38   C  C   . THR A 1 6   ? 12.297  -29.867 9.804   1.000 11.272 0 6   THR A C   1 ? 
ATOM   39   O  O   . THR A 1 6   ? 12.662  -30.987 10.124  1.000 11.372 0 6   THR A O   1 ? 
ATOM   40   C  CB  . THR A 1 6   ? 14.504  -28.806 9.295   1.000 13.886 0 6   THR A CB  1 ? 
ATOM   41   O  OG1 . THR A 1 6   ? 15.185  -27.604 9.620   1.000 14.572 0 6   THR A OG1 1 ? 
ATOM   42   C  CG2 . THR A 1 6   ? 14.293  -28.958 7.802   1.000 15.645 0 6   THR A CG2 1 ? 
ATOM   43   N  N   . CYS A 1 7   ? 11.148  -29.642 9.174   1.000 10.021 0 7   CYS A N   1 ? 
ATOM   44   C  CA  . CYS A 1 7   ? 10.156  -30.682 8.967   1.000 10.146 0 7   CYS A CA  1 ? 
ATOM   45   C  C   . CYS A 1 7   ? 10.715  -31.835 8.143   1.000 11.842 0 7   CYS A C   1 ? 
ATOM   46   O  O   . CYS A 1 7   ? 10.446  -33.021 8.413   1.000 12.728 0 7   CYS A O   1 ? 
ATOM   47   C  CB  . CYS A 1 7   ? 8.943   -30.091 8.238   1.000 9.523  0 7   CYS A CB  1 ? 
ATOM   48   S  SG  . CYS A 1 7   ? 8.082   -28.744 9.074   1.000 9.241  0 7   CYS A SG  1 ? 
ATOM   49   N  N   . GLY A 1 8   ? 11.457  -31.477 7.102   1.000 13.312 0 8   GLY A N   1 ? 
ATOM   50   C  CA  . GLY A 1 8   ? 11.815  -32.393 6.037   1.000 13.647 0 8   GLY A CA  1 ? 
ATOM   51   C  C   . GLY A 1 8   ? 10.937  -32.120 4.829   1.000 14.003 0 8   GLY A C   1 ? 
ATOM   52   O  O   . GLY A 1 8   ? 9.723   -31.929 4.958   1.000 13.626 0 8   GLY A O   1 ? 
ATOM   53   N  N   . ALA A 1 9   ? 11.546  -32.128 3.645   1.000 14.197 0 9   ALA A N   1 ? 
ATOM   54   C  CA  . ALA A 1 9   ? 10.834  -31.724 2.447   1.000 14.690 0 9   ALA A CA  1 ? 
ATOM   55   C  C   . ALA A 1 9   ? 9.563   -32.553 2.291   1.000 14.383 0 9   ALA A C   1 ? 
ATOM   56   O  O   . ALA A 1 9   ? 9.619   -33.789 2.355   1.000 14.788 0 9   ALA A O   1 ? 
ATOM   57   C  CB  . ALA A 1 9   ? 11.761  -31.823 1.256   1.000 15.452 0 9   ALA A CB  1 ? 
ATOM   58   N  N   . ASN A 1 10  ? 8.435   -31.831 2.167   1.000 14.501 0 10  ASN A N   1 ? 
ATOM   59   C  CA  . ASN A 1 10  ? 7.127   -32.358 1.787   1.000 14.591 0 10  ASN A CA  1 ? 
ATOM   60   C  C   . ASN A 1 10  ? 6.624   -33.428 2.761   1.000 14.911 0 10  ASN A C   1 ? 
ATOM   61   O  O   . ASN A 1 10  ? 5.794   -34.253 2.386   1.000 16.068 0 10  ASN A O   1 ? 
ATOM   62   C  CB  . ASN A 1 10  ? 7.108   -32.888 0.346   1.000 15.987 0 10  ASN A CB  1 ? 
ATOM   63   C  CG  . ASN A 1 10  ? 7.720   -31.940 -0.664  1.000 16.608 0 10  ASN A CG  1 ? 
ATOM   64   O  OD1 . ASN A 1 10  ? 8.769   -32.261 -1.228  1.000 16.642 0 10  ASN A OD1 1 ? 
ATOM   65   N  ND2 . ASN A 1 10  ? 7.077   -30.793 -0.876  1.000 15.289 0 10  ASN A ND2 1 ? 
ATOM   66   N  N   . THR A 1 11  ? 7.043   -33.355 4.034   1.000 13.723 0 11  THR A N   1 ? 
ATOM   67   C  CA  . THR A 1 11  ? 6.513   -34.206 5.079   1.000 13.177 0 11  THR A CA  1 ? 
ATOM   68   C  C   . THR A 1 11  ? 5.226   -33.603 5.646   1.000 12.096 0 11  THR A C   1 ? 
ATOM   69   O  O   . THR A 1 11  ? 4.549   -34.233 6.458   1.000 12.730 0 11  THR A O   1 ? 
ATOM   70   C  CB  . THR A 1 11  ? 7.539   -34.410 6.198   1.000 14.475 0 11  THR A CB  1 ? 
ATOM   71   O  OG1 . THR A 1 11  ? 7.944   -33.146 6.679   1.000 13.686 0 11  THR A OG1 1 ? 
ATOM   72   C  CG2 . THR A 1 11  ? 8.798   -35.126 5.760   1.000 16.347 0 11  THR A CG2 1 ? 
ATOM   73   N  N   . VAL A 1 12  ? 4.897   -32.378 5.229   1.000 10.804 0 12  VAL A N   1 ? 
ATOM   74   C  CA  . VAL A 1 12  ? 3.690   -31.680 5.639   1.000 10.135 0 12  VAL A CA  1 ? 
ATOM   75   C  C   . VAL A 1 12  ? 2.969   -31.273 4.351   1.000 10.402 0 12  VAL A C   1 ? 
ATOM   76   O  O   . VAL A 1 12  ? 2.992   -30.132 3.931   1.000 9.898  0 12  VAL A O   1 ? 
ATOM   77   C  CB  . VAL A 1 12  ? 3.979   -30.471 6.560   1.000 11.297 0 12  VAL A CB  1 ? 
ATOM   78   C  CG1 . VAL A 1 12  ? 2.682   -29.917 7.133   1.000 11.604 0 12  VAL A CG1 1 ? 
ATOM   79   C  CG2 . VAL A 1 12  ? 4.963   -30.828 7.679   1.000 11.244 0 12  VAL A CG2 1 ? 
ATOM   80   N  N   . PRO A 1 13  ? 2.362   -32.237 3.632   1.000 10.129 0 13  PRO A N   1 ? 
ATOM   81   C  CA  . PRO A 1 13  ? 1.999   -32.025 2.238   1.000 9.447  0 13  PRO A CA  1 ? 
ATOM   82   C  C   . PRO A 1 13  ? 0.763   -31.158 2.057   1.000 8.987  0 13  PRO A C   1 ? 
ATOM   83   O  O   . PRO A 1 13  ? 0.471   -30.721 0.955   1.000 9.294  0 13  PRO A O   1 ? 
ATOM   84   C  CB  . PRO A 1 13  ? 1.803   -33.446 1.733   1.000 9.867  0 13  PRO A CB  1 ? 
ATOM   85   C  CG  . PRO A 1 13  ? 1.339   -34.189 2.954   1.000 9.980  0 13  PRO A CG  1 ? 
ATOM   86   C  CD  . PRO A 1 13  ? 2.171   -33.623 4.074   1.000 10.042 0 13  PRO A CD  1 ? 
ATOM   87   N  N   . TYR A 1 14  ? 0.109   -30.840 3.173   1.000 8.106  0 14  TYR A N   1 ? 
ATOM   88   C  CA  . TYR A 1 14  ? -1.058  -29.974 3.136   1.000 8.062  0 14  TYR A CA  1 ? 
ATOM   89   C  C   . TYR A 1 14  ? -0.677  -28.515 3.358   1.000 8.253  0 14  TYR A C   1 ? 
ATOM   90   O  O   . TYR A 1 14  ? -1.524  -27.624 3.243   1.000 7.722  0 14  TYR A O   1 ? 
ATOM   91   C  CB  . TYR A 1 14  ? -2.095  -30.455 4.148   1.000 8.390  0 14  TYR A CB  1 ? 
ATOM   92   C  CG  . TYR A 1 14  ? -1.512  -30.654 5.508   1.000 8.455  0 14  TYR A CG  1 ? 
ATOM   93   C  CD1 . TYR A 1 14  ? -1.240  -29.579 6.343   1.000 9.208  0 14  TYR A CD1 1 ? 
ATOM   94   C  CD2 . TYR A 1 14  ? -1.026  -31.891 5.880   1.000 9.136  0 14  TYR A CD2 1 ? 
ATOM   95   C  CE1 . TYR A 1 14  ? -0.676  -29.771 7.594   1.000 9.118  0 14  TYR A CE1 1 ? 
ATOM   96   C  CE2 . TYR A 1 14  ? -0.501  -32.101 7.138   1.000 9.431  0 14  TYR A CE2 1 ? 
ATOM   97   C  CZ  . TYR A 1 14  ? -0.238  -31.030 7.958   1.000 10.064 0 14  TYR A CZ  1 ? 
ATOM   98   O  OH  . TYR A 1 14  ? 0.386   -31.226 9.169   1.000 10.279 0 14  TYR A OH  1 ? 
ATOM   99   N  N   . GLN A 1 15  ? 0.579   -28.259 3.695   1.000 8.029  0 15  GLN A N   1 ? 
ATOM   100  C  CA  . GLN A 1 15  ? 1.030   -26.920 3.995   1.000 8.291  0 15  GLN A CA  1 ? 
ATOM   101  C  C   . GLN A 1 15  ? 1.125   -26.115 2.704   1.000 9.024  0 15  GLN A C   1 ? 
ATOM   102  O  O   . GLN A 1 15  ? 1.743   -26.566 1.735   1.000 8.376  0 15  GLN A O   1 ? 
ATOM   103  C  CB  . GLN A 1 15  ? 2.412   -26.935 4.644   1.000 8.834  0 15  GLN A CB  1 ? 
ATOM   104  C  CG  . GLN A 1 15  ? 2.984   -25.536 4.847   1.000 8.973  0 15  GLN A CG  1 ? 
ATOM   105  C  CD  . GLN A 1 15  ? 2.500   -24.826 6.092   1.000 9.878  0 15  GLN A CD  1 ? 
ATOM   106  O  OE1 . GLN A 1 15  ? 2.495   -25.379 7.193   1.000 10.480 0 15  GLN A OE1 1 ? 
ATOM   107  N  NE2 . GLN A 1 15  ? 2.083   -23.583 5.921   1.000 9.379  0 15  GLN A NE2 1 ? 
ATOM   108  N  N   . VAL A 1 16  ? 0.545   -24.919 2.680   1.000 8.425  0 16  VAL A N   1 ? 
ATOM   109  C  CA  . VAL A 1 16  ? 0.732   -24.063 1.512   1.000 9.116  0 16  VAL A CA  1 ? 
ATOM   110  C  C   . VAL A 1 16  ? 1.350   -22.752 1.963   1.000 8.133  0 16  VAL A C   1 ? 
ATOM   111  O  O   . VAL A 1 16  ? 1.228   -22.351 3.123   1.000 8.358  0 16  VAL A O   1 ? 
ATOM   112  C  CB  . VAL A 1 16  ? -0.557  -23.845 0.686   1.000 9.940  0 16  VAL A CB  1 ? 
ATOM   113  C  CG1 . VAL A 1 16  ? -1.363  -25.135 0.540   1.000 10.615 0 16  VAL A CG1 1 ? 
ATOM   114  C  CG2 . VAL A 1 16  ? -1.446  -22.750 1.231   1.000 10.371 0 16  VAL A CG2 1 ? 
ATOM   115  N  N   . SER A 1 17  ? 2.003   -22.079 0.999   1.000 7.614  0 17  SER A N   1 ? 
ATOM   116  C  CA  . SER A 1 17  ? 2.472   -20.714 1.153   1.000 7.577  0 17  SER A CA  1 ? 
ATOM   117  C  C   . SER A 1 17  ? 1.554   -19.785 0.352   1.000 8.070  0 17  SER A C   1 ? 
ATOM   118  O  O   . SER A 1 17  ? 1.227   -20.108 -0.796  1.000 9.908  0 17  SER A O   1 ? 
ATOM   119  C  CB  . SER A 1 17  ? 3.883   -20.578 0.660   1.000 7.113  0 17  SER A CB  1 ? 
ATOM   120  O  OG  . SER A 1 17  ? 4.208   -19.211 0.497   1.000 6.635  0 17  SER A OG  1 ? 
ATOM   121  N  N   . LEU A 1 18  ? 1.078   -18.726 0.971   1.000 7.555  0 18  LEU A N   1 ? 
ATOM   122  C  CA  . LEU A 1 18  ? 0.358   -17.735 0.221   1.000 7.796  0 18  LEU A CA  1 ? 
ATOM   123  C  C   . LEU A 1 18  ? 1.401   -16.708 -0.197  1.000 7.911  0 18  LEU A C   1 ? 
ATOM   124  O  O   . LEU A 1 18  ? 2.135   -16.149 0.638   1.000 8.757  0 18  LEU A O   1 ? 
ATOM   125  C  CB  . LEU A 1 18  ? -0.771  -17.081 1.017   1.000 7.942  0 18  LEU A CB  1 ? 
ATOM   126  C  CG  . LEU A 1 18  ? -1.778  -18.037 1.666   1.000 8.793  0 18  LEU A CG  1 ? 
ATOM   127  C  CD1 . LEU A 1 18  ? -2.871  -17.282 2.405   1.000 8.905  0 18  LEU A CD1 1 ? 
ATOM   128  C  CD2 . LEU A 1 18  ? -2.365  -19.029 0.695   1.000 8.945  0 18  LEU A CD2 1 ? 
ATOM   129  N  N   . ASN A 1 19  ? 1.349   -16.383 -1.482  1.000 7.915  0 19  ASN A N   1 ? 
ATOM   130  C  CA  . ASN A 1 19  ? 2.359   -15.532 -2.081  1.000 7.854  0 19  ASN A CA  1 ? 
ATOM   131  C  C   . ASN A 1 19  ? 1.689   -14.339 -2.754  1.000 8.664  0 19  ASN A C   1 ? 
ATOM   132  O  O   . ASN A 1 19  ? 0.832   -14.562 -3.565  1.000 8.844  0 19  ASN A O   1 ? 
ATOM   133  C  CB  . ASN A 1 19  ? 3.193   -16.341 -3.071  1.000 8.142  0 19  ASN A CB  1 ? 
ATOM   134  C  CG  . ASN A 1 19  ? 4.327   -15.534 -3.644  1.000 8.163  0 19  ASN A CG  1 ? 
ATOM   135  O  OD1 . ASN A 1 19  ? 4.075   -14.621 -4.426  1.000 8.312  0 19  ASN A OD1 1 ? 
ATOM   136  N  ND2 . ASN A 1 19  ? 5.537   -15.809 -3.203  1.000 8.023  0 19  ASN A ND2 1 ? 
ATOM   137  N  N   . SER A 1 20  ? 2.129   -13.109 -2.469  1.000 9.226  0 20  SER A N   1 ? 
ATOM   138  C  CA  . SER A 1 20  ? 1.608   -11.937 -3.162  1.000 10.471 0 20  SER A CA  1 ? 
ATOM   139  C  C   . SER A 1 20  ? 2.786   -11.138 -3.711  1.000 11.022 0 20  SER A C   1 ? 
ATOM   140  O  O   . SER A 1 20  ? 2.907   -9.926  -3.530  1.000 12.909 0 20  SER A O   1 ? 
ATOM   141  C  CB  . SER A 1 20  ? 0.786   -11.104 -2.229  1.000 13.692 0 20  SER A CB  1 ? 
ATOM   142  O  OG  . SER A 1 20  ? 1.636   -10.663 -1.138  1.000 15.118 0 20  SER A OG  1 ? 
ATOM   143  N  N   . GLY A 1 21  ? 3.726   -11.850 -4.327  1.000 8.956  0 21  GLY A N   1 ? 
ATOM   144  C  CA  . GLY A 1 21  ? 5.004   -11.262 -4.662  1.000 9.690  0 21  GLY A CA  1 ? 
ATOM   145  C  C   . GLY A 1 21  ? 6.089   -11.696 -3.695  1.000 9.348  0 21  GLY A C   1 ? 
ATOM   146  O  O   . GLY A 1 21  ? 7.248   -11.412 -3.934  1.000 10.275 0 21  GLY A O   1 ? 
ATOM   147  N  N   . TYR A 1 22  ? 5.688   -12.320 -2.581  1.000 8.576  0 22  TYR A N   1 ? 
ATOM   148  C  CA  . TYR A 1 22  ? 6.527   -12.725 -1.471  1.000 9.012  0 22  TYR A CA  1 ? 
ATOM   149  C  C   . TYR A 1 22  ? 5.649   -13.610 -0.584  1.000 8.818  0 22  TYR A C   1 ? 
ATOM   150  O  O   . TYR A 1 22  ? 4.442   -13.476 -0.629  1.000 7.979  0 22  TYR A O   1 ? 
ATOM   151  C  CB  . TYR A 1 22  ? 7.056   -11.506 -0.687  1.000 9.568  0 22  TYR A CB  1 ? 
ATOM   152  C  CG  . TYR A 1 22  ? 5.989   -10.504 -0.349  1.000 11.279 0 22  TYR A CG  1 ? 
ATOM   153  C  CD1 . TYR A 1 22  ? 5.213   -10.655 0.796   1.000 13.074 0 22  TYR A CD1 1 ? 
ATOM   154  C  CD2 . TYR A 1 22  ? 5.715   -9.453  -1.212  1.000 11.380 0 22  TYR A CD2 1 ? 
ATOM   155  C  CE1 . TYR A 1 22  ? 4.189   -9.769  1.070   1.000 12.984 0 22  TYR A CE1 1 ? 
ATOM   156  C  CE2 . TYR A 1 22  ? 4.690   -8.567  -0.944  1.000 13.107 0 22  TYR A CE2 1 ? 
ATOM   157  C  CZ  . TYR A 1 22  ? 3.931   -8.726  0.200   1.000 13.687 0 22  TYR A CZ  1 ? 
ATOM   158  O  OH  . TYR A 1 22  ? 2.913   -7.827  0.452   1.000 15.388 0 22  TYR A OH  1 ? 
ATOM   159  N  N   . HIS A 1 23  ? 6.244   -14.527 0.170   1.000 8.979  0 23  HIS A N   1 ? 
ATOM   160  C  CA  . HIS A 1 23  ? 5.492   -15.309 1.144   1.000 9.388  0 23  HIS A CA  1 ? 
ATOM   161  C  C   . HIS A 1 23  ? 5.004   -14.378 2.245   1.000 10.025 0 23  HIS A C   1 ? 
ATOM   162  O  O   . HIS A 1 23  ? 5.785   -13.610 2.816   1.000 9.012  0 23  HIS A O   1 ? 
ATOM   163  C  CB  . HIS A 1 23  ? 6.350   -16.435 1.735   1.000 10.066 0 23  HIS A CB  1 ? 
ATOM   164  C  CG  . HIS A 1 23  ? 5.749   -17.048 2.957   1.000 9.162  0 23  HIS A CG  1 ? 
ATOM   165  N  ND1 . HIS A 1 23  ? 4.832   -18.061 2.934   1.000 8.933  0 23  HIS A ND1 1 ? 
ATOM   166  C  CD2 . HIS A 1 23  ? 5.838   -16.615 4.255   1.000 9.459  0 23  HIS A CD2 1 ? 
ATOM   167  C  CE1 . HIS A 1 23  ? 4.419   -18.272 4.189   1.000 9.042  0 23  HIS A CE1 1 ? 
ATOM   168  N  NE2 . HIS A 1 23  ? 5.027   -17.408 5.016   1.000 9.037  0 23  HIS A NE2 1 ? 
ATOM   169  N  N   . PHE A 1 24  ? 3.700   -14.459 2.573   1.000 10.540 0 24  PHE A N   1 ? 
ATOM   170  C  CA  . PHE A 1 24  ? 3.209   -13.613 3.653   1.000 9.688  0 24  PHE A CA  1 ? 
ATOM   171  C  C   . PHE A 1 24  ? 2.370   -14.375 4.681   1.000 9.523  0 24  PHE A C   1 ? 
ATOM   172  O  O   . PHE A 1 24  ? 2.152   -13.850 5.788   1.000 9.696  0 24  PHE A O   1 ? 
ATOM   173  C  CB  . PHE A 1 24  ? 2.472   -12.416 3.042   1.000 9.977  0 24  PHE A CB  1 ? 
ATOM   174  C  CG  . PHE A 1 24  ? 1.162   -12.769 2.387   1.000 10.116 0 24  PHE A CG  1 ? 
ATOM   175  C  CD1 . PHE A 1 24  ? -0.015  -12.819 3.122   1.000 11.072 0 24  PHE A CD1 1 ? 
ATOM   176  C  CD2 . PHE A 1 24  ? 1.099   -13.105 1.044   1.000 10.103 0 24  PHE A CD2 1 ? 
ATOM   177  C  CE1 . PHE A 1 24  ? -1.219  -13.110 2.514   1.000 10.592 0 24  PHE A CE1 1 ? 
ATOM   178  C  CE2 . PHE A 1 24  ? -0.113  -13.406 0.447   1.000 10.111 0 24  PHE A CE2 1 ? 
ATOM   179  C  CZ  . PHE A 1 24  ? -1.263  -13.450 1.189   1.000 11.641 0 24  PHE A CZ  1 ? 
ATOM   180  N  N   . CYS A 1 25  ? 1.889   -15.567 4.331   1.000 8.251  0 25  CYS A N   1 ? 
ATOM   181  C  CA  . CYS A 1 25  ? 1.027   -16.335 5.211   1.000 8.395  0 25  CYS A CA  1 ? 
ATOM   182  C  C   . CYS A 1 25  ? 1.080   -17.796 4.782   1.000 8.860  0 25  CYS A C   1 ? 
ATOM   183  O  O   . CYS A 1 25  ? 1.413   -18.135 3.646   1.000 8.566  0 25  CYS A O   1 ? 
ATOM   184  C  CB  . CYS A 1 25  ? -0.416  -15.811 5.188   1.000 8.413  0 25  CYS A CB  1 ? 
ATOM   185  S  SG  . CYS A 1 25  ? -0.739  -14.557 6.441   1.000 8.190  0 25  CYS A SG  1 ? 
ATOM   186  N  N   . GLY A 1 26  ? 0.745   -18.674 5.725   1.000 8.267  0 26  GLY A N   1 ? 
ATOM   187  C  CA  . GLY A 1 26  ? 0.465   -20.052 5.412   1.000 7.987  0 26  GLY A CA  1 ? 
ATOM   188  C  C   . GLY A 1 26  ? -1.008  -20.311 5.143   1.000 7.419  0 26  GLY A C   1 ? 
ATOM   189  O  O   . GLY A 1 26  ? -1.879  -19.414 5.177   1.000 7.356  0 26  GLY A O   1 ? 
ATOM   190  N  N   . GLY A 1 27  ? -1.266  -21.598 4.917   1.000 6.986  0 27  GLY A N   1 ? 
ATOM   191  C  CA  . GLY A 1 27  ? -2.579  -22.125 4.725   1.000 7.552  0 27  GLY A CA  1 ? 
ATOM   192  C  C   . GLY A 1 27  ? -2.532  -23.637 4.734   1.000 7.056  0 27  GLY A C   1 ? 
ATOM   193  O  O   . GLY A 1 27  ? -1.438  -24.211 4.740   1.000 6.859  0 27  GLY A O   1 ? 
ATOM   194  N  N   . SER A 1 28  ? -3.728  -24.256 4.684   1.000 7.607  0 28  SER A N   1 ? 
ATOM   195  C  CA  . SER A 1 28  ? -3.878  -25.693 4.697   1.000 9.074  0 28  SER A CA  1 ? 
ATOM   196  C  C   . SER A 1 28  ? -4.744  -26.103 3.516   1.000 8.706  0 28  SER A C   1 ? 
ATOM   197  O  O   . SER A 1 28  ? -5.794  -25.517 3.329   1.000 8.557  0 28  SER A O   1 ? 
ATOM   198  C  CB  . SER A 1 28  ? -4.499  -26.178 5.985   1.000 10.204 0 28  SER A CB  1 ? 
ATOM   199  O  OG  . SER A 1 28  ? -3.717  -25.834 7.119   1.000 11.695 0 28  SER A OG  1 ? 
ATOM   200  N  N   . LEU A 1 29  ? -4.274  -27.056 2.706   1.000 8.844  0 29  LEU A N   1 ? 
ATOM   201  C  CA  . LEU A 1 29  ? -5.063  -27.554 1.597   1.000 9.926  0 29  LEU A CA  1 ? 
ATOM   202  C  C   . LEU A 1 29  ? -6.071  -28.563 2.141   1.000 9.784  0 29  LEU A C   1 ? 
ATOM   203  O  O   . LEU A 1 29  ? -5.664  -29.562 2.702   1.000 9.814  0 29  LEU A O   1 ? 
ATOM   204  C  CB  . LEU A 1 29  ? -4.147  -28.221 0.580   1.000 10.844 0 29  LEU A CB  1 ? 
ATOM   205  C  CG  . LEU A 1 29  ? -4.824  -28.681 -0.713  1.000 12.335 0 29  LEU A CG  1 ? 
ATOM   206  C  CD1 . LEU A 1 29  ? -5.124  -27.470 -1.579  1.000 12.792 0 29  LEU A CD1 1 ? 
ATOM   207  C  CD2 . LEU A 1 29  ? -3.923  -29.699 -1.445  1.000 12.240 0 29  LEU A CD2 1 ? 
ATOM   208  N  N   . ILE A 1 30  ? -7.374  -28.319 1.947   1.000 10.350 0 30  ILE A N   1 ? 
ATOM   209  C  CA  . ILE A 1 30  ? -8.384  -29.212 2.493   1.000 11.638 0 30  ILE A CA  1 ? 
ATOM   210  C  C   . ILE A 1 30  ? -9.054  -30.082 1.434   1.000 12.810 0 30  ILE A C   1 ? 
ATOM   211  O  O   . ILE A 1 30  ? -9.716  -31.043 1.802   1.000 12.334 0 30  ILE A O   1 ? 
ATOM   212  C  CB  . ILE A 1 30  ? -9.398  -28.413 3.330   1.000 12.738 0 30  ILE A CB  1 ? 
ATOM   213  C  CG1 . ILE A 1 30  ? -10.112 -27.329 2.530   1.000 13.065 0 30  ILE A CG1 1 ? 
ATOM   214  C  CG2 . ILE A 1 30  ? -8.696  -27.826 4.531   1.000 12.780 0 30  ILE A CG2 1 ? 
ATOM   215  C  CD1 . ILE A 1 30  ? -11.382 -26.848 3.203   1.000 12.721 0 30  ILE A CD1 1 ? 
ATOM   216  N  N   . ASN A 1 31  ? -8.916  -29.728 0.154   1.000 13.285 0 31  ASN A N   1 ? 
ATOM   217  C  CA  . ASN A 1 31  ? -9.220  -30.634 -0.945  1.000 14.033 0 31  ASN A CA  1 ? 
ATOM   218  C  C   . ASN A 1 31  ? -8.517  -30.075 -2.179  1.000 14.187 0 31  ASN A C   1 ? 
ATOM   219  O  O   . ASN A 1 31  ? -7.695  -29.185 -2.070  1.000 13.775 0 31  ASN A O   1 ? 
ATOM   220  C  CB  . ASN A 1 31  ? -10.727 -30.821 -1.109  1.000 16.011 0 31  ASN A CB  1 ? 
ATOM   221  C  CG  . ASN A 1 31  ? -11.417 -29.509 -1.397  1.000 16.945 0 31  ASN A CG  1 ? 
ATOM   222  O  OD1 . ASN A 1 31  ? -10.922 -28.709 -2.182  1.000 16.072 0 31  ASN A OD1 1 ? 
ATOM   223  N  ND2 . ASN A 1 31  ? -12.543 -29.267 -0.737  1.000 19.816 0 31  ASN A ND2 1 ? 
ATOM   224  N  N   . SER A 1 32  ? -8.783  -30.594 -3.379  1.000 14.727 0 32  SER A N   1 ? 
ATOM   225  C  CA  . SER A 1 32  ? -7.961  -30.202 -4.516  1.000 14.731 0 32  SER A CA  1 ? 
ATOM   226  C  C   . SER A 1 32  ? -8.218  -28.750 -4.924  1.000 13.529 0 32  SER A C   1 ? 
ATOM   227  O  O   . SER A 1 32  ? -7.471  -28.187 -5.720  1.000 12.823 0 32  SER A O   1 ? 
ATOM   228  C  CB  . SER A 1 32  ? -8.205  -31.154 -5.671  1.000 15.398 0 32  SER A CB  1 ? 
ATOM   229  O  OG  . SER A 1 32  ? -9.526  -30.951 -6.107  1.000 15.936 0 32  SER A OG  1 ? 
ATOM   230  N  N   . GLN A 1 33  ? -9.254  -28.104 -4.400  1.000 12.298 0 33  GLN A N   1 ? 
ATOM   231  C  CA  . GLN A 1 33  ? -9.535  -26.761 -4.870  1.000 14.013 0 33  GLN A CA  1 ? 
ATOM   232  C  C   . GLN A 1 33  ? -9.556  -25.694 -3.786  1.000 11.176 0 33  GLN A C   1 ? 
ATOM   233  O  O   . GLN A 1 33  ? -9.761  -24.532 -4.122  1.000 11.689 0 33  GLN A O   1 ? 
ATOM   234  C  CB  . GLN A 1 33  ? -10.908 -26.750 -5.540  1.000 16.725 0 33  GLN A CB  1 ? 
ATOM   235  C  CG  . GLN A 1 33  ? -10.916 -27.487 -6.867  1.000 22.580 0 33  GLN A CG  1 ? 
ATOM   236  C  CD  . GLN A 1 33  ? -12.304 -27.489 -7.461  1.000 25.325 0 33  GLN A CD  1 ? 
ATOM   237  O  OE1 . GLN A 1 33  ? -13.134 -28.334 -7.120  1.000 32.023 0 33  GLN A OE1 1 ? 
ATOM   238  N  NE2 . GLN A 1 33  ? -12.588 -26.470 -8.248  1.000 26.337 0 33  GLN A NE2 1 ? 
ATOM   239  N  N   . TRP A 1 34  ? -9.411  -26.077 -2.510  1.000 9.495  0 34  TRP A N   1 ? 
ATOM   240  C  CA  . TRP A 1 34  ? -9.699  -25.146 -1.430  1.000 9.387  0 34  TRP A CA  1 ? 
ATOM   241  C  C   . TRP A 1 34  ? -8.605  -25.175 -0.376  1.000 8.750  0 34  TRP A C   1 ? 
ATOM   242  O  O   . TRP A 1 34  ? -8.110  -26.239 0.000   1.000 7.768  0 34  TRP A O   1 ? 
ATOM   243  C  CB  . TRP A 1 34  ? -11.018 -25.478 -0.744  1.000 10.075 0 34  TRP A CB  1 ? 
ATOM   244  C  CG  . TRP A 1 34  ? -12.217 -25.134 -1.566  1.000 10.612 0 34  TRP A CG  1 ? 
ATOM   245  C  CD1 . TRP A 1 34  ? -12.910 -25.973 -2.387  1.000 10.820 0 34  TRP A CD1 1 ? 
ATOM   246  C  CD2 . TRP A 1 34  ? -12.875 -23.859 -1.627  1.000 10.880 0 34  TRP A CD2 1 ? 
ATOM   247  N  NE1 . TRP A 1 34  ? -13.965 -25.312 -2.942  1.000 12.067 0 34  TRP A NE1 1 ? 
ATOM   248  C  CE2 . TRP A 1 34  ? -13.958 -24.009 -2.514  1.000 10.447 0 34  TRP A CE2 1 ? 
ATOM   249  C  CE3 . TRP A 1 34  ? -12.653 -22.630 -1.011  1.000 10.054 0 34  TRP A CE3 1 ? 
ATOM   250  C  CZ2 . TRP A 1 34  ? -14.834 -22.954 -2.772  1.000 11.053 0 34  TRP A CZ2 1 ? 
ATOM   251  C  CZ3 . TRP A 1 34  ? -13.510 -21.583 -1.286  1.000 10.689 0 34  TRP A CZ3 1 ? 
ATOM   252  C  CH2 . TRP A 1 34  ? -14.571 -21.752 -2.173  1.000 11.577 0 34  TRP A CH2 1 ? 
ATOM   253  N  N   . VAL A 1 35  ? -8.277  -23.964 0.070   1.000 8.553  0 35  VAL A N   1 ? 
ATOM   254  C  CA  . VAL A 1 35  ? -7.297  -23.739 1.111   1.000 8.419  0 35  VAL A CA  1 ? 
ATOM   255  C  C   . VAL A 1 35  ? -7.991  -23.010 2.255   1.000 8.093  0 35  VAL A C   1 ? 
ATOM   256  O  O   . VAL A 1 35  ? -8.817  -22.123 2.023   1.000 8.222  0 35  VAL A O   1 ? 
ATOM   257  C  CB  . VAL A 1 35  ? -6.144  -22.921 0.523   1.000 8.693  0 35  VAL A CB  1 ? 
ATOM   258  C  CG1 . VAL A 1 35  ? -5.288  -22.305 1.614   1.000 9.420  0 35  VAL A CG1 1 ? 
ATOM   259  C  CG2 . VAL A 1 35  ? -5.322  -23.779 -0.436  1.000 8.980  0 35  VAL A CG2 1 ? 
ATOM   260  N  N   . VAL A 1 36  ? -7.649  -23.414 3.471   1.000 8.186  0 36  VAL A N   1 ? 
