data_9KNG
# 
_entry.id   9KNG 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.403 
_audit_conform.dict_location   http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic 
# 
loop_
_database_2.database_id 
_database_2.database_code 
_database_2.pdbx_database_accession 
_database_2.pdbx_DOI 
PDB   9KNG         pdb_00009kng 10.2210/pdb9kng/pdb 
WWPDB D_1300053792 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
_pdbx_audit_revision_history.part_number 
1 'Structure model' 1 0 2025-04-16 ? 
2 'Structure model' 1 1 2025-04-23 ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
_pdbx_audit_revision_category.ordinal             1 
_pdbx_audit_revision_category.revision_ordinal    2 
_pdbx_audit_revision_category.data_content_type   'Structure model' 
_pdbx_audit_revision_category.category            citation 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.pdbx_database_id_PubMed' 
2 2 'Structure model' '_citation.title'                   
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9KNG 
_pdbx_database_status.recvd_initial_deposition_date   2024-11-18 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBJ 
_pdbx_database_status.process_site                    PDBC 
_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           N 
# 
_pdbx_contact_author.id                 4 
_pdbx_contact_author.email              liu_jinsong@gibh.ac.cn 
_pdbx_contact_author.name_first         Jinsong 
_pdbx_contact_author.name_last          Liu 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0003-2317-0558 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Xu, T.'   1 0000-0002-1826-2012 
'Wang, N.' 2 0009-0000-4095-3963 
'Liu, J.'  3 0000-0003-2317-0558 
# 
_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                   CN 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Acta Pharmacol.Sin.' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           1745-7254 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            ? 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     
'Identification of indoles as potential endogenous ligands of ERR gamma and their modulation on drug binding.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1038/s41401-025-01550-6 
_citation.pdbx_database_id_PubMed   40200124 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Shuai, Y.Y.' 1  ? 
primary 'Zhang, H.Y.' 2  ? 
primary 'Chen, R.'    3  ? 
primary 'Wang, B.L.'  4  ? 
primary 'Ding, P.'    5  ? 
primary 'Dong, Y.'    6  ? 
primary 'Sun, M.Z.'   7  ? 
primary 'Wu, X.S.'    8  ? 
primary 'Xu, Y.'      9  ? 
primary 'Zhang, Y.'   10 ? 
primary 'Liu, J.S.'   11 ? 
primary 'Wang, N.'    12 ? 
primary 'Xu, T.T.'    13 ? 
# 
loop_
_entity.id 
_entity.type 
_entity.src_method 
_entity.pdbx_description 
_entity.formula_weight 
_entity.pdbx_number_of_molecules 
_entity.pdbx_ec 
_entity.pdbx_mutation 
_entity.pdbx_fragment 
_entity.details 
1 polymer     man 'Estrogen-related receptor gamma'        28386.941 1   ? ? ? ? 
2 polymer     man 'Nuclear receptor-interacting protein 1' 1692.997  1   ? ? ? ? 
3 non-polymer syn 6-methyl-1,3-benzothiazole-2,4-diamine   179.242   1   ? ? ? ? 
4 water       nat water                                    18.015    196 ? ? ? ? 
# 
loop_
_entity_name_com.entity_id 
_entity_name_com.name 
1 'ERR gamma-2,Estrogen receptor-related protein 3,Nuclear receptor subfamily 3 group B member 3' 
2 'Nuclear factor RIP140,Receptor-interacting protein 140'                                        
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)' no no 
;MGSSHHHHHHSSGLVPRGSHMPAKKPYNKIVSHLLVAEPEKIYAMPDPTVPDSDIKALTTLCDLADRELVVIIGWAKHIP
GFSTLSLADQMSLLQSAWMEILILGVVYRSLSFEDELVYADDYIMDEDQSKLAGLLDLNNAILQLVKKYKSMKLEKEEFV
TLKAIALANSDSMHIEDVEAVQKLQDVLHEALQDYEAGQHMEDPRRAGKMLMTLPLLRQTSTKAVQHFYNIKLEGKVPMH
KLFLEMLEAKV
;
;MGSSHHHHHHSSGLVPRGSHMPAKKPYNKIVSHLLVAEPEKIYAMPDPTVPDSDIKALTTLCDLADRELVVIIGWAKHIP
GFSTLSLADQMSLLQSAWMEILILGVVYRSLSFEDELVYADDYIMDEDQSKLAGLLDLNNAILQLVKKYKSMKLEKEEFV
TLKAIALANSDSMHIEDVEAVQKLQDVLHEALQDYEAGQHMEDPRRAGKMLMTLPLLRQTSTKAVQHFYNIKLEGKVPMH
KLFLEMLEAKV
;
A ? 