ATOM   261  C  CA  . VAL A 1 36  ? -8.047  -22.718 4.674   1.000 8.774  0 36  VAL A CA  1 ? 
ATOM   262  C  C   . VAL A 1 36  ? -6.854  -21.892 5.155   1.000 8.269  0 36  VAL A C   1 ? 
ATOM   263  O  O   . VAL A 1 36  ? -5.733  -22.397 5.284   1.000 8.028  0 36  VAL A O   1 ? 
ATOM   264  C  CB  . VAL A 1 36  ? -8.540  -23.696 5.765   1.000 9.954  0 36  VAL A CB  1 ? 
ATOM   265  C  CG1 . VAL A 1 36  ? -8.851  -22.908 7.029   1.000 11.223 0 36  VAL A CG1 1 ? 
ATOM   266  C  CG2 . VAL A 1 36  ? -9.767  -24.488 5.338   1.000 12.152 0 36  VAL A CG2 1 ? 
ATOM   267  N  N   . SER A 1 37  ? -7.115  -20.639 5.491   1.000 8.152  0 37  SER A N   1 ? 
ATOM   268  C  CA  . SER A 1 37  ? -6.112  -19.815 6.133   1.000 8.161  0 37  SER A CA  1 ? 
ATOM   269  C  C   . SER A 1 37  ? -6.788  -18.885 7.127   1.000 7.937  0 37  SER A C   1 ? 
ATOM   270  O  O   . SER A 1 37  ? -7.948  -19.090 7.467   1.000 7.539  0 37  SER A O   1 ? 
ATOM   271  C  CB  . SER A 1 37  ? -5.362  -19.111 5.031   1.000 8.079  0 37  SER A CB  1 ? 
ATOM   272  O  OG  . SER A 1 37  ? -4.268  -18.344 5.489   1.000 7.134  0 37  SER A OG  1 ? 
ATOM   273  N  N   . ALA A 1 38  ? -6.060  -17.866 7.578   1.000 8.363  0 38  ALA A N   1 ? 
ATOM   274  C  CA  . ALA A 1 38  ? -6.571  -16.891 8.528   1.000 8.889  0 38  ALA A CA  1 ? 
ATOM   275  C  C   . ALA A 1 38  ? -7.181  -15.739 7.749   1.000 8.819  0 38  ALA A C   1 ? 
ATOM   276  O  O   . ALA A 1 38  ? -6.603  -15.292 6.763   1.000 9.612  0 38  ALA A O   1 ? 
ATOM   277  C  CB  . ALA A 1 38  ? -5.476  -16.421 9.438   1.000 8.513  0 38  ALA A CB  1 ? 
ATOM   278  N  N   . ALA A 1 39  ? -8.311  -15.220 8.242   1.000 8.262  0 39  ALA A N   1 ? 
ATOM   279  C  CA  . ALA A 1 39  ? -8.891  -14.035 7.655   1.000 7.747  0 39  ALA A CA  1 ? 
ATOM   280  C  C   . ALA A 1 39  ? -7.927  -12.861 7.711   1.000 7.651  0 39  ALA A C   1 ? 
ATOM   281  O  O   . ALA A 1 39  ? -8.017  -11.989 6.844   1.000 7.384  0 39  ALA A O   1 ? 
ATOM   282  C  CB  . ALA A 1 39  ? -10.155 -13.660 8.356   1.000 7.713  0 39  ALA A CB  1 ? 
ATOM   283  N  N   . HIS A 1 40  ? -7.091  -12.802 8.758   1.000 7.054  0 40  HIS A N   1 ? 
ATOM   284  C  CA  . HIS A 1 40  ? -6.180  -11.664 8.862   1.000 6.826  0 40  HIS A CA  1 ? 
ATOM   285  C  C   . HIS A 1 40  ? -5.099  -11.694 7.780   1.000 7.508  0 40  HIS A C   1 ? 
ATOM   286  O  O   . HIS A 1 40  ? -4.414  -10.686 7.606   1.000 8.031  0 40  HIS A O   1 ? 
ATOM   287  C  CB  . HIS A 1 40  ? -5.650  -11.515 10.274  1.000 6.579  0 40  HIS A CB  1 ? 
ATOM   288  C  CG  . HIS A 1 40  ? -4.458  -12.331 10.621  1.000 6.451  0 40  HIS A CG  1 ? 
ATOM   289  N  ND1 . HIS A 1 40  ? -4.492  -13.399 11.450  1.000 6.570  0 40  HIS A ND1 1 ? 
ATOM   290  C  CD2 . HIS A 1 40  ? -3.161  -12.049 10.337  1.000 6.917  0 40  HIS A CD2 1 ? 
ATOM   291  C  CE1 . HIS A 1 40  ? -3.238  -13.873 11.554  1.000 6.500  0 40  HIS A CE1 1 ? 
ATOM   292  N  NE2 . HIS A 1 40  ? -2.387  -13.015 10.908  1.000 6.517  0 40  HIS A NE2 1 ? 
ATOM   293  N  N   . CYS A 1 41  ? -5.000  -12.808 7.052   1.000 7.560  0 41  CYS A N   1 ? 
ATOM   294  C  CA  . CYS A 1 41  ? -4.105  -12.979 5.918   1.000 8.772  0 41  CYS A CA  1 ? 
ATOM   295  C  C   . CYS A 1 41  ? -4.769  -12.510 4.632   1.000 9.710  0 41  CYS A C   1 ? 
ATOM   296  O  O   . CYS A 1 41  ? -4.153  -12.590 3.581   1.000 11.806 0 41  CYS A O   1 ? 
ATOM   297  C  CB  . CYS A 1 41  ? -3.697  -14.434 5.730   1.000 8.513  0 41  CYS A CB  1 ? 
ATOM   298  S  SG  . CYS A 1 41  ? -2.633  -15.022 7.054   1.000 8.823  0 41  CYS A SG  1 ? 
ATOM   299  N  N   . TYR A 1 42  ? -6.033  -12.092 4.681   1.000 9.851  0 42  TYR A N   1 ? 
ATOM   300  C  CA  . TYR A 1 42  ? -6.689  -11.643 3.473   1.000 10.434 0 42  TYR A CA  1 ? 
ATOM   301  C  C   . TYR A 1 42  ? -5.862  -10.596 2.717   1.000 9.770  0 42  TYR A C   1 ? 
ATOM   302  O  O   . TYR A 1 42  ? -5.421  -9.593  3.248   1.000 9.241  0 42  TYR A O   1 ? 
ATOM   303  C  CB  . TYR A 1 42  ? -8.090  -11.083 3.728   1.000 12.011 0 42  TYR A CB  1 ? 
ATOM   304  C  CG  . TYR A 1 42  ? -8.627  -10.506 2.446   1.000 12.554 0 42  TYR A CG  1 ? 
ATOM   305  C  CD1 . TYR A 1 42  ? -9.038  -11.364 1.443   1.000 14.118 0 42  TYR A CD1 1 ? 
ATOM   306  C  CD2 . TYR A 1 42  ? -8.629  -9.145  2.188   1.000 13.596 0 42  TYR A CD2 1 ? 
ATOM   307  C  CE1 . TYR A 1 42  ? -9.487  -10.883 0.225   1.000 15.898 0 42  TYR A CE1 1 ? 
ATOM   308  C  CE2 . TYR A 1 42  ? -9.038  -8.650  0.952   1.000 15.335 0 42  TYR A CE2 1 ? 
ATOM   309  C  CZ  . TYR A 1 42  ? -9.481  -9.528  -0.022  1.000 15.545 0 42  TYR A CZ  1 ? 
ATOM   310  O  OH  . TYR A 1 42  ? -9.896  -9.170  -1.284  1.000 21.877 0 42  TYR A OH  1 ? 
ATOM   311  N  N   . LYS A 1 43  ? -5.713  -10.835 1.417   1.000 11.220 0 43  LYS A N   1 ? 
ATOM   312  C  CA  . LYS A 1 43  ? -5.419  -9.775  0.487   1.000 14.110 0 43  LYS A CA  1 ? 
ATOM   313  C  C   . LYS A 1 43  ? -5.806  -10.214 -0.915  1.000 13.621 0 43  LYS A C   1 ? 
ATOM   314  O  O   . LYS A 1 43  ? -6.133  -11.377 -1.160  1.000 13.075 0 43  LYS A O   1 ? 
ATOM   315  C  CB  . LYS A 1 43  ? -3.976  -9.332  0.602   1.000 17.857 0 43  LYS A CB  1 ? 
ATOM   316  C  CG  . LYS A 1 43  ? -2.970  -10.338 0.123   1.000 19.985 0 43  LYS A CG  1 ? 
ATOM   317  C  CD  . LYS A 1 43  ? -1.606  -9.719  0.084   1.000 21.827 0 43  LYS A CD  1 ? 
ATOM   318  C  CE  . LYS A 1 43  ? -0.962  -9.568  1.433   1.000 22.799 0 43  LYS A CE  1 ? 
ATOM   319  N  NZ  . LYS A 1 43  ? 0.418   -9.058  1.243   1.000 26.891 0 43  LYS A NZ  1 ? 
ATOM   320  N  N   . SER A 1 44  ? -5.888  -9.238  -1.815  1.000 14.758 0 44  SER A N   1 ? 
ATOM   321  C  CA  . SER A 1 44  ? -6.199  -9.568  -3.198  1.000 16.542 0 44  SER A CA  1 ? 
ATOM   322  C  C   . SER A 1 44  ? -4.911  -10.023 -3.887  1.000 16.989 0 44  SER A C   1 ? 
ATOM   323  O  O   . SER A 1 44  ? -3.812  -9.714  -3.417  1.000 19.046 0 44  SER A O   1 ? 
ATOM   324  C  CB  . SER A 1 44  ? -6.848  -8.390  -3.886  1.000 17.745 0 44  SER A CB  1 ? 
ATOM   325  O  OG  . SER A 1 44  ? -5.941  -7.320  -3.895  1.000 21.062 0 44  SER A OG  1 ? 
ATOM   326  N  N   . GLY A 1 45  ? -5.067  -10.791 -4.970  1.000 18.101 0 45  GLY A N   1 ? 
ATOM   327  C  CA  . GLY A 1 45  ? -3.956  -11.233 -5.804  1.000 18.095 0 45  GLY A CA  1 ? 
ATOM   328  C  C   . GLY A 1 45  ? -3.105  -12.304 -5.125  1.000 19.088 0 45  GLY A C   1 ? 
ATOM   329  O  O   . GLY A 1 45  ? -1.872  -12.214 -5.093  1.000 25.555 0 45  GLY A O   1 ? 
ATOM   330  N  N   . ILE A 1 46  ? -3.770  -13.298 -4.544  1.000 15.004 0 46  ILE A N   1 ? 
ATOM   331  C  CA  . ILE A 1 46  ? -3.049  -14.365 -3.881  1.000 14.072 0 46  ILE A CA  1 ? 
ATOM   332  C  C   . ILE A 1 46  ? -2.709  -15.442 -4.903  1.000 12.607 0 46  ILE A C   1 ? 
ATOM   333  O  O   . ILE A 1 46  ? -3.549  -15.894 -5.708  1.000 13.939 0 46  ILE A O   1 ? 
ATOM   334  C  CB  . ILE A 1 46  ? -3.853  -14.917 -2.690  1.000 12.919 0 46  ILE A CB  1 ? 
ATOM   335  C  CG1 . ILE A 1 46  ? -4.001  -13.872 -1.597  1.000 14.263 0 46  ILE A CG1 1 ? 
ATOM   336  C  CG2 . ILE A 1 46  ? -3.214  -16.187 -2.139  1.000 13.013 0 46  ILE A CG2 1 ? 
ATOM   337  C  CD1 . ILE A 1 46  ? -4.985  -14.265 -0.531  1.000 14.705 0 46  ILE A CD1 1 ? 
ATOM   338  N  N   . GLN A 1 47  ? -1.463  -15.905 -4.826  1.000 11.823 0 47  GLN A N   1 ? 
ATOM   339  C  CA  . GLN A 1 47  ? -1.049  -17.111 -5.495  1.000 11.669 0 47  GLN A CA  1 ? 
ATOM   340  C  C   . GLN A 1 47  ? -0.762  -18.156 -4.429  1.000 11.699 0 47  GLN A C   1 ? 
ATOM   341  O  O   . GLN A 1 47  ? 0.040   -17.899 -3.510  1.000 12.173 0 47  GLN A O   1 ? 
ATOM   342  C  CB  . GLN A 1 47  ? 0.221   -16.890 -6.308  1.000 12.153 0 47  GLN A CB  1 ? 
ATOM   343  C  CG  . GLN A 1 47  ? 0.606   -18.128 -7.112  1.000 13.394 0 47  GLN A CG  1 ? 
ATOM   344  C  CD  . GLN A 1 47  ? 1.911   -17.906 -7.827  1.000 15.104 0 47  GLN A CD  1 ? 
ATOM   345  O  OE1 . GLN A 1 47  ? 2.967   -17.790 -7.207  1.000 15.384 0 47  GLN A OE1 1 ? 
ATOM   346  N  NE2 . GLN A 1 47  ? 1.829   -17.893 -9.149  1.000 15.600 0 47  GLN A NE2 1 ? 
ATOM   347  N  N   . VAL A 1 48  ? -1.363  -19.321 -4.599  1.000 10.730 0 48  VAL A N   1 ? 
ATOM   348  C  CA  . VAL A 1 48  ? -1.165  -20.384 -3.639  1.000 10.551 0 48  VAL A CA  1 ? 
ATOM   349  C  C   . VAL A 1 48  ? -0.023  -21.249 -4.124  1.000 9.650  0 48  VAL A C   1 ? 
ATOM   350  O  O   . VAL A 1 48  ? -0.015  -21.654 -5.265  1.000 9.299  0 48  VAL A O   1 ? 
ATOM   351  C  CB  . VAL A 1 48  ? -2.455  -21.193 -3.459  1.000 11.205 0 48  VAL A CB  1 ? 
ATOM   352  C  CG1 . VAL A 1 48  ? -2.278  -22.364 -2.529  1.000 12.137 0 48  VAL A CG1 1 ? 
ATOM   353  C  CG2 . VAL A 1 48  ? -3.548  -20.271 -2.973  1.000 10.936 0 48  VAL A CG2 1 ? 
ATOM   354  N  N   . ARG A 1 49  ? 0.914   -21.550 -3.225  1.000 8.940  0 49  ARG A N   1 ? 
ATOM   355  C  CA  . ARG A 1 49  ? 2.061   -22.359 -3.584  1.000 8.799  0 49  ARG A CA  1 ? 
ATOM   356  C  C   . ARG A 1 49  ? 2.076   -23.638 -2.776  1.000 9.226  0 49  ARG A C   1 ? 
ATOM   357  O  O   . ARG A 1 49  ? 2.172   -23.604 -1.547  1.000 8.509  0 49  ARG A O   1 ? 
ATOM   358  C  CB  . ARG A 1 49  ? 3.344   -21.577 -3.377  1.000 8.410  0 49  ARG A CB  1 ? 
ATOM   359  C  CG  . ARG A 1 49  ? 3.369   -20.360 -4.281  1.000 8.891  0 49  ARG A CG  1 ? 
ATOM   360  C  CD  . ARG A 1 49  ? 4.703   -19.717 -4.286  1.000 9.180  0 49  ARG A CD  1 ? 
ATOM   361  N  NE  . ARG A 1 49  ? 4.754   -18.787 -5.404  1.000 9.437  0 49  ARG A NE  1 ? 
ATOM   362  C  CZ  . ARG A 1 49  ? 5.891   -18.352 -5.956  1.000 9.362  0 49  ARG A CZ  1 ? 
ATOM   363  N  NH1 . ARG A 1 49  ? 7.067   -18.673 -5.413  1.000 9.154  0 49  ARG A NH1 1 ? 
ATOM   364  N  NH2 . ARG A 1 49  ? 5.839   -17.756 -7.134  1.000 10.465 0 49  ARG A NH2 1 ? 
ATOM   365  N  N   . LEU A 1 50  ? 1.904   -24.736 -3.504  1.000 9.816  0 50  LEU A N   1 ? 
ATOM   366  C  CA  . LEU A 1 50  ? 1.819   -26.052 -2.913  1.000 10.780 0 50  LEU A CA  1 ? 
ATOM   367  C  C   . LEU A 1 50  ? 3.096   -26.813 -3.168  1.000 9.957  0 50  LEU A C   1 ? 
ATOM   368  O  O   . LEU A 1 50  ? 3.797   -26.543 -4.137  1.000 10.450 0 50  LEU A O   1 ? 
ATOM   369  C  CB  . LEU A 1 50  ? 0.628   -26.780 -3.528  1.000 11.812 0 50  LEU A CB  1 ? 
ATOM   370  C  CG  . LEU A 1 50  ? -0.711  -26.046 -3.471  1.000 13.701 0 50  LEU A CG  1 ? 
ATOM   371  C  CD1 . LEU A 1 50  ? -0.934  -25.201 -4.720  1.000 15.241 0 50  LEU A CD1 1 ? 
ATOM   372  C  CD2 . LEU A 1 50  ? -1.853  -27.032 -3.356  1.000 17.230 0 50  LEU A CD2 1 ? 
ATOM   373  N  N   . GLY A 1 51  ? 3.353   -27.808 -2.331  1.000 9.227  0 51  GLY A N   1 ? 
ATOM   374  C  CA  . GLY A 1 51  ? 4.482   -28.685 -2.574  1.000 9.072  0 51  GLY A CA  1 ? 
ATOM   375  C  C   . GLY A 1 51  ? 5.815   -28.020 -2.269  1.000 9.568  0 51  GLY A C   1 ? 
ATOM   376  O  O   . GLY A 1 51  ? 6.865   -28.479 -2.749  1.000 9.919  0 51  GLY A O   1 ? 
ATOM   377  N  N   . GLU A 1 52  ? 5.746   -26.999 -1.407  1.000 9.172  0 52  GLU A N   1 ? 
ATOM   378  C  CA  . GLU A 1 52  ? 6.909   -26.180 -1.083  1.000 8.732  0 52  GLU A CA  1 ? 
ATOM   379  C  C   . GLU A 1 52  ? 7.733   -26.833 0.027   1.000 9.362  0 52  GLU A C   1 ? 
ATOM   380  O  O   . GLU A 1 52  ? 7.188   -27.304 1.008   1.000 8.650  0 52  GLU A O   1 ? 
ATOM   381  C  CB  . GLU A 1 52  ? 6.537   -24.747 -0.714  1.000 9.704  0 52  GLU A CB  1 ? 
ATOM   382  C  CG  . GLU A 1 52  ? 6.136   -23.882 -1.879  1.000 9.634  0 52  GLU A CG  1 ? 
ATOM   383  C  CD  . GLU A 1 52  ? 7.319   -23.403 -2.723  1.000 9.827  0 52  GLU A CD  1 ? 
ATOM   384  O  OE1 . GLU A 1 52  ? 8.399   -24.043 -2.685  1.000 9.647  0 52  GLU A OE1 1 ? 
ATOM   385  O  OE2 . GLU A 1 52  ? 7.186   -22.354 -3.353  1.000 9.817  0 52  GLU A OE2 1 ? 
ATOM   386  N  N   . ASP A 1 53  ? 9.069   -26.775 -0.113  1.000 9.876  0 53  ASP A N   1 ? 
ATOM   387  C  CA  . ASP A 1 53  ? 9.948   -26.901 1.032   1.000 10.595 0 53  ASP A CA  1 ? 
ATOM   388  C  C   . ASP A 1 53  ? 10.727  -25.597 1.139   1.000 10.603 0 53  ASP A C   1 ? 
ATOM   389  O  O   . ASP A 1 53  ? 10.352  -24.733 1.908   1.000 10.817 0 53  ASP A O   1 ? 
ATOM   390  C  CB  . ASP A 1 53  ? 10.831  -28.136 1.030   1.000 11.123 0 53  ASP A CB  1 ? 
ATOM   391  C  CG  . ASP A 1 53  ? 11.521  -28.302 2.375   1.000 12.477 0 53  ASP A CG  1 ? 
ATOM   392  O  OD1 . ASP A 1 53  ? 10.841  -28.149 3.427   1.000 11.815 0 53  ASP A OD1 1 ? 
ATOM   393  O  OD2 . ASP A 1 53  ? 12.726  -28.560 2.366   1.000 13.451 0 53  ASP A OD2 1 ? 
ATOM   394  N  N   . ASN A 1 54  ? 11.766  -25.424 0.315   1.000 10.905 0 54  ASN A N   1 ? 
ATOM   395  C  CA  . ASN A 1 54  ? 12.481  -24.173 0.295   1.000 11.007 0 54  ASN A CA  1 ? 
ATOM   396  C  C   . ASN A 1 54  ? 11.650  -23.148 -0.484  1.000 11.760 0 54  ASN A C   1 ? 
ATOM   397  O  O   . ASN A 1 54  ? 11.436  -23.335 -1.681  1.000 12.806 0 54  ASN A O   1 ? 
ATOM   398  C  CB  . ASN A 1 54  ? 13.857  -24.347 -0.352  1.000 10.868 0 54  ASN A CB  1 ? 
ATOM   399  C  CG  . ASN A 1 54  ? 14.729  -23.127 -0.180  1.000 11.031 0 54  ASN A CG  1 ? 
ATOM   400  O  OD1 . ASN A 1 54  ? 14.253  -22.012 -0.347  1.000 10.590 0 54  ASN A OD1 1 ? 
ATOM   401  N  ND2 . ASN A 1 54  ? 15.977  -23.334 0.214   1.000 12.877 0 54  ASN A ND2 1 ? 
ATOM   402  N  N   . ILE A 1 55  ? 11.122  -22.113 0.175   1.000 11.325 0 55  ILE A N   1 ? 
ATOM   403  C  CA  . ILE A 1 55  ? 10.214  -21.225 -0.533  1.000 12.354 0 55  ILE A CA  1 ? 
ATOM   404  C  C   . ILE A 1 55  ? 10.966  -20.286 -1.479  1.000 12.012 0 55  ILE A C   1 ? 
ATOM   405  O  O   . ILE A 1 55  ? 10.312  -19.598 -2.262  1.000 11.042 0 55  ILE A O   1 ? 
ATOM   406  C  CB  . ILE A 1 55  ? 9.286   -20.412 0.385   1.000 14.603 0 55  ILE A CB  1 ? 
ATOM   407  C  CG1 . ILE A 1 55  ? 10.094  -19.662 1.452   1.000 16.058 0 55  ILE A CG1 1 ? 
ATOM   408  C  CG2 . ILE A 1 55  ? 8.151   -21.308 0.881   1.000 14.675 0 55  ILE A CG2 1 ? 
ATOM   409  C  CD1 . ILE A 1 55  ? 9.262   -18.526 2.078   1.000 18.014 0 55  ILE A CD1 1 ? 
ATOM   410  N  N   . ASN A 1 56  ? 12.297  -20.283 -1.410  1.000 11.706 0 56  ASN A N   1 ? 
ATOM   411  C  CA  . ASN A 1 56  ? 13.130  -19.377 -2.201  1.000 12.708 0 56  ASN A CA  1 ? 
ATOM   412  C  C   . ASN A 1 56  ? 13.757  -20.066 -3.418  1.000 12.116 0 56  ASN A C   1 ? 
ATOM   413  O  O   . ASN A 1 56  ? 14.286  -19.366 -4.288  1.000 12.305 0 56  ASN A O   1 ? 
ATOM   414  C  CB  . ASN A 1 56  ? 14.211  -18.695 -1.368  1.000 14.387 0 56  ASN A CB  1 ? 
ATOM   415  C  CG  . ASN A 1 56  ? 13.602  -17.647 -0.464  1.000 17.980 0 56  ASN A CG  1 ? 
ATOM   416  O  OD1 . ASN A 1 56  ? 12.734  -16.896 -0.909  1.000 25.852 0 56  ASN A OD1 1 ? 
ATOM   417  N  ND2 . ASN A 1 56  ? 14.003  -17.655 0.797   1.000 21.797 0 56  ASN A ND2 1 ? 
ATOM   418  N  N   . VAL A 1 57  ? 13.576  -21.380 -3.549  1.000 12.091 0 57  VAL A N   1 ? 
ATOM   419  C  CA  . VAL A 1 57  ? 14.201  -22.160 -4.610  1.000 12.687 0 57  VAL A CA  1 ? 
ATOM   420  C  C   . VAL A 1 57  ? 13.140  -23.068 -5.204  1.000 13.183 0 57  VAL A C   1 ? 
ATOM   421  O  O   . VAL A 1 57  ? 12.452  -23.777 -4.475  1.000 11.409 0 57  VAL A O   1 ? 
ATOM   422  C  CB  . VAL A 1 57  ? 15.401  -23.008 -4.137  1.000 13.027 0 57  VAL A CB  1 ? 
ATOM   423  C  CG1 . VAL A 1 57  ? 15.959  -23.855 -5.260  1.000 14.698 0 57  VAL A CG1 1 ? 
ATOM   424  C  CG2 . VAL A 1 57  ? 16.488  -22.158 -3.530  1.000 13.619 0 57  VAL A CG2 1 ? 
ATOM   425  N  N   . VAL A 1 58  ? 13.063  -23.083 -6.535  1.000 14.663 0 58  VAL A N   1 ? 
ATOM   426  C  CA  . VAL A 1 58  ? 12.216  -24.064 -7.194  1.000 14.999 0 58  VAL A CA  1 ? 
ATOM   427  C  C   . VAL A 1 58  ? 12.934  -25.417 -7.184  1.000 16.920 0 58  VAL A C   1 ? 
ATOM   428  O  O   . VAL A 1 58  ? 13.972  -25.590 -7.822  1.000 17.374 0 58  VAL A O   1 ? 
ATOM   429  C  CB  . VAL A 1 58  ? 11.788  -23.627 -8.612  1.000 15.013 0 58  VAL A CB  1 ? 
ATOM   430  C  CG1 . VAL A 1 58  ? 11.014  -24.744 -9.323  1.000 15.693 0 58  VAL A CG1 1 ? 
ATOM   431  C  CG2 . VAL A 1 58  ? 10.987  -22.359 -8.581  1.000 15.180 0 58  VAL A CG2 1 ? 
ATOM   432  N  N   . GLU A 1 59  ? 12.360  -26.391 -6.466  1.000 15.963 0 59  GLU A N   1 ? 
ATOM   433  C  CA  . GLU A 1 59  ? 12.987  -27.684 -6.225  1.000 18.096 0 59  GLU A CA  1 ? 
ATOM   434  C  C   . GLU A 1 59  ? 12.373  -28.797 -7.079  1.000 19.680 0 59  GLU A C   1 ? 
ATOM   435  O  O   . GLU A 1 59  ? 12.950  -29.887 -7.197  1.000 17.023 0 59  GLU A O   1 ? 
ATOM   436  C  CB  . GLU A 1 59  ? 12.884  -28.042 -4.741  1.000 17.515 0 59  GLU A CB  1 ? 
ATOM   437  C  CG  . GLU A 1 59  ? 13.629  -27.061 -3.864  1.000 18.839 0 59  GLU A CG  1 ? 
ATOM   438  C  CD  . GLU A 1 59  ? 13.645  -27.385 -2.374  1.000 20.544 0 59  GLU A CD  1 ? 
ATOM   439  O  OE1 . GLU A 1 59  ? 12.607  -27.285 -1.721  1.000 16.253 0 59  GLU A OE1 1 ? 
ATOM   440  O  OE2 . GLU A 1 59  ? 14.727  -27.740 -1.877  1.000 23.030 0 59  GLU A OE2 1 ? 
ATOM   441  N  N   . GLY A 1 60  ? 11.191  -28.538 -7.644  1.000 19.940 0 60  GLY A N   1 ? 
ATOM   442  C  CA  . GLY A 1 60  ? 10.631  -29.401 -8.670  1.000 20.232 0 60  GLY A CA  1 ? 
ATOM   443  C  C   . GLY A 1 60  ? 9.288   -30.020 -8.301  1.000 20.999 0 60  GLY A C   1 ? 
ATOM   444  O  O   . GLY A 1 60  ? 8.720   -30.716 -9.137  1.000 24.621 0 60  GLY A O   1 ? 
ATOM   445  N  N   . ASN A 1 61  ? 8.802   -29.850 -7.061  1.000 17.615 0 61  ASN A N   1 ? 
ATOM   446  C  CA  . ASN A 1 61  ? 7.550   -30.485 -6.676  1.000 17.468 0 61  ASN A CA  1 ? 
ATOM   447  C  C   . ASN A 1 61  ? 6.448   -29.462 -6.417  1.000 15.129 0 61  ASN A C   1 ? 
ATOM   448  O  O   . ASN A 1 61  ? 5.333   -29.839 -6.033  1.000 15.441 0 61  ASN A O   1 ? 
ATOM   449  C  CB  . ASN A 1 61  ? 7.777   -31.379 -5.468  1.000 19.257 0 61  ASN A CB  1 ? 
ATOM   450  C  CG  . ASN A 1 61  ? 8.692   -32.526 -5.835  1.000 22.277 0 61  ASN A CG  1 ? 
ATOM   451  O  OD1 . ASN A 1 61  ? 8.426   -33.222 -6.816  1.000 27.482 0 61  ASN A OD1 1 ? 
ATOM   452  N  ND2 . ASN A 1 61  ? 9.767   -32.715 -5.083  1.000 22.079 0 61  ASN A ND2 1 ? 
ATOM   453  N  N   . GLU A 1 62  ? 6.753   -28.187 -6.697  1.000 12.926 0 62  GLU A N   1 ? 
ATOM   454  C  CA  . GLU A 1 62  ? 5.792   -27.120 -6.483  1.000 12.715 0 62  GLU A CA  1 ? 
ATOM   455  C  C   . GLU A 1 62  ? 4.649   -27.166 -7.495  1.000 12.888 0 62  GLU A C   1 ? 
ATOM   456  O  O   . GLU A 1 62  ? 4.811   -27.571 -8.652  1.000 11.805 0 62  GLU A O   1 ? 
ATOM   457  C  CB  . GLU A 1 62  ? 6.438   -25.745 -6.577  1.000 13.292 0 62  GLU A CB  1 ? 
ATOM   458  C  CG  . GLU A 1 62  ? 7.518   -25.573 -5.542  1.000 12.598 0 62  GLU A CG  1 ? 
ATOM   459  C  CD  . GLU A 1 62  ? 8.913   -25.969 -6.003  1.000 13.774 0 62  GLU A CD  1 ? 
ATOM   460  O  OE1 . GLU A 1 62  ? 9.041   -26.655 -7.059  1.000 12.892 0 62  GLU A OE1 1 ? 
ATOM   461  O  OE2 . GLU A 1 62  ? 9.878   -25.585 -5.297  1.000 10.669 0 62  GLU A OE2 1 ? 
ATOM   462  N  N   . GLN A 1 63  ? 3.520   -26.651 -7.030  1.000 11.075 0 63  GLN A N   1 ? 
ATOM   463  C  CA  . GLN A 1 63  ? 2.427   -26.229 -7.894  1.000 11.234 0 63  GLN A CA  1 ? 
ATOM   464  C  C   . GLN A 1 63  ? 2.048   -24.822 -7.473  1.000 11.451 0 63  GLN A C   1 ? 
ATOM   465  O  O   . GLN A 1 63  ? 1.788   -24.572 -6.284  1.000 11.535 0 63  GLN A O   1 ? 
ATOM   466  C  CB  . GLN A 1 63  ? 1.250   -27.197 -7.768  1.000 11.261 0 63  GLN A CB  1 ? 
ATOM   467  C  CG  . GLN A 1 63  ? 1.563   -28.642 -8.136  1.000 11.347 0 63  GLN A CG  1 ? 
ATOM   468  C  CD  . GLN A 1 63  ? 0.389   -29.551 -7.868  1.000 11.894 0 63  GLN A CD  1 ? 
ATOM   469  O  OE1 . GLN A 1 63  ? -0.768  -29.184 -8.136  1.000 14.384 0 63  GLN A OE1 1 ? 
ATOM   470  N  NE2 . GLN A 1 63  ? 0.679   -30.709 -7.298  1.000 12.942 0 63  GLN A NE2 1 ? 
ATOM   471  N  N   . PHE A 1 64  ? 2.091   -23.889 -8.417  1.000 11.052 0 64  PHE A N   1 ? 
ATOM   472  C  CA  . PHE A 1 64  ? 1.716   -22.503 -8.154  1.000 11.674 0 64  PHE A CA  1 ? 
ATOM   473  C  C   . PHE A 1 64  ? 0.360   -22.292 -8.818  1.000 13.474 0 64  PHE A C   1 ? 
ATOM   474  O  O   . PHE A 1 64  ? 0.225   -22.473 -10.044 1.000 13.229 0 64  PHE A O   1 ? 
ATOM   475  C  CB  . PHE A 1 64  ? 2.745   -21.506 -8.693  1.000 12.517 0 64  PHE A CB  1 ? 
ATOM   476  C  CG  . PHE A 1 64  ? 4.151   -21.596 -8.141  1.000 12.986 0 64  PHE A CG  1 ? 
ATOM   477  C  CD1 . PHE A 1 64  ? 4.463   -22.360 -7.023  1.000 12.740 0 64  PHE A CD1 1 ? 
ATOM   478  C  CD2 . PHE A 1 64  ? 5.173   -20.910 -8.773  1.000 13.874 0 64  PHE A CD2 1 ? 
ATOM   479  C  CE1 . PHE A 1 64  ? 5.767   -22.417 -6.537  1.000 13.152 0 64  PHE A CE1 1 ? 
ATOM   480  C  CE2 . PHE A 1 64  ? 6.468   -20.935 -8.267  1.000 14.337 0 64  PHE A CE2 1 ? 
ATOM   481  C  CZ  . PHE A 1 64  ? 6.767   -21.714 -7.174  1.000 13.168 0 64  PHE A CZ  1 ? 
ATOM   482  N  N   . ILE A 1 65  ? -0.671  -21.985 -8.025  1.000 11.341 0 65  ILE A N   1 ? 
ATOM   483  C  CA  . ILE A 1 65  ? -2.006  -21.794 -8.576  1.000 12.225 0 65  ILE A CA  1 ? 
ATOM   484  C  C   . ILE A 1 65  ? -2.597  -20.510 -8.002  1.000 12.133 0 65  ILE A C   1 ? 
ATOM   485  O  O   . ILE A 1 65  ? -2.615  -20.347 -6.792  1.000 12.532 0 65  ILE A O   1 ? 
ATOM   486  C  CB  . ILE A 1 65  ? -2.875  -23.018 -8.242  1.000 12.296 0 65  ILE A CB  1 ? 
ATOM   487  C  CG1 . ILE A 1 65  ? -2.223  -24.352 -8.635  1.000 13.589 0 65  ILE A CG1 1 ? 
ATOM   488  C  CG2 . ILE A 1 65  ? -4.260  -22.869 -8.869  1.000 11.851 0 65  ILE A CG2 1 ? 
ATOM   489  C  CD1 . ILE A 1 65  ? -2.973  -25.589 -8.174  1.000 14.672 0 65  ILE A CD1 1 ? 
ATOM   490  N  N   . SER A 1 66  ? -3.090  -19.617 -8.864  1.000 12.076 0 66  SER A N   1 ? 
ATOM   491  C  CA  . SER A 1 66  ? -3.710  -18.385 -8.437  1.000 13.035 0 66  SER A CA  1 ? 
ATOM   492  C  C   . SER A 1 66  ? -5.042  -18.707 -7.776  1.000 13.345 0 66  SER A C   1 ? 
ATOM   493  O  O   . SER A 1 66  ? -5.716  -19.669 -8.155  1.000 13.154 0 66  SER A O   1 ? 
ATOM   494  C  CB  . SER A 1 66  ? -3.940  -17.434 -9.593  1.000 15.127 0 66  SER A CB  1 ? 
ATOM   495  O  OG  . SER A 1 66  ? -2.731  -17.242 -10.298 1.000 18.888 0 66  SER A OG  1 ? 
ATOM   496  N  N   . ALA A 1 67  ? -5.402  -17.839 -6.834  1.000 12.728 0 67  ALA A N   1 ? 
ATOM   497  C  CA  . ALA A 1 67  ? -6.680  -17.872 -6.167  1.000 13.786 0 67  ALA A CA  1 ? 
ATOM   498  C  C   . ALA A 1 67  ? -7.707  -17.280 -7.115  1.000 12.438 0 67  ALA A C   1 ? 
ATOM   499  O  O   . ALA A 1 67  ? -7.466  -16.249 -7.720  1.000 14.150 0 67  ALA A O   1 ? 
ATOM   500  C  CB  . ALA A 1 67  ? -6.617  -17.079 -4.882  1.000 13.439 0 67  ALA A CB  1 ? 
ATOM   501  N  N   . SER A 1 68  ? -8.874  -17.906 -7.209  1.000 12.559 0 68  SER A N   1 ? 
ATOM   502  C  CA  . SER A 1 68  ? -9.953  -17.307 -7.955  1.000 13.609 0 68  SER A CA  1 ? 
ATOM   503  C  C   . SER A 1 68  ? -10.855 -16.460 -7.053  1.000 13.914 0 68  SER A C   1 ? 
ATOM   504  O  O   . SER A 1 68  ? -11.437 -15.482 -7.492  1.000 15.309 0 68  SER A O   1 ? 
ATOM   505  C  CB  . SER A 1 68  ? -10.735 -18.356 -8.698  1.000 14.927 0 68  SER A CB  1 ? 
ATOM   506  O  OG  . SER A 1 68  ? -11.282 -19.298 -7.810  1.000 16.864 0 68  SER A OG  1 ? 
ATOM   507  N  N   . LYS A 1 69  ? -10.960 -16.852 -5.775  1.000 14.975 0 69  LYS A N   1 ? 
ATOM   508  C  CA  . LYS A 1 69  ? -11.972 -16.367 -4.866  1.000 15.916 0 69  LYS A CA  1 ? 
ATOM   509  C  C   . LYS A 1 69  ? -11.381 -16.456 -3.465  1.000 13.237 0 69  LYS A C   1 ? 
ATOM   510  O  O   . LYS A 1 69  ? -10.751 -17.473 -3.169  1.000 11.144 0 69  LYS A O   1 ? 
ATOM   511  C  CB  . LYS A 1 69  ? -13.115 -17.387 -4.916  1.000 18.904 0 69  LYS A CB  1 ? 
ATOM   512  C  CG  . LYS A 1 69  ? -14.526 -16.885 -4.827  1.000 23.910 0 69  LYS A CG  1 ? 
ATOM   513  C  CD  . LYS A 1 69  ? -15.456 -18.049 -5.102  1.000 24.863 0 69  LYS A CD  1 ? 
ATOM   514  C  CE  . LYS A 1 69  ? -15.395 -18.553 -6.531  1.000 23.002 0 69  LYS A CE  1 ? 
ATOM   515  N  NZ  . LYS A 1 69  ? -16.633 -19.254 -6.949  1.000 22.508 0 69  LYS A NZ  1 ? 
ATOM   516  N  N   . SER A 1 70  ? -11.640 -15.447 -2.633  1.000 12.937 0 70  SER A N   1 ? 
ATOM   517  C  CA  . SER A 1 70  ? -11.338 -15.530 -1.205  1.000 12.815 0 70  SER A CA  1 ? 
ATOM   518  C  C   . SER A 1 70  ? -12.593 -15.193 -0.422  1.000 12.025 0 70  SER A C   1 ? 
ATOM   519  O  O   . SER A 1 70  ? -13.333 -14.286 -0.804  1.000 13.111 0 70  SER A O   1 ? 
ATOM   520  C  CB  . SER A 1 70  ? -10.240 -14.601 -0.800  1.000 14.071 0 70  SER A CB  1 ? 
ATOM   521  O  OG  . SER A 1 70  ? -8.999  -15.116 -1.245  1.000 17.116 0 70  SER A OG  1 ? 
ATOM   522  N  N   . ILE A 1 71  ? -12.869 -16.010 0.589   1.000 10.744 0 71  ILE A N   1 ? 
ATOM   523  C  CA  . ILE A 1 71  ? -14.059 -15.840 1.370   1.000 9.451  0 71  ILE A CA  1 ? 
ATOM   524  C  C   . ILE A 1 71  ? -13.672 -15.755 2.823   1.000 9.126  0 71  ILE A C   1 ? 
ATOM   525  O  O   . ILE A 1 71  ? -13.243 -16.730 3.412   1.000 9.517  0 71  ILE A O   1 ? 
ATOM   526  C  CB  . ILE A 1 71  ? -15.065 -16.970 1.173   1.000 9.659  0 71  ILE A CB  1 ? 
ATOM   527  C  CG1 . ILE A 1 71  ? -15.355 -17.138 -0.323  1.000 11.245 0 71  ILE A CG1 1 ? 
ATOM   528  C  CG2 . ILE A 1 71  ? -16.293 -16.623 2.004   1.000 9.841  0 71  ILE A CG2 1 ? 
ATOM   529  C  CD1 . ILE A 1 71  ? -16.090 -18.387 -0.661  1.000 12.034 0 71  ILE A CD1 1 ? 
ATOM   530  N  N   . VAL A 1 72  ? -13.841 -14.560 3.342   1.000 9.299  0 72  VAL A N   1 ? 
ATOM   531  C  CA  . VAL A 1 72  ? -13.560 -14.285 4.733   1.000 9.067  0 72  VAL A CA  1 ? 
ATOM   532  C  C   . VAL A 1 72  ? -14.819 -14.651 5.523   1.000 9.196  0 72  VAL A C   1 ? 
ATOM   533  O  O   . VAL A 1 72  ? -15.931 -14.419 5.084   1.000 9.234  0 72  VAL A O   1 ? 
ATOM   534  C  CB  . VAL A 1 72  ? -13.119 -12.818 4.875   1.000 9.632  0 72  VAL A CB  1 ? 
ATOM   535  C  CG1 . VAL A 1 72  ? -13.156 -12.349 6.323   1.000 9.461  0 72  VAL A CG1 1 ? 
ATOM   536  C  CG2 . VAL A 1 72  ? -11.727 -12.580 4.293   1.000 9.696  0 72  VAL A CG2 1 ? 
ATOM   537  N  N   . HIS A 1 73  ? -14.626 -15.231 6.712   1.000 9.255  0 73  HIS A N   1 ? 
ATOM   538  C  CA  . HIS A 1 73  ? -15.730 -15.616 7.555   1.000 8.560  0 73  HIS A CA  1 ? 
ATOM   539  C  C   . HIS A 1 73  ? -16.626 -14.397 7.767   1.000 8.205  0 73  HIS A C   1 ? 
ATOM   540  O  O   . HIS A 1 73  ? -16.190 -13.285 8.046   1.000 7.892  0 73  HIS A O   1 ? 
ATOM   541  C  CB  . HIS A 1 73  ? -15.237 -16.199 8.881   1.000 8.773  0 73  HIS A CB  1 ? 
ATOM   542  C  CG  . HIS A 1 73  ? -16.344 -16.793 9.678   1.000 9.332  0 73  HIS A CG  1 ? 
ATOM   543  N  ND1 . HIS A 1 73  ? -17.289 -16.060 10.351  1.000 9.531  0 73  HIS A ND1 1 ? 
ATOM   544  C  CD2 . HIS A 1 73  ? -16.721 -18.095 9.711   1.000 9.632  0 73  HIS A CD2 1 ? 
ATOM   545  C  CE1 . HIS A 1 73  ? -18.194 -16.909 10.846  1.000 10.291 0 73  HIS A CE1 1 ? 
ATOM   546  N  NE2 . HIS A 1 73  ? -17.865 -18.182 10.443  1.000 9.744  0 73  HIS A NE2 1 ? 
ATOM   547  N  N   . PRO A 1 74  ? -17.947 -14.570 7.661   1.000 9.223  0 74  PRO A N   1 ? 
ATOM   548  C  CA  . PRO A 1 74  ? -18.836 -13.410 7.697   1.000 9.379  0 74  PRO A CA  1 ? 
ATOM   549  C  C   . PRO A 1 74  ? -18.839 -12.665 9.032   1.000 9.713  0 74  PRO A C   1 ? 
ATOM   550  O  O   . PRO A 1 74  ? -19.362 -11.551 9.085   1.000 9.695  0 74  PRO A O   1 ? 
ATOM   551  C  CB  . PRO A 1 74  ? -20.215 -14.010 7.377   1.000 10.766 0 74  PRO A CB  1 ? 
ATOM   552  C  CG  . PRO A 1 74  ? -20.089 -15.435 7.781   1.000 10.462 0 74  PRO A CG  1 ? 
ATOM   553  C  CD  . PRO A 1 74  ? -18.662 -15.826 7.429   1.000 9.627  0 74  PRO A CD  1 ? 
ATOM   554  N  N   . SER A 1 75  ? -18.297 -13.274 10.085  1.000 9.418  0 75  SER A N   1 ? 
ATOM   555  C  CA  . SER A 1 75  ? -18.299 -12.690 11.417  1.000 9.509  0 75  SER A CA  1 ? 
ATOM   556  C  C   . SER A 1 75  ? -16.875 -12.378 11.869  1.000 8.853  0 75  SER A C   1 ? 
ATOM   557  O  O   . SER A 1 75  ? -16.650 -12.075 13.034  1.000 7.875  0 75  SER A O   1 ? 
ATOM   558  C  CB  . SER A 1 75  ? -18.988 -13.625 12.396  1.000 11.391 0 75  SER A CB  1 ? 
ATOM   559  O  OG  . SER A 1 75  ? -20.363 -13.645 12.142  1.000 13.657 0 75  SER A OG  1 ? 
ATOM   560  N  N   . TYR A 1 76  ? -15.934 -12.440 10.929  1.000 8.795  0 76  TYR A N   1 ? 
ATOM   561  C  CA  . TYR A 1 76  ? -14.561 -12.090 11.244  1.000 8.347  0 76  TYR A CA  1 ? 
ATOM   562  C  C   . TYR A 1 76  ? -14.461 -10.660 11.790  1.000 9.910  0 76  TYR A C   1 ? 
ATOM   563  O  O   . TYR A 1 76  ? -14.961 -9.687  11.215  1.000 9.176  0 76  TYR A O   1 ? 
ATOM   564  C  CB  . TYR A 1 76  ? -13.644 -12.255 10.034  1.000 8.177  0 76  TYR A CB  1 ? 
ATOM   565  C  CG  . TYR A 1 76  ? -12.276 -11.680 10.253  1.000 7.762  0 76  TYR A CG  1 ? 
ATOM   566  C  CD1 . TYR A 1 76  ? -11.464 -12.184 11.270  1.000 7.856  0 76  TYR A CD1 1 ? 
ATOM   567  C  CD2 . TYR A 1 76  ? -11.784 -10.631 9.471   1.000 7.474  0 76  TYR A CD2 1 ? 
ATOM   568  C  CE1 . TYR A 1 76  ? -10.197 -11.635 11.470  1.000 7.696  0 76  TYR A CE1 1 ? 
ATOM   569  C  CE2 . TYR A 1 76  ? -10.534 -10.080 9.656   1.000 8.389  0 76  TYR A CE2 1 ? 
ATOM   570  C  CZ  . TYR A 1 76  ? -9.707  -10.633 10.635  1.000 8.587  0 76  TYR A CZ  1 ? 
ATOM   571  O  OH  . TYR A 1 76  ? -8.465  -10.100 10.831  1.000 10.305 0 76  TYR A OH  1 ? 
ATOM   572  N  N   . ASN A 1 77  ? -13.781 -10.546 12.928  1.000 9.701  0 77  ASN A N   1 ? 
ATOM   573  C  CA  . ASN A 1 77  ? -13.603 -9.265  13.591  1.000 10.427 0 77  ASN A CA  1 ? 
ATOM   574  C  C   . ASN A 1 77  ? -12.107 -9.009  13.648  1.000 9.949  0 77  ASN A C   1 ? 
ATOM   575  O  O   . ASN A 1 77  ? -11.394 -9.730  14.334  1.000 11.290 0 77  ASN A O   1 ? 
ATOM   576  C  CB  . ASN A 1 77  ? -14.273 -9.267  14.965  1.000 11.061 0 77  ASN A CB  1 ? 
ATOM   577  C  CG  . ASN A 1 77  ? -14.101 -7.954  15.674  1.000 11.251 0 77  ASN A CG  1 ? 
ATOM   578  O  OD1 . ASN A 1 77  ? -13.065 -7.294  15.565  1.000 11.803 0 77  ASN A OD1 1 ? 
ATOM   579  N  ND2 . ASN A 1 77  ? -15.159 -7.497  16.306  1.000 13.203 0 77  ASN A ND2 1 ? 
ATOM   580  N  N   . SER A 1 78  ? -11.628 -8.041  12.859  1.000 10.741 0 78  SER A N   1 ? 
ATOM   581  C  CA  . SER A 1 78  ? -10.207 -7.795  12.727  1.000 11.114 0 78  SER A CA  1 ? 
ATOM   582  C  C   . SER A 1 78  ? -9.597  -7.205  14.006  1.000 12.462 0 78  SER A C   1 ? 
ATOM   583  O  O   . SER A 1 78  ? -8.370  -7.257  14.183  1.000 11.354 0 78  SER A O   1 ? 
ATOM   584  C  CB  . SER A 1 78  ? -9.910  -6.944  11.530  1.000 11.330 0 78  SER A CB  1 ? 
ATOM   585  O  OG  . SER A 1 78  ? -10.578 -5.695  11.588  1.000 12.533 0 78  SER A OG  1 ? 
ATOM   586  N  N   . ASN A 1 79  ? -10.434 -6.639  14.868  1.000 11.980 0 79  ASN A N   1 ? 
ATOM   587  C  CA  . ASN A 1 79  ? -9.966  -6.017  16.094  1.000 12.344 0 79  ASN A CA  1 ? 
ATOM   588  C  C   . ASN A 1 79  ? -9.659  -7.083  17.145  1.000 13.183 0 79  ASN A C   1 ? 
ATOM   589  O  O   . ASN A 1 79  ? -8.575  -7.094  17.710  1.000 14.688 0 79  ASN A O   1 ? 
ATOM   590  C  CB  . ASN A 1 79  ? -11.010 -5.037  16.622  1.000 12.253 0 79  ASN A CB  1 ? 
ATOM   591  C  CG  . ASN A 1 79  ? -11.175 -3.880  15.674  1.000 12.861 0 79  ASN A CG  1 ? 
ATOM   592  O  OD1 . ASN A 1 79  ? -10.190 -3.432  15.086  1.000 15.921 0 79  ASN A OD1 1 ? 
ATOM   593  N  ND2 . ASN A 1 79  ? -12.394 -3.368  15.603  1.000 14.504 0 79  ASN A ND2 1 ? 
ATOM   594  N  N   . THR A 1 80  ? -10.554 -8.050  17.299  1.000 11.962 0 80  THR A N   1 ? 
ATOM   595  C  CA  . THR A 1 80  ? -10.446 -9.114  18.301  1.000 13.616 0 80  THR A CA  1 ? 
ATOM   596  C  C   . THR A 1 80  ? -9.853  -10.406 17.738  1.000 12.847 0 80  THR A C   1 ? 
ATOM   597  O  O   . THR A 1 80  ? -9.489  -11.316 18.510  1.000 11.332 0 80  THR A O   1 ? 
ATOM   598  C  CB  . THR A 1 80  ? -11.820 -9.462  18.880  1.000 14.239 0 80  THR A CB  1 ? 
ATOM   599  O  OG1 . THR A 1 80  ? -12.664 -9.953  17.840  1.000 13.517 0 80  THR A OG1 1 ? 
ATOM   600  C  CG2 . THR A 1 80  ? -12.513 -8.293  19.547  1.000 15.768 0 80  THR A CG2 1 ? 
ATOM   601  N  N   . LEU A 1 81  ? -9.811  -10.495 16.398  1.000 12.166 0 81  LEU A N   1 ? 
ATOM   602  C  CA  . LEU A 1 81  ? -9.472  -11.706 15.642  1.000 11.575 0 81  LEU A CA  1 ? 
ATOM   603  C  C   . LEU A 1 81  ? -10.420 -12.876 15.909  1.000 10.670 0 81  LEU A C   1 ? 
ATOM   604  O  O   . LEU A 1 81  ? -10.052 -14.024 15.637  1.000 10.967 0 81  LEU A O   1 ? 
ATOM   605  C  CB  . LEU A 1 81  ? -8.011  -12.107 15.906  1.000 12.507 0 81  LEU A CB  1 ? 
ATOM   606  C  CG  . LEU A 1 81  ? -6.961  -11.155 15.321  1.000 15.430 0 81  LEU A CG  1 ? 
ATOM   607  C  CD1 . LEU A 1 81  ? -5.542  -11.602 15.591  1.000 17.010 0 81  LEU A CD1 1 ? 
ATOM   608  C  CD2 . LEU A 1 81  ? -7.138  -10.991 13.824  1.000 16.270 0 81  LEU A CD2 1 ? 
ATOM   609  N  N   . ASN A 1 82  ? -11.612 -12.593 16.431  1.000 9.627  0 82  ASN A N   1 ? 
ATOM   610  C  CA  . ASN A 1 82  ? -12.668 -13.592 16.524  1.000 8.933  0 82  ASN A CA  1 ? 
ATOM   611  C  C   . ASN A 1 82  ? -13.028 -14.050 15.107  1.000 8.333  0 82  ASN A C   1 ? 
ATOM   612  O  O   . ASN A 1 82  ? -13.178 -13.217 14.226  1.000 7.480  0 82  ASN A O   1 ? 
ATOM   613  C  CB  . ASN A 1 82  ? -13.898 -13.070 17.252  1.000 9.554  0 82  ASN A CB  1 ? 
ATOM   614  C  CG  . ASN A 1 82  ? -14.769 -14.194 17.740  1.000 10.232 0 82  ASN A CG  1 ? 
ATOM   615  O  OD1 . ASN A 1 82  ? -14.337 -15.330 17.948  1.000 9.397  0 82  ASN A OD1 1 ? 
ATOM   616  N  ND2 . ASN A 1 82  ? -16.006 -13.850 17.979  1.000 11.707 0 82  ASN A ND2 1 ? 
ATOM   617  N  N   . ASN A 1 83  ? -13.113 -15.375 14.904  1.000 8.032  0 83  ASN A N   1 ? 
ATOM   618  C  CA  . ASN A 1 83  ? -13.456 -15.973 13.630  1.000 8.005  0 83  ASN A CA  1 ? 
ATOM   619  C  C   . ASN A 1 83  ? -12.434 -15.667 12.558  1.000 7.935  0 83  ASN A C   1 ? 
ATOM   620  O  O   . ASN A 1 83  ? -12.802 -15.356 11.439  1.000 8.130  0 83  ASN A O   1 ? 
ATOM   621  C  CB  . ASN A 1 83  ? -14.843 -15.535 13.143  1.000 8.830  0 83  ASN A CB  1 ? 
ATOM   622  C  CG  . ASN A 1 83  ? -15.929 -15.726 14.177  1.000 8.540  0 83  ASN A CG  1 ? 
ATOM   623  O  OD1 . ASN A 1 83  ? -16.330 -16.847 14.478  1.000 9.884  0 83  ASN A OD1 1 ? 
ATOM   624  N  ND2 . ASN A 1 83  ? -16.529 -14.624 14.587  1.000 8.472  0 83  ASN A ND2 1 ? 
ATOM   625  N  N   . ASP A 1 84  ? -11.159 -15.824 12.924  1.000 7.518  0 84  ASP A N   1 ? 
ATOM   626  C  CA  . ASP A 1 84  ? -10.035 -15.597 12.050  1.000 7.754  0 84  ASP A CA  1 ? 
ATOM   627  C  C   . ASP A 1 84  ? -9.819  -16.814 11.172  1.000 7.162  0 84  ASP A C   1 ? 
ATOM   628  O  O   . ASP A 1 84  ? -8.914  -17.631 11.367  1.000 6.880  0 84  ASP A O   1 ? 
ATOM   629  C  CB  . ASP A 1 84  ? -8.824  -15.237 12.893  1.000 7.991  0 84  ASP A CB  1 ? 
ATOM   630  C  CG  . ASP A 1 84  ? -7.670  -14.711 12.073  1.000 7.078  0 84  ASP A CG  1 ? 
ATOM   631  O  OD1 . ASP A 1 84  ? -7.909  -14.329 10.870  1.000 7.090  0 84  ASP A OD1 1 ? 
ATOM   632  O  OD2 . ASP A 1 84  ? -6.554  -14.713 12.623  1.000 7.100  0 84  ASP A OD2 1 ? 
ATOM   633  N  N   . ILE A 1 85  ? -10.616 -16.837 10.101  1.000 7.140  0 85  ILE A N   1 ? 
ATOM   634  C  CA  . ILE A 1 85  ? -10.635 -17.964 9.197   1.000 7.005  0 85  ILE A CA  1 ? 
ATOM   635  C  C   . ILE A 1 85  ? -11.135 -17.455 7.848   1.000 7.101  0 85  ILE A C   1 ? 
ATOM   636  O  O   . ILE A 1 85  ? -12.059 -16.646 7.778   1.000 6.636  0 85  ILE A O   1 ? 
ATOM   637  C  CB  . ILE A 1 85  ? -11.491 -19.141 9.717   1.000 6.921  0 85  ILE A CB  1 ? 
ATOM   638  C  CG1 . ILE A 1 85  ? -11.365 -20.343 8.770   1.000 7.387  0 85  ILE A CG1 1 ? 
ATOM   639  C  CG2 . ILE A 1 85  ? -12.927 -18.732 9.976   1.000 7.456  0 85  ILE A CG2 1 ? 
ATOM   640  C  CD1 . ILE A 1 85  ? -11.905 -21.645 9.294   1.000 7.471  0 85  ILE A CD1 1 ? 
ATOM   641  N  N   . MET A 1 86  ? -10.517 -17.949 6.794   1.000 8.018  0 86  MET A N   1 ? 
ATOM   642  C  CA  . MET A 1 86  ? -10.959 -17.626 5.449   1.000 8.651  0 86  MET A CA  1 ? 
ATOM   643  C  C   . MET A 1 86  ? -10.676 -18.806 4.548   1.000 8.141  0 86  MET A C   1 ? 
ATOM   644  O  O   . MET A 1 86  ? -9.846  -19.652 4.854   1.000 8.325  0 86  MET A O   1 ? 
ATOM   645  C  CB  . MET A 1 86  ? -10.306 -16.363 4.882   1.000 10.424 0 86  MET A CB  1 ? 
ATOM   646  C  CG  . MET A 1 86  ? -8.923  -16.431 4.509   1.000 13.355 0 86  MET A CG  1 ? 
ATOM   647  S  SD  . MET A 1 86  ? -8.405  -14.964 3.518   1.000 16.574 0 86  MET A SD  1 ? 
ATOM   648  C  CE  . MET A 1 86  ? -6.714  -15.499 3.389   1.000 15.499 0 86  MET A CE  1 ? 
ATOM   649  N  N   . LEU A 1 87  ? -11.407 -18.847 3.444   1.000 8.376  0 87  LEU A N   1 ? 
ATOM   650  C  CA  . LEU A 1 87  ? -11.308 -19.919 2.486   1.000 8.568  0 87  LEU A CA  1 ? 
ATOM   651  C  C   . LEU A 1 87  ? -10.820 -19.298 1.198   1.000 8.260  0 87  LEU A C   1 ? 
ATOM   652  O  O   . LEU A 1 87  ? -11.227 -18.198 0.859   1.000 9.168  0 87  LEU A O   1 ? 
ATOM   653  C  CB  . LEU A 1 87  ? -12.677 -20.554 2.249   1.000 9.111  0 87  LEU A CB  1 ? 
ATOM   654  C  CG  . LEU A 1 87  ? -13.155 -21.486 3.355   1.000 10.270 0 87  LEU A CG  1 ? 
ATOM   655  C  CD1 . LEU A 1 87  ? -14.661 -21.700 3.286   1.000 10.412 0 87  LEU A CD1 1 ? 
ATOM   656  C  CD2 . LEU A 1 87  ? -12.400 -22.801 3.262   1.000 11.205 0 87  LEU A CD2 1 ? 
ATOM   657  N  N   . ILE A 1 88  ? -9.912  -19.996 0.539   1.000 8.509  0 88  ILE A N   1 ? 
ATOM   658  C  CA  . ILE A 1 88  ? -9.364  -19.521 -0.719  1.000 8.975  0 88  ILE A CA  1 ? 
ATOM   659  C  C   . ILE A 1 88  ? -9.631  -20.639 -1.710  1.000 9.275  0 88  ILE A C   1 ? 
ATOM   660  O  O   . ILE A 1 88  ? -9.249  -21.771 -1.483  1.000 8.442  0 88  ILE A O   1 ? 
ATOM   661  C  CB  . ILE A 1 88  ? -7.856  -19.219 -0.601  1.000 10.213 0 88  ILE A CB  1 ? 
ATOM   662  C  CG1 . ILE A 1 88  ? -7.537  -18.191 0.488   1.000 10.159 0 88  ILE A CG1 1 ? 
ATOM   663  C  CG2 . ILE A 1 88  ? -7.269  -18.798 -1.956  1.000 10.350 0 88  ILE A CG2 1 ? 
ATOM   664  C  CD1 . ILE A 1 88  ? -6.099  -18.213 0.940   1.000 11.038 0 88  ILE A CD1 1 ? 
ATOM   665  N  N   . LYS A 1 89  ? -10.289 -20.309 -2.816  1.000 10.184 0 89  LYS A N   1 ? 
ATOM   666  C  CA  . LYS A 1 89  ? -10.444 -21.257 -3.895  1.000 11.414 0 89  LYS A CA  1 ? 
ATOM   667  C  C   . LYS A 1 89  ? -9.383  -21.060 -4.980  1.000 11.332 0 89  LYS A C   1 ? 
ATOM   668  O  O   . LYS A 1 89  ? -9.060  -19.922 -5.333  1.000 10.217 0 89  LYS A O   1 ? 
ATOM   669  C  CB  . LYS A 1 89  ? -11.812 -21.074 -4.530  1.000 13.484 0 89  LYS A CB  1 ? 
ATOM   670  C  CG  . LYS A 1 89  ? -12.207 -22.300 -5.319  1.000 14.587 0 89  LYS A CG  1 ? 
ATOM   671  C  CD  . LYS A 1 89  ? -13.554 -22.179 -5.931  1.000 16.169 0 89  LYS A CD  1 ? 
ATOM   672  C  CE  . LYS A 1 89  ? -13.856 -23.441 -6.701  1.000 17.560 0 89  LYS A CE  1 ? 
ATOM   673  N  NZ  . LYS A 1 89  ? -15.075 -23.287 -7.515  1.000 19.953 0 89  LYS A NZ  1 ? 
ATOM   674  N  N   . LEU A 1 90  ? -8.839  -22.178 -5.453  1.000 11.562 0 90  LEU A N   1 ? 
ATOM   675  C  CA  . LEU A 1 90  ? -7.825  -22.201 -6.496  1.000 13.150 0 90  LEU A CA  1 ? 
ATOM   676  C  C   . LEU A 1 90  ? -8.535  -22.118 -7.839  1.000 13.335 0 90  LEU A C   1 ? 
ATOM   677  O  O   . LEU A 1 90  ? -9.616  -22.709 -7.997  1.000 12.699 0 90  LEU A O   1 ? 
ATOM   678  C  CB  . LEU A 1 90  ? -7.011  -23.495 -6.419  1.000 13.753 0 90  LEU A CB  1 ? 
ATOM   679  C  CG  . LEU A 1 90  ? -6.423  -23.841 -5.053  1.000 15.855 0 90  LEU A CG  1 ? 
ATOM   680  C  CD1 . LEU A 1 90  ? -5.615  -25.114 -5.119  1.000 16.359 0 90  LEU A CD1 1 ? 
ATOM   681  C  CD2 . LEU A 1 90  ? -5.587  -22.706 -4.572  1.000 16.972 0 90  LEU A CD2 1 ? 
ATOM   682  N  N   . LYS A 1 91  ? -7.873  -21.469 -8.804  1.000 15.044 0 91  LYS A N   1 ? 
ATOM   683  C  CA  . LYS A 1 91  ? -8.413  -21.284 -10.151 1.000 16.836 0 91  LYS A CA  1 ? 
ATOM   684  C  C   . LYS A 1 91  ? -8.510  -22.621 -10.875 1.000 16.664 0 91  LYS A C   1 ? 
ATOM   685  O  O   . LYS A 1 91  ? -9.319  -22.800 -11.794 1.000 15.945 0 91  LYS A O   1 ? 
ATOM   686  C  CB  . LYS A 1 91  ? -7.525  -20.323 -10.949 1.000 19.872 0 91  LYS A CB  1 ? 
ATOM   687  C  CG  . LYS A 1 91  ? -7.908  -18.868 -10.771 1.000 23.024 0 91  LYS A CG  1 ? 
ATOM   688  C  CD  . LYS A 1 91  ? -7.016  -17.892 -11.497 1.000 27.987 0 91  LYS A CD  1 ? 
ATOM   689  C  CE  . LYS A 1 91  ? -6.977  -18.059 -13.003 1.000 32.687 0 91  LYS A CE  1 ? 
ATOM   690  N  NZ  . LYS A 1 91  ? -6.935  -16.726 -13.663 1.000 36.197 0 91  LYS A NZ  1 ? 
ATOM   691  N  N   . SER A 1 92  ? -7.634  -23.542 -10.485 1.000 14.823 0 92  SER A N   1 ? 
ATOM   692  C  CA  . SER A 1 92  ? -7.605  -24.873 -11.029 1.000 15.762 0 92  SER A CA  1 ? 
ATOM   693  C  C   . SER A 1 92  ? -7.253  -25.848 -9.908  1.000 16.452 0 92  SER A C   1 ? 
ATOM   694  O  O   . SER A 1 92  ? -6.620  -25.458 -8.914  1.000 15.277 0 92  SER A O   1 ? 
ATOM   695  C  CB  . SER A 1 92  ? -6.650  -24.922 -12.211 1.000 17.257 0 92  SER A CB  1 ? 
ATOM   696  O  OG  . SER A 1 92  ? -5.322  -24.735 -11.798 1.000 21.330 0 92  SER A OG  1 ? 
ATOM   697  N  N   . ALA A 1 93  ? -7.731  -27.087 -10.038 1.000 14.708 0 93  ALA A N   1 ? 
ATOM   698  C  CA  . ALA A 1 93  ? -7.517  -28.078 -9.006  1.000 15.093 0 93  ALA A CA  1 ? 
ATOM   699  C  C   . ALA A 1 93  ? -6.039  -28.429 -8.942  1.000 15.306 0 93  ALA A C   1 ? 
ATOM   700  O  O   . ALA A 1 93  ? -5.389  -28.626 -9.968  1.000 14.628 0 93  ALA A O   1 ? 
ATOM   701  C  CB  . ALA A 1 93  ? -8.348  -29.300 -9.262  1.000 16.210 0 93  ALA A CB  1 ? 
ATOM   702  N  N   . ALA A 1 94  ? -5.537  -28.586 -7.715  1.000 13.681 0 94  ALA A N   1 ? 
ATOM   703  C  CA  . ALA A 1 94  ? -4.218  -29.144 -7.499  1.000 13.858 0 94  ALA A CA  1 ? 
ATOM   704  C  C   . ALA A 1 94  ? -4.239  -30.620 -7.881  1.000 14.867 0 94  ALA A C   1 ? 
ATOM   705  O  O   . ALA A 1 94  ? -5.261  -31.291 -7.757  1.000 14.194 0 94  ALA A O   1 ? 