2 'polypeptide(L)' no no NNSLLLHLLKSQTIP NNSLLLHLLKSQTIP C ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
3 6-methyl-1,3-benzothiazole-2,4-diamine A1EGD 
4 water                                  HOH   
# 
loop_
_entity_poly_seq.entity_id 
_entity_poly_seq.num 
_entity_poly_seq.mon_id 
_entity_poly_seq.hetero 
1 1   MET n 
1 2   GLY n 
1 3   SER n 
1 4   SER n 
1 5   HIS n 
1 6   HIS n 
1 7   HIS n 
1 8   HIS n 
1 9   HIS n 
1 10  HIS n 
1 11  SER n 
1 12  SER n 
1 13  GLY n 
1 14  LEU n 
1 15  VAL n 
1 16  PRO n 
1 17  ARG n 
1 18  GLY n 
1 19  SER n 
1 20  HIS n 
1 21  MET n 
1 22  PRO n 
1 23  ALA n 
1 24  LYS n 
1 25  LYS n 
1 26  PRO n 
1 27  TYR n 
1 28  ASN n 
1 29  LYS n 
1 30  ILE n 
1 31  VAL n 
1 32  SER n 
1 33  HIS n 
1 34  LEU n 
1 35  LEU n 
1 36  VAL n 
1 37  ALA n 
1 38  GLU n 
1 39  PRO n 
1 40  GLU n 
1 41  LYS n 
1 42  ILE n 
1 43  TYR n 
1 44  ALA n 
1 45  MET n 
1 46  PRO n 
1 47  ASP n 
1 48  PRO n 
1 49  THR n 
1 50  VAL n 
1 51  PRO n 
1 52  ASP n 
1 53  SER n 
1 54  ASP n 
1 55  ILE n 
1 56  LYS n 
1 57  ALA n 
1 58  LEU n 
1 59  THR n 
1 60  THR n 
1 61  LEU n 
1 62  CYS n 
1 63  ASP n 
1 64  LEU n 
1 65  ALA n 
1 66  ASP n 
1 67  ARG n 
1 68  GLU n 
1 69  LEU n 
1 70  VAL n 
1 71  VAL n 
1 72  ILE n 
1 73  ILE n 
1 74  GLY n 
1 75  TRP n 
1 76  ALA n 
1 77  LYS n 
1 78  HIS n 
1 79  ILE n 
1 80  PRO n 
1 81  GLY n 
1 82  PHE n 
1 83  SER n 
1 84  THR n 
1 85  LEU n 
1 86  SER n 
1 87  LEU n 
1 88  ALA n 
1 89  ASP n 
1 90  GLN n 
1 91  MET n 
1 92  SER n 
1 93  LEU n 
1 94  LEU n 
1 95  GLN n 
1 96  SER n 
1 97  ALA n 
1 98  TRP n 
1 99  MET n 
1 100 GLU n 
1 101 ILE n 
1 102 LEU n 
1 103 ILE n 
1 104 LEU n 
1 105 GLY n 
1 106 VAL n 
1 107 VAL n 
1 108 TYR n 
1 109 ARG n 
1 110 SER n 
1 111 LEU n 
1 112 SER n 
1 113 PHE n 
1 114 GLU n 
1 115 ASP n 
1 116 GLU n 
1 117 LEU n 
1 118 VAL n 
1 119 TYR n 
1 120 ALA n 
1 121 ASP n 
1 122 ASP n 
1 123 TYR n 
1 124 ILE n 
1 125 MET n 
1 126 ASP n 
1 127 GLU n 
1 128 ASP n 
1 129 GLN n 
1 130 SER n 
1 131 LYS n 
1 132 LEU n 
1 133 ALA n 
1 134 GLY n 
1 135 LEU n 
1 136 LEU n 
1 137 ASP n 
1 138 LEU n 
1 139 ASN n 
1 140 ASN n 
1 141 ALA n 
1 142 ILE n 
1 143 LEU n 
1 144 GLN n 
1 145 LEU n 
1 146 VAL n 
1 147 LYS n 
1 148 LYS n 
1 149 TYR n 
1 150 LYS n 
1 151 SER n 
1 152 MET n 
1 153 LYS n 
1 154 LEU n 
1 155 GLU n 
1 156 LYS n 
1 157 GLU n 
1 158 GLU n 
1 159 PHE n 
1 160 VAL n 
1 161 THR n 
1 162 LEU n 
1 163 LYS n 
1 164 ALA n 
1 165 ILE n 
1 166 ALA n 
1 167 LEU n 
1 168 ALA n 
1 169 ASN n 
1 170 SER n 
1 171 ASP n 
1 172 SER n 
1 173 MET n 
1 174 HIS n 
1 175 ILE n 
1 176 GLU n 
1 177 ASP n 
1 178 VAL n 
1 179 GLU n 
1 180 ALA n 
1 181 VAL n 
1 182 GLN n 
1 183 LYS n 
1 184 LEU n 
1 185 GLN n 
1 186 ASP n 
1 187 VAL n 
1 188 LEU n 
1 189 HIS n 
1 190 GLU n 
1 191 ALA n 
1 192 LEU n 
1 193 GLN n 
1 194 ASP n 
1 195 TYR n 
1 196 GLU n 
1 197 ALA n 
1 198 GLY n 
1 199 GLN n 
1 200 HIS n 
1 201 MET n 
1 202 GLU n 
1 203 ASP n 
1 204 PRO n 
1 205 ARG n 
1 206 ARG n 
1 207 ALA n 
1 208 GLY n 
1 209 LYS n 
1 210 MET n 
1 211 LEU n 
1 212 MET n 
1 213 THR n 
1 214 LEU n 
1 215 PRO n 
1 216 LEU n 
1 217 LEU n 
1 218 ARG n 
1 219 GLN n 
1 220 THR n 
1 221 SER n 
1 222 THR n 
1 223 LYS n 
1 224 ALA n 
1 225 VAL n 
1 226 GLN n 
1 227 HIS n 
1 228 PHE n 
1 229 TYR n 
1 230 ASN n 
1 231 ILE n 
1 232 LYS n 
1 233 LEU n 
1 234 GLU n 
1 235 GLY n 
1 236 LYS n 
1 237 VAL n 
1 238 PRO n 
1 239 MET n 
1 240 HIS n 
1 241 LYS n 
1 242 LEU n 
1 243 PHE n 
1 244 LEU n 
1 245 GLU n 
1 246 MET n 
1 247 LEU n 
1 248 GLU n 
1 249 ALA n 
1 250 LYS n 
1 251 VAL n 
2 1   ASN n 
2 2   ASN n 
2 3   SER n 
2 4   LEU n 
2 5   LEU n 
2 6   LEU n 
2 7   HIS n 
2 8   LEU n 
2 9   LEU n 
2 10  LYS n 
2 11  SER n 
2 12  GLN n 
2 13  THR n 
2 14  ILE n 
2 15  PRO n 
# 
loop_
_entity_src_gen.entity_id 
_entity_src_gen.pdbx_src_id 
_entity_src_gen.pdbx_alt_source_flag 
_entity_src_gen.pdbx_seq_type 