ATOM   706  C  CB  . ALA A 1 94  ? -3.817  -28.966 -6.053  1.000 13.663 0 94  ALA A CB  1 ? 
ATOM   707  N  N   . SER A 1 95  ? -3.073  -31.109 -8.317  1.000 15.604 0 95  SER A N   1 ? 
ATOM   708  C  CA  . SER A 1 95  ? -2.798  -32.525 -8.466  1.000 18.531 0 95  SER A CA  1 ? 
ATOM   709  C  C   . SER A 1 95  ? -2.312  -33.072 -7.139  1.000 17.894 0 95  SER A C   1 ? 
ATOM   710  O  O   . SER A 1 95  ? -1.199  -32.758 -6.709  1.000 20.533 0 95  SER A O   1 ? 
ATOM   711  C  CB  . SER A 1 95  ? -1.750  -32.801 -9.506  1.000 19.932 0 95  SER A CB  1 ? 
ATOM   712  O  OG  . SER A 1 95  ? -2.153  -32.277 -10.739 1.000 26.794 0 95  SER A OG  1 ? 
ATOM   713  N  N   . LEU A 1 96  ? -3.113  -33.940 -6.534  1.000 18.055 0 96  LEU A N   1 ? 
ATOM   714  C  CA  . LEU A 1 96  ? -2.771  -34.500 -5.243  1.000 19.485 0 96  LEU A CA  1 ? 
ATOM   715  C  C   . LEU A 1 96  ? -1.878  -35.710 -5.475  1.000 23.074 0 96  LEU A C   1 ? 
ATOM   716  O  O   . LEU A 1 96  ? -2.186  -36.530 -6.335  1.000 23.817 0 96  LEU A O   1 ? 
ATOM   717  C  CB  . LEU A 1 96  ? -4.057  -34.865 -4.509  1.000 20.935 0 96  LEU A CB  1 ? 
ATOM   718  C  CG  . LEU A 1 96  ? -5.043  -33.712 -4.343  1.000 24.043 0 96  LEU A CG  1 ? 
ATOM   719  C  CD1 . LEU A 1 96  ? -6.191  -34.102 -3.412  1.000 24.413 0 96  LEU A CD1 1 ? 
ATOM   720  C  CD2 . LEU A 1 96  ? -4.359  -32.459 -3.828  1.000 24.179 0 96  LEU A CD2 1 ? 
ATOM   721  N  N   . ASN A 1 97  ? -0.764  -35.760 -4.734  1.000 22.986 0 97  ASN A N   1 ? 
ATOM   722  C  CA  . ASN A 1 97  ? 0.271   -36.779 -4.880  1.000 26.194 0 97  ASN A CA  1 ? 
ATOM   723  C  C   . ASN A 1 97  ? 0.886   -37.017 -3.497  1.000 27.338 0 97  ASN A C   1 ? 
ATOM   724  O  O   . ASN A 1 97  ? 0.232   -36.771 -2.483  1.000 29.469 0 97  ASN A O   1 ? 
ATOM   725  C  CB  . ASN A 1 97  ? 1.220   -36.407 -6.030  1.000 26.446 0 97  ASN A CB  1 ? 
ATOM   726  C  CG  . ASN A 1 97  ? 1.835   -35.026 -5.931  1.000 29.670 0 97  ASN A CG  1 ? 
ATOM   727  O  OD1 . ASN A 1 97  ? 1.724   -34.211 -6.844  1.000 32.455 0 97  ASN A OD1 1 ? 
ATOM   728  N  ND2 . ASN A 1 97  ? 2.541   -34.761 -4.852  1.000 28.565 0 97  ASN A ND2 1 ? 
ATOM   729  N  N   . SER A 1 98  ? 2.122   -37.519 -3.418  1.000 28.628 0 98  SER A N   1 ? 
ATOM   730  C  CA  . SER A 1 98  ? 2.703   -37.800 -2.112  1.000 27.318 0 98  SER A CA  1 ? 
ATOM   731  C  C   . SER A 1 98  ? 3.215   -36.509 -1.479  1.000 25.781 0 98  SER A C   1 ? 
ATOM   732  O  O   . SER A 1 98  ? 3.339   -36.443 -0.268  1.000 28.250 0 98  SER A O   1 ? 
ATOM   733  C  CB  . SER A 1 98  ? 3.801   -38.838 -2.177  1.000 27.755 0 98  SER A CB  1 ? 
ATOM   734  O  OG  . SER A 1 98  ? 4.982   -38.279 -2.731  1.000 31.352 0 98  SER A OG  1 ? 
ATOM   735  N  N   . ARG A 1 99  ? 3.501   -35.490 -2.304  1.000 23.619 0 99  ARG A N   1 ? 
ATOM   736  C  CA  . ARG A 1 99  ? 4.083   -34.234 -1.848  1.000 22.122 0 99  ARG A CA  1 ? 
ATOM   737  C  C   . ARG A 1 99  ? 3.029   -33.150 -1.662  1.000 20.458 0 99  ARG A C   1 ? 
ATOM   738  O  O   . ARG A 1 99  ? 3.308   -32.146 -1.002  1.000 20.924 0 99  ARG A O   1 ? 
ATOM   739  C  CB  . ARG A 1 99  ? 5.102   -33.745 -2.876  1.000 23.863 0 99  ARG A CB  1 ? 
ATOM   740  C  CG  . ARG A 1 99  ? 6.153   -34.805 -3.148  1.000 27.598 0 99  ARG A CG  1 ? 
ATOM   741  C  CD  . ARG A 1 99  ? 7.502   -34.314 -3.592  1.000 30.893 0 99  ARG A CD  1 ? 
ATOM   742  N  NE  . ARG A 1 99  ? 8.383   -35.468 -3.734  1.000 30.185 0 99  ARG A NE  1 ? 
ATOM   743  C  CZ  . ARG A 1 99  ? 9.485   -35.687 -3.018  1.000 35.451 0 99  ARG A CZ  1 ? 
ATOM   744  N  NH1 . ARG A 1 99  ? 9.796   -34.917 -1.983  1.000 30.201 0 99  ARG A NH1 1 ? 
ATOM   745  N  NH2 . ARG A 1 99  ? 10.271  -36.701 -3.349  1.000 35.501 0 99  ARG A NH2 1 ? 
ATOM   746  N  N   . VAL A 1 100 ? 1.870   -33.324 -2.331  1.000 16.525 0 100 VAL A N   1 ? 
ATOM   747  C  CA  . VAL A 1 100 ? 0.749   -32.401 -2.237  1.000 15.011 0 100 VAL A CA  1 ? 
ATOM   748  C  C   . VAL A 1 100 ? -0.502  -33.207 -1.893  1.000 15.222 0 100 VAL A C   1 ? 
ATOM   749  O  O   . VAL A 1 100 ? -0.948  -34.045 -2.667  1.000 14.381 0 100 VAL A O   1 ? 
ATOM   750  C  CB  . VAL A 1 100 ? 0.535   -31.585 -3.518  1.000 14.535 0 100 VAL A CB  1 ? 
ATOM   751  C  CG1 . VAL A 1 100 ? -0.705  -30.711 -3.411  1.000 14.493 0 100 VAL A CG1 1 ? 
ATOM   752  C  CG2 . VAL A 1 100 ? 1.767   -30.776 -3.894  1.000 15.475 0 100 VAL A CG2 1 ? 
ATOM   753  N  N   . ALA A 1 101 ? -1.047  -32.944 -0.709  1.000 13.765 0 101 ALA A N   1 ? 
ATOM   754  C  CA  . ALA A 1 101 ? -2.115  -33.760 -0.162  1.000 13.249 0 101 ALA A CA  1 ? 
ATOM   755  C  C   . ALA A 1 101 ? -2.981  -32.896 0.747   1.000 14.377 0 101 ALA A C   1 ? 
ATOM   756  O  O   . ALA A 1 101 ? -2.504  -31.961 1.372   1.000 14.923 0 101 ALA A O   1 ? 
ATOM   757  C  CB  . ALA A 1 101 ? -1.561  -34.946 0.589   1.000 13.676 0 101 ALA A CB  1 ? 
ATOM   758  N  N   . SER A 1 102 ? -4.268  -33.229 0.804   1.000 12.557 0 102 SER A N   1 ? 
ATOM   759  C  CA  . SER A 1 102 ? -5.206  -32.488 1.621   1.000 13.612 0 102 SER A CA  1 ? 
ATOM   760  C  C   . SER A 1 102 ? -5.171  -32.983 3.061   1.000 13.718 0 102 SER A C   1 ? 
ATOM   761  O  O   . SER A 1 102 ? -4.753  -34.106 3.352   1.000 13.060 0 102 SER A O   1 ? 
ATOM   762  C  CB  . SER A 1 102 ? -6.602  -32.578 1.040   1.000 14.392 0 102 SER A CB  1 ? 
ATOM   763  O  OG  . SER A 1 102 ? -7.066  -33.914 0.995   1.000 15.543 0 102 SER A OG  1 ? 
ATOM   764  N  N   . ILE A 1 103 ? -5.562  -32.102 3.979   1.000 11.219 0 103 ILE A N   1 ? 
ATOM   765  C  CA  . ILE A 1 103 ? -5.717  -32.464 5.373   1.000 11.826 0 103 ILE A CA  1 ? 
ATOM   766  C  C   . ILE A 1 103 ? -7.205  -32.582 5.696   1.000 12.286 0 103 ILE A C   1 ? 
ATOM   767  O  O   . ILE A 1 103 ? -7.982  -31.788 5.222   1.000 13.082 0 103 ILE A O   1 ? 
ATOM   768  C  CB  . ILE A 1 103 ? -5.020  -31.454 6.305   1.000 12.356 0 103 ILE A CB  1 ? 
ATOM   769  C  CG1 . ILE A 1 103 ? -5.107  -31.956 7.747   1.000 12.453 0 103 ILE A CG1 1 ? 
ATOM   770  C  CG2 . ILE A 1 103 ? -5.532  -30.035 6.181   1.000 12.311 0 103 ILE A CG2 1 ? 
ATOM   771  C  CD1 . ILE A 1 103 ? -4.233  -33.129 7.957   1.000 12.859 0 103 ILE A CD1 1 ? 
ATOM   772  N  N   . SER A 1 104 ? -7.586  -33.580 6.496   1.000 12.825 0 104 SER A N   1 ? 
ATOM   773  C  CA  . SER A 1 104 ? -8.970  -33.744 6.922   1.000 14.128 0 104 SER A CA  1 ? 
ATOM   774  C  C   . SER A 1 104 ? -9.413  -32.623 7.856   1.000 12.828 0 104 SER A C   1 ? 
ATOM   775  O  O   . SER A 1 104 ? -8.664  -32.197 8.735   1.000 12.355 0 104 SER A O   1 ? 
ATOM   776  C  CB  . SER A 1 104 ? -9.153  -35.049 7.636   1.000 17.494 0 104 SER A CB  1 ? 
ATOM   777  O  OG  . SER A 1 104 ? -8.972  -36.137 6.751   1.000 24.065 0 104 SER A OG  1 ? 
ATOM   778  N  N   . LEU A 1 105 ? -10.674 -32.222 7.690   1.000 12.816 0 105 LEU A N   1 ? 
ATOM   779  C  CA  . LEU A 1 105 ? -11.375 -31.398 8.654   1.000 13.498 0 105 LEU A CA  1 ? 
ATOM   780  C  C   . LEU A 1 105 ? -11.775 -32.262 9.842   1.000 13.991 0 105 LEU A C   1 ? 
ATOM   781  O  O   . LEU A 1 105 ? -12.049 -33.447 9.670   1.000 13.638 0 105 LEU A O   1 ? 
ATOM   782  C  CB  . LEU A 1 105 ? -12.601 -30.818 7.951   1.000 14.400 0 105 LEU A CB  1 ? 
ATOM   783  C  CG  . LEU A 1 105 ? -12.273 -29.717 6.942   1.000 15.891 0 105 LEU A CG  1 ? 
ATOM   784  C  CD1 . LEU A 1 105 ? -13.535 -29.231 6.251   1.000 17.538 0 105 LEU A CD1 1 ? 
ATOM   785  C  CD2 . LEU A 1 105 ? -11.543 -28.568 7.627   1.000 16.944 0 105 LEU A CD2 1 ? 
ATOM   786  N  N   . PRO A 1 106 ? -11.871 -31.690 11.067  1.000 12.927 0 106 PRO A N   1 ? 
ATOM   787  C  CA  . PRO A 1 106 ? -12.227 -32.477 12.239  1.000 14.608 0 106 PRO A CA  1 ? 
ATOM   788  C  C   . PRO A 1 106 ? -13.727 -32.768 12.251  1.000 16.310 0 106 PRO A C   1 ? 
ATOM   789  O  O   . PRO A 1 106 ? -14.515 -31.997 11.722  1.000 16.252 0 106 PRO A O   1 ? 
ATOM   790  C  CB  . PRO A 1 106 ? -11.763 -31.580 13.378  1.000 13.432 0 106 PRO A CB  1 ? 
ATOM   791  C  CG  . PRO A 1 106 ? -11.967 -30.186 12.887  1.000 13.032 0 106 PRO A CG  1 ? 
ATOM   792  C  CD  . PRO A 1 106 ? -11.743 -30.250 11.384  1.000 13.013 0 106 PRO A CD  1 ? 
ATOM   793  N  N   . THR A 1 107 ? -14.095 -33.910 12.827  1.000 19.253 0 107 THR A N   1 ? 
ATOM   794  C  CA  . THR A 1 107 ? -15.489 -34.223 13.101  1.000 23.064 0 107 THR A CA  1 ? 
ATOM   795  C  C   . THR A 1 107 ? -15.833 -33.762 14.507  1.000 23.793 0 107 THR A C   1 ? 
ATOM   796  O  O   . THR A 1 107 ? -16.991 -33.478 14.789  1.000 27.492 0 107 THR A O   1 ? 
ATOM   797  C  CB  . THR A 1 107 ? -15.771 -35.722 12.956  1.000 24.740 0 107 THR A CB  1 ? 
ATOM   798  O  OG1 . THR A 1 107 ? -14.846 -36.421 13.786  1.000 30.355 0 107 THR A OG1 1 ? 
ATOM   799  C  CG2 . THR A 1 107 ? -15.626 -36.181 11.526  1.000 29.103 0 107 THR A CG2 1 ? 
ATOM   800  N  N   . SER A 1 108 ? -14.825 -33.715 15.374  1.000 21.335 0 108 SER A N   1 ? 
ATOM   801  C  CA  . SER A 1 108 ? -15.006 -33.249 16.733  1.000 21.105 0 108 SER A CA  1 ? 
ATOM   802  C  C   . SER A 1 108 ? -13.790 -32.416 17.135  1.000 19.111 0 108 SER A C   1 ? 
ATOM   803  O  O   . SER A 1 108 ? -12.755 -32.457 16.485  1.000 18.802 0 108 SER A O   1 ? 
ATOM   804  C  CB  . SER A 1 108 ? -15.234 -34.428 17.649  1.000 23.888 0 108 SER A CB  1 ? 
ATOM   805  O  OG  . SER A 1 108 ? -14.023 -35.120 17.882  1.000 26.285 0 108 SER A OG  1 ? 
ATOM   806  N  N   . CYS A 1 109 ? -13.911 -31.666 18.223  1.000 17.161 0 109 CYS A N   1 ? 
ATOM   807  C  CA  . CYS A 1 109 ? -12.847 -30.767 18.624  1.000 16.051 0 109 CYS A CA  1 ? 
ATOM   808  C  C   . CYS A 1 109 ? -11.766 -31.568 19.346  1.000 18.479 0 109 CYS A C   1 ? 
ATOM   809  O  O   . CYS A 1 109 ? -12.026 -32.656 19.837  1.000 21.288 0 109 CYS A O   1 ? 
ATOM   810  C  CB  . CYS A 1 109 ? -13.409 -29.631 19.471  1.000 14.846 0 109 CYS A CB  1 ? 
ATOM   811  S  SG  . CYS A 1 109 ? -14.738 -28.682 18.672  1.000 14.616 0 109 CYS A SG  1 ? 
ATOM   812  N  N   . ALA A 1 110 ? -10.555 -31.032 19.385  1.000 16.484 0 110 ALA A N   1 ? 
ATOM   813  C  CA  . ALA A 1 110 ? -9.456  -31.723 20.015  1.000 17.199 0 110 ALA A CA  1 ? 
ATOM   814  C  C   . ALA A 1 110 ? -9.445  -31.408 21.505  1.000 17.314 0 110 ALA A C   1 ? 
ATOM   815  O  O   . ALA A 1 110 ? -9.965  -30.379 21.928  1.000 18.328 0 110 ALA A O   1 ? 
ATOM   816  C  CB  . ALA A 1 110 ? -8.175  -31.295 19.393  1.000 18.063 0 110 ALA A CB  1 ? 
ATOM   817  N  N   . SER A 1 111 ? -8.819  -32.309 22.258  1.000 18.852 0 111 SER A N   1 ? 
ATOM   818  C  CA  . SER A 1 111 ? -8.776  -32.246 23.707  1.000 20.379 0 111 SER A CA  1 ? 
ATOM   819  C  C   . SER A 1 111 ? -7.526  -31.487 24.170  1.000 16.452 0 111 SER A C   1 ? 
ATOM   820  O  O   . SER A 1 111 ? -6.480  -31.567 23.546  1.000 16.402 0 111 SER A O   1 ? 
ATOM   821  C  CB  . SER A 1 111 ? -8.795  -33.647 24.267  1.000 22.647 0 111 SER A CB  1 ? 
ATOM   822  O  OG  . SER A 1 111 ? -9.973  -34.324 23.840  1.000 26.424 0 111 SER A OG  1 ? 
ATOM   823  N  N   . ALA A 1 112 ? -7.635  -30.797 25.303  1.000 15.048 0 112 ALA A N   1 ? 
ATOM   824  C  CA  . ALA A 1 112 ? -6.474  -30.261 25.992  1.000 13.421 0 112 ALA A CA  1 ? 
ATOM   825  C  C   . ALA A 1 112 ? -5.458  -31.368 26.233  1.000 14.214 0 112 ALA A C   1 ? 
ATOM   826  O  O   . ALA A 1 112 ? -5.848  -32.507 26.481  1.000 14.305 0 112 ALA A O   1 ? 
ATOM   827  C  CB  . ALA A 1 112 ? -6.870  -29.651 27.298  1.000 14.580 0 112 ALA A CB  1 ? 
ATOM   828  N  N   . GLY A 1 113 ? -4.176  -31.018 26.143  1.000 14.961 0 113 GLY A N   1 ? 
ATOM   829  C  CA  . GLY A 1 113 ? -3.086  -31.962 26.317  1.000 15.055 0 113 GLY A CA  1 ? 
ATOM   830  C  C   . GLY A 1 113 ? -2.660  -32.635 25.011  1.000 15.252 0 113 GLY A C   1 ? 
ATOM   831  O  O   . GLY A 1 113 ? -1.594  -33.217 24.954  1.000 16.296 0 113 GLY A O   1 ? 
ATOM   832  N  N   . THR A 1 114 ? -3.529  -32.631 23.993  1.000 14.545 0 114 THR A N   1 ? 
ATOM   833  C  CA  . THR A 1 114 ? -3.204  -33.262 22.733  1.000 15.308 0 114 THR A CA  1 ? 
ATOM   834  C  C   . THR A 1 114 ? -2.030  -32.533 22.107  1.000 14.286 0 114 THR A C   1 ? 
ATOM   835  O  O   . THR A 1 114 ? -2.027  -31.315 22.028  1.000 14.979 0 114 THR A O   1 ? 
ATOM   836  C  CB  . THR A 1 114 ? -4.393  -33.293 21.769  1.000 16.723 0 114 THR A CB  1 ? 
ATOM   837  O  OG1 . THR A 1 114 ? -5.389  -34.050 22.468  1.000 19.593 0 114 THR A OG1 1 ? 
ATOM   838  C  CG2 . THR A 1 114 ? -4.041  -33.942 20.453  1.000 16.597 0 114 THR A CG2 1 ? 
ATOM   839  N  N   . GLN A 1 115 ? -1.045  -33.293 21.635  1.000 13.307 0 115 GLN A N   1 ? 
ATOM   840  C  CA  . GLN A 1 115 ? 0.095   -32.671 20.980  1.000 14.580 0 115 GLN A CA  1 ? 
ATOM   841  C  C   . GLN A 1 115 ? -0.244  -32.479 19.508  1.000 12.811 0 115 GLN A C   1 ? 
ATOM   842  O  O   . GLN A 1 115 ? -0.742  -33.391 18.861  1.000 14.837 0 115 GLN A O   1 ? 
ATOM   843  C  CB  . GLN A 1 115 ? 1.331   -33.566 21.091  1.000 17.035 0 115 GLN A CB  1 ? 
ATOM   844  C  CG  . GLN A 1 115 ? 1.929   -33.609 22.490  1.000 20.315 0 115 GLN A CG  1 ? 
ATOM   845  C  CD  . GLN A 1 115 ? 2.755   -32.399 22.840  1.000 22.408 0 115 GLN A CD  1 ? 
ATOM   846  O  OE1 . GLN A 1 115 ? 3.204   -31.640 21.988  1.000 26.222 0 115 GLN A OE1 1 ? 
ATOM   847  N  NE2 . GLN A 1 115 ? 2.992   -32.226 24.131  1.000 31.807 0 115 GLN A NE2 1 ? 
ATOM   848  N  N   . CYS A 1 116 ? 0.014   -31.282 18.996  1.000 13.743 0 116 CYS A N   1 ? 
ATOM   849  C  CA  . CYS A 1 116 ? -0.335  -30.945 17.637  1.000 12.169 0 116 CYS A CA  1 ? 
ATOM   850  C  C   . CYS A 1 116 ? 0.930   -30.525 16.911  1.000 11.550 0 116 CYS A C   1 ? 
ATOM   851  O  O   . CYS A 1 116 ? 1.977   -30.256 17.524  1.000 11.143 0 116 CYS A O   1 ? 
ATOM   852  C  CB  . CYS A 1 116 ? -1.330  -29.807 17.600  1.000 12.449 0 116 CYS A CB  1 ? 
ATOM   853  S  SG  . CYS A 1 116 ? -2.801  -30.186 18.589  1.000 12.434 0 116 CYS A SG  1 ? 
ATOM   854  N  N   . LEU A 1 117 ? 0.807   -30.518 15.587  1.000 10.308 0 117 LEU A N   1 ? 
ATOM   855  C  CA  . LEU A 1 117 ? 1.937   -30.166 14.749  1.000 9.888  0 117 LEU A CA  1 ? 
ATOM   856  C  C   . LEU A 1 117 ? 1.582   -28.834 14.090  1.000 8.989  0 117 LEU A C   1 ? 
ATOM   857  O  O   . LEU A 1 117 ? 0.577   -28.752 13.404  1.000 8.571  0 117 LEU A O   1 ? 
ATOM   858  C  CB  . LEU A 1 117 ? 2.150   -31.230 13.688  1.000 10.719 0 117 LEU A CB  1 ? 
ATOM   859  C  CG  . LEU A 1 117 ? 3.280   -30.873 12.715  1.000 11.505 0 117 LEU A CG  1 ? 
ATOM   860  C  CD1 . LEU A 1 117 ? 4.628   -31.043 13.394  1.000 12.484 0 117 LEU A CD1 1 ? 
ATOM   861  C  CD2 . LEU A 1 117 ? 3.156   -31.673 11.451  1.000 12.176 0 117 LEU A CD2 1 ? 
ATOM   862  N  N   . ILE A 1 118 ? 2.430   -27.844 14.327  1.000 9.271  0 118 ILE A N   1 ? 
ATOM   863  C  CA  . ILE A 1 118 ? 2.275   -26.515 13.756  1.000 9.872  0 118 ILE A CA  1 ? 
ATOM   864  C  C   . ILE A 1 118 ? 3.439   -26.303 12.804  1.000 9.757  0 118 ILE A C   1 ? 
ATOM   865  O  O   . ILE A 1 118 ? 4.562   -26.690 13.107  1.000 11.409 0 118 ILE A O   1 ? 
ATOM   866  C  CB  . ILE A 1 118 ? 2.287   -25.489 14.897  1.000 11.119 0 118 ILE A CB  1 ? 
ATOM   867  C  CG1 . ILE A 1 118 ? 1.225   -25.860 15.937  1.000 12.463 0 118 ILE A CG1 1 ? 
ATOM   868  C  CG2 . ILE A 1 118 ? 2.087   -24.081 14.360  1.000 11.292 0 118 ILE A CG2 1 ? 
ATOM   869  C  CD1 . ILE A 1 118 ? 1.287   -25.031 17.158  1.000 13.796 0 118 ILE A CD1 1 ? 
ATOM   870  N  N   . SER A 1 119 ? 3.179   -25.648 11.675  1.000 8.727  0 119 SER A N   1 ? 
ATOM   871  C  CA  . SER A 1 119 ? 4.188   -25.561 10.653  1.000 8.363  0 119 SER A CA  1 ? 
ATOM   872  C  C   . SER A 1 119 ? 4.082   -24.209 9.958   1.000 7.635  0 119 SER A C   1 ? 
ATOM   873  O  O   . SER A 1 119 ? 3.045   -23.553 9.952   1.000 7.805  0 119 SER A O   1 ? 
ATOM   874  C  CB  . SER A 1 119 ? 4.100   -26.775 9.755   1.000 8.534  0 119 SER A CB  1 ? 
ATOM   875  O  OG  . SER A 1 119 ? 2.825   -26.898 9.161   1.000 9.653  0 119 SER A OG  1 ? 
ATOM   876  N  N   . GLY A 1 120 ? 5.252   -23.739 9.507   1.000 8.209  0 120 GLY A N   1 ? 
ATOM   877  C  CA  . GLY A 1 120 ? 5.285   -22.608 8.605   1.000 7.159  0 120 GLY A CA  1 ? 
ATOM   878  C  C   . GLY A 1 120 ? 6.670   -22.031 8.383   1.000 7.731  0 120 GLY A C   1 ? 
ATOM   879  O  O   . GLY A 1 120 ? 7.713   -22.558 8.815   1.000 6.594  0 120 GLY A O   1 ? 
ATOM   880  N  N   . TRP A 1 121 ? 6.665   -20.971 7.576   1.000 8.058  0 121 TRP A N   1 ? 
ATOM   881  C  CA  . TRP A 1 121 ? 7.882   -20.304 7.140   1.000 8.841  0 121 TRP A CA  1 ? 
ATOM   882  C  C   . TRP A 1 121 ? 8.127   -18.991 7.881   1.000 9.736  0 121 TRP A C   1 ? 
ATOM   883  O  O   . TRP A 1 121 ? 8.823   -18.090 7.392   1.000 9.873  0 121 TRP A O   1 ? 
ATOM   884  C  CB  . TRP A 1 121 ? 7.870   -20.070 5.641   1.000 8.906  0 121 TRP A CB  1 ? 
ATOM   885  C  CG  . TRP A 1 121 ? 8.041   -21.313 4.828   1.000 8.095  0 121 TRP A CG  1 ? 
ATOM   886  C  CD1 . TRP A 1 121 ? 9.218   -21.919 4.456   1.000 7.963  0 121 TRP A CD1 1 ? 
ATOM   887  C  CD2 . TRP A 1 121 ? 6.982   -22.074 4.255   1.000 8.097  0 121 TRP A CD2 1 ? 
ATOM   888  N  NE1 . TRP A 1 121 ? 8.944   -23.028 3.712   1.000 8.622  0 121 TRP A NE1 1 ? 
ATOM   889  C  CE2 . TRP A 1 121 ? 7.589   -23.115 3.518   1.000 8.155  0 121 TRP A CE2 1 ? 
ATOM   890  C  CE3 . TRP A 1 121 ? 5.582   -21.929 4.205   1.000 7.626  0 121 TRP A CE3 1 ? 
ATOM   891  C  CZ2 . TRP A 1 121 ? 6.846   -24.029 2.795   1.000 8.304  0 121 TRP A CZ2 1 ? 
ATOM   892  C  CZ3 . TRP A 1 121 ? 4.846   -22.867 3.513   1.000 8.189  0 121 TRP A CZ3 1 ? 
ATOM   893  C  CH2 . TRP A 1 121 ? 5.482   -23.870 2.787   1.000 8.652  0 121 TRP A CH2 1 ? 
ATOM   894  N  N   . GLY A 1 122 ? 7.499   -18.856 9.047   1.000 10.356 0 122 GLY A N   1 ? 
ATOM   895  C  CA  . GLY A 1 122 ? 7.556   -17.605 9.769   1.000 9.546  0 122 GLY A CA  1 ? 
ATOM   896  C  C   . GLY A 1 122 ? 8.871   -17.414 10.535  1.000 10.336 0 122 GLY A C   1 ? 
ATOM   897  O  O   . GLY A 1 122 ? 9.781   -18.249 10.483  1.000 9.285  0 122 GLY A O   1 ? 
ATOM   898  N  N   . ASN A 1 123 ? 8.951   -16.259 11.208  1.000 10.558 0 123 ASN A N   1 ? 
ATOM   899  C  CA  . ASN A 1 123 ? 10.149  -15.845 11.907  1.000 11.464 0 123 ASN A CA  1 ? 
ATOM   900  C  C   . ASN A 1 123 ? 10.561  -16.939 12.882  1.000 11.323 0 123 ASN A C   1 ? 
ATOM   901  O  O   . ASN A 1 123 ? 9.694   -17.544 13.503  1.000 9.876  0 123 ASN A O   1 ? 
ATOM   902  C  CB  . ASN A 1 123 ? 9.864   -14.547 12.657  1.000 12.723 0 123 ASN A CB  1 ? 
ATOM   903  C  CG  . ASN A 1 123 ? 11.077  -13.880 13.256  1.000 13.489 0 123 ASN A CG  1 ? 
ATOM   904  O  OD1 . ASN A 1 123 ? 12.188  -14.404 13.190  1.000 14.994 0 123 ASN A OD1 1 ? 
ATOM   905  N  ND2 . ASN A 1 123 ? 10.830  -12.756 13.908  1.000 16.385 0 123 ASN A ND2 1 ? 
ATOM   906  N  N   . THR A 1 124 ? 11.877  -17.192 13.004  1.000 12.437 0 124 THR A N   1 ? 
ATOM   907  C  CA  . THR A 1 124 ? 12.377  -18.239 13.874  1.000 13.596 0 124 THR A CA  1 ? 
ATOM   908  C  C   . THR A 1 124 ? 12.964  -17.682 15.173  1.000 15.990 0 124 THR A C   1 ? 
ATOM   909  O  O   . THR A 1 124 ? 13.472  -18.468 15.979  1.000 14.031 0 124 THR A O   1 ? 
ATOM   910  C  CB  . THR A 1 124 ? 13.424  -19.091 13.146  1.000 13.440 0 124 THR A CB  1 ? 
ATOM   911  O  OG1 . THR A 1 124 ? 14.562  -18.263 12.860  1.000 13.677 0 124 THR A OG1 1 ? 
ATOM   912  C  CG2 . THR A 1 124 ? 12.879  -19.769 11.901  1.000 14.071 0 124 THR A CG2 1 ? 
ATOM   913  N  N   . LYS A 1 125 ? 12.972  -16.352 15.339  1.000 18.188 0 125 LYS A N   1 ? 
ATOM   914  C  CA  . LYS A 1 125 ? 13.449  -15.740 16.579  1.000 21.895 0 125 LYS A CA  1 ? 
ATOM   915  C  C   . LYS A 1 125 ? 12.323  -15.099 17.401  1.000 22.014 0 125 LYS A C   1 ? 
ATOM   916  O  O   . LYS A 1 125 ? 11.392  -14.485 16.882  1.000 23.963 0 125 LYS A O   1 ? 
ATOM   917  C  CB  . LYS A 1 125 ? 14.516  -14.708 16.217  1.000 23.710 0 125 LYS A CB  1 ? 
ATOM   918  C  CG  . LYS A 1 125 ? 15.776  -15.298 15.605  1.000 27.221 0 125 LYS A CG  1 ? 
ATOM   919  C  CD  . LYS A 1 125 ? 16.841  -14.247 15.368  1.000 32.316 0 125 LYS A CD  1 ? 
ATOM   920  C  CE  . LYS A 1 125 ? 18.096  -14.783 14.705  1.000 35.122 0 125 LYS A CE  1 ? 
ATOM   921  N  NZ  . LYS A 1 125 ? 18.512  -16.076 15.297  1.000 35.479 0 125 LYS A NZ  1 ? 
ATOM   922  N  N   . SER A 1 126 ? 12.431  -15.201 18.734  1.000 25.453 0 126 SER A N   1 ? 
ATOM   923  C  CA  . SER A 1 126 ? 11.505  -14.538 19.654  1.000 28.621 0 126 SER A CA  1 ? 
ATOM   924  C  C   . SER A 1 126 ? 11.798  -13.046 19.811  1.000 32.230 0 126 SER A C   1 ? 
ATOM   925  O  O   . SER A 1 126 ? 10.943  -12.307 20.307  1.000 37.349 0 126 SER A O   1 ? 
ATOM   926  C  CB  . SER A 1 126 ? 11.579  -15.204 21.005  1.000 30.246 0 126 SER A CB  1 ? 
ATOM   927  O  OG  . SER A 1 126 ? 12.935  -15.329 21.394  1.000 28.587 0 126 SER A OG  1 ? 
ATOM   928  N  N   . SER A 1 127 ? 13.018  -12.616 19.460  1.000 34.617 0 127 SER A N   1 ? 
ATOM   929  C  CA  . SER A 1 127 ? 13.418  -11.214 19.542  1.000 40.367 0 127 SER A CA  1 ? 
ATOM   930  C  C   . SER A 1 127 ? 13.917  -10.713 18.189  1.000 40.547 0 127 SER A C   1 ? 
ATOM   931  O  O   . SER A 1 127 ? 13.441  -9.707  17.668  1.000 43.025 0 127 SER A O   1 ? 