_entity_src_gen.pdbx_beg_seq_num 
_entity_src_gen.pdbx_end_seq_num 
_entity_src_gen.gene_src_common_name 
_entity_src_gen.gene_src_genus 
_entity_src_gen.pdbx_gene_src_gene 
_entity_src_gen.gene_src_species 
_entity_src_gen.gene_src_strain 
_entity_src_gen.gene_src_tissue 
_entity_src_gen.gene_src_tissue_fraction 
_entity_src_gen.gene_src_details 
_entity_src_gen.pdbx_gene_src_fragment 
_entity_src_gen.pdbx_gene_src_scientific_name 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 
_entity_src_gen.pdbx_gene_src_variant 
_entity_src_gen.pdbx_gene_src_cell_line 
_entity_src_gen.pdbx_gene_src_atcc 
_entity_src_gen.pdbx_gene_src_organ 
_entity_src_gen.pdbx_gene_src_organelle 
_entity_src_gen.pdbx_gene_src_cell 
_entity_src_gen.pdbx_gene_src_cellular_location 
_entity_src_gen.host_org_common_name 
_entity_src_gen.pdbx_host_org_scientific_name 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 
_entity_src_gen.host_org_genus 
_entity_src_gen.pdbx_host_org_gene 
_entity_src_gen.pdbx_host_org_organ 
_entity_src_gen.host_org_species 
_entity_src_gen.pdbx_host_org_tissue 
_entity_src_gen.pdbx_host_org_tissue_fraction 
_entity_src_gen.pdbx_host_org_strain 
_entity_src_gen.pdbx_host_org_variant 
_entity_src_gen.pdbx_host_org_cell_line 
_entity_src_gen.pdbx_host_org_atcc 
_entity_src_gen.pdbx_host_org_culture_collection 
_entity_src_gen.pdbx_host_org_cell 
_entity_src_gen.pdbx_host_org_organelle 
_entity_src_gen.pdbx_host_org_cellular_location 
_entity_src_gen.pdbx_host_org_vector_type 
_entity_src_gen.pdbx_host_org_vector 
_entity_src_gen.host_org_details 
_entity_src_gen.expression_system_id 
_entity_src_gen.plasmid_name 
_entity_src_gen.plasmid_details 
_entity_src_gen.pdbx_description 
1 1 sample 'Biological sequence' 1 251 human ? 'ESRRG, ERR3, ERRG2, KIAA0832, NR3B3' ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? 
? 'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
2 1 sample 'Biological sequence' 1 15  human ? NRIP1                                 ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? 
? 'Escherichia coli' 562 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
A1EGD non-polymer         . 6-methyl-1,3-benzothiazole-2,4-diamine ? 'C8 H9 N3 S'     179.242 
ALA   'L-peptide linking' y ALANINE                                ? 'C3 H7 N O2'     89.093  
ARG   'L-peptide linking' y ARGININE                               ? 'C6 H15 N4 O2 1' 175.209 
ASN   'L-peptide linking' y ASPARAGINE                             ? 'C4 H8 N2 O3'    132.118 
ASP   'L-peptide linking' y 'ASPARTIC ACID'                        ? 'C4 H7 N O4'     133.103 
CYS   'L-peptide linking' y CYSTEINE                               ? 'C3 H7 N O2 S'   121.158 
GLN   'L-peptide linking' y GLUTAMINE                              ? 'C5 H10 N2 O3'   146.144 
GLU   'L-peptide linking' y 'GLUTAMIC ACID'                        ? 'C5 H9 N O4'     147.129 
GLY   'peptide linking'   y GLYCINE                                ? 'C2 H5 N O2'     75.067  
HIS   'L-peptide linking' y HISTIDINE                              ? 'C6 H10 N3 O2 1' 156.162 
HOH   non-polymer         . WATER                                  ? 'H2 O'           18.015  
ILE   'L-peptide linking' y ISOLEUCINE                             ? 'C6 H13 N O2'    131.173 
LEU   'L-peptide linking' y LEUCINE                                ? 'C6 H13 N O2'    131.173 
LYS   'L-peptide linking' y LYSINE                                 ? 'C6 H15 N2 O2 1' 147.195 
MET   'L-peptide linking' y METHIONINE                             ? 'C5 H11 N O2 S'  149.211 
PHE   'L-peptide linking' y PHENYLALANINE                          ? 'C9 H11 N O2'    165.189 
PRO   'L-peptide linking' y PROLINE                                ? 'C5 H9 N O2'     115.130 
SER   'L-peptide linking' y SERINE                                 ? 'C3 H7 N O3'     105.093 
THR   'L-peptide linking' y THREONINE                              ? 'C4 H9 N O3'     119.119 
TRP   'L-peptide linking' y TRYPTOPHAN                             ? 'C11 H12 N2 O2'  204.225 
TYR   'L-peptide linking' y TYROSINE                               ? 'C9 H11 N O3'    181.189 
VAL   'L-peptide linking' y VALINE                                 ? 'C5 H11 N O2'    117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   208 ?   ?   ?   A . n 
A 1 2   GLY 2   209 ?   ?   ?   A . n 
A 1 3   SER 3   210 ?   ?   ?   A . n 
A 1 4   SER 4   211 ?   ?   ?   A . n 
A 1 5   HIS 5   212 ?   ?   ?   A . n 
A 1 6   HIS 6   213 ?   ?   ?   A . n 
A 1 7   HIS 7   214 ?   ?   ?   A . n 
A 1 8   HIS 8   215 ?   ?   ?   A . n 
A 1 9   HIS 9   216 ?   ?   ?   A . n 
A 1 10  HIS 10  217 ?   ?   ?   A . n 
A 1 11  SER 11  218 ?   ?   ?   A . n 
A 1 12  SER 12  219 ?   ?   ?   A . n 
A 1 13  GLY 13  220 ?   ?   ?   A . n 
A 1 14  LEU 14  221 ?   ?   ?   A . n 
A 1 15  VAL 15  222 ?   ?   ?   A . n 
A 1 16  PRO 16  223 ?   ?   ?   A . n 
A 1 17  ARG 17  224 ?   ?   ?   A . n 
A 1 18  GLY 18  225 ?   ?   ?   A . n 
A 1 19  SER 19  226 ?   ?   ?   A . n 
A 1 20  HIS 20  227 ?   ?   ?   A . n 
A 1 21  MET 21  228 ?   ?   ?   A . n 
A 1 22  PRO 22  229 ?   ?   ?   A . n 
A 1 23  ALA 23  230 ?   ?   ?   A . n 
A 1 24  LYS 24  231 ?   ?   ?   A . n 
A 1 25  LYS 25  232 ?   ?   ?   A . n 
A 1 26  PRO 26  233 ?   ?   ?   A . n 
A 1 27  TYR 27  234 234 TYR TYR A . n 
A 1 28  ASN 28  235 235 ASN ASN A . n 
A 1 29  LYS 29  236 236 LYS LYS A . n 
A 1 30  ILE 30  237 237 ILE ILE A . n 
A 1 31  VAL 31  238 238 VAL VAL A . n 
A 1 32  SER 32  239 239 SER SER A . n 
A 1 33  HIS 33  240 240 HIS HIS A . n 
A 1 34  LEU 34  241 241 LEU LEU A . n 
A 1 35  LEU 35  242 242 LEU LEU A . n 
A 1 36  VAL 36  243 243 VAL VAL A . n 
A 1 37  ALA 37  244 244 ALA ALA A . n 
A 1 38  GLU 38  245 245 GLU GLU A . n 
A 1 39  PRO 39  246 246 PRO PRO A . n 
A 1 40  GLU 40  247 247 GLU GLU A . n 
A 1 41  LYS 41  248 248 LYS LYS A . n 
A 1 42  ILE 42  249 249 ILE ILE A . n 
A 1 43  TYR 43  250 250 TYR TYR A . n 
A 1 44  ALA 44  251 251 ALA ALA A . n 
A 1 45  MET 45  252 252 MET MET A . n 
A 1 46  PRO 46  253 253 PRO PRO A . n 
A 1 47  ASP 47  254 254 ASP ASP A . n 
A 1 48  PRO 48  255 255 PRO PRO A . n 
A 1 49  THR 49  256 256 THR THR A . n 
A 1 50  VAL 50  257 257 VAL VAL A . n 
A 1 51  PRO 51  258 258 PRO PRO A . n 
A 1 52  ASP 52  259 259 ASP ASP A . n 
A 1 53  SER 53  260 260 SER SER A . n 
A 1 54  ASP 54  261 261 ASP ASP A . n 
A 1 55  ILE 55  262 262 ILE ILE A . n 
A 1 56  LYS 56  263 263 LYS LYS A . n 
A 1 57  ALA 57  264 264 ALA ALA A . n 
A 1 58  LEU 58  265 265 LEU LEU A . n 
A 1 59  THR 59  266 266 THR THR A . n 
A 1 60  THR 60  267 267 THR THR A . n 
A 1 61  LEU 61  268 268 LEU LEU A . n 
A 1 62  CYS 62  269 269 CYS CYS A . n 
A 1 63  ASP 63  270 270 ASP ASP A . n 
A 1 64  LEU 64  271 271 LEU LEU A . n 
A 1 65  ALA 65  272 272 ALA ALA A . n 
A 1 66  ASP 66  273 273 ASP ASP A . n 
A 1 67  ARG 67  274 274 ARG ARG A . n 
A 1 68  GLU 68  275 275 GLU GLU A . n 
A 1 69  LEU 69  276 276 LEU LEU A . n 
A 1 70  VAL 70  277 277 VAL VAL A . n 
A 1 71  VAL 71  278 278 VAL VAL A . n 
A 1 72  ILE 72  279 279 ILE ILE A . n 
A 1 73  ILE 73  280 280 ILE ILE A . n 
A 1 74  GLY 74  281 281 GLY GLY A . n 
A 1 75  TRP 75  282 282 TRP TRP A . n 
A 1 76  ALA 76  283 283 ALA ALA A . n 
A 1 77  LYS 77  284 284 LYS LYS A . n 
A 1 78  HIS 78  285 285 HIS HIS A . n 
A 1 79  ILE 79  286 286 ILE ILE A . n 
A 1 80  PRO 80  287 287 PRO PRO A . n 
A 1 81  GLY 81  288 288 GLY GLY A . n 
A 1 82  PHE 82  289 289 PHE PHE A . n 
A 1 83  SER 83  290 290 SER SER A . n 
A 1 84  THR 84  291 291 THR THR A . n 
A 1 85  LEU 85  292 292 LEU LEU A . n 
A 1 86  SER 86  293 293 SER SER A . n 
A 1 87  LEU 87  294 294 LEU LEU A . n 
A 1 88  ALA 88  295 295 ALA ALA A . n 
A 1 89  ASP 89  296 296 ASP ASP A . n 
A 1 90  GLN 90  297 297 GLN GLN A . n 
A 1 91  MET 91  298 298 MET MET A . n 