ATOM   932  C  CB  . SER A 1 127 ? 14.481  -11.004 20.596  1.000 44.001 0 127 SER A CB  1 ? 
ATOM   933  O  OG  . SER A 1 127 ? 13.910  -11.044 21.896  1.000 48.784 0 127 SER A OG  1 ? 
ATOM   934  N  N   . GLY A 1 128 ? 14.917  -11.398 17.637  1.000 39.895 0 128 GLY A N   1 ? 
ATOM   935  C  CA  . GLY A 1 128 ? 15.433  -10.999 16.342  1.000 39.352 0 128 GLY A CA  1 ? 
ATOM   936  C  C   . GLY A 1 128 ? 14.389  -11.132 15.229  1.000 38.223 0 128 GLY A C   1 ? 
ATOM   937  O  O   . GLY A 1 128 ? 13.184  -11.337 15.466  1.000 32.993 0 128 GLY A O   1 ? 
ATOM   938  N  N   . THR A 1 129 ? 14.883  -10.974 13.998  1.000 29.878 0 129 THR A N   1 ? 
ATOM   939  C  CA  . THR A 1 129 ? 14.168  -11.433 12.828  1.000 28.537 0 129 THR A CA  1 ? 
ATOM   940  C  C   . THR A 1 129 ? 15.108  -12.325 12.016  1.000 26.207 0 129 THR A C   1 ? 
ATOM   941  O  O   . THR A 1 129 ? 16.203  -11.926 11.618  1.000 23.986 0 129 THR A O   1 ? 
ATOM   942  C  CB  . THR A 1 129 ? 13.596  -10.256 12.033  1.000 29.632 0 129 THR A CB  1 ? 
ATOM   943  O  OG1 . THR A 1 129 ? 12.726  -9.525  12.900  1.000 32.306 0 129 THR A OG1 1 ? 
ATOM   944  C  CG2 . THR A 1 129 ? 12.834  -10.695 10.805  1.000 29.397 0 129 THR A CG2 1 ? 
ATOM   945  N  N   . SER A 1 130 ? 14.655  -13.560 11.794  1.000 21.907 0 130 SER A N   1 ? 
ATOM   946  C  CA  . SER A 1 130 ? 15.339  -14.467 10.906  1.000 21.269 0 130 SER A CA  1 ? 
ATOM   947  C  C   . SER A 1 130 ? 14.306  -15.396 10.289  1.000 19.853 0 130 SER A C   1 ? 
ATOM   948  O  O   . SER A 1 130 ? 13.682  -16.148 11.005  1.000 16.920 0 130 SER A O   1 ? 
ATOM   949  C  CB  . SER A 1 130 ? 16.395  -15.261 11.605  1.000 23.280 0 130 SER A CB  1 ? 
ATOM   950  O  OG  . SER A 1 130 ? 16.935  -16.223 10.724  1.000 24.081 0 130 SER A OG  1 ? 
ATOM   951  N  N   . TYR A 1 131 ? 14.106  -15.268 8.981   1.000 17.619 0 131 TYR A N   1 ? 
ATOM   952  C  CA  . TYR A 1 131 ? 13.139  -16.087 8.282   1.000 17.565 0 131 TYR A CA  1 ? 
ATOM   953  C  C   . TYR A 1 131 ? 13.880  -17.262 7.676   1.000 17.799 0 131 TYR A C   1 ? 
ATOM   954  O  O   . TYR A 1 131 ? 14.983  -17.103 7.158   1.000 17.793 0 131 TYR A O   1 ? 
ATOM   955  C  CB  . TYR A 1 131 ? 12.344  -15.249 7.287   1.000 19.231 0 131 TYR A CB  1 ? 
ATOM   956  C  CG  . TYR A 1 131 ? 11.341  -14.339 7.948   1.000 21.354 0 131 TYR A CG  1 ? 
ATOM   957  C  CD1 . TYR A 1 131 ? 11.708  -13.106 8.486   1.000 21.254 0 131 TYR A CD1 1 ? 
ATOM   958  C  CD2 . TYR A 1 131 ? 10.023  -14.740 8.079   1.000 23.144 0 131 TYR A CD2 1 ? 
ATOM   959  C  CE1 . TYR A 1 131 ? 10.767  -12.271 9.073   1.000 23.964 0 131 TYR A CE1 1 ? 
ATOM   960  C  CE2 . TYR A 1 131 ? 9.083   -13.939 8.701   1.000 24.528 0 131 TYR A CE2 1 ? 
ATOM   961  C  CZ  . TYR A 1 131 ? 9.453   -12.706 9.207   1.000 25.629 0 131 TYR A CZ  1 ? 
ATOM   962  O  OH  . TYR A 1 131 ? 8.474   -11.930 9.790   1.000 30.446 0 131 TYR A OH  1 ? 
ATOM   963  N  N   . PRO A 1 132 ? 13.322  -18.481 7.783   1.000 15.358 0 132 PRO A N   1 ? 
ATOM   964  C  CA  . PRO A 1 132 ? 13.970  -19.681 7.262   1.000 16.091 0 132 PRO A CA  1 ? 
ATOM   965  C  C   . PRO A 1 132 ? 13.595  -19.804 5.797   1.000 17.025 0 132 PRO A C   1 ? 
ATOM   966  O  O   . PRO A 1 132 ? 12.651  -19.187 5.343   1.000 19.018 0 132 PRO A O   1 ? 
ATOM   967  C  CB  . PRO A 1 132 ? 13.296  -20.788 8.070   1.000 15.273 0 132 PRO A CB  1 ? 
ATOM   968  C  CG  . PRO A 1 132 ? 11.857  -20.261 8.250   1.000 15.029 0 132 PRO A CG  1 ? 
ATOM   969  C  CD  . PRO A 1 132 ? 12.004  -18.762 8.388   1.000 15.532 0 132 PRO A CD  1 ? 
ATOM   970  N  N   . ASP A 1 133 ? 14.295  -20.633 5.061   1.000 19.198 0 133 ASP A N   1 ? 
ATOM   971  C  CA  . ASP A 1 133 ? 13.864  -20.824 3.688   1.000 19.585 0 133 ASP A CA  1 ? 
ATOM   972  C  C   . ASP A 1 133 ? 13.079  -22.133 3.595   1.000 16.642 0 133 ASP A C   1 ? 
ATOM   973  O  O   . ASP A 1 133 ? 12.240  -22.261 2.716   1.000 15.343 0 133 ASP A O   1 ? 
ATOM   974  C  CB  . ASP A 1 133 ? 15.024  -20.688 2.696   1.000 23.993 0 133 ASP A CB  1 ? 
ATOM   975  C  CG  . ASP A 1 133 ? 16.242  -21.558 2.955   1.000 27.830 0 133 ASP A CG  1 ? 
ATOM   976  O  OD1 . ASP A 1 133 ? 16.239  -22.307 3.974   1.000 30.461 0 133 ASP A OD1 1 ? 
ATOM   977  O  OD2 . ASP A 1 133 ? 17.197  -21.483 2.113   1.000 32.448 0 133 ASP A OD2 1 ? 
ATOM   978  N  N   . VAL A 1 134 ? 13.341  -23.063 4.512   1.000 12.937 0 134 VAL A N   1 ? 
ATOM   979  C  CA  . VAL A 1 134 ? 12.696  -24.356 4.492   1.000 12.788 0 134 VAL A CA  1 ? 
ATOM   980  C  C   . VAL A 1 134 ? 11.646  -24.419 5.607   1.000 10.995 0 134 VAL A C   1 ? 
ATOM   981  O  O   . VAL A 1 134 ? 11.661  -23.617 6.539   1.000 10.303 0 134 VAL A O   1 ? 
ATOM   982  C  CB  . VAL A 1 134 ? 13.712  -25.498 4.586   1.000 14.571 0 134 VAL A CB  1 ? 
ATOM   983  C  CG1 . VAL A 1 134 ? 14.725  -25.430 3.453   1.000 15.929 0 134 VAL A CG1 1 ? 
ATOM   984  C  CG2 . VAL A 1 134 ? 14.454  -25.526 5.911   1.000 16.289 0 134 VAL A CG2 1 ? 
ATOM   985  N  N   . LEU A 1 135 ? 10.708  -25.355 5.443   1.000 9.320  0 135 LEU A N   1 ? 
ATOM   986  C  CA  . LEU A 1 135 ? 9.551   -25.403 6.315   1.000 9.371  0 135 LEU A CA  1 ? 
ATOM   987  C  C   . LEU A 1 135 ? 9.994   -25.884 7.700   1.000 8.609  0 135 LEU A C   1 ? 
ATOM   988  O  O   . LEU A 1 135 ? 10.763  -26.818 7.832   1.000 8.739  0 135 LEU A O   1 ? 
ATOM   989  C  CB  . LEU A 1 135 ? 8.491   -26.320 5.697   1.000 9.269  0 135 LEU A CB  1 ? 
ATOM   990  C  CG  . LEU A 1 135 ? 7.160   -26.405 6.453   1.000 9.869  0 135 LEU A CG  1 ? 
ATOM   991  C  CD1 . LEU A 1 135 ? 6.468   -25.076 6.456   1.000 10.063 0 135 LEU A CD1 1 ? 
ATOM   992  C  CD2 . LEU A 1 135 ? 6.269   -27.500 5.876   1.000 10.551 0 135 LEU A CD2 1 ? 
ATOM   993  N  N   . LYS A 1 136 ? 9.548   -25.167 8.714   1.000 8.401  0 136 LYS A N   1 ? 
ATOM   994  C  CA  . LYS A 1 136 ? 9.777   -25.493 10.100  1.000 9.020  0 136 LYS A CA  1 ? 
ATOM   995  C  C   . LYS A 1 136 ? 8.486   -26.038 10.708  1.000 8.275  0 136 LYS A C   1 ? 
ATOM   996  O  O   . LYS A 1 136 ? 7.365   -25.675 10.345  1.000 6.734  0 136 LYS A O   1 ? 
ATOM   997  C  CB  . LYS A 1 136 ? 10.223  -24.234 10.834  1.000 10.174 0 136 LYS A CB  1 ? 
ATOM   998  C  CG  . LYS A 1 136 ? 11.470  -23.576 10.279  1.000 11.430 0 136 LYS A CG  1 ? 
ATOM   999  C  CD  . LYS A 1 136 ? 12.643  -24.537 10.314  1.000 13.305 0 136 LYS A CD  1 ? 
ATOM   1000 C  CE  . LYS A 1 136 ? 13.947  -23.899 9.922   1.000 15.822 0 136 LYS A CE  1 ? 
ATOM   1001 N  NZ  . LYS A 1 136 ? 15.038  -24.891 10.096  1.000 17.997 0 136 LYS A NZ  1 ? 
ATOM   1002 N  N   . CYS A 1 137 ? 8.705   -26.843 11.734  1.000 8.709  0 137 CYS A N   1 ? 
ATOM   1003 C  CA  . CYS A 1 137 ? 7.672   -27.575 12.422  1.000 9.223  0 137 CYS A CA  1 ? 
ATOM   1004 C  C   . CYS A 1 137 ? 7.877   -27.436 13.921  1.000 9.372  0 137 CYS A C   1 ? 
ATOM   1005 O  O   . CYS A 1 137 ? 8.964   -27.150 14.419  1.000 10.319 0 137 CYS A O   1 ? 
ATOM   1006 C  CB  . CYS A 1 137 ? 7.769   -29.040 12.056  1.000 9.146  0 137 CYS A CB  1 ? 
ATOM   1007 S  SG  . CYS A 1 137 ? 6.974   -29.592 10.526  1.000 9.284  0 137 CYS A SG  1 ? 
ATOM   1008 N  N   . LEU A 1 138 ? 6.754   -27.557 14.625  1.000 11.002 0 138 LEU A N   1 ? 
ATOM   1009 C  CA  . LEU A 1 138 ? 6.762   -27.490 16.063  1.000 10.641 0 138 LEU A CA  1 ? 
ATOM   1010 C  C   . LEU A 1 138 ? 5.693   -28.450 16.552  1.000 11.687 0 138 LEU A C   1 ? 
ATOM   1011 O  O   . LEU A 1 138 ? 4.569   -28.393 16.063  1.000 9.647  0 138 LEU A O   1 ? 
ATOM   1012 C  CB  . LEU A 1 138 ? 6.427   -26.056 16.470  1.000 11.541 0 138 LEU A CB  1 ? 
ATOM   1013 C  CG  . LEU A 1 138 ? 6.325   -25.835 17.981  1.000 12.317 0 138 LEU A CG  1 ? 
ATOM   1014 C  CD1 . LEU A 1 138 ? 7.682   -26.075 18.622  1.000 13.500 0 138 LEU A CD1 1 ? 
ATOM   1015 C  CD2 . LEU A 1 138 ? 5.802   -24.438 18.271  1.000 13.117 0 138 LEU A CD2 1 ? 
ATOM   1016 N  N   . LYS A 1 139 ? 6.032   -29.255 17.567  1.000 11.007 0 139 LYS A N   1 ? 
ATOM   1017 C  CA  . LYS A 1 139 ? 5.027   -30.024 18.266  1.000 13.151 0 139 LYS A CA  1 ? 
ATOM   1018 C  C   . LYS A 1 139 ? 4.663   -29.239 19.506  1.000 12.638 0 139 LYS A C   1 ? 
ATOM   1019 O  O   . LYS A 1 139 ? 5.541   -28.836 20.267  1.000 12.647 0 139 LYS A O   1 ? 
ATOM   1020 C  CB  . LYS A 1 139 ? 5.557   -31.406 18.630  1.000 15.742 0 139 LYS A CB  1 ? 
ATOM   1021 C  CG  . LYS A 1 139 ? 5.787   -32.228 17.385  1.000 19.178 0 139 LYS A CG  1 ? 
ATOM   1022 C  CD  . LYS A 1 139 ? 6.062   -33.630 17.654  1.000 22.513 0 139 LYS A CD  1 ? 
ATOM   1023 C  CE  . LYS A 1 139 ? 5.778   -34.460 16.427  1.000 23.862 0 139 LYS A CE  1 ? 
ATOM   1024 N  NZ  . LYS A 1 139 ? 6.184   -35.838 16.721  1.000 24.071 0 139 LYS A NZ  1 ? 
ATOM   1025 N  N   . ALA A 1 140 ? 3.367   -29.070 19.707  1.000 11.866 0 140 ALA A N   1 ? 
ATOM   1026 C  CA  . ALA A 1 140 ? 2.918   -28.244 20.809  1.000 12.018 0 140 ALA A CA  1 ? 
ATOM   1027 C  C   . ALA A 1 140 ? 1.605   -28.762 21.345  1.000 12.070 0 140 ALA A C   1 ? 
ATOM   1028 O  O   . ALA A 1 140 ? 0.745   -29.183 20.594  1.000 11.819 0 140 ALA A O   1 ? 
ATOM   1029 C  CB  . ALA A 1 140 ? 2.812   -26.800 20.405  1.000 12.566 0 140 ALA A CB  1 ? 
ATOM   1030 N  N   . PRO A 1 141 ? 1.395   -28.741 22.677  1.000 12.034 0 141 PRO A N   1 ? 
ATOM   1031 C  CA  . PRO A 1 141 ? 0.139   -29.228 23.215  1.000 11.506 0 141 PRO A CA  1 ? 
ATOM   1032 C  C   . PRO A 1 141 ? -0.937  -28.154 23.249  1.000 11.004 0 141 PRO A C   1 ? 
ATOM   1033 O  O   . PRO A 1 141 ? -0.656  -26.973 23.397  1.000 11.148 0 141 PRO A O   1 ? 
ATOM   1034 C  CB  . PRO A 1 141 ? 0.558   -29.685 24.616  1.000 12.427 0 141 PRO A CB  1 ? 
ATOM   1035 C  CG  . PRO A 1 141 ? 1.614   -28.693 24.993  1.000 12.445 0 141 PRO A CG  1 ? 
ATOM   1036 C  CD  . PRO A 1 141 ? 2.384   -28.414 23.718  1.000 12.582 0 141 PRO A CD  1 ? 
ATOM   1037 N  N   . ILE A 1 142 ? -2.192  -28.596 23.116  1.000 10.628 0 142 ILE A N   1 ? 
ATOM   1038 C  CA  . ILE A 1 142 ? -3.317  -27.716 23.364  1.000 10.544 0 142 ILE A CA  1 ? 
ATOM   1039 C  C   . ILE A 1 142 ? -3.367  -27.444 24.863  1.000 11.319 0 142 ILE A C   1 ? 
ATOM   1040 O  O   . ILE A 1 142 ? -3.298  -28.385 25.657  1.000 11.717 0 142 ILE A O   1 ? 
ATOM   1041 C  CB  . ILE A 1 142 ? -4.624  -28.327 22.844  1.000 10.444 0 142 ILE A CB  1 ? 
ATOM   1042 C  CG1 . ILE A 1 142 ? -4.635  -28.434 21.308  1.000 10.609 0 142 ILE A CG1 1 ? 
ATOM   1043 C  CG2 . ILE A 1 142 ? -5.806  -27.508 23.349  1.000 10.228 0 142 ILE A CG2 1 ? 
ATOM   1044 C  CD1 . ILE A 1 142 ? -5.866  -29.103 20.772  1.000 11.361 0 142 ILE A CD1 1 ? 
ATOM   1045 N  N   . LEU A 1 143 ? -3.489  -26.171 25.233  1.000 12.407 0 143 LEU A N   1 ? 
ATOM   1046 C  CA  . LEU A 1 143 ? -3.559  -25.786 26.639  1.000 14.207 0 143 LEU A CA  1 ? 
ATOM   1047 C  C   . LEU A 1 143 ? -5.008  -25.767 27.109  1.000 14.332 0 143 LEU A C   1 ? 
ATOM   1048 O  O   . LEU A 1 143 ? -5.954  -25.744 26.314  1.000 15.869 0 143 LEU A O   1 ? 
ATOM   1049 C  CB  . LEU A 1 143 ? -2.888  -24.424 26.821  1.000 15.913 0 143 LEU A CB  1 ? 
ATOM   1050 C  CG  . LEU A 1 143 ? -1.409  -24.395 26.466  1.000 17.154 0 143 LEU A CG  1 ? 
ATOM   1051 C  CD1 . LEU A 1 143 ? -0.848  -22.999 26.592  1.000 17.988 0 143 LEU A CD1 1 ? 
ATOM   1052 C  CD2 . LEU A 1 143 ? -0.627  -25.359 27.337  1.000 20.620 0 143 LEU A CD2 1 ? 
ATOM   1053 N  N   . SER A 1 144 ? -5.191  -25.880 28.442  1.000 14.732 0 144 SER A N   1 ? 
ATOM   1054 C  CA  . SER A 1 144 ? -6.528  -25.822 28.995  1.000 15.265 0 144 SER A CA  1 ? 
ATOM   1055 C  C   . SER A 1 144 ? -7.065  -24.446 28.669  1.000 16.376 0 144 SER A C   1 ? 
ATOM   1056 O  O   . SER A 1 144 ? -6.279  -23.514 28.588  1.000 16.376 0 144 SER A O   1 ? 
ATOM   1057 C  CB  . SER A 1 144 ? -6.534  -26.016 30.504  1.000 15.997 0 144 SER A CB  1 ? 
ATOM   1058 O  OG  . SER A 1 144 ? -5.821  -24.962 31.140  1.000 17.016 0 144 SER A OG  1 ? 
ATOM   1059 N  N   . ASP A 1 145 ? -8.384  -24.312 28.582  1.000 19.701 0 145 ASP A N   1 ? 
ATOM   1060 C  CA  . ASP A 1 145 ? -8.994  -23.014 28.348  1.000 23.033 0 145 ASP A CA  1 ? 
ATOM   1061 C  C   . ASP A 1 145 ? -8.769  -22.115 29.553  1.000 21.602 0 145 ASP A C   1 ? 
ATOM   1062 O  O   . ASP A 1 145 ? -8.586  -20.919 29.387  1.000 19.620 0 145 ASP A O   1 ? 
ATOM   1063 C  CB  . ASP A 1 145 ? -10.472 -23.132 27.996  1.000 27.536 0 145 ASP A CB  1 ? 
ATOM   1064 C  CG  . ASP A 1 145 ? -10.668 -23.691 26.593  1.000 32.035 0 145 ASP A CG  1 ? 
ATOM   1065 O  OD1 . ASP A 1 145 ? -9.891  -23.306 25.664  1.000 30.744 0 145 ASP A OD1 1 ? 
ATOM   1066 O  OD2 . ASP A 1 145 ? -11.596 -24.494 26.434  1.000 34.324 0 145 ASP A OD2 1 ? 
ATOM   1067 N  N   . SER A 1 146 ? -8.710  -22.689 30.751  1.000 20.872 0 146 SER A N   1 ? 
ATOM   1068 C  CA  . SER A 1 146 ? -8.474  -21.856 31.914  1.000 21.063 0 146 SER A CA  1 ? 
ATOM   1069 C  C   . SER A 1 146 ? -7.095  -21.202 31.807  1.000 17.927 0 146 SER A C   1 ? 
ATOM   1070 O  O   . SER A 1 146 ? -6.990  -19.991 31.992  1.000 17.832 0 146 SER A O   1 ? 
ATOM   1071 C  CB  . SER A 1 146 ? -8.682  -22.612 33.216  1.000 25.087 0 146 SER A CB  1 ? 
ATOM   1072 O  OG  . SER A 1 146 ? -7.496  -23.277 33.612  1.000 31.868 0 146 SER A OG  1 ? 
ATOM   1073 N  N   . SER A 1 147 ? -6.052  -21.952 31.395  1.000 16.675 0 147 SER A N   1 ? 
ATOM   1074 C  CA  . SER A 1 147 ? -4.734  -21.350 31.284  1.000 17.013 0 147 SER A CA  1 ? 
ATOM   1075 C  C   . SER A 1 147 ? -4.645  -20.372 30.100  1.000 15.357 0 147 SER A C   1 ? 
ATOM   1076 O  O   . SER A 1 147 ? -3.856  -19.411 30.119  1.000 12.502 0 147 SER A O   1 ? 
ATOM   1077 C  CB  . SER A 1 147 ? -3.650  -22.384 31.240  1.000 19.829 0 147 SER A CB  1 ? 
ATOM   1078 O  OG  . SER A 1 147 ? -3.648  -23.076 30.005  1.000 25.749 0 147 SER A OG  1 ? 
ATOM   1079 N  N   . CYS A 1 148 ? -5.399  -20.662 29.048  1.000 14.594 0 148 CYS A N   1 ? 
ATOM   1080 C  CA  . CYS A 1 148 ? -5.466  -19.794 27.871  1.000 13.629 0 148 CYS A CA  1 ? 
ATOM   1081 C  C   . CYS A 1 148 ? -6.081  -18.448 28.255  1.000 15.513 0 148 CYS A C   1 ? 
ATOM   1082 O  O   . CYS A 1 148 ? -5.540  -17.391 27.946  1.000 14.810 0 148 CYS A O   1 ? 
ATOM   1083 C  CB  . CYS A 1 148 ? -6.283  -20.507 26.803  1.000 13.061 0 148 CYS A CB  1 ? 
ATOM   1084 S  SG  . CYS A 1 148 ? -6.261  -19.649 25.210  1.000 12.377 0 148 CYS A SG  1 ? 
ATOM   1085 N  N   . LYS A 1 149 ? -7.221  -18.497 28.963  1.000 17.340 0 149 LYS A N   1 ? 
ATOM   1086 C  CA  . LYS A 1 149 ? -7.947  -17.299 29.350  1.000 19.569 0 149 LYS A CA  1 ? 
ATOM   1087 C  C   . LYS A 1 149 ? -7.120  -16.514 30.367  1.000 19.925 0 149 LYS A C   1 ? 
ATOM   1088 O  O   . LYS A 1 149 ? -7.204  -15.295 30.402  1.000 18.601 0 149 LYS A O   1 ? 
ATOM   1089 C  CB  . LYS A 1 149 ? -9.344  -17.687 29.856  1.000 23.154 0 149 LYS A CB  1 ? 
ATOM   1090 C  CG  . LYS A 1 149 ? -10.276 -18.171 28.757  1.000 26.422 0 149 LYS A CG  1 ? 
ATOM   1091 C  CD  . LYS A 1 149 ? -11.598 -18.725 29.229  1.000 32.055 0 149 LYS A CD  1 ? 
ATOM   1092 C  CE  . LYS A 1 149 ? -12.600 -18.831 28.093  1.000 40.328 0 149 LYS A CE  1 ? 
ATOM   1093 N  NZ  . LYS A 1 149 ? -13.884 -19.451 28.515  1.000 43.885 0 149 LYS A NZ  1 ? 
ATOM   1094 N  N   . SER A 1 150 ? -6.335  -17.222 31.201  1.000 17.943 0 150 SER A N   1 ? 
ATOM   1095 C  CA  . SER A 1 150 ? -5.474  -16.574 32.179  1.000 18.587 0 150 SER A CA  1 ? 
ATOM   1096 C  C   . SER A 1 150 ? -4.315  -15.862 31.509  1.000 16.847 0 150 SER A C   1 ? 
ATOM   1097 O  O   . SER A 1 150 ? -3.902  -14.811 31.979  1.000 14.968 0 150 SER A O   1 ? 
ATOM   1098 C  CB  . SER A 1 150 ? -4.965  -17.527 33.228  1.000 21.145 0 150 SER A CB  1 ? 
ATOM   1099 O  OG  . SER A 1 150 ? -6.009  -17.758 34.150  1.000 25.257 0 150 SER A OG  1 ? 
ATOM   1100 N  N   . ALA A 1 151 ? -3.808  -16.443 30.415  1.000 15.730 0 151 ALA A N   1 ? 
ATOM   1101 C  CA  . ALA A 1 151 ? -2.723  -15.847 29.671  1.000 13.863 0 151 ALA A CA  1 ? 
ATOM   1102 C  C   . ALA A 1 151 ? -3.197  -14.574 28.975  1.000 13.190 0 151 ALA A C   1 ? 
ATOM   1103 O  O   . ALA A 1 151 ? -2.429  -13.631 28.844  1.000 14.175 0 151 ALA A O   1 ? 
ATOM   1104 C  CB  . ALA A 1 151 ? -2.166  -16.838 28.666  1.000 13.969 0 151 ALA A CB  1 ? 
ATOM   1105 N  N   . TYR A 1 152 ? -4.444  -14.571 28.487  1.000 13.070 0 152 TYR A N   1 ? 
ATOM   1106 C  CA  . TYR A 1 152 ? -4.949  -13.485 27.674  1.000 12.378 0 152 TYR A CA  1 ? 
ATOM   1107 C  C   . TYR A 1 152 ? -6.301  -13.041 28.207  1.000 12.922 0 152 TYR A C   1 ? 
ATOM   1108 O  O   . TYR A 1 152 ? -7.341  -13.270 27.593  1.000 11.944 0 152 TYR A O   1 ? 
ATOM   1109 C  CB  . TYR A 1 152 ? -5.034  -13.932 26.228  1.000 12.327 0 152 TYR A CB  1 ? 
ATOM   1110 C  CG  . TYR A 1 152 ? -3.714  -14.227 25.599  1.000 11.225 0 152 TYR A CG  1 ? 
ATOM   1111 C  CD1 . TYR A 1 152 ? -2.893  -13.183 25.169  1.000 11.496 0 152 TYR A CD1 1 ? 
ATOM   1112 C  CD2 . TYR A 1 152 ? -3.314  -15.527 25.346  1.000 12.326 0 152 TYR A CD2 1 ? 
ATOM   1113 C  CE1 . TYR A 1 152 ? -1.692  -13.438 24.535  1.000 11.166 0 152 TYR A CE1 1 ? 
ATOM   1114 C  CE2 . TYR A 1 152 ? -2.142  -15.788 24.679  1.000 10.975 0 152 TYR A CE2 1 ? 
ATOM   1115 C  CZ  . TYR A 1 152 ? -1.333  -14.745 24.272  1.000 11.147 0 152 TYR A CZ  1 ? 
ATOM   1116 O  OH  . TYR A 1 152 ? -0.139  -14.993 23.651  1.000 11.184 0 152 TYR A OH  1 ? 
ATOM   1117 N  N   . PRO A 1 153 ? -6.310  -12.432 29.409  1.000 13.463 0 153 PRO A N   1 ? 
ATOM   1118 C  CA  . PRO A 1 153 ? -7.573  -12.087 30.048  1.000 14.506 0 153 PRO A CA  1 ? 
ATOM   1119 C  C   . PRO A 1 153 ? -8.411  -11.156 29.181  1.000 13.319 0 153 PRO A C   1 ? 
ATOM   1120 O  O   . PRO A 1 153 ? -7.903  -10.173 28.661  1.000 15.861 0 153 PRO A O   1 ? 
ATOM   1121 C  CB  . PRO A 1 153 ? -7.124  -11.425 31.371  1.000 16.100 0 153 PRO A CB  1 ? 
ATOM   1122 C  CG  . PRO A 1 153 ? -5.688  -11.848 31.565  1.000 15.912 0 153 PRO A CG  1 ? 
ATOM   1123 C  CD  . PRO A 1 153 ? -5.130  -12.015 30.172  1.000 14.977 0 153 PRO A CD  1 ? 
ATOM   1124 N  N   . GLY A 1 154 ? -9.680  -11.512 29.005  1.000 13.155 0 154 GLY A N   1 ? 
ATOM   1125 C  CA  . GLY A 1 154 ? -10.637 -10.658 28.328  1.000 14.349 0 154 GLY A CA  1 ? 
ATOM   1126 C  C   . GLY A 1 154 ? -10.550 -10.793 26.808  1.000 15.472 0 154 GLY A C   1 ? 
ATOM   1127 O  O   . GLY A 1 154 ? -11.229 -10.060 26.102  1.000 18.638 0 154 GLY A O   1 ? 
ATOM   1128 N  N   . GLN A 1 155 ? -9.675  -11.674 26.302  1.000 14.388 0 155 GLN A N   1 ? 
ATOM   1129 C  CA  . GLN A 1 155 ? -9.385  -11.703 24.872  1.000 14.535 0 155 GLN A CA  1 ? 
ATOM   1130 C  C   . GLN A 1 155 ? -9.706  -13.032 24.187  1.000 14.454 0 155 GLN A C   1 ? 
ATOM   1131 O  O   . GLN A 1 155 ? -9.618  -13.113 22.954  1.000 12.846 0 155 GLN A O   1 ? 
ATOM   1132 C  CB  . GLN A 1 155 ? -7.913  -11.387 24.666  1.000 15.728 0 155 GLN A CB  1 ? 
ATOM   1133 C  CG  . GLN A 1 155 ? -7.579  -9.975  25.131  1.000 18.931 0 155 GLN A CG  1 ? 
ATOM   1134 C  CD  . GLN A 1 155 ? -6.106  -9.832  25.352  1.000 21.715 0 155 GLN A CD  1 ? 
ATOM   1135 O  OE1 . GLN A 1 155 ? -5.363  -9.709  24.394  1.000 25.118 0 155 GLN A OE1 1 ? 
ATOM   1136 N  NE2 . GLN A 1 155 ? -5.684  -9.852  26.610  1.000 28.566 0 155 GLN A NE2 1 ? 
ATOM   1137 N  N   . ILE A 1 156 ? -9.971  -14.092 24.956  1.000 13.388 0 156 ILE A N   1 ? 
ATOM   1138 C  CA  . ILE A 1 156 ? -10.133 -15.418 24.351  1.000 13.273 0 156 ILE A CA  1 ? 
ATOM   1139 C  C   . ILE A 1 156 ? -11.622 -15.689 24.165  1.000 13.225 0 156 ILE A C   1 ? 
ATOM   1140 O  O   . ILE A 1 156 ? -12.375 -15.735 25.122  1.000 12.302 0 156 ILE A O   1 ? 
ATOM   1141 C  CB  . ILE A 1 156 ? -9.412  -16.528 25.139  1.000 12.667 0 156 ILE A CB  1 ? 
ATOM   1142 C  CG1 . ILE A 1 156 ? -7.924  -16.219 25.286  1.000 13.543 0 156 ILE A CG1 1 ? 
ATOM   1143 C  CG2 . ILE A 1 156 ? -9.650  -17.907 24.502  1.000 13.025 0 156 ILE A CG2 1 ? 
ATOM   1144 C  CD1 . ILE A 1 156 ? -7.187  -16.119 23.961  1.000 13.138 0 156 ILE A CD1 1 ? 
ATOM   1145 N  N   . THR A 1 157 ? -12.028 -15.958 22.919  1.000 11.660 0 157 THR A N   1 ? 
ATOM   1146 C  CA  . THR A 1 157 ? -13.395 -16.363 22.660  1.000 12.304 0 157 THR A CA  1 ? 
ATOM   1147 C  C   . THR A 1 157 ? -13.478 -17.875 22.584  1.000 11.183 0 157 THR A C   1 ? 
ATOM   1148 O  O   . THR A 1 157 ? -12.494 -18.579 22.496  1.000 10.622 0 157 THR A O   1 ? 
ATOM   1149 C  CB  . THR A 1 157 ? -13.913 -15.711 21.368  1.000 13.010 0 157 THR A CB  1 ? 
ATOM   1150 O  OG1 . THR A 1 157 ? -13.250 -16.393 20.300  1.000 11.318 0 157 THR A OG1 1 ? 
ATOM   1151 C  CG2 . THR A 1 157 ? -13.636 -14.223 21.307  1.000 14.348 0 157 THR A CG2 1 ? 
ATOM   1152 N  N   . SER A 1 158 ? -14.695 -18.387 22.471  1.000 12.754 0 158 SER A N   1 ? 
ATOM   1153 C  CA  . SER A 1 158 ? -14.920 -19.800 22.283  1.000 13.970 0 158 SER A CA  1 ? 
ATOM   1154 C  C   . SER A 1 158 ? -14.479 -20.287 20.902  1.000 13.088 0 158 SER A C   1 ? 