A 1 92  SER 92  299 299 SER SER A . n 
A 1 93  LEU 93  300 300 LEU LEU A . n 
A 1 94  LEU 94  301 301 LEU LEU A . n 
A 1 95  GLN 95  302 302 GLN GLN A . n 
A 1 96  SER 96  303 303 SER SER A . n 
A 1 97  ALA 97  304 304 ALA ALA A . n 
A 1 98  TRP 98  305 305 TRP TRP A . n 
A 1 99  MET 99  306 306 MET MET A . n 
A 1 100 GLU 100 307 307 GLU GLU A . n 
A 1 101 ILE 101 308 308 ILE ILE A . n 
A 1 102 LEU 102 309 309 LEU LEU A . n 
A 1 103 ILE 103 310 310 ILE ILE A . n 
A 1 104 LEU 104 311 311 LEU LEU A . n 
A 1 105 GLY 105 312 312 GLY GLY A . n 
A 1 106 VAL 106 313 313 VAL VAL A . n 
A 1 107 VAL 107 314 314 VAL VAL A . n 
A 1 108 TYR 108 315 315 TYR TYR A . n 
A 1 109 ARG 109 316 316 ARG ARG A . n 
A 1 110 SER 110 317 317 SER SER A . n 
A 1 111 LEU 111 318 318 LEU LEU A . n 
A 1 112 SER 112 319 319 SER SER A . n 
A 1 113 PHE 113 320 320 PHE PHE A . n 
A 1 114 GLU 114 321 321 GLU GLU A . n 
A 1 115 ASP 115 322 322 ASP ASP A . n 
A 1 116 GLU 116 323 323 GLU GLU A . n 
A 1 117 LEU 117 324 324 LEU LEU A . n 
A 1 118 VAL 118 325 325 VAL VAL A . n 
A 1 119 TYR 119 326 326 TYR TYR A . n 
A 1 120 ALA 120 327 327 ALA ALA A . n 
A 1 121 ASP 121 328 328 ASP ASP A . n 
A 1 122 ASP 122 329 329 ASP ASP A . n 
A 1 123 TYR 123 330 330 TYR TYR A . n 
A 1 124 ILE 124 331 331 ILE ILE A . n 
A 1 125 MET 125 332 332 MET MET A . n 
A 1 126 ASP 126 333 333 ASP ASP A . n 
A 1 127 GLU 127 334 334 GLU GLU A . n 
A 1 128 ASP 128 335 335 ASP ASP A . n 
A 1 129 GLN 129 336 336 GLN GLN A . n 
A 1 130 SER 130 337 337 SER SER A . n 
A 1 131 LYS 131 338 338 LYS LYS A . n 
A 1 132 LEU 132 339 339 LEU LEU A . n 
A 1 133 ALA 133 340 340 ALA ALA A . n 
A 1 134 GLY 134 341 341 GLY GLY A . n 
A 1 135 LEU 135 342 342 LEU LEU A . n 
A 1 136 LEU 136 343 343 LEU LEU A . n 
A 1 137 ASP 137 344 344 ASP ASP A . n 
A 1 138 LEU 138 345 345 LEU LEU A . n 
A 1 139 ASN 139 346 346 ASN ASN A . n 
A 1 140 ASN 140 347 347 ASN ASN A . n 
A 1 141 ALA 141 348 348 ALA ALA A . n 
A 1 142 ILE 142 349 349 ILE ILE A . n 
A 1 143 LEU 143 350 350 LEU LEU A . n 
A 1 144 GLN 144 351 351 GLN GLN A . n 
A 1 145 LEU 145 352 352 LEU LEU A . n 
A 1 146 VAL 146 353 353 VAL VAL A . n 
A 1 147 LYS 147 354 354 LYS LYS A . n 
A 1 148 LYS 148 355 355 LYS LYS A . n 
A 1 149 TYR 149 356 356 TYR TYR A . n 
A 1 150 LYS 150 357 357 LYS LYS A . n 
A 1 151 SER 151 358 358 SER SER A . n 
A 1 152 MET 152 359 359 MET MET A . n 
A 1 153 LYS 153 360 360 LYS LYS A . n 
A 1 154 LEU 154 361 361 LEU LEU A . n 
A 1 155 GLU 155 362 362 GLU GLU A . n 
A 1 156 LYS 156 363 363 LYS LYS A . n 
A 1 157 GLU 157 364 364 GLU GLU A . n 
A 1 158 GLU 158 365 365 GLU GLU A . n 
A 1 159 PHE 159 366 366 PHE PHE A . n 
A 1 160 VAL 160 367 367 VAL VAL A . n 
A 1 161 THR 161 368 368 THR THR A . n 
A 1 162 LEU 162 369 369 LEU LEU A . n 
A 1 163 LYS 163 370 370 LYS LYS A . n 
A 1 164 ALA 164 371 371 ALA ALA A . n 
A 1 165 ILE 165 372 372 ILE ILE A . n 
A 1 166 ALA 166 373 373 ALA ALA A . n 
A 1 167 LEU 167 374 374 LEU LEU A . n 
A 1 168 ALA 168 375 375 ALA ALA A . n 
A 1 169 ASN 169 376 376 ASN ASN A . n 
A 1 170 SER 170 377 377 SER SER A . n 
A 1 171 ASP 171 378 378 ASP ASP A . n 
A 1 172 SER 172 379 379 SER SER A . n 
A 1 173 MET 173 380 380 MET MET A . n 
A 1 174 HIS 174 381 381 HIS HIS A . n 
A 1 175 ILE 175 382 382 ILE ILE A . n 
A 1 176 GLU 176 383 383 GLU GLU A . n 
A 1 177 ASP 177 384 384 ASP ASP A . n 
A 1 178 VAL 178 385 385 VAL VAL A . n 
A 1 179 GLU 179 386 386 GLU GLU A . n 
A 1 180 ALA 180 387 387 ALA ALA A . n 
A 1 181 VAL 181 388 388 VAL VAL A . n 
A 1 182 GLN 182 389 389 GLN GLN A . n 
A 1 183 LYS 183 390 390 LYS LYS A . n 
A 1 184 LEU 184 391 391 LEU LEU A . n 
A 1 185 GLN 185 392 392 GLN GLN A . n 
A 1 186 ASP 186 393 393 ASP ASP A . n 
A 1 187 VAL 187 394 394 VAL VAL A . n 
A 1 188 LEU 188 395 395 LEU LEU A . n 
A 1 189 HIS 189 396 396 HIS HIS A . n 
A 1 190 GLU 190 397 397 GLU GLU A . n 
A 1 191 ALA 191 398 398 ALA ALA A . n 
A 1 192 LEU 192 399 399 LEU LEU A . n 
A 1 193 GLN 193 400 400 GLN GLN A . n 
A 1 194 ASP 194 401 401 ASP ASP A . n 
A 1 195 TYR 195 402 402 TYR TYR A . n 
A 1 196 GLU 196 403 403 GLU GLU A . n 
A 1 197 ALA 197 404 404 ALA ALA A . n 
A 1 198 GLY 198 405 405 GLY GLY A . n 
A 1 199 GLN 199 406 406 GLN GLN A . n 
A 1 200 HIS 200 407 407 HIS HIS A . n 
A 1 201 MET 201 408 408 MET MET A . n 
A 1 202 GLU 202 409 409 GLU GLU A . n 
A 1 203 ASP 203 410 410 ASP ASP A . n 
A 1 204 PRO 204 411 411 PRO PRO A . n 
A 1 205 ARG 205 412 412 ARG ARG A . n 
A 1 206 ARG 206 413 413 ARG ARG A . n 
A 1 207 ALA 207 414 414 ALA ALA A . n 
A 1 208 GLY 208 415 415 GLY GLY A . n 
A 1 209 LYS 209 416 416 LYS LYS A . n 
A 1 210 MET 210 417 417 MET MET A . n 
A 1 211 LEU 211 418 418 LEU LEU A . n 
A 1 212 MET 212 419 419 MET MET A . n 
A 1 213 THR 213 420 420 THR THR A . n 
A 1 214 LEU 214 421 421 LEU LEU A . n 
A 1 215 PRO 215 422 422 PRO PRO A . n 
A 1 216 LEU 216 423 423 LEU LEU A . n 
A 1 217 LEU 217 424 424 LEU LEU A . n 
A 1 218 ARG 218 425 425 ARG ARG A . n 
A 1 219 GLN 219 426 426 GLN GLN A . n 
A 1 220 THR 220 427 427 THR THR A . n 
A 1 221 SER 221 428 428 SER SER A . n 
A 1 222 THR 222 429 429 THR THR A . n 
A 1 223 LYS 223 430 430 LYS LYS A . n 
A 1 224 ALA 224 431 431 ALA ALA A . n 
A 1 225 VAL 225 432 432 VAL VAL A . n 
A 1 226 GLN 226 433 433 GLN GLN A . n 
A 1 227 HIS 227 434 434 HIS HIS A . n 
A 1 228 PHE 228 435 435 PHE PHE A . n 
A 1 229 TYR 229 436 436 TYR TYR A . n 
A 1 230 ASN 230 437 437 ASN ASN A . n 
A 1 231 ILE 231 438 438 ILE ILE A . n 
A 1 232 LYS 232 439 439 LYS LYS A . n 
A 1 233 LEU 233 440 440 LEU LEU A . n 
A 1 234 GLU 234 441 441 GLU GLU A . n 
A 1 235 GLY 235 442 442 GLY GLY A . n 
A 1 236 LYS 236 443 443 LYS LYS A . n 
A 1 237 VAL 237 444 444 VAL VAL A . n 
A 1 238 PRO 238 445 445 PRO PRO A . n 
A 1 239 MET 239 446 446 MET MET A . n 
A 1 240 HIS 240 447 447 HIS HIS A . n 
A 1 241 LYS 241 448 448 LYS LYS A . n 
A 1 242 LEU 242 449 449 LEU LEU A . n 
A 1 243 PHE 243 450 450 PHE PHE A . n 
A 1 244 LEU 244 451 451 LEU LEU A . n 
A 1 245 GLU 245 452 452 GLU GLU A . n 
A 1 246 MET 246 453 453 MET MET A . n 
A 1 247 LEU 247 454 454 LEU LEU A . n 
A 1 248 GLU 248 455 455 GLU GLU A . n 
A 1 249 ALA 249 456 456 ALA ALA A . n 
A 1 250 LYS 250 457 457 LYS LYS A . n 
A 1 251 VAL 251 458 ?   ?   ?   A . n 
B 2 1   ASN 1   376 ?   ?   ?   C . n 
B 2 2   ASN 2   377 ?   ?   ?   C . n 
B 2 3   SER 3   378 378 SER SER C . n 
B 2 4   LEU 4   379 379 LEU LEU C . n 
B 2 5   LEU 5   380 380 LEU LEU C . n 
B 2 6   LEU 6   381 381 LEU LEU C . n 
B 2 7   HIS 7   382 382 HIS HIS C . n 
B 2 8   LEU 8   383 383 LEU LEU C . n 
B 2 9   LEU 9   384 384 LEU LEU C . n 
B 2 10  LYS 10  385 385 LYS LYS C . n 
B 2 11  SER 11  386 386 SER SER C . n 
B 2 12  GLN 12  387 ?   ?   ?   C . n 
B 2 13  THR 13  388 ?   ?   ?   C . n 
B 2 14  ILE 14  389 ?   ?   ?   C . n 
B 2 15  PRO 15  390 ?   ?   ?   C . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        A1EGD 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   A1EGD 
_pdbx_entity_instance_feature.auth_asym_id   ? 
_pdbx_entity_instance_feature.auth_seq_num   ? 
_pdbx_entity_instance_feature.feature_type   'SUBJECT OF INVESTIGATION' 
_pdbx_entity_instance_feature.details        ? 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
C 3 A1EGD 1   501 501 A1EGD XT6 A . 
D 4 HOH   1   601 144 HOH   HOH A . 
D 4 HOH   2   602 145 HOH   HOH A . 
D 4 HOH   3   603 134 HOH   HOH A . 
D 4 HOH   4   604 146 HOH   HOH A . 
D 4 HOH   5   605 118 HOH   HOH A . 
D 4 HOH   6   606 60  HOH   HOH A . 
D 4 HOH   7   607 161 HOH   HOH A . 
D 4 HOH   8   608 174 HOH   HOH A . 
D 4 HOH   9   609 106 HOH   HOH A . 
D 4 HOH   10  610 168 HOH   HOH A . 
D 4 HOH   11  611 92  HOH   HOH A . 
D 4 HOH   12  612 158 HOH   HOH A . 
D 4 HOH   13  613 112 HOH   HOH A . 
D 4 HOH   14  614 87  HOH   HOH A . 
D 4 HOH   15  615 111 HOH   HOH A . 