ATOM   1155 O  O   . SER A 1 158 ? -14.519 -21.490 20.636  1.000 13.225 0 158 SER A O   1 ? 
ATOM   1156 C  CB  . SER A 1 158 ? -16.381 -20.059 22.496  1.000 17.096 0 158 SER A CB  1 ? 
ATOM   1157 O  OG  . SER A 1 158 ? -17.115 -19.215 21.652  1.000 20.654 0 158 SER A OG  1 ? 
ATOM   1158 N  N   . ASN A 1 159 ? -14.051 -19.364 20.033  1.000 10.983 0 159 ASN A N   1 ? 
ATOM   1159 C  CA  . ASN A 1 159 ? -13.591 -19.735 18.703  1.000 10.098 0 159 ASN A CA  1 ? 
ATOM   1160 C  C   . ASN A 1 159 ? -12.057 -19.721 18.634  1.000 10.227 0 159 ASN A C   1 ? 
ATOM   1161 O  O   . ASN A 1 159 ? -11.492 -19.687 17.556  1.000 8.696  0 159 ASN A O   1 ? 
ATOM   1162 C  CB  . ASN A 1 159 ? -14.110 -18.772 17.665  1.000 10.665 0 159 ASN A CB  1 ? 
ATOM   1163 C  CG  . ASN A 1 159 ? -15.617 -18.761 17.655  1.000 10.305 0 159 ASN A CG  1 ? 
ATOM   1164 O  OD1 . ASN A 1 159 ? -16.193 -19.845 17.605  1.000 12.210 0 159 ASN A OD1 1 ? 
ATOM   1165 N  ND2 . ASN A 1 159 ? -16.236 -17.585 17.734  1.000 10.201 0 159 ASN A ND2 1 ? 
ATOM   1166 N  N   . MET A 1 160 ? -11.410 -19.732 19.804  1.000 10.017 0 160 MET A N   1 ? 
ATOM   1167 C  CA  . MET A 1 160 ? -9.963  -19.715 19.898  1.000 10.015 0 160 MET A CA  1 ? 
ATOM   1168 C  C   . MET A 1 160 ? -9.496  -20.789 20.876  1.000 11.310 0 160 MET A C   1 ? 
ATOM   1169 O  O   . MET A 1 160 ? -10.185 -21.110 21.871  1.000 10.029 0 160 MET A O   1 ? 
ATOM   1170 C  CB  . MET A 1 160 ? -9.463  -18.369 20.426  1.000 10.067 0 160 MET A CB  1 ? 
ATOM   1171 C  CG  . MET A 1 160 ? -9.822  -17.210 19.587  1.000 10.836 0 160 MET A CG  1 ? 
ATOM   1172 S  SD  . MET A 1 160 ? -9.473  -15.655 20.422  1.000 10.441 0 160 MET A SD  1 ? 
ATOM   1173 C  CE  . MET A 1 160 ? -10.272 -14.541 19.271  1.000 12.053 0 160 MET A CE  1 ? 
ATOM   1174 N  N   . PHE A 1 161 ? -8.271  -21.275 20.647  1.000 10.388 0 161 PHE A N   1 ? 
ATOM   1175 C  CA  . PHE A 1 161 ? -7.613  -22.051 21.685  1.000 11.123 0 161 PHE A CA  1 ? 
ATOM   1176 C  C   . PHE A 1 161 ? -6.133  -21.713 21.711  1.000 10.773 0 161 PHE A C   1 ? 
ATOM   1177 O  O   . PHE A 1 161 ? -5.588  -21.119 20.772  1.000 11.149 0 161 PHE A O   1 ? 
ATOM   1178 C  CB  . PHE A 1 161 ? -7.841  -23.566 21.517  1.000 11.280 0 161 PHE A CB  1 ? 
ATOM   1179 C  CG  . PHE A 1 161 ? -7.198  -24.164 20.305  1.000 11.655 0 161 PHE A CG  1 ? 
ATOM   1180 C  CD1 . PHE A 1 161 ? -5.929  -24.698 20.383  1.000 11.500 0 161 PHE A CD1 1 ? 
ATOM   1181 C  CD2 . PHE A 1 161 ? -7.869  -24.226 19.092  1.000 12.649 0 161 PHE A CD2 1 ? 
ATOM   1182 C  CE1 . PHE A 1 161 ? -5.311  -25.248 19.257  1.000 13.541 0 161 PHE A CE1 1 ? 
ATOM   1183 C  CE2 . PHE A 1 161 ? -7.265  -24.796 17.977  1.000 13.255 0 161 PHE A CE2 1 ? 
ATOM   1184 C  CZ  . PHE A 1 161 ? -5.998  -25.326 18.066  1.000 12.380 0 161 PHE A CZ  1 ? 
ATOM   1185 N  N   . CYS A 1 162 ? -5.525  -21.999 22.857  1.000 9.902  0 162 CYS A N   1 ? 
ATOM   1186 C  CA  . CYS A 1 162 ? -4.095  -21.835 23.060  1.000 9.355  0 162 CYS A CA  1 ? 
ATOM   1187 C  C   . CYS A 1 162 ? -3.363  -23.156 22.902  1.000 9.074  0 162 CYS A C   1 ? 
ATOM   1188 O  O   . CYS A 1 162 ? -3.859  -24.227 23.238  1.000 9.276  0 162 CYS A O   1 ? 
ATOM   1189 C  CB  . CYS A 1 162 ? -3.814  -21.275 24.457  1.000 9.731  0 162 CYS A CB  1 ? 
ATOM   1190 S  SG  . CYS A 1 162 ? -4.313  -19.551 24.695  1.000 10.990 0 162 CYS A SG  1 ? 
ATOM   1191 N  N   . ALA A 1 163 ? -2.171  -23.088 22.328  1.000 8.483  0 163 ALA A N   1 ? 
ATOM   1192 C  CA  . ALA A 1 163 ? -1.308  -24.244 22.225  1.000 8.555  0 163 ALA A CA  1 ? 
ATOM   1193 C  C   . ALA A 1 163 ? 0.093   -23.716 22.355  1.000 8.912  0 163 ALA A C   1 ? 
ATOM   1194 O  O   . ALA A 1 163 ? 0.384   -22.630 21.881  1.000 9.649  0 163 ALA A O   1 ? 
ATOM   1195 C  CB  . ALA A 1 163 ? -1.523  -24.968 20.930  1.000 8.010  0 163 ALA A CB  1 ? 
ATOM   1196 N  N   . GLY A 1 164 ? 0.970   -24.494 23.001  1.000 9.652  0 164 GLY A N   1 ? 
ATOM   1197 C  CA  . GLY A 1 164 ? 2.323   -24.032 23.133  1.000 11.459 0 164 GLY A CA  1 ? 
ATOM   1198 C  C   . GLY A 1 164 ? 2.801   -24.314 24.545  1.000 13.325 0 164 GLY A C   1 ? 
ATOM   1199 O  O   . GLY A 1 164 ? 2.372   -25.295 25.151  1.000 13.183 0 164 GLY A O   1 ? 
ATOM   1200 N  N   . TYR A 1 165 ? 3.643   -23.415 25.025  1.000 14.362 0 165 TYR A N   1 ? 
ATOM   1201 C  CA  . TYR A 1 165 ? 4.462   -23.673 26.199  1.000 16.322 0 165 TYR A CA  1 ? 
ATOM   1202 C  C   . TYR A 1 165 ? 4.456   -22.392 26.997  1.000 16.897 0 165 TYR A C   1 ? 
ATOM   1203 O  O   . TYR A 1 165 ? 4.870   -21.365 26.482  1.000 17.761 0 165 TYR A O   1 ? 
ATOM   1204 C  CB  . TYR A 1 165 ? 5.875   -24.061 25.765  1.000 16.608 0 165 TYR A CB  1 ? 
ATOM   1205 C  CG  . TYR A 1 165 ? 5.932   -25.336 24.976  1.000 16.156 0 165 TYR A CG  1 ? 
ATOM   1206 C  CD1 . TYR A 1 165 ? 5.986   -26.563 25.615  1.000 17.002 0 165 TYR A CD1 1 ? 
ATOM   1207 C  CD2 . TYR A 1 165 ? 5.815   -25.335 23.599  1.000 16.295 0 165 TYR A CD2 1 ? 
ATOM   1208 C  CE1 . TYR A 1 165 ? 6.006   -27.753 24.916  1.000 18.041 0 165 TYR A CE1 1 ? 
ATOM   1209 C  CE2 . TYR A 1 165 ? 5.832   -26.520 22.886  1.000 16.667 0 165 TYR A CE2 1 ? 
ATOM   1210 C  CZ  . TYR A 1 165 ? 5.931   -27.730 23.538  1.000 16.228 0 165 TYR A CZ  1 ? 
ATOM   1211 O  OH  . TYR A 1 165 ? 5.925   -28.908 22.837  1.000 17.676 0 165 TYR A OH  1 ? 
ATOM   1212 N  N   . LEU A 1 166 ? 3.929   -22.465 28.215  1.000 17.505 0 166 LEU A N   1 ? 
ATOM   1213 C  CA  . LEU A 1 166 ? 3.845   -21.305 29.072  1.000 19.408 0 166 LEU A CA  1 ? 
ATOM   1214 C  C   . LEU A 1 166 ? 5.238   -20.837 29.479  1.000 19.310 0 166 LEU A C   1 ? 
ATOM   1215 O  O   . LEU A 1 166 ? 5.412   -19.659 29.748  1.000 20.181 0 166 LEU A O   1 ? 
ATOM   1216 C  CB  . LEU A 1 166 ? 2.994   -21.678 30.285  1.000 21.094 0 166 LEU A CB  1 ? 
ATOM   1217 C  CG  . LEU A 1 166 ? 1.523   -21.962 30.003  1.000 22.718 0 166 LEU A CG  1 ? 
ATOM   1218 C  CD1 . LEU A 1 166 ? 0.826   -22.398 31.288  1.000 24.625 0 166 LEU A CD1 1 ? 
ATOM   1219 C  CD2 . LEU A 1 166 ? 0.832   -20.747 29.414  1.000 23.022 0 166 LEU A CD2 1 ? 
ATOM   1220 N  N   . GLU A 1 167 ? 6.229   -21.739 29.468  1.000 18.775 0 167 GLU A N   1 ? 
ATOM   1221 C  CA  . GLU A 1 167 ? 7.579   -21.340 29.834  1.000 22.092 0 167 GLU A CA  1 ? 
ATOM   1222 C  C   . GLU A 1 167 ? 8.183   -20.478 28.736  1.000 22.764 0 167 GLU A C   1 ? 
ATOM   1223 O  O   . GLU A 1 167 ? 9.172   -19.794 28.970  1.000 24.986 0 167 GLU A O   1 ? 
ATOM   1224 C  CB  . GLU A 1 167 ? 8.468   -22.548 30.132  1.000 24.177 0 167 GLU A CB  1 ? 
ATOM   1225 C  CG  . GLU A 1 167 ? 8.441   -23.596 29.035  1.000 28.276 0 167 GLU A CG  1 ? 
ATOM   1226 C  CD  . GLU A 1 167 ? 7.400   -24.704 29.098  1.000 28.564 0 167 GLU A CD  1 ? 
ATOM   1227 O  OE1 . GLU A 1 167 ? 7.796   -25.845 28.831  1.000 35.334 0 167 GLU A OE1 1 ? 
ATOM   1228 O  OE2 . GLU A 1 167 ? 6.205   -24.443 29.333  1.000 23.685 0 167 GLU A OE2 1 ? 
ATOM   1229 N  N   . GLY A 1 168 ? 7.592   -20.518 27.540  1.000 21.797 0 168 GLY A N   1 ? 
ATOM   1230 C  CA  . GLY A 1 168 ? 8.116   -19.778 26.407  1.000 21.556 0 168 GLY A CA  1 ? 
ATOM   1231 C  C   . GLY A 1 168 ? 9.150   -20.600 25.646  1.000 20.072 0 168 GLY A C   1 ? 
ATOM   1232 O  O   . GLY A 1 168 ? 9.423   -21.750 25.966  1.000 23.417 0 168 GLY A O   1 ? 
ATOM   1233 N  N   . GLY A 1 169 ? 9.708   -19.989 24.611  1.000 19.108 0 169 GLY A N   1 ? 
ATOM   1234 C  CA  . GLY A 1 169 ? 10.824  -20.553 23.892  1.000 18.516 0 169 GLY A CA  1 ? 
ATOM   1235 C  C   . GLY A 1 169 ? 10.388  -21.250 22.606  1.000 16.259 0 169 GLY A C   1 ? 
ATOM   1236 O  O   . GLY A 1 169 ? 11.202  -21.464 21.731  1.000 15.424 0 169 GLY A O   1 ? 
ATOM   1237 N  N   . LYS A 1 170 ? 9.133   -21.676 22.540  1.000 13.997 0 170 LYS A N   1 ? 
ATOM   1238 C  CA  . LYS A 1 170 ? 8.641   -22.476 21.427  1.000 15.242 0 170 LYS A CA  1 ? 
ATOM   1239 C  C   . LYS A 1 170 ? 7.257   -21.971 21.062  1.000 12.311 0 170 LYS A C   1 ? 
ATOM   1240 O  O   . LYS A 1 170 ? 6.378   -21.900 21.899  1.000 11.687 0 170 LYS A O   1 ? 
ATOM   1241 C  CB  . LYS A 1 170 ? 8.553   -23.960 21.794  1.000 17.505 0 170 LYS A CB  1 ? 
ATOM   1242 C  CG  . LYS A 1 170 ? 9.885   -24.626 22.094  1.000 20.038 0 170 LYS A CG  1 ? 
ATOM   1243 C  CD  . LYS A 1 170 ? 9.751   -26.125 22.312  1.000 23.285 0 170 LYS A CD  1 ? 
ATOM   1244 C  CE  . LYS A 1 170 ? 9.266   -26.496 23.696  1.000 27.956 0 170 LYS A CE  1 ? 
ATOM   1245 N  NZ  . LYS A 1 170 ? 10.383  -26.619 24.675  1.000 33.836 0 170 LYS A NZ  1 ? 
ATOM   1246 N  N   . ASP A 1 171 ? 7.064   -21.613 19.794  1.000 10.288 0 171 ASP A N   1 ? 
ATOM   1247 C  CA  . ASP A 1 171 ? 5.837   -20.962 19.415  1.000 10.264 0 171 ASP A CA  1 ? 
ATOM   1248 C  C   . ASP A 1 171 ? 5.832   -20.791 17.900  1.000 10.346 0 171 ASP A C   1 ? 
ATOM   1249 O  O   . ASP A 1 171 ? 6.879   -20.806 17.244  1.000 10.473 0 171 ASP A O   1 ? 
ATOM   1250 C  CB  . ASP A 1 171 ? 5.690   -19.600 20.085  1.000 10.227 0 171 ASP A CB  1 ? 
ATOM   1251 C  CG  . ASP A 1 171 ? 4.318   -18.945 20.139  1.000 9.556  0 171 ASP A CG  1 ? 
ATOM   1252 O  OD1 . ASP A 1 171 ? 3.292   -19.570 19.731  1.000 8.669  0 171 ASP A OD1 1 ? 
ATOM   1253 O  OD2 . ASP A 1 171 ? 4.298   -17.779 20.584  1.000 10.444 0 171 ASP A OD2 1 ? 
ATOM   1254 N  N   . SER A 1 172 ? 4.638   -20.519 17.388  1.000 9.716  0 172 SER A N   1 ? 
ATOM   1255 C  CA  . SER A 1 172 ? 4.502   -19.974 16.051  1.000 9.202  0 172 SER A CA  1 ? 
ATOM   1256 C  C   . SER A 1 172 ? 4.747   -18.458 16.121  1.000 9.222  0 172 SER A C   1 ? 
ATOM   1257 O  O   . SER A 1 172 ? 4.905   -17.897 17.212  1.000 8.275  0 172 SER A O   1 ? 
ATOM   1258 C  CB  . SER A 1 172 ? 3.176   -20.400 15.429  1.000 9.592  0 172 SER A CB  1 ? 
ATOM   1259 O  OG  . SER A 1 172 ? 2.120   -19.872 16.170  1.000 9.523  0 172 SER A OG  1 ? 
ATOM   1260 N  N   . CYS A 1 173 ? 4.893   -17.818 14.959  1.000 10.486 0 173 CYS A N   1 ? 
ATOM   1261 C  CA  . CYS A 1 173 ? 5.264   -16.416 14.912  1.000 12.000 0 173 CYS A CA  1 ? 
ATOM   1262 C  C   . CYS A 1 173 ? 4.783   -15.778 13.602  1.000 13.008 0 173 CYS A C   1 ? 
ATOM   1263 O  O   . CYS A 1 173 ? 4.112   -16.425 12.793  1.000 11.352 0 173 CYS A O   1 ? 
ATOM   1264 C  CB  . CYS A 1 173 ? 6.764   -16.341 15.111  1.000 12.686 0 173 CYS A CB  1 ? 
ATOM   1265 S  SG  . CYS A 1 173 ? 7.405   -14.728 15.612  1.000 14.235 0 173 CYS A SG  1 ? 
ATOM   1266 N  N   . GLN A 1 174 ? 5.110   -14.488 13.448  1.000 14.307 0 174 GLN A N   1 ? 
ATOM   1267 C  CA  . GLN A 1 174 ? 4.794   -13.685 12.274  1.000 17.503 0 174 GLN A CA  1 ? 
ATOM   1268 C  C   . GLN A 1 174 ? 5.219   -14.487 11.042  1.000 14.125 0 174 GLN A C   1 ? 
ATOM   1269 O  O   . GLN A 1 174 ? 6.352   -14.956 11.001  1.000 13.263 0 174 GLN A O   1 ? 
ATOM   1270 C  CB  . GLN A 1 174 ? 5.579   -12.355 12.233  1.000 22.489 0 174 GLN A CB  1 ? 
ATOM   1271 C  CG  . GLN A 1 174 ? 5.985   -11.727 13.578  1.000 31.039 0 174 GLN A CG  1 ? 
ATOM   1272 C  CD  . GLN A 1 174 ? 7.399   -11.164 13.612  1.000 35.001 0 174 GLN A CD  1 ? 
ATOM   1273 O  OE1 . GLN A 1 174 ? 8.174   -11.434 14.528  1.000 42.379 0 174 GLN A OE1 1 ? 
ATOM   1274 N  NE2 . GLN A 1 174 ? 7.747   -10.335 12.639  1.000 42.861 0 174 GLN A NE2 1 ? 
ATOM   1275 N  N   . GLY A 1 175 ? 4.337   -14.593 10.047  1.000 11.166 0 175 GLY A N   1 ? 
ATOM   1276 C  CA  . GLY A 1 175 ? 4.661   -15.306 8.823   1.000 11.193 0 175 GLY A CA  1 ? 
ATOM   1277 C  C   . GLY A 1 175 ? 4.206   -16.769 8.850   1.000 10.410 0 175 GLY A C   1 ? 
ATOM   1278 O  O   . GLY A 1 175 ? 4.150   -17.403 7.801   1.000 9.623  0 175 GLY A O   1 ? 
ATOM   1279 N  N   . ASP A 1 176 ? 3.912   -17.306 10.056  1.000 8.982  0 176 ASP A N   1 ? 
ATOM   1280 C  CA  . ASP A 1 176 ? 3.255   -18.595 10.183  1.000 8.738  0 176 ASP A CA  1 ? 
ATOM   1281 C  C   . ASP A 1 176 ? 1.734   -18.486 10.116  1.000 7.812  0 176 ASP A C   1 ? 
ATOM   1282 O  O   . ASP A 1 176 ? 1.048   -19.513 9.991   1.000 7.118  0 176 ASP A O   1 ? 
ATOM   1283 C  CB  . ASP A 1 176 ? 3.585   -19.254 11.535  1.000 8.538  0 176 ASP A CB  1 ? 
ATOM   1284 C  CG  . ASP A 1 176 ? 5.044   -19.613 11.660  1.000 8.657  0 176 ASP A CG  1 ? 
ATOM   1285 O  OD1 . ASP A 1 176 ? 5.628   -20.072 10.618  1.000 8.455  0 176 ASP A OD1 1 ? 
ATOM   1286 O  OD2 . ASP A 1 176 ? 5.602   -19.376 12.744  1.000 9.485  0 176 ASP A OD2 1 ? 
ATOM   1287 N  N   . SER A 1 177 ? 1.232   -17.249 10.316  1.000 7.647  0 177 SER A N   1 ? 
ATOM   1288 C  CA  . SER A 1 177 ? -0.192  -16.917 10.313  1.000 8.289  0 177 SER A CA  1 ? 
ATOM   1289 C  C   . SER A 1 177 ? -0.897  -17.606 9.150   1.000 7.738  0 177 SER A C   1 ? 
ATOM   1290 O  O   . SER A 1 177 ? -0.381  -17.603 8.047   1.000 6.343  0 177 SER A O   1 ? 
ATOM   1291 C  CB  . SER A 1 177 ? -0.379  -15.447 10.188  1.000 11.162 0 177 SER A CB  1 ? 
ATOM   1292 O  OG  . SER A 1 177 ? 0.042   -14.750 11.335  1.000 13.428 0 177 SER A OG  1 ? 
ATOM   1293 N  N   . GLY A 1 178 ? -2.088  -18.145 9.426   1.000 7.298  0 178 GLY A N   1 ? 
ATOM   1294 C  CA  . GLY A 1 178 ? -2.910  -18.860 8.462   1.000 7.898  0 178 GLY A CA  1 ? 
ATOM   1295 C  C   . GLY A 1 178 ? -2.585  -20.351 8.360   1.000 8.080  0 178 GLY A C   1 ? 
ATOM   1296 O  O   . GLY A 1 178 ? -3.364  -21.133 7.794   1.000 8.966  0 178 GLY A O   1 ? 
ATOM   1297 N  N   . GLY A 1 179 ? -1.441  -20.725 8.902   1.000 7.631  0 179 GLY A N   1 ? 
ATOM   1298 C  CA  . GLY A 1 179 ? -0.947  -22.071 8.761   1.000 7.764  0 179 GLY A CA  1 ? 
ATOM   1299 C  C   . GLY A 1 179 ? -1.699  -23.074 9.632   1.000 8.122  0 179 GLY A C   1 ? 
ATOM   1300 O  O   . GLY A 1 179 ? -2.501  -22.748 10.516  1.000 7.629  0 179 GLY A O   1 ? 
ATOM   1301 N  N   . PRO A 1 180 ? -1.373  -24.355 9.445   1.000 8.289  0 180 PRO A N   1 ? 
ATOM   1302 C  CA  . PRO A 1 180 ? -2.059  -25.436 10.149  1.000 8.481  0 180 PRO A CA  1 ? 
ATOM   1303 C  C   . PRO A 1 180 ? -1.554  -25.738 11.544  1.000 8.469  0 180 PRO A C   1 ? 
ATOM   1304 O  O   . PRO A 1 180 ? -0.360  -25.677 11.841  1.000 8.477  0 180 PRO A O   1 ? 
ATOM   1305 C  CB  . PRO A 1 180 ? -1.738  -26.665 9.312   1.000 8.536  0 180 PRO A CB  1 ? 
ATOM   1306 C  CG  . PRO A 1 180 ? -0.455  -26.352 8.630   1.000 9.567  0 180 PRO A CG  1 ? 
ATOM   1307 C  CD  . PRO A 1 180 ? -0.426  -24.859 8.443   1.000 8.970  0 180 PRO A CD  1 ? 
ATOM   1308 N  N   . VAL A 1 181 ? -2.526  -26.089 12.370  1.000 9.507  0 181 VAL A N   1 ? 
ATOM   1309 C  CA  . VAL A 1 181 ? -2.324  -26.825 13.586  1.000 9.469  0 181 VAL A CA  1 ? 
ATOM   1310 C  C   . VAL A 1 181 ? -3.048  -28.146 13.390  1.000 9.308  0 181 VAL A C   1 ? 
ATOM   1311 O  O   . VAL A 1 181 ? -4.286  -28.156 13.359  1.000 8.837  0 181 VAL A O   1 ? 
ATOM   1312 C  CB  . VAL A 1 181 ? -2.885  -26.082 14.811  1.000 9.438  0 181 VAL A CB  1 ? 
ATOM   1313 C  CG1 . VAL A 1 181 ? -2.525  -26.808 16.093  1.000 9.952  0 181 VAL A CG1 1 ? 
ATOM   1314 C  CG2 . VAL A 1 181 ? -2.426  -24.626 14.827  1.000 9.975  0 181 VAL A CG2 1 ? 
ATOM   1315 N  N   . VAL A 1 182 ? -2.287  -29.218 13.245  1.000 8.975  0 182 VAL A N   1 ? 
ATOM   1316 C  CA  . VAL A 1 182 ? -2.867  -30.525 12.987  1.000 9.324  0 182 VAL A CA  1 ? 
ATOM   1317 C  C   . VAL A 1 182 ? -2.744  -31.387 14.241  1.000 10.212 0 182 VAL A C   1 ? 
ATOM   1318 O  O   . VAL A 1 182 ? -1.653  -31.589 14.761  1.000 10.590 0 182 VAL A O   1 ? 
ATOM   1319 C  CB  . VAL A 1 182 ? -2.223  -31.174 11.742  1.000 9.332  0 182 VAL A CB  1 ? 
ATOM   1320 C  CG1 . VAL A 1 182 ? -2.578  -32.656 11.647  1.000 8.955  0 182 VAL A CG1 1 ? 
ATOM   1321 C  CG2 . VAL A 1 182 ? -2.679  -30.438 10.500  1.000 9.464  0 182 VAL A CG2 1 ? 
ATOM   1322 N  N   . CYS A 1 183 ? -3.872  -31.964 14.682  1.000 10.313 0 183 CYS A N   1 ? 
ATOM   1323 C  CA  . CYS A 1 183 ? -3.844  -32.815 15.861  1.000 11.200 0 183 CYS A CA  1 ? 
ATOM   1324 C  C   . CYS A 1 183 ? -4.564  -34.103 15.510  1.000 12.286 0 183 CYS A C   1 ? 
ATOM   1325 O  O   . CYS A 1 183 ? -5.684  -34.072 15.014  1.000 12.632 0 183 CYS A O   1 ? 
ATOM   1326 C  CB  . CYS A 1 183 ? -4.486  -32.179 17.094  1.000 10.662 0 183 CYS A CB  1 ? 
ATOM   1327 S  SG  . CYS A 1 183 ? -4.298  -30.390 17.206  1.000 11.883 0 183 CYS A SG  1 ? 
ATOM   1328 N  N   . SER A 1 184 ? -3.876  -35.237 15.722  1.000 14.425 0 184 SER A N   1 ? 
ATOM   1329 C  CA  . SER A 1 184 ? -4.445  -36.546 15.437  1.000 15.630 0 184 SER A CA  1 ? 
ATOM   1330 C  C   . SER A 1 184 ? -4.939  -36.594 13.988  1.000 15.254 0 184 SER A C   1 ? 
ATOM   1331 O  O   . SER A 1 184 ? -6.022  -37.093 13.702  1.000 18.671 0 184 SER A O   1 ? 
ATOM   1332 C  CB  . SER A 1 184 ? -5.552  -36.894 16.420  1.000 20.007 0 184 SER A CB  1 ? 
ATOM   1333 O  OG  . SER A 1 184 ? -5.196  -36.510 17.747  1.000 23.285 0 184 SER A OG  1 ? 
ATOM   1334 N  N   . GLY A 1 185 ? -4.127  -36.048 13.085  1.000 13.342 0 185 GLY A N   1 ? 
ATOM   1335 C  CA  . GLY A 1 185 ? -4.358  -36.088 11.646  1.000 14.577 0 185 GLY A CA  1 ? 
ATOM   1336 C  C   . GLY A 1 185 ? -5.542  -35.250 11.153  1.000 13.695 0 185 GLY A C   1 ? 
ATOM   1337 O  O   . GLY A 1 185 ? -5.984  -35.445 10.024  1.000 16.448 0 185 GLY A O   1 ? 
ATOM   1338 N  N   . LYS A 1 186 ? -6.059  -34.320 11.960  1.000 13.065 0 186 LYS A N   1 ? 
ATOM   1339 C  CA  . LYS A 1 186 ? -7.147  -33.441 11.542  1.000 12.690 0 186 LYS A CA  1 ? 
ATOM   1340 C  C   . LYS A 1 186 ? -6.672  -32.002 11.687  1.000 11.448 0 186 LYS A C   1 ? 
ATOM   1341 O  O   . LYS A 1 186 ? -5.932  -31.692 12.600  1.000 10.687 0 186 LYS A O   1 ? 
ATOM   1342 C  CB  . LYS A 1 186 ? -8.397  -33.615 12.414  1.000 15.324 0 186 LYS A CB  1 ? 
ATOM   1343 C  CG  . LYS A 1 186 ? -8.981  -35.024 12.481  1.000 18.902 0 186 LYS A CG  1 ? 
ATOM   1344 C  CD  . LYS A 1 186 ? -9.351  -35.588 11.153  1.000 21.879 0 186 LYS A CD  1 ? 
ATOM   1345 C  CE  . LYS A 1 186 ? -10.127 -36.876 11.317  1.000 26.916 0 186 LYS A CE  1 ? 
ATOM   1346 N  NZ  . LYS A 1 186 ? -10.522 -37.431 10.002  1.000 31.453 0 186 LYS A NZ  1 ? 
ATOM   1347 N  N   . LEU A 1 187 ? -7.165  -31.103 10.833  1.000 10.538 0 187 LEU A N   1 ? 
ATOM   1348 C  CA  . LEU A 1 187 ? -6.867  -29.686 10.994  1.000 10.987 0 187 LEU A CA  1 ? 
ATOM   1349 C  C   . LEU A 1 187 ? -7.707  -29.113 12.130  1.000 10.938 0 187 LEU A C   1 ? 
ATOM   1350 O  O   . LEU A 1 187 ? -8.906  -28.945 11.963  1.000 11.044 0 187 LEU A O   1 ? 
ATOM   1351 C  CB  . LEU A 1 187 ? -7.201  -28.991 9.678   1.000 10.699 0 187 LEU A CB  1 ? 
ATOM   1352 C  CG  . LEU A 1 187 ? -6.946  -27.486 9.688   1.000 10.367 0 187 LEU A CG  1 ? 
ATOM   1353 C  CD1 . LEU A 1 187 ? -5.444  -27.229 9.820   1.000 10.117 0 187 LEU A CD1 1 ? 
ATOM   1354 C  CD2 . LEU A 1 187 ? -7.495  -26.853 8.416   1.000 10.873 0 187 LEU A CD2 1 ? 
ATOM   1355 N  N   . GLN A 1 188 ? -7.099  -28.810 13.283  1.000 10.771 0 188 GLN A N   1 ? 
ATOM   1356 C  CA  . GLN A 1 188 ? -7.870  -28.331 14.416  1.000 10.561 0 188 GLN A CA  1 ? 
ATOM   1357 C  C   . GLN A 1 188 ? -7.660  -26.843 14.647  1.000 10.355 0 188 GLN A C   1 ? 
ATOM   1358 O  O   . GLN A 1 188 ? -8.437  -26.212 15.331  1.000 9.151  0 188 GLN A O   1 ? 
ATOM   1359 C  CB  . GLN A 1 188 ? -7.502  -29.110 15.676  1.000 11.747 0 188 GLN A CB  1 ? 
ATOM   1360 C  CG  . GLN A 1 188 ? -7.927  -30.558 15.603  1.000 12.408 0 188 GLN A CG  1 ? 
ATOM   1361 C  CD  . GLN A 1 188 ? -9.401  -30.737 15.864  1.000 13.366 0 188 GLN A CD  1 ? 
ATOM   1362 O  OE1 . GLN A 1 188 ? -10.157 -29.778 16.010  1.000 16.612 0 188 GLN A OE1 1 ? 
ATOM   1363 N  NE2 . GLN A 1 188 ? -9.795  -31.993 16.025  1.000 13.823 0 188 GLN A NE2 1 ? 
ATOM   1364 N  N   . GLY A 1 189 ? -6.603  -26.290 14.064  1.000 9.075  0 189 GLY A N   1 ? 
ATOM   1365 C  CA  . GLY A 1 189 ? -6.275  -24.919 14.363  1.000 8.533  0 189 GLY A CA  1 ? 
ATOM   1366 C  C   . GLY A 1 189 ? -5.703  -24.196 13.155  1.000 8.498  0 189 GLY A C   1 ? 
ATOM   1367 O  O   . GLY A 1 189 ? -5.237  -24.817 12.199  1.000 8.385  0 189 GLY A O   1 ? 
ATOM   1368 N  N   . ILE A 1 190 ? -5.826  -22.886 13.218  1.000 8.302  0 190 ILE A N   1 ? 
ATOM   1369 C  CA  . ILE A 1 190 ? -5.170  -21.985 12.290  1.000 7.768  0 190 ILE A CA  1 ? 
ATOM   1370 C  C   . ILE A 1 190 ? -4.334  -21.012 13.108  1.000 7.518  0 190 ILE A C   1 ? 
ATOM   1371 O  O   . ILE A 1 190 ? -4.845  -20.366 14.033  1.000 8.853  0 190 ILE A O   1 ? 
ATOM   1372 C  CB  . ILE A 1 190 ? -6.209  -21.231 11.446  1.000 7.774  0 190 ILE A CB  1 ? 
ATOM   1373 C  CG1 . ILE A 1 190 ? -7.143  -22.166 10.671  1.000 8.032  0 190 ILE A CG1 1 ? 
ATOM   1374 C  CG2 . ILE A 1 190 ? -5.503  -20.273 10.522  1.000 7.910  0 190 ILE A CG2 1 ? 
ATOM   1375 C  CD1 . ILE A 1 190 ? -8.396  -21.492 10.239  1.000 9.003  0 190 ILE A CD1 1 ? 
ATOM   1376 N  N   . VAL A 1 191 ? -3.078  -20.836 12.682  1.000 7.164  0 191 VAL A N   1 ? 
ATOM   1377 C  CA  . VAL A 1 191 ? -2.198  -19.875 13.325  1.000 6.950  0 191 VAL A CA  1 ? 
ATOM   1378 C  C   . VAL A 1 191 ? -2.871  -18.502 13.232  1.000 6.883  0 191 VAL A C   1 ? 
ATOM   1379 O  O   . VAL A 1 191 ? -3.047  -17.961 12.152  1.000 6.182  0 191 VAL A O   1 ? 
ATOM   1380 C  CB  . VAL A 1 191 ? -0.784  -19.933 12.712  1.000 7.283  0 191 VAL A CB  1 ? 
ATOM   1381 C  CG1 . VAL A 1 191 ? 0.106   -18.891 13.344  1.000 7.684  0 191 VAL A CG1 1 ? 
ATOM   1382 C  CG2 . VAL A 1 191 ? -0.152  -21.310 12.775  1.000 7.541  0 191 VAL A CG2 1 ? 
ATOM   1383 N  N   . SER A 1 192 ? -3.184  -17.925 14.401  1.000 6.081  0 192 SER A N   1 ? 
ATOM   1384 C  CA  . SER A 1 192 ? -3.947  -16.687 14.430  1.000 6.788  0 192 SER A CA  1 ? 
ATOM   1385 C  C   . SER A 1 192 ? -3.174  -15.553 15.077  1.000 7.421  0 192 SER A C   1 ? 
ATOM   1386 O  O   . SER A 1 192 ? -2.784  -14.600 14.431  1.000 7.712  0 192 SER A O   1 ? 
ATOM   1387 C  CB  . SER A 1 192 ? -5.211  -16.964 15.086  1.000 6.795  0 192 SER A CB  1 ? 
ATOM   1388 O  OG  . SER A 1 192 ? -6.049  -15.849 15.051  1.000 6.293  0 192 SER A OG  1 ? 
ATOM   1389 N  N   . TRP A 1 193 ? -2.948  -15.620 16.388  1.000 7.583  0 193 TRP A N   1 ? 
ATOM   1390 C  CA  . TRP A 1 193 ? -2.283  -14.494 16.999  1.000 8.501  0 193 TRP A CA  1 ? 
ATOM   1391 C  C   . TRP A 1 193 ? -1.532  -14.912 18.259  1.000 9.133  0 193 TRP A C   1 ? 
ATOM   1392 O  O   . TRP A 1 193 ? -1.472  -16.057 18.632  1.000 7.639  0 193 TRP A O   1 ? 
ATOM   1393 C  CB  . TRP A 1 193 ? -3.286  -13.362 17.252  1.000 8.959  0 193 TRP A CB  1 ? 
ATOM   1394 C  CG  . TRP A 1 193 ? -4.404  -13.665 18.186  1.000 9.789  0 193 TRP A CG  1 ? 
ATOM   1395 C  CD1 . TRP A 1 193 ? -5.576  -14.301 17.890  1.000 10.576 0 193 TRP A CD1 1 ? 
ATOM   1396 C  CD2 . TRP A 1 193 ? -4.489  -13.306 19.580  1.000 11.513 0 193 TRP A CD2 1 ? 
ATOM   1397 N  NE1 . TRP A 1 193 ? -6.388  -14.352 18.997  1.000 10.481 0 193 TRP A NE1 1 ? 
ATOM   1398 C  CE2 . TRP A 1 193 ? -5.754  -13.732 20.040  1.000 11.069 0 193 TRP A CE2 1 ? 
ATOM   1399 C  CE3 . TRP A 1 193 ? -3.640  -12.609 20.453  1.000 12.642 0 193 TRP A CE3 1 ? 
ATOM   1400 C  CZ2 . TRP A 1 193 ? -6.178  -13.535 21.362  1.000 12.168 0 193 TRP A CZ2 1 ? 
ATOM   1401 C  CZ3 . TRP A 1 193 ? -4.055  -12.421 21.751  1.000 12.996 0 193 TRP A CZ3 1 ? 
ATOM   1402 C  CH2 . TRP A 1 193 ? -5.307  -12.867 22.188  1.000 13.039 0 193 TRP A CH2 1 ? 
ATOM   1403 N  N   . GLY A 1 194 ? -0.989  -13.911 18.942  1.000 10.115 0 194 GLY A N   1 ? 
ATOM   1404 C  CA  . GLY A 1 194 ? -0.242  -14.165 20.162  1.000 11.962 0 194 GLY A CA  1 ? 
ATOM   1405 C  C   . GLY A 1 194 ? 0.470   -12.880 20.543  1.000 14.431 0 194 GLY A C   1 ? 
ATOM   1406 O  O   . GLY A 1 194 ? 0.494   -11.932 19.757  1.000 17.523 0 194 GLY A O   1 ? 
ATOM   1407 N  N   . SER A 1 195 ? 0.943   -12.771 21.777  1.000 14.738 0 195 SER A N   1 ? 
ATOM   1408 C  CA  . SER A 1 195 ? 1.629   -11.544 22.135  1.000 15.678 0 195 SER A CA  1 ? 
ATOM   1409 C  C   . SER A 1 195 ? 3.128   -11.793 21.980  1.000 16.404 0 195 SER A C   1 ? 
ATOM   1410 O  O   . SER A 1 195 ? 3.738   -12.512 22.773  1.000 15.996 0 195 SER A O   1 ? 
ATOM   1411 C  CB  . SER A 1 195 ? 1.226   -11.087 23.509  1.000 16.752 0 195 SER A CB  1 ? 
ATOM   1412 O  OG  . SER A 1 195 ? 1.950   -9.914  23.832  1.000 21.036 0 195 SER A OG  1 ? 
ATOM   1413 N  N   . GLY A 1 196 ? 3.679   -11.251 20.894  1.000 14.964 0 196 GLY A N   1 ? 
ATOM   1414 C  CA  . GLY A 1 196 ? 5.018   -11.574 20.454  1.000 14.762 0 196 GLY A CA  1 ? 
ATOM   1415 C  C   . GLY A 1 196 ? 5.031   -13.036 20.030  1.000 14.233 0 196 GLY A C   1 ? 
ATOM   1416 O  O   . GLY A 1 196 ? 3.972   -13.585 19.709  1.000 13.962 0 196 GLY A O   1 ? 
ATOM   1417 N  N   . CYS A 1 197 ? 6.215   -13.643 20.104  1.000 13.471 0 197 CYS A N   1 ? 
ATOM   1418 C  CA  . CYS A 1 197 ? 6.396   -15.054 19.846  1.000 14.549 0 197 CYS A CA  1 ? 
ATOM   1419 C  C   . CYS A 1 197 ? 7.252   -15.660 20.952  1.000 13.994 0 197 CYS A C   1 ? 
ATOM   1420 O  O   . CYS A 1 197 ? 8.286   -15.085 21.318  1.000 15.079 0 197 CYS A O   1 ? 
ATOM   1421 C  CB  . CYS A 1 197 ? 7.084   -15.272 18.509  1.000 14.487 0 197 CYS A CB  1 ? 
ATOM   1422 S  SG  . CYS A 1 197 ? 6.279   -14.269 17.234  1.000 15.103 0 197 CYS A SG  1 ? 
ATOM   1423 N  N   . ALA A 1 198 ? 6.816   -16.819 21.439  1.000 12.819 0 198 ALA A N   1 ? 
ATOM   1424 C  CA  . ALA A 1 198 ? 7.623   -17.658 22.320  1.000 14.296 0 198 ALA A CA  1 ? 
ATOM   1425 C  C   . ALA A 1 198 ? 7.929   -16.933 23.633  1.000 15.275 0 198 ALA A C   1 ? 
ATOM   1426 O  O   . ALA A 1 198 ? 8.916   -17.286 24.305  1.000 16.295 0 198 ALA A O   1 ? 
ATOM   1427 C  CB  . ALA A 1 198 ? 8.890   -18.112 21.642  1.000 14.200 0 198 ALA A CB  1 ? 
ATOM   1428 N  N   . GLN A 1 199 ? 7.048   -15.994 24.015  1.000 16.668 0 199 GLN A N   1 ? 
ATOM   1429 C  CA  . GLN A 1 199 ? 7.213   -15.255 25.253  1.000 17.865 0 199 GLN A CA  1 ? 
ATOM   1430 C  C   . GLN A 1 199 ? 6.649   -16.088 26.397  1.000 16.788 0 199 GLN A C   1 ? 
ATOM   1431 O  O   . GLN A 1 199 ? 5.688   -16.814 26.234  1.000 14.443 0 199 GLN A O   1 ? 
ATOM   1432 C  CB  . GLN A 1 199 ? 6.552   -13.879 25.141  1.000 19.329 0 199 GLN A CB  1 ? 
ATOM   1433 C  CG  . GLN A 1 199 ? 7.174   -12.989 24.073  1.000 22.054 0 199 GLN A CG  1 ? 
ATOM   1434 C  CD  . GLN A 1 199 ? 8.661   -12.821 24.255  1.000 25.858 0 199 GLN A CD  1 ? 
ATOM   1435 O  OE1 . GLN A 1 199 ? 9.110   -12.189 25.211  1.000 26.727 0 199 GLN A OE1 1 ? 
ATOM   1436 N  NE2 . GLN A 1 199 ? 9.442   -13.408 23.351  1.000 27.318 0 199 GLN A NE2 1 ? 
ATOM   1437 N  N   . LYS A 1 200 ? 7.226   -15.934 27.589  1.000 18.470 0 200 LYS A N   1 ? 
ATOM   1438 C  CA  . LYS A 1 200 ? 6.735   -16.625 28.769  1.000 20.095 0 200 LYS A CA  1 ? 
ATOM   1439 C  C   . LYS A 1 200 ? 5.310   -16.156 29.056  1.000 17.586 0 200 LYS A C   1 ? 
ATOM   1440 O  O   . LYS A 1 200 ? 5.004   -14.989 28.892  1.000 18.322 0 200 LYS A O   1 ? 
ATOM   1441 C  CB  . LYS A 1 200 ? 7.764   -16.364 29.881  1.000 25.139 0 200 LYS A CB  1 ? 
ATOM   1442 C  CG  . LYS A 1 200 ? 7.402   -16.805 31.285  1.000 30.738 0 200 LYS A CG  1 ? 
ATOM   1443 C  CD  . LYS A 1 200 ? 8.409   -16.248 32.286  1.000 36.184 0 200 LYS A CD  1 ? 
ATOM   1444 C  CE  . LYS A 1 200 ? 7.869   -16.187 33.697  1.000 42.554 0 200 LYS A CE  1 ? 
ATOM   1445 N  NZ  . LYS A 1 200 ? 7.554   -17.550 34.184  1.000 45.113 0 200 LYS A NZ  1 ? 
ATOM   1446 N  N   . ASN A 1 201 ? 4.423   -17.107 29.360  1.000 17.068 0 201 ASN A N   1 ? 
ATOM   1447 C  CA  . ASN A 1 201 ? 3.025   -16.884 29.708  1.000 18.482 0 201 ASN A CA  1 ? 
ATOM   1448 C  C   . ASN A 1 201 ? 2.193   -16.304 28.557  1.000 16.262 0 201 ASN A C   1 ? 
ATOM   1449 O  O   . ASN A 1 201 ? 1.097   -15.826 28.801  1.000 15.650 0 201 ASN A O   1 ? 
ATOM   1450 C  CB  . ASN A 1 201 ? 2.890   -16.015 30.966  1.000 22.630 0 201 ASN A CB  1 ? 
ATOM   1451 C  CG  . ASN A 1 201 ? 3.482   -16.659 32.206  1.000 27.546 0 201 ASN A CG  1 ? 
ATOM   1452 O  OD1 . ASN A 1 201 ? 4.250   -16.034 32.936  1.000 35.703 0 201 ASN A OD1 1 ? 
ATOM   1453 N  ND2 . ASN A 1 201 ? 3.116   -17.902 32.465  1.000 30.731 0 201 ASN A ND2 1 ? 
ATOM   1454 N  N   . LYS A 1 202 ? 2.704   -16.347 27.317  1.000 15.343 0 202 LYS A N   1 ? 
ATOM   1455 C  CA  . LYS A 1 202 ? 1.989   -15.837 26.167  1.000 13.858 0 202 LYS A CA  1 ? 
ATOM   1456 C  C   . LYS A 1 202 ? 2.012   -16.904 25.069  1.000 14.578 0 202 LYS A C   1 ? 
ATOM   1457 O  O   . LYS A 1 202 ? 2.763   -16.822 24.111  1.000 12.004 0 202 LYS A O   1 ? 
ATOM   1458 C  CB  . LYS A 1 202 ? 2.576   -14.502 25.712  1.000 16.510 0 202 LYS A CB  1 ? 
ATOM   1459 C  CG  . LYS A 1 202 ? 2.447   -13.408 26.750  1.000 17.094 0 202 LYS A CG  1 ? 
ATOM   1460 C  CD  . LYS A 1 202 ? 1.039   -12.963 26.980  1.000 20.830 0 202 LYS A CD  1 ? 
ATOM   1461 C  CE  . LYS A 1 202 ? 0.878   -12.119 28.217  1.000 22.558 0 202 LYS A CE  1 ? 
ATOM   1462 N  NZ  . LYS A 1 202 ? -0.466  -11.492 28.196  1.000 26.166 0 202 LYS A NZ  1 ? 
ATOM   1463 N  N   . PRO A 1 203 ? 1.213   -17.983 25.201  1.000 13.166 0 203 PRO A N   1 ? 
ATOM   1464 C  CA  . PRO A 1 203 ? 1.228   -19.024 24.176  1.000 12.388 0 203 PRO A CA  1 ? 
ATOM   1465 C  C   . PRO A 1 203 ? 0.569   -18.541 22.888  1.000 11.343 0 203 PRO A C   1 ? 
ATOM   1466 O  O   . PRO A 1 203 ? -0.040  -17.477 22.849  1.000 11.655 0 203 PRO A O   1 ? 
ATOM   1467 C  CB  . PRO A 1 203 ? 0.444   -20.157 24.830  1.000 13.270 0 203 PRO A CB  1 ? 
ATOM   1468 C  CG  . PRO A 1 203 ? -0.498  -19.466 25.762  1.000 14.868 0 203 PRO A CG  1 ? 
ATOM   1469 C  CD  . PRO A 1 203 ? 0.245   -18.249 26.264  1.000 13.718 0 203 PRO A CD  1 ? 
ATOM   1470 N  N   . GLY A 1 204 ? 0.704   -19.329 21.836  1.000 11.108 0 204 GLY A N   1 ? 
ATOM   1471 C  CA  . GLY A 1 204 ? -0.000  -19.037 20.594  1.000 9.829  0 204 GLY A CA  1 ? 
ATOM   1472 C  C   . GLY A 1 204 ? -1.498  -19.239 20.735  1.000 8.793  0 204 GLY A C   1 ? 
ATOM   1473 O  O   . GLY A 1 204 ? -1.947  -20.140 21.449  1.000 8.829  0 204 GLY A O   1 ? 
ATOM   1474 N  N   . VAL A 1 205 ? -2.265  -18.357 20.079  1.000 7.975  0 205 VAL A N   1 ? 
ATOM   1475 C  CA  . VAL A 1 205 ? -3.705  -18.492 20.003  1.000 7.776  0 205 VAL A CA  1 ? 
ATOM   1476 C  C   . VAL A 1 205 ? -4.084  -18.895 18.573  1.000 7.476  0 205 VAL A C   1 ? 
ATOM   1477 O  O   . VAL A 1 205 ? -3.531  -18.369 17.607  1.000 7.832  0 205 VAL A O   1 ? 
ATOM   1478 C  CB  . VAL A 1 205 ? -4.412  -17.196 20.445  1.000 8.168  0 205 VAL A CB  1 ? 
ATOM   1479 C  CG1 . VAL A 1 205 ? -5.916  -17.313 20.543  1.000 8.936  0 205 VAL A CG1 1 ? 
ATOM   1480 C  CG2 . VAL A 1 205 ? -3.846  -16.652 21.753  1.000 8.416  0 205 VAL A CG2 1 ? 
ATOM   1481 N  N   . TYR A 1 206 ? -5.012  -19.865 18.471  1.000 6.903  0 206 TYR A N   1 ? 
ATOM   1482 C  CA  . TYR A 1 206 ? -5.338  -20.519 17.211  1.000 7.070  0 206 TYR A CA  1 ? 
ATOM   1483 C  C   . TYR A 1 206 ? -6.860  -20.435 17.026  1.000 7.793  0 206 TYR A C   1 ? 
ATOM   1484 O  O   . TYR A 1 206 ? -7.693  -20.594 17.932  1.000 7.716  0 206 TYR A O   1 ? 
ATOM   1485 C  CB  . TYR A 1 206 ? -4.750  -21.943 17.190  1.000 6.973  0 206 TYR A CB  1 ? 
ATOM   1486 C  CG  . TYR A 1 206 ? -3.260  -21.960 17.378  1.000 7.236  0 206 TYR A CG  1 ? 
ATOM   1487 C  CD1 . TYR A 1 206 ? -2.430  -21.724 16.310  1.000 6.786  0 206 TYR A CD1 1 ? 
ATOM   1488 C  CD2 . TYR A 1 206 ? -2.677  -22.061 18.640  1.000 6.965  0 206 TYR A CD2 1 ? 
ATOM   1489 C  CE1 . TYR A 1 206 ? -1.068  -21.636 16.442  1.000 7.376  0 206 TYR A CE1 1 ? 
ATOM   1490 C  CE2 . TYR A 1 206 ? -1.304  -21.939 18.801  1.000 7.238  0 206 TYR A CE2 1 ? 
ATOM   1491 C  CZ  . TYR A 1 206 ? -0.489  -21.789 17.688  1.000 7.797  0 206 TYR A CZ  1 ? 
ATOM   1492 O  OH  . TYR A 1 206 ? 0.852   -21.652 17.754  1.000 7.805  0 206 TYR A OH  1 ? 
ATOM   1493 N  N   . THR A 1 207 ? -7.243  -20.200 15.787  1.000 7.435  0 207 THR A N   1 ? 
ATOM   1494 C  CA  . THR A 1 207 ? -8.626  -20.326 15.413  1.000 7.508  0 207 THR A CA  1 ? 
ATOM   1495 C  C   . THR A 1 207 ? -9.039  -21.773 15.635  1.000 7.848  0 207 THR A C   1 ? 
ATOM   1496 O  O   . THR A 1 207 ? -8.386  -22.694 15.150  1.000 7.958  0 207 THR A O   1 ? 
ATOM   1497 C  CB  . THR A 1 207 ? -8.844  -19.855 13.965  1.000 7.377  0 207 THR A CB  1 ? 
ATOM   1498 O  OG1 . THR A 1 207 ? -8.286  -18.543 13.818  1.000 6.923  0 207 THR A OG1 1 ? 
ATOM   1499 C  CG2 . THR A 1 207 ? -10.301 -19.951 13.600  1.000 7.474  0 207 THR A CG2 1 ? 
ATOM   1500 N  N   . LYS A 1 208 ? -10.232 -21.947 16.215  1.000 8.813  0 208 LYS A N   1 ? 
ATOM   1501 C  CA  . LYS A 1 208 ? -10.750 -23.256 16.575  1.000 9.883  0 208 LYS A CA  1 ? 
ATOM   1502 C  C   . LYS A 1 208 ? -11.569 -23.821 15.417  1.000 9.160  0 208 LYS A C   1 ? 
ATOM   1503 O  O   . LYS A 1 208 ? -12.781 -23.672 15.353  1.000 8.585  0 208 LYS A O   1 ? 
ATOM   1504 C  CB  . LYS A 1 208 ? -11.575 -23.140 17.859  1.000 11.334 0 208 LYS A CB  1 ? 
ATOM   1505 C  CG  . LYS A 1 208 ? -12.037 -24.495 18.362  1.000 12.975 0 208 LYS A CG  1 ? 
ATOM   1506 C  CD  . LYS A 1 208 ? -12.886 -24.435 19.588  1.000 15.435 0 208 LYS A CD  1 ? 
ATOM   1507 C  CE  . LYS A 1 208 ? -12.189 -23.885 20.794  1.000 17.972 0 208 LYS A CE  1 ? 
ATOM   1508 N  NZ  . LYS A 1 208 ? -13.083 -23.990 21.974  1.000 21.278 0 208 LYS A NZ  1 ? 
ATOM   1509 N  N   . VAL A 1 209 ? -10.887 -24.515 14.495  1.000 8.934  0 209 VAL A N   1 ? 
ATOM   1510 C  CA  . VAL A 1 209 ? -11.455 -24.997 13.251  1.000 8.687  0 209 VAL A CA  1 ? 
ATOM   1511 C  C   . VAL A 1 209 ? -12.722 -25.830 13.449  1.000 8.703  0 209 VAL A C   1 ? 
ATOM   1512 O  O   . VAL A 1 209 ? -13.614 -25.749 12.634  1.000 8.758  0 209 VAL A O   1 ? 
ATOM   1513 C  CB  . VAL A 1 209 ? -10.400 -25.730 12.406  1.000 9.083  0 209 VAL A CB  1 ? 
ATOM   1514 C  CG1 . VAL A 1 209 ? -11.038 -26.407 11.220  1.000 9.129  0 209 VAL A CG1 1 ? 
ATOM   1515 C  CG2 . VAL A 1 209 ? -9.297  -24.768 11.990  1.000 9.124  0 209 VAL A CG2 1 ? 
ATOM   1516 N  N   . CYS A 1 210 ? -12.848 -26.566 14.547  1.000 9.353  0 210 CYS A N   1 ? 
ATOM   1517 C  CA  . CYS A 1 210 ? -13.981 -27.473 14.628  1.000 9.796  0 210 CYS A CA  1 ? 
ATOM   1518 C  C   . CYS A 1 210 ? -15.304 -26.710 14.732  1.000 9.704  0 210 CYS A C   1 ? 
ATOM   1519 O  O   . CYS A 1 210 ? -16.340 -27.326 14.456  1.000 11.616 0 210 CYS A O   1 ? 
ATOM   1520 C  CB  . CYS A 1 210 ? -13.857 -28.422 15.792  1.000 10.794 0 210 CYS A CB  1 ? 
ATOM   1521 S  SG  . CYS A 1 210 ? -13.710 -27.547 17.355  1.000 11.752 0 210 CYS A SG  1 ? 
ATOM   1522 N  N   . ASN A 1 211 ? -15.273 -25.415 15.091  1.000 10.030 0 211 ASN A N   1 ? 
ATOM   1523 C  CA  . ASN A 1 211 ? -16.462 -24.576 15.162  1.000 10.541 0 211 ASN A CA  1 ? 
ATOM   1524 C  C   . ASN A 1 211 ? -16.958 -24.149 13.772  1.000 10.915 0 211 ASN A C   1 ? 
ATOM   1525 O  O   . ASN A 1 211 ? -18.084 -23.663 13.660  1.000 11.777 0 211 ASN A O   1 ? 
ATOM   1526 C  CB  . ASN A 1 211 ? -16.197 -23.350 16.050  1.000 10.633 0 211 ASN A CB  1 ? 
ATOM   1527 C  CG  . ASN A 1 211 ? -16.114 -23.710 17.518  1.000 11.677 0 211 ASN A CG  1 ? 
ATOM   1528 O  OD1 . ASN A 1 211 ? -16.318 -24.856 17.895  1.000 13.430 0 211 ASN A OD1 1 ? 
ATOM   1529 N  ND2 . ASN A 1 211 ? -15.870 -22.717 18.344  1.000 12.333 0 211 ASN A ND2 1 ? 
ATOM   1530 N  N   . TYR A 1 212 ? -16.160 -24.368 12.719  1.000 9.741  0 212 TYR A N   1 ? 
ATOM   1531 C  CA  . TYR A 1 212 ? -16.362 -23.774 11.403  1.000 9.038  0 212 TYR A CA  1 ? 
ATOM   1532 C  C   . TYR A 1 212 ? -16.658 -24.804 10.332  1.000 9.846  0 212 TYR A C   1 ? 
ATOM   1533 O  O   . TYR A 1 212 ? -16.787 -24.444 9.163   1.000 9.004  0 212 TYR A O   1 ? 
ATOM   1534 C  CB  . TYR A 1 212 ? -15.151 -22.955 10.970  1.000 9.534  0 212 TYR A CB  1 ? 
ATOM   1535 C  CG  . TYR A 1 212 ? -14.952 -21.811 11.933  1.000 9.979  0 212 TYR A CG  1 ? 
ATOM   1536 C  CD1 . TYR A 1 212 ? -15.743 -20.687 11.843  1.000 10.650 0 212 TYR A CD1 1 ? 
ATOM   1537 C  CD2 . TYR A 1 212 ? -13.992 -21.873 12.926  1.000 10.457 0 212 TYR A CD2 1 ? 
ATOM   1538 C  CE1 . TYR A 1 212 ? -15.636 -19.654 12.750  1.000 10.465 0 212 TYR A CE1 1 ? 
ATOM   1539 C  CE2 . TYR A 1 212 ? -13.864 -20.859 13.856  1.000 10.264 0 212 TYR A CE2 1 ? 
ATOM   1540 C  CZ  . TYR A 1 212 ? -14.670 -19.744 13.742  1.000 10.707 0 212 TYR A CZ  1 ? 
ATOM   1541 O  OH  . TYR A 1 212 ? -14.560 -18.734 14.632  1.000 11.049 0 212 TYR A OH  1 ? 
ATOM   1542 N  N   . VAL A 1 213 ? -16.719 -26.087 10.710  1.000 10.706 0 213 VAL A N   1 ? 
ATOM   1543 C  CA  . VAL A 1 213 ? -16.817 -27.120 9.700   1.000 11.614 0 213 VAL A CA  1 ? 
ATOM   1544 C  C   . VAL A 1 213 ? -18.109 -26.944 8.893   1.000 12.321 0 213 VAL A C   1 ? 
ATOM   1545 O  O   . VAL A 1 213 ? -18.116 -27.105 7.677   1.000 12.227 0 213 VAL A O   1 ? 
ATOM   1546 C  CB  . VAL A 1 213 ? -16.708 -28.512 10.338  1.000 12.374 0 213 VAL A CB  1 ? 
ATOM   1547 C  CG1 . VAL A 1 213 ? -17.083 -29.577 9.326   1.000 14.001 0 213 VAL A CG1 1 ? 
ATOM   1548 C  CG2 . VAL A 1 213 ? -15.310 -28.741 10.867  1.000 13.656 0 213 VAL A CG2 1 ? 
ATOM   1549 N  N   . SER A 1 214 ? -19.204 -26.637 9.575   1.000 11.594 0 214 SER A N   1 ? 
ATOM   1550 C  CA  . SER A 1 214 ? -20.465 -26.457 8.880   1.000 13.563 0 214 SER A CA  1 ? 
ATOM   1551 C  C   . SER A 1 214 ? -20.377 -25.320 7.873   1.000 11.691 0 214 SER A C   1 ? 
ATOM   1552 O  O   . SER A 1 214 ? -20.859 -25.447 6.759   1.000 12.102 0 214 SER A O   1 ? 
ATOM   1553 C  CB  . SER A 1 214 ? -21.571 -26.243 9.838   1.000 15.727 0 214 SER A CB  1 ? 
ATOM   1554 O  OG  . SER A 1 214 ? -21.909 -27.502 10.367  1.000 20.854 0 214 SER A OG  1 ? 
ATOM   1555 N  N   . TRP A 1 215 ? -19.766 -24.207 8.276   1.000 10.333 0 215 TRP A N   1 ? 
ATOM   1556 C  CA  . TRP A 1 215 ? -19.616 -23.087 7.364   1.000 10.441 0 215 TRP A CA  1 ? 
ATOM   1557 C  C   . TRP A 1 215 ? -18.700 -23.487 6.208   1.000 9.924  0 215 TRP A C   1 ? 
ATOM   1558 O  O   . TRP A 1 215 ? -18.990 -23.159 5.054   1.000 10.312 0 215 TRP A O   1 ? 
ATOM   1559 C  CB  . TRP A 1 215 ? -19.099 -21.848 8.098   1.000 9.822  0 215 TRP A CB  1 ? 
ATOM   1560 C  CG  . TRP A 1 215 ? -18.690 -20.731 7.203   1.000 9.105  0 215 TRP A CG  1 ? 
ATOM   1561 C  CD1 . TRP A 1 215 ? -19.496 -19.869 6.520   1.000 9.571  0 215 TRP A CD1 1 ? 
ATOM   1562 C  CD2 . TRP A 1 215 ? -17.348 -20.345 6.908   1.000 9.487  0 215 TRP A CD2 1 ? 
ATOM   1563 N  NE1 . TRP A 1 215 ? -18.730 -18.994 5.801   1.000 9.378  0 215 TRP A NE1 1 ? 
ATOM   1564 C  CE2 . TRP A 1 215 ? -17.414 -19.287 5.979   1.000 9.103  0 215 TRP A CE2 1 ? 
ATOM   1565 C  CE3 . TRP A 1 215 ? -16.088 -20.843 7.270   1.000 9.159  0 215 TRP A CE3 1 ? 
ATOM   1566 C  CZ2 . TRP A 1 215 ? -16.274 -18.641 5.508   1.000 9.249  0 215 TRP A CZ2 1 ? 
ATOM   1567 C  CZ3 . TRP A 1 215 ? -14.971 -20.197 6.799   1.000 9.675  0 215 TRP A CZ3 1 ? 
ATOM   1568 C  CH2 . TRP A 1 215 ? -15.053 -19.148 5.892   1.000 9.461  0 215 TRP A CH2 1 ? 
ATOM   1569 N  N   . ILE A 1 216 ? -17.610 -24.205 6.508   1.000 10.007 0 216 ILE A N   1 ? 
ATOM   1570 C  CA  . ILE A 1 216 ? -16.687 -24.578 5.457   1.000 10.596 0 216 ILE A CA  1 ? 
ATOM   1571 C  C   . ILE A 1 216 ? -17.376 -25.471 4.428   1.000 10.654 0 216 ILE A C   1 ? 
ATOM   1572 O  O   . ILE A 1 216 ? -17.311 -25.218 3.236   1.000 9.319  0 216 ILE A O   1 ? 
ATOM   1573 C  CB  . ILE A 1 216 ? -15.412 -25.241 5.990   1.000 10.661 0 216 ILE A CB  1 ? 
ATOM   1574 C  CG1 . ILE A 1 216 ? -14.558 -24.281 6.819   1.000 10.724 0 216 ILE A CG1 1 ? 
ATOM   1575 C  CG2 . ILE A 1 216 ? -14.672 -25.854 4.822   1.000 10.373 0 216 ILE A CG2 1 ? 
ATOM   1576 C  CD1 . ILE A 1 216 ? -13.425 -24.971 7.531   1.000 11.975 0 216 ILE A CD1 1 ? 
ATOM   1577 N  N   . LYS A 1 217 ? -18.100 -26.498 4.897   1.000 11.473 0 217 LYS A N   1 ? 
ATOM   1578 C  CA  . LYS A 1 217 ? -18.794 -27.419 4.012   1.000 14.148 0 217 LYS A CA  1 ? 
ATOM   1579 C  C   . LYS A 1 217 ? -19.856 -26.722 3.167   1.000 13.634 0 217 LYS A C   1 ? 
ATOM   1580 O  O   . LYS A 1 217 ? -19.940 -26.987 1.971   1.000 14.361 0 217 LYS A O   1 ? 
ATOM   1581 C  CB  . LYS A 1 217 ? -19.362 -28.581 4.826   1.000 16.171 0 217 LYS A CB  1 ? 
ATOM   1582 C  CG  . LYS A 1 217 ? -18.270 -29.520 5.290   1.000 18.992 0 217 LYS A CG  1 ? 
ATOM   1583 C  CD  . LYS A 1 217 ? -18.769 -30.624 6.209   1.000 25.411 0 217 LYS A CD  1 ? 
ATOM   1584 C  CE  . LYS A 1 217 ? -17.678 -31.584 6.636   1.000 28.336 0 217 LYS A CE  1 ? 
ATOM   1585 N  NZ  . LYS A 1 217 ? -17.100 -32.287 5.465   1.000 33.708 0 217 LYS A NZ  1 ? 
ATOM   1586 N  N   . GLN A 1 218 ? -20.626 -25.826 3.771   1.000 13.961 0 218 GLN A N   1 ? 
ATOM   1587 C  CA  . GLN A 1 218 ? -21.693 -25.155 3.057   1.000 15.627 0 218 GLN A CA  1 ? 
ATOM   1588 C  C   . GLN A 1 218 ? -21.074 -24.235 2.014   1.000 13.988 0 218 GLN A C   1 ? 
ATOM   1589 O  O   . GLN A 1 218 ? -21.623 -24.068 0.927   1.000 14.997 0 218 GLN A O   1 ? 
ATOM   1590 C  CB  . GLN A 1 218 ? -22.583 -24.355 4.013   1.000 19.250 0 218 GLN A CB  1 ? 
ATOM   1591 C  CG  . GLN A 1 218 ? -23.382 -25.257 4.950   1.000 25.594 0 218 GLN A CG  1 ? 
ATOM   1592 C  CD  . GLN A 1 218 ? -24.045 -24.465 6.051   1.000 31.990 0 218 GLN A CD  1 ? 
ATOM   1593 O  OE1 . GLN A 1 218 ? -23.813 -24.684 7.240   1.000 40.698 0 218 GLN A OE1 1 ? 
ATOM   1594 N  NE2 . GLN A 1 218 ? -24.855 -23.499 5.655   1.000 39.342 0 218 GLN A NE2 1 ? 
ATOM   1595 N  N   . THR A 1 219 ? -19.975 -23.565 2.385   1.000 11.965 0 219 THR A N   1 ? 
ATOM   1596 C  CA  . THR A 1 219 ? -19.402 -22.576 1.498   1.000 12.268 0 219 THR A CA  1 ? 