D 4 HOH   16  616 80  HOH   HOH A . 
D 4 HOH   17  617 143 HOH   HOH A . 
D 4 HOH   18  618 183 HOH   HOH A . 
D 4 HOH   19  619 16  HOH   HOH A . 
D 4 HOH   20  620 133 HOH   HOH A . 
D 4 HOH   21  621 46  HOH   HOH A . 
D 4 HOH   22  622 140 HOH   HOH A . 
D 4 HOH   23  623 149 HOH   HOH A . 
D 4 HOH   24  624 30  HOH   HOH A . 
D 4 HOH   25  625 120 HOH   HOH A . 
D 4 HOH   26  626 1   HOH   HOH A . 
D 4 HOH   27  627 36  HOH   HOH A . 
D 4 HOH   28  628 58  HOH   HOH A . 
D 4 HOH   29  629 104 HOH   HOH A . 
D 4 HOH   30  630 125 HOH   HOH A . 
D 4 HOH   31  631 181 HOH   HOH A . 
D 4 HOH   32  632 63  HOH   HOH A . 
D 4 HOH   33  633 113 HOH   HOH A . 
D 4 HOH   34  634 48  HOH   HOH A . 
D 4 HOH   35  635 97  HOH   HOH A . 
D 4 HOH   36  636 76  HOH   HOH A . 
D 4 HOH   37  637 37  HOH   HOH A . 
D 4 HOH   38  638 99  HOH   HOH A . 
D 4 HOH   39  639 78  HOH   HOH A . 
D 4 HOH   40  640 101 HOH   HOH A . 
D 4 HOH   41  641 23  HOH   HOH A . 
D 4 HOH   42  642 12  HOH   HOH A . 
D 4 HOH   43  643 191 HOH   HOH A . 
D 4 HOH   44  644 10  HOH   HOH A . 
D 4 HOH   45  645 127 HOH   HOH A . 
D 4 HOH   46  646 171 HOH   HOH A . 
D 4 HOH   47  647 165 HOH   HOH A . 
D 4 HOH   48  648 65  HOH   HOH A . 
D 4 HOH   49  649 47  HOH   HOH A . 
D 4 HOH   50  650 4   HOH   HOH A . 
D 4 HOH   51  651 54  HOH   HOH A . 
D 4 HOH   52  652 27  HOH   HOH A . 
D 4 HOH   53  653 14  HOH   HOH A . 
D 4 HOH   54  654 190 HOH   HOH A . 
D 4 HOH   55  655 130 HOH   HOH A . 
D 4 HOH   56  656 5   HOH   HOH A . 
D 4 HOH   57  657 156 HOH   HOH A . 
D 4 HOH   58  658 20  HOH   HOH A . 
D 4 HOH   59  659 79  HOH   HOH A . 
D 4 HOH   60  660 6   HOH   HOH A . 
D 4 HOH   61  661 64  HOH   HOH A . 
D 4 HOH   62  662 123 HOH   HOH A . 
D 4 HOH   63  663 26  HOH   HOH A . 
D 4 HOH   64  664 167 HOH   HOH A . 
D 4 HOH   65  665 25  HOH   HOH A . 
D 4 HOH   66  666 11  HOH   HOH A . 
D 4 HOH   67  667 44  HOH   HOH A . 
D 4 HOH   68  668 129 HOH   HOH A . 
D 4 HOH   69  669 24  HOH   HOH A . 
D 4 HOH   70  670 188 HOH   HOH A . 
D 4 HOH   71  671 3   HOH   HOH A . 
D 4 HOH   72  672 102 HOH   HOH A . 
D 4 HOH   73  673 141 HOH   HOH A . 
D 4 HOH   74  674 193 HOH   HOH A . 
D 4 HOH   75  675 96  HOH   HOH A . 
D 4 HOH   76  676 109 HOH   HOH A . 
D 4 HOH   77  677 34  HOH   HOH A . 
D 4 HOH   78  678 105 HOH   HOH A . 
D 4 HOH   79  679 184 HOH   HOH A . 
D 4 HOH   80  680 86  HOH   HOH A . 
D 4 HOH   81  681 81  HOH   HOH A . 
D 4 HOH   82  682 100 HOH   HOH A . 
D 4 HOH   83  683 89  HOH   HOH A . 
D 4 HOH   84  684 22  HOH   HOH A . 
D 4 HOH   85  685 32  HOH   HOH A . 
D 4 HOH   86  686 42  HOH   HOH A . 
D 4 HOH   87  687 88  HOH   HOH A . 
D 4 HOH   88  688 33  HOH   HOH A . 
D 4 HOH   89  689 192 HOH   HOH A . 
D 4 HOH   90  690 70  HOH   HOH A . 
D 4 HOH   91  691 7   HOH   HOH A . 
D 4 HOH   92  692 39  HOH   HOH A . 
D 4 HOH   93  693 69  HOH   HOH A . 
D 4 HOH   94  694 31  HOH   HOH A . 
D 4 HOH   95  695 186 HOH   HOH A . 
D 4 HOH   96  696 51  HOH   HOH A . 
D 4 HOH   97  697 8   HOH   HOH A . 
D 4 HOH   98  698 91  HOH   HOH A . 
D 4 HOH   99  699 142 HOH   HOH A . 
D 4 HOH   100 700 68  HOH   HOH A . 
D 4 HOH   101 701 150 HOH   HOH A . 
D 4 HOH   102 702 187 HOH   HOH A . 
D 4 HOH   103 703 45  HOH   HOH A . 
D 4 HOH   104 704 17  HOH   HOH A . 
D 4 HOH   105 705 93  HOH   HOH A . 
D 4 HOH   106 706 155 HOH   HOH A . 
D 4 HOH   107 707 83  HOH   HOH A . 
D 4 HOH   108 708 43  HOH   HOH A . 
D 4 HOH   109 709 162 HOH   HOH A . 
D 4 HOH   110 710 66  HOH   HOH A . 
D 4 HOH   111 711 52  HOH   HOH A . 