ATOM   1597 C  C   . THR A 1 219 ? -18.848 -23.281 0.272   1.000 12.583 0 219 THR A C   1 ? 
ATOM   1598 O  O   . THR A 1 219 ? -19.053 -22.829 -0.839  1.000 13.447 0 219 THR A O   1 ? 
ATOM   1599 C  CB  . THR A 1 219 ? -18.350 -21.715 2.210   1.000 12.380 0 219 THR A CB  1 ? 
ATOM   1600 O  OG1 . THR A 1 219 ? -19.024 -21.082 3.300   1.000 11.763 0 219 THR A OG1 1 ? 
ATOM   1601 C  CG2 . THR A 1 219 ? -17.704 -20.694 1.299   1.000 13.516 0 219 THR A CG2 1 ? 
ATOM   1602 N  N   . ILE A 1 220 ? -18.145 -24.385 0.516   1.000 12.086 0 220 ILE A N   1 ? 
ATOM   1603 C  CA  . ILE A 1 220 ? -17.500 -25.163 -0.529  1.000 15.567 0 220 ILE A CA  1 ? 
ATOM   1604 C  C   . ILE A 1 220 ? -18.524 -25.792 -1.470  1.000 15.883 0 220 ILE A C   1 ? 
ATOM   1605 O  O   . ILE A 1 220 ? -18.230 -26.083 -2.634  1.000 14.997 0 220 ILE A O   1 ? 
ATOM   1606 C  CB  . ILE A 1 220 ? -16.610 -26.210 0.158   1.000 19.211 0 220 ILE A CB  1 ? 
ATOM   1607 C  CG1 . ILE A 1 220 ? -15.276 -25.561 0.515   1.000 20.778 0 220 ILE A CG1 1 ? 
ATOM   1608 C  CG2 . ILE A 1 220 ? -16.452 -27.473 -0.649  1.000 22.167 0 220 ILE A CG2 1 ? 
ATOM   1609 C  CD1 . ILE A 1 220 ? -14.371 -26.505 1.292   1.000 24.123 0 220 ILE A CD1 1 ? 
ATOM   1610 N  N   . ALA A 1 221 ? -19.724 -26.023 -0.942  1.000 14.290 0 221 ALA A N   1 ? 
ATOM   1611 C  CA  . ALA A 1 221 ? -20.770 -26.678 -1.709  1.000 14.617 0 221 ALA A CA  1 ? 
ATOM   1612 C  C   . ALA A 1 221 ? -21.444 -25.671 -2.627  1.000 15.144 0 221 ALA A C   1 ? 
ATOM   1613 O  O   . ALA A 1 221 ? -22.197 -26.055 -3.520  1.000 17.721 0 221 ALA A O   1 ? 
ATOM   1614 C  CB  . ALA A 1 221 ? -21.701 -27.323 -0.726  1.000 14.642 0 221 ALA A CB  1 ? 
ATOM   1615 N  N   . SER A 1 222 ? -21.084 -24.381 -2.499  1.000 13.916 0 222 SER A N   1 ? 
ATOM   1616 C  CA  . SER A 1 222 ? -21.819 -23.339 -3.193  1.000 15.689 0 222 SER A CA  1 ? 
ATOM   1617 C  C   . SER A 1 222 ? -20.940 -22.375 -3.967  1.000 13.458 0 222 SER A C   1 ? 
ATOM   1618 O  O   . SER A 1 222 ? -21.457 -21.401 -4.479  1.000 13.858 0 222 SER A O   1 ? 
ATOM   1619 C  CB  . SER A 1 222 ? -22.664 -22.616 -2.205  1.000 17.323 0 222 SER A CB  1 ? 
ATOM   1620 O  OG  . SER A 1 222 ? -23.908 -23.301 -2.099  1.000 19.973 0 222 SER A OG  1 ? 
ATOM   1621 N  N   . ASN A 1 223 ? -19.631 -22.616 -3.985  1.000 12.194 0 223 ASN A N   1 ? 
ATOM   1622 C  CA  . ASN A 1 223 ? -18.680 -21.693 -4.571  1.000 13.488 0 223 ASN A CA  1 ? 
ATOM   1623 C  C   . ASN A 1 223 ? -17.575 -22.474 -5.302  1.000 14.261 0 223 ASN A C   1 ? 
ATOM   1624 O  O   . ASN A 1 223 ? -16.783 -21.804 -6.004  1.000 15.020 0 223 ASN A O   1 ? 
ATOM   1625 C  CB  . ASN A 1 223 ? -18.036 -20.778 -3.521  1.000 13.812 0 223 ASN A CB  1 ? 
ATOM   1626 C  CG  . ASN A 1 223 ? -19.007 -19.826 -2.890  1.000 13.561 0 223 ASN A CG  1 ? 
ATOM   1627 O  OD1 . ASN A 1 223 ? -19.195 -18.724 -3.406  1.000 13.649 0 223 ASN A OD1 1 ? 
ATOM   1628 N  ND2 . ASN A 1 223 ? -19.644 -20.262 -1.807  1.000 12.862 0 223 ASN A ND2 1 ? 
ATOM   1629 O  OXT . ASN A 1 223 ? -17.519 -23.689 -5.112  1.000 15.018 0 223 ASN A OXT 1 ? 
HETATM 1630 CA CA  . CA  B 2 .   ? 10.403  -24.224 -3.579  1.000 9.424  0 301 CA  A CA  1 ? 
HETATM 1631 C  C1  . BEN C 3 .   ? 1.854   -15.659 16.859  1.000 16.798 0 302 BEN A C1  1 ? 
HETATM 1632 C  C2  . BEN C 3 .   ? 1.332   -16.222 15.697  1.000 16.781 0 302 BEN A C2  1 ? 
HETATM 1633 C  C3  . BEN C 3 .   ? 1.021   -15.423 14.608  1.000 18.054 0 302 BEN A C3  1 ? 
HETATM 1634 C  C4  . BEN C 3 .   ? 1.233   -14.066 14.647  1.000 17.621 0 302 BEN A C4  1 ? 
HETATM 1635 C  C5  . BEN C 3 .   ? 1.747   -13.498 15.785  1.000 17.865 0 302 BEN A C5  1 ? 
HETATM 1636 C  C6  . BEN C 3 .   ? 2.089   -14.289 16.879  1.000 17.569 0 302 BEN A C6  1 ? 
HETATM 1637 C  C   . BEN C 3 .   ? 2.177   -16.512 18.032  1.000 15.421 0 302 BEN A C   1 ? 
HETATM 1638 N  N1  . BEN C 3 .   ? 1.850   -17.769 18.098  1.000 14.351 0 302 BEN A N1  1 ? 
HETATM 1639 N  N2  . BEN C 3 .   ? 2.915   -15.961 19.011  1.000 15.372 0 302 BEN A N2  1 ? 
HETATM 1640 O  O   . HOH D 4 .   ? -6.985  -15.135 -11.814 1.000 49.582 0 401 HOH A O   1 ? 
HETATM 1641 O  O   . HOH D 4 .   ? -1.749  -8.345  -3.206  1.000 42.529 0 402 HOH A O   1 ? 
HETATM 1642 O  O   . HOH D 4 .   ? -10.285 -31.942 4.229   1.000 30.118 0 403 HOH A O   1 ? 
HETATM 1643 O  O   . HOH D 4 .   ? 1.619   -8.747  3.439   1.000 28.936 0 404 HOH A O   1 ? 
HETATM 1644 O  O   . HOH D 4 .   ? -0.521  -18.381 -10.723 1.000 29.751 0 405 HOH A O   1 ? 
HETATM 1645 O  O   . HOH D 4 .   ? 5.930   -12.632 28.860  1.000 33.928 0 406 HOH A O   1 ? 
HETATM 1646 O  O   . HOH D 4 .   ? 11.459  -28.667 5.828   1.000 11.757 0 407 HOH A O   1 ? 
HETATM 1647 O  O   . HOH D 4 .   ? -14.538 -25.341 -9.408  1.000 27.053 0 408 HOH A O   1 ? 
HETATM 1648 O  O   . HOH D 4 .   ? -8.010  -34.234 16.026  1.000 19.269 0 409 HOH A O   1 ? 
HETATM 1649 O  O   . HOH D 4 .   ? -18.729 -19.699 17.427  1.000 60.676 0 410 HOH A O   1 ? 
HETATM 1650 O  O   . HOH D 4 .   ? -10.810 -24.788 -9.009  1.000 24.509 0 411 HOH A O   1 ? 
HETATM 1651 O  O   . HOH D 4 .   ? -10.713 -27.286 16.261  1.000 10.172 0 412 HOH A O   1 ? 
HETATM 1652 O  O   . HOH D 4 .   ? 2.034   -10.018 19.002  1.000 28.992 0 413 HOH A O   1 ? 
HETATM 1653 O  O   . HOH D 4 .   ? -5.763  -19.280 22.559  1.000 76.795 0 414 HOH A O   1 ? 
HETATM 1654 O  O   . HOH D 4 .   ? 3.693   -12.168 6.984   1.000 36.105 0 415 HOH A O   1 ? 
HETATM 1655 O  O   . HOH D 4 .   ? 11.315  -28.157 18.718  1.000 26.126 0 416 HOH A O   1 ? 
HETATM 1656 O  O   . HOH D 4 .   ? 0.264   -33.161 26.778  1.000 38.183 0 417 HOH A O   1 ? 
HETATM 1657 O  O   . HOH D 4 .   ? -5.035  -23.207 34.469  1.000 45.193 0 418 HOH A O   1 ? 
HETATM 1658 O  O   . HOH D 4 .   ? -4.641  -23.403 7.950   1.000 14.209 0 419 HOH A O   1 ? 
HETATM 1659 O  O   . HOH D 4 .   ? 4.716   -30.479 0.433   1.000 15.057 0 420 HOH A O   1 ? 
HETATM 1660 O  O   . HOH D 4 .   ? -9.027  -3.923  12.719  1.000 22.803 0 421 HOH A O   1 ? 
HETATM 1661 O  O   . HOH D 4 .   ? -3.950  -26.952 -11.556 1.000 37.741 0 422 HOH A O   1 ? 
HETATM 1662 O  O   . HOH D 4 .   ? 8.781   -33.503 -9.406  1.000 41.256 0 423 HOH A O   1 ? 
HETATM 1663 O  O   . HOH D 4 .   ? -12.749 -36.030 10.065  1.000 29.811 0 424 HOH A O   1 ? 
HETATM 1664 O  O   . HOH D 4 .   ? 11.421  -35.661 2.811   1.000 41.920 0 425 HOH A O   1 ? 
HETATM 1665 O  O   . HOH D 4 .   ? 10.795  -15.535 -2.090  1.000 30.261 0 426 HOH A O   1 ? 
HETATM 1666 O  O   . HOH D 4 .   ? 3.534   -31.490 -7.056  1.000 17.500 0 427 HOH A O   1 ? 
HETATM 1667 O  O   . HOH D 4 .   ? -8.144  -34.802 3.255   1.000 42.933 0 428 HOH A O   1 ? 
HETATM 1668 O  O   . HOH D 4 .   ? -13.140 -23.626 28.415  1.000 42.836 0 429 HOH A O   1 ? 
HETATM 1669 O  O   . HOH D 4 .   ? -16.707 -26.063 20.232  1.000 32.817 0 430 HOH A O   1 ? 
HETATM 1670 O  O   . HOH D 4 .   ? -7.490  -8.289  9.139   1.000 17.891 0 431 HOH A O   1 ? 
HETATM 1671 O  O   . HOH D 4 .   ? -1.525  -35.128 16.977  1.000 22.308 0 432 HOH A O   1 ? 
HETATM 1672 O  O   . HOH D 4 .   ? 10.084  -12.166 17.056  1.000 27.161 0 433 HOH A O   1 ? 
HETATM 1673 O  O   . HOH D 4 .   ? -9.629  -10.918 21.146  1.000 18.097 0 434 HOH A O   1 ? 
HETATM 1674 O  O   . HOH D 4 .   ? 5.095   -30.603 24.726  1.000 52.247 0 435 HOH A O   1 ? 
HETATM 1675 O  O   . HOH D 4 .   ? 8.165   -28.992 2.835   1.000 13.309 0 436 HOH A O   1 ? 
HETATM 1676 O  O   . HOH D 4 .   ? -7.508  -34.424 20.876  1.000 24.242 0 437 HOH A O   1 ? 
HETATM 1677 O  O   . HOH D 4 .   ? 14.041  -29.281 4.589   1.000 19.233 0 438 HOH A O   1 ? 
HETATM 1678 O  O   . HOH D 4 .   ? -7.503  -13.141 -2.650  1.000 27.568 0 439 HOH A O   1 ? 
HETATM 1679 O  O   . HOH D 4 .   ? 4.147   -37.311 15.776  1.000 50.737 0 440 HOH A O   1 ? 
HETATM 1680 O  O   . HOH D 4 .   ? -17.969 -17.170 -5.228  1.000 28.953 0 441 HOH A O   1 ? 
HETATM 1681 O  O   . HOH D 4 .   ? -8.349  -38.322 14.262  1.000 31.115 0 442 HOH A O   1 ? 
HETATM 1682 O  O   . HOH D 4 .   ? -5.275  -14.696 -7.463  1.000 28.382 0 443 HOH A O   1 ? 
HETATM 1683 O  O   . HOH D 4 .   ? -21.980 -12.529 13.999  1.000 40.408 0 444 HOH A O   1 ? 
HETATM 1684 O  O   . HOH D 4 .   ? -15.177 -10.348 18.767  1.000 27.927 0 445 HOH A O   1 ? 
HETATM 1685 O  O   . HOH D 4 .   ? -21.768 -15.580 10.863  1.000 43.280 0 446 HOH A O   1 ? 
HETATM 1686 O  O   . HOH D 4 .   ? 15.807  -19.576 -6.529  1.000 17.179 0 447 HOH A O   1 ? 
HETATM 1687 O  O   . HOH D 4 .   ? 8.411   -12.950 2.593   1.000 24.156 0 448 HOH A O   1 ? 
HETATM 1688 O  O   . HOH D 4 .   ? -23.969 -27.852 -4.530  1.000 32.460 0 449 HOH A O   1 ? 
HETATM 1689 O  O   . HOH D 4 .   ? -16.186 -26.386 -4.400  1.000 21.723 0 450 HOH A O   1 ? 
HETATM 1690 O  O   . HOH D 4 .   ? 4.650   -15.079 22.741  1.000 14.178 0 451 HOH A O   1 ? 
HETATM 1691 O  O   . HOH D 4 .   ? 0.889   -28.844 10.404  1.000 6.585  0 452 HOH A O   1 ? 
HETATM 1692 O  O   . HOH D 4 .   ? -17.062 -9.430  9.477   1.000 30.884 0 453 HOH A O   1 ? 
HETATM 1693 O  O   . HOH D 4 .   ? -6.590  -8.365  5.400   1.000 34.564 0 454 HOH A O   1 ? 
HETATM 1694 O  O   . HOH D 4 .   ? 9.293   -28.497 -4.039  1.000 13.057 0 455 HOH A O   1 ? 
HETATM 1695 O  O   . HOH D 4 .   ? -8.456  -16.147 16.360  1.000 13.133 0 456 HOH A O   1 ? 
HETATM 1696 O  O   . HOH D 4 .   ? -15.797 -13.222 -1.421  1.000 25.364 0 457 HOH A O   1 ? 
HETATM 1697 O  O   . HOH D 4 .   ? 14.668  -21.534 -8.155  1.000 12.233 0 458 HOH A O   1 ? 
HETATM 1698 O  O   . HOH D 4 .   ? 5.785   -33.674 -7.470  1.000 36.855 0 459 HOH A O   1 ? 
HETATM 1699 O  O   . HOH D 4 .   ? -12.565 -34.642 22.936  1.000 47.332 0 460 HOH A O   1 ? 
HETATM 1700 O  O   . HOH D 4 .   ? -2.502  -37.069 -2.196  1.000 27.267 0 461 HOH A O   1 ? 
HETATM 1701 O  O   . HOH D 4 .   ? -4.755  -22.208 -12.772 1.000 33.732 0 462 HOH A O   1 ? 
HETATM 1702 O  O   . HOH D 4 .   ? -18.878 -16.952 18.275  1.000 40.673 0 463 HOH A O   1 ? 
HETATM 1703 O  O   . HOH D 4 .   ? -8.499  -9.264  6.680   1.000 17.387 0 464 HOH A O   1 ? 
HETATM 1704 O  O   . HOH D 4 .   ? 0.803   -35.271 -9.237  1.000 37.953 0 465 HOH A O   1 ? 
HETATM 1705 O  O   . HOH D 4 .   ? -16.783 -32.238 2.709   1.000 40.758 0 466 HOH A O   1 ? 
HETATM 1706 O  O   . HOH D 4 .   ? -19.175 -29.412 0.855   1.000 28.699 0 467 HOH A O   1 ? 
HETATM 1707 O  O   . HOH D 4 .   ? 1.505   -28.482 -0.327  1.000 12.822 0 468 HOH A O   1 ? 
HETATM 1708 O  O   . HOH D 4 .   ? -5.194  -36.779 22.962  1.000 38.497 0 469 HOH A O   1 ? 
HETATM 1709 O  O   . HOH D 4 .   ? -5.623  -35.076 25.439  1.000 14.239 0 470 HOH A O   1 ? 
HETATM 1710 O  O   . HOH D 4 .   ? 2.913   -14.206 -6.923  1.000 24.625 0 471 HOH A O   1 ? 
HETATM 1711 O  O   . HOH D 4 .   ? -6.083  -35.929 7.278   1.000 24.735 0 472 HOH A O   1 ? 
HETATM 1712 O  O   . HOH D 4 .   ? -3.190  -20.212 -11.589 1.000 21.811 0 473 HOH A O   1 ? 
HETATM 1713 O  O   . HOH D 4 .   ? -0.884  -9.741  26.059  1.000 29.454 0 474 HOH A O   1 ? 
HETATM 1714 O  O   . HOH D 4 .   ? 8.983   -14.952 -0.191  1.000 16.207 0 475 HOH A O   1 ? 
HETATM 1715 O  O   . HOH D 4 .   ? -1.156  -36.081 21.861  1.000 26.036 0 476 HOH A O   1 ? 
HETATM 1716 O  O   . HOH D 4 .   ? 9.461   -14.252 27.705  1.000 31.319 0 477 HOH A O   1 ? 
HETATM 1717 O  O   . HOH D 4 .   ? -8.779  -1.043  14.704  1.000 12.510 0 478 HOH A O   1 ? 
HETATM 1718 O  O   . HOH D 4 .   ? -11.256 -17.165 15.997  1.000 11.483 0 479 HOH A O   1 ? 
HETATM 1719 O  O   . HOH D 4 .   ? 8.686   -37.733 -5.419  1.000 51.542 0 480 HOH A O   1 ? 
HETATM 1720 O  O   . HOH D 4 .   ? 4.630   -28.068 1.875   1.000 15.050 0 481 HOH A O   1 ? 
HETATM 1721 O  O   . HOH D 4 .   ? 4.146   -36.464 2.910   1.000 32.619 0 482 HOH A O   1 ? 
HETATM 1722 O  O   . HOH D 4 .   ? -1.772  -19.332 32.002  1.000 32.127 0 483 HOH A O   1 ? 
HETATM 1723 O  O   . HOH D 4 .   ? 0.091   -10.447 -6.055  1.000 42.732 0 484 HOH A O   1 ? 
HETATM 1724 O  O   . HOH D 4 .   ? -18.861 -17.817 15.227  1.000 33.404 0 485 HOH A O   1 ? 
HETATM 1725 O  O   . HOH D 4 .   ? -3.083  -26.552 30.183  1.000 26.319 0 486 HOH A O   1 ? 
HETATM 1726 O  O   . HOH D 4 .   ? 1.900   -13.302 9.462   1.000 55.614 0 487 HOH A O   1 ? 
HETATM 1727 O  O   . HOH D 4 .   ? -0.528  -38.211 -0.176  1.000 53.891 0 488 HOH A O   1 ? 
HETATM 1728 O  O   . HOH D 4 .   ? 5.941   -30.311 3.612   1.000 14.023 0 489 HOH A O   1 ? 
HETATM 1729 O  O   . HOH D 4 .   ? 6.510   -28.838 -10.520 1.000 34.969 0 490 HOH A O   1 ? 
HETATM 1730 O  O   . HOH D 4 .   ? 10.571  -30.697 -2.747  1.000 21.086 0 491 HOH A O   1 ? 
HETATM 1731 O  O   . HOH D 4 .   ? 9.498   -18.043 -6.720  1.000 22.465 0 492 HOH A O   1 ? 
HETATM 1732 O  O   . HOH D 4 .   ? 14.378  -32.233 3.628   1.000 26.854 0 493 HOH A O   1 ? 
HETATM 1733 O  O   . HOH D 4 .   ? -18.054 -27.067 17.453  1.000 38.022 0 494 HOH A O   1 ? 
HETATM 1734 O  O   . HOH D 4 .   ? -11.048 -4.706  8.961   1.000 29.249 0 495 HOH A O   1 ? 
HETATM 1735 O  O   . HOH D 4 .   ? -0.801  -18.480 16.800  1.000 13.340 0 496 HOH A O   1 ? 
HETATM 1736 O  O   . HOH D 4 .   ? -19.466 -20.321 11.451  1.000 17.063 0 497 HOH A O   1 ? 
HETATM 1737 O  O   . HOH D 4 .   ? -4.866  -36.592 1.950   1.000 26.583 0 498 HOH A O   1 ? 
HETATM 1738 O  O   . HOH D 4 .   ? -2.503  -9.667  24.471  1.000 33.863 0 499 HOH A O   1 ? 
HETATM 1739 O  O   . HOH D 4 .   ? -13.365 -7.366  10.674  1.000 11.833 0 500 HOH A O   1 ? 
HETATM 1740 O  O   . HOH D 4 .   ? 0.820   -33.987 9.825   1.000 19.772 0 501 HOH A O   1 ? 
HETATM 1741 O  O   . HOH D 4 .   ? -1.795  -11.903 14.418  1.000 17.340 0 502 HOH A O   1 ? 
HETATM 1742 O  O   . HOH D 4 .   ? -8.768  -34.526 -1.238  1.000 27.656 0 503 HOH A O   1 ? 
HETATM 1743 O  O   . HOH D 4 .   ? -16.332 -31.732 19.773  1.000 22.728 0 504 HOH A O   1 ? 
HETATM 1744 O  O   . HOH D 4 .   ? -9.899  -14.543 27.917  1.000 25.605 0 505 HOH A O   1 ? 
HETATM 1745 O  O   . HOH D 4 .   ? -18.853 -14.919 16.262  1.000 24.018 0 506 HOH A O   1 ? 
HETATM 1746 O  O   . HOH D 4 .   ? -9.732  -27.303 -12.103 1.000 24.406 0 507 HOH A O   1 ? 
HETATM 1747 O  O   . HOH D 4 .   ? -7.046  -23.331 24.930  1.000 13.197 0 508 HOH A O   1 ? 
HETATM 1748 O  O   . HOH D 4 .   ? -13.179 -13.586 26.894  1.000 41.362 0 509 HOH A O   1 ? 
HETATM 1749 O  O   . HOH D 4 .   ? -1.177  -27.767 -10.637 1.000 37.093 0 510 HOH A O   1 ? 
HETATM 1750 O  O   . HOH D 4 .   ? -1.293  -35.520 13.485  1.000 18.415 0 511 HOH A O   1 ? 
HETATM 1751 O  O   . HOH D 4 .   ? -19.729 -23.380 11.273  1.000 18.983 0 512 HOH A O   1 ? 
HETATM 1752 O  O   . HOH D 4 .   ? -22.691 -22.763 9.125   1.000 43.091 0 513 HOH A O   1 ? 
HETATM 1753 O  O   . HOH D 4 .   ? -4.109  -8.153  9.031   1.000 31.844 0 514 HOH A O   1 ? 
HETATM 1754 O  O   . HOH D 4 .   ? -5.599  -34.686 -7.883  1.000 36.745 0 515 HOH A O   1 ? 
HETATM 1755 O  O   . HOH D 4 .   ? -10.092 -27.486 21.511  1.000 31.561 0 516 HOH A O   1 ? 
HETATM 1756 O  O   . HOH D 4 .   ? 12.054  -34.255 10.528  1.000 51.504 0 517 HOH A O   1 ? 
HETATM 1757 O  O   . HOH D 4 .   ? -12.305 -33.359 5.537   1.000 20.442 0 518 HOH A O   1 ? 
HETATM 1758 O  O   . HOH D 4 .   ? -16.552 -30.259 14.469  1.000 38.553 0 519 HOH A O   1 ? 
HETATM 1759 O  O   . HOH D 4 .   ? -12.522 -29.830 -4.394  1.000 48.953 0 520 HOH A O   1 ? 
HETATM 1760 O  O   . HOH D 4 .   ? 6.166   -12.304 7.977   1.000 42.269 0 521 HOH A O   1 ? 
HETATM 1761 O  O   . HOH D 4 .   ? -2.326  -12.334 32.358  1.000 41.889 0 522 HOH A O   1 ? 
HETATM 1762 O  O   . HOH D 4 .   ? -13.903 -20.099 -8.962  1.000 44.573 0 523 HOH A O   1 ? 
HETATM 1763 O  O   . HOH D 4 .   ? -10.464 -30.883 26.242  1.000 23.960 0 524 HOH A O   1 ? 
HETATM 1764 O  O   . HOH D 4 .   ? -17.165 -12.028 3.796   1.000 31.332 0 525 HOH A O   1 ? 
HETATM 1765 O  O   . HOH D 4 .   ? -10.996 -13.926 30.167  1.000 31.018 0 526 HOH A O   1 ? 
HETATM 1766 O  O   . HOH D 4 .   ? -17.219 -5.690  17.510  1.000 44.631 0 527 HOH A O   1 ? 
HETATM 1767 O  O   . HOH D 4 .   ? -9.902  -33.366 -3.548  1.000 25.878 0 528 HOH A O   1 ? 
HETATM 1768 O  O   . HOH D 4 .   ? -12.534 -12.829 -3.780  1.000 28.705 0 529 HOH A O   1 ? 
HETATM 1769 O  O   . HOH D 4 .   ? 2.533   -34.597 8.654   1.000 39.314 0 530 HOH A O   1 ? 
HETATM 1770 O  O   . HOH D 4 .   ? -2.536  -34.485 -12.741 1.000 43.164 0 531 HOH A O   1 ? 
HETATM 1771 O  O   . HOH D 4 .   ? 8.198   -14.565 -3.850  1.000 21.793 0 532 HOH A O   1 ? 
HETATM 1772 O  O   . HOH D 4 .   ? -0.586  -11.424 16.992  1.000 28.557 0 533 HOH A O   1 ? 
HETATM 1773 O  O   . HOH D 4 .   ? -10.111 -28.071 19.039  1.000 23.363 0 534 HOH A O   1 ? 
HETATM 1774 O  O   . HOH D 4 .   ? 0.464   -13.078 -6.807  1.000 32.061 0 535 HOH A O   1 ? 
HETATM 1775 O  O   . HOH D 4 .   ? -2.094  -8.846  -5.763  1.000 49.142 0 536 HOH A O   1 ? 
HETATM 1776 O  O   . HOH D 4 .   ? -22.164 -11.377 10.247  1.000 27.018 0 537 HOH A O   1 ? 
HETATM 1777 O  O   . HOH D 4 .   ? 6.923   -33.413 9.533   1.000 41.249 0 538 HOH A O   1 ? 
HETATM 1778 O  O   . HOH D 4 .   ? 0.275   -17.763 31.372  1.000 38.048 0 539 HOH A O   1 ? 
HETATM 1779 O  O   . HOH D 4 .   ? -6.809  -13.432 -4.901  1.000 32.174 0 540 HOH A O   1 ? 
HETATM 1780 O  O   . HOH D 4 .   ? -11.981 -20.993 24.351  1.000 36.733 0 541 HOH A O   1 ? 
HETATM 1781 O  O   . HOH D 4 .   ? -2.459  -36.164 24.787  1.000 39.757 0 542 HOH A O   1 ? 
HETATM 1782 O  O   . HOH D 4 .   ? -7.715  -35.164 18.939  1.000 51.112 0 543 HOH A O   1 ? 
HETATM 1783 O  O   . HOH D 4 .   ? -1.978  -36.225 18.636  1.000 39.837 0 544 HOH A O   1 ? 
HETATM 1784 O  O   . HOH D 4 .   ? -4.655  -35.960 -0.621  1.000 20.764 0 545 HOH A O   1 ? 
HETATM 1785 O  O   . HOH D 4 .   ? -19.529 -19.724 -7.983  1.000 37.781 0 546 HOH A O   1 ? 
HETATM 1786 O  O   . HOH D 4 .   ? -12.171 -24.079 -11.627 1.000 44.840 0 547 HOH A O   1 ? 
HETATM 1787 O  O   . HOH D 4 .   ? 0.643   -7.646  22.013  1.000 32.179 0 548 HOH A O   1 ? 
HETATM 1788 O  O   . HOH D 4 .   ? -14.647 -4.468  17.573  1.000 30.648 0 549 HOH A O   1 ? 
HETATM 1789 O  O   . HOH D 4 .   ? 10.273  -35.211 -8.490  1.000 46.591 0 550 HOH A O   1 ? 
HETATM 1790 O  O   . HOH D 4 .   ? -9.367  -37.289 22.825  1.000 29.146 0 551 HOH A O   1 ? 
HETATM 1791 O  O   . HOH D 4 .   ? -9.796  -11.648 -3.299  1.000 35.604 0 552 HOH A O   1 ? 
HETATM 1792 O  O   . HOH D 4 .   ? -20.742 -16.566 13.488  1.000 48.823 0 553 HOH A O   1 ? 
HETATM 1793 O  O   . HOH D 4 .   ? -17.896 -15.569 20.135  1.000 45.632 0 554 HOH A O   1 ? 
HETATM 1794 O  O   . HOH D 4 .   ? -22.869 -21.123 6.978   1.000 43.316 0 555 HOH A O   1 ? 
HETATM 1795 O  O   . HOH D 4 .   ? -7.234  -36.278 -1.453  1.000 42.108 0 556 HOH A O   1 ? 
HETATM 1796 O  O   . HOH D 4 .   ? -5.744  -9.552  -8.100  1.000 39.317 0 557 HOH A O   1 ? 
HETATM 1797 O  O   . HOH D 4 .   ? -14.631 -28.552 -3.868  1.000 41.181 0 558 HOH A O   1 ? 
HETATM 1798 O  O   . HOH D 4 .   ? -4.528  -7.822  -7.028  1.000 48.392 0 559 HOH A O   1 ? 
HETATM 1799 O  O   . HOH D 4 .   ? -1.323  -9.572  21.584  1.000 27.168 0 560 HOH A O   1 ? 
HETATM 1800 O  O   . HOH D 4 .   ? -18.529 -20.136 15.004  1.000 48.698 0 561 HOH A O   1 ? 
HETATM 1801 O  O   . HOH D 4 .   ? -1.494  -14.318 -8.756  1.000 36.448 0 562 HOH A O   1 ? 
HETATM 1802 O  O   . HOH D 4 .   ? 3.690   -14.907 -9.582  1.000 37.679 0 563 HOH A O   1 ? 
HETATM 1803 O  O   . HOH D 4 .   ? -19.786 -23.943 18.295  1.000 56.135 0 564 HOH A O   1 ? 
HETATM 1804 O  O   . HOH D 4 .   ? 4.366   -31.050 -9.636  1.000 41.942 0 565 HOH A O   1 ? 
HETATM 1805 O  O   . HOH D 4 .   ? -17.647 -30.070 16.497  1.000 45.474 0 566 HOH A O   1 ? 
HETATM 1806 O  O   . HOH D 4 .   ? -18.846 -9.186  13.532  1.000 40.795 0 567 HOH A O   1 ? 
HETATM 1807 O  O   . HOH D 4 .   ? 12.907  -30.908 -2.212  1.000 27.550 0 568 HOH A O   1 ? 
HETATM 1808 O  O   . HOH D 4 .   ? -20.899 -15.508 15.280  1.000 53.967 0 569 HOH A O   1 ? 
HETATM 1809 O  O   . HOH D 4 .   ? -18.155 -7.953  11.909  1.000 37.946 0 570 HOH A O   1 ? 
HETATM 1810 O  O   . HOH D 4 .   ? -3.548  -13.560 -8.731  1.000 52.705 0 571 HOH A O   1 ? 
HETATM 1811 O  O   . HOH D 4 .   ? -1.158  -17.173 33.302  1.000 41.358 0 572 HOH A O   1 ? 
HETATM 1812 O  O   . HOH D 4 .   ? -21.722 -17.767 10.393  1.000 35.933 0 573 HOH A O   1 ? 
HETATM 1813 O  O   . HOH D 4 .   ? -20.208 -11.168 15.217  1.000 47.068 0 574 HOH A O   1 ? 
HETATM 1814 O  O   . HOH D 4 .   ? -19.858 -14.834 18.484  1.000 54.412 0 575 HOH A O   1 ? 
HETATM 1815 O  O   . HOH D 4 .   ? -14.501 -5.315  19.794  1.000 47.919 0 576 HOH A O   1 ? 
HETATM 1816 O  O   . HOH D 4 .   ? -19.849 -21.454 18.955  1.000 46.585 0 577 HOH A O   1 ? 
HETATM 1817 O  O   . HOH D 4 .   ? 2.568   -9.799  31.241  1.000 46.064 0 578 HOH A O   1 ? 
HETATM 1818 O  O   . HOH D 4 .   ? 8.976   -35.813 -10.623 1.000 39.024 0 579 HOH A O   1 ? 
HETATM 1819 O  O   . HOH D 4 .   ? -24.975 -15.353 16.225  1.000 52.961 0 580 HOH A O   1 ? 
# 