D 4 HOH   112 712 90  HOH   HOH A . 
D 4 HOH   113 713 71  HOH   HOH A . 
D 4 HOH   114 714 160 HOH   HOH A . 
D 4 HOH   115 715 2   HOH   HOH A . 
D 4 HOH   116 716 57  HOH   HOH A . 
D 4 HOH   117 717 18  HOH   HOH A . 
D 4 HOH   118 718 40  HOH   HOH A . 
D 4 HOH   119 719 62  HOH   HOH A . 
D 4 HOH   120 720 21  HOH   HOH A . 
D 4 HOH   121 721 55  HOH   HOH A . 
D 4 HOH   122 722 177 HOH   HOH A . 
D 4 HOH   123 723 115 HOH   HOH A . 
D 4 HOH   124 724 98  HOH   HOH A . 
D 4 HOH   125 725 61  HOH   HOH A . 
D 4 HOH   126 726 124 HOH   HOH A . 
D 4 HOH   127 727 147 HOH   HOH A . 
D 4 HOH   128 728 49  HOH   HOH A . 
D 4 HOH   129 729 29  HOH   HOH A . 
D 4 HOH   130 730 172 HOH   HOH A . 
D 4 HOH   131 731 179 HOH   HOH A . 
D 4 HOH   132 732 82  HOH   HOH A . 
D 4 HOH   133 733 178 HOH   HOH A . 
D 4 HOH   134 734 139 HOH   HOH A . 
D 4 HOH   135 735 75  HOH   HOH A . 
D 4 HOH   136 736 15  HOH   HOH A . 
D 4 HOH   137 737 19  HOH   HOH A . 
D 4 HOH   138 738 9   HOH   HOH A . 
D 4 HOH   139 739 173 HOH   HOH A . 
D 4 HOH   140 740 131 HOH   HOH A . 
D 4 HOH   141 741 196 HOH   HOH A . 
D 4 HOH   142 742 77  HOH   HOH A . 
D 4 HOH   143 743 94  HOH   HOH A . 
D 4 HOH   144 744 110 HOH   HOH A . 
D 4 HOH   145 745 74  HOH   HOH A . 
D 4 HOH   146 746 13  HOH   HOH A . 
D 4 HOH   147 747 176 HOH   HOH A . 
D 4 HOH   148 748 157 HOH   HOH A . 
D 4 HOH   149 749 195 HOH   HOH A . 
D 4 HOH   150 750 28  HOH   HOH A . 
D 4 HOH   151 751 67  HOH   HOH A . 
D 4 HOH   152 752 85  HOH   HOH A . 
D 4 HOH   153 753 73  HOH   HOH A . 
D 4 HOH   154 754 122 HOH   HOH A . 
D 4 HOH   155 755 152 HOH   HOH A . 
D 4 HOH   156 756 59  HOH   HOH A . 
D 4 HOH   157 757 38  HOH   HOH A . 
D 4 HOH   158 758 154 HOH   HOH A . 
D 4 HOH   159 759 170 HOH   HOH A . 
D 4 HOH   160 760 35  HOH   HOH A . 
D 4 HOH   161 761 175 HOH   HOH A . 
D 4 HOH   162 762 164 HOH   HOH A . 
D 4 HOH   163 763 107 HOH   HOH A . 
D 4 HOH   164 764 108 HOH   HOH A . 
D 4 HOH   165 765 137 HOH   HOH A . 
D 4 HOH   166 766 148 HOH   HOH A . 
D 4 HOH   167 767 95  HOH   HOH A . 
D 4 HOH   168 768 132 HOH   HOH A . 
D 4 HOH   169 769 114 HOH   HOH A . 
D 4 HOH   170 770 72  HOH   HOH A . 
D 4 HOH   171 771 117 HOH   HOH A . 
D 4 HOH   172 772 194 HOH   HOH A . 
D 4 HOH   173 773 126 HOH   HOH A . 
D 4 HOH   174 774 185 HOH   HOH A . 
D 4 HOH   175 775 159 HOH   HOH A . 
D 4 HOH   176 776 56  HOH   HOH A . 
D 4 HOH   177 777 128 HOH   HOH A . 
D 4 HOH   178 778 103 HOH   HOH A . 
D 4 HOH   179 779 50  HOH   HOH A . 
D 4 HOH   180 780 166 HOH   HOH A . 
D 4 HOH   181 781 135 HOH   HOH A . 
D 4 HOH   182 782 169 HOH   HOH A . 
D 4 HOH   183 783 151 HOH   HOH A . 
D 4 HOH   184 784 116 HOH   HOH A . 
D 4 HOH   185 785 189 HOH   HOH A . 
D 4 HOH   186 786 84  HOH   HOH A . 
D 4 HOH   187 787 138 HOH   HOH A . 
D 4 HOH   188 788 153 HOH   HOH A . 
D 4 HOH   189 789 163 HOH   HOH A . 
D 4 HOH   190 790 41  HOH   HOH A . 
D 4 HOH   191 791 119 HOH   HOH A . 
D 4 HOH   192 792 136 HOH   HOH A . 
D 4 HOH   193 793 53  HOH   HOH A . 
D 4 HOH   194 794 121 HOH   HOH A . 
D 4 HOH   195 795 182 HOH   HOH A . 
D 4 HOH   196 796 180 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  ? ? ? 5.8.0258 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? .        2 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? DIALS   ? ? ? .        3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? MOLREP  ? ? ? .        4 
# 
_cell.angle_alpha                  90.00 
_cell.angle_alpha_esd              ? 
_cell.angle_beta                   90.00 
_cell.angle_beta_esd               ? 
_cell.angle_gamma                  90.00 
_cell.angle_gamma_esd              ? 
_cell.entry_id                     9KNG 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     64.292 
_cell.length_a_esd                 ? 
_cell.length_b                     64.292 
_cell.length_b_esd                 ? 
_cell.length_c                     137.907 
_cell.length_c_esd                 ? 
_cell.volume                       ? 
_cell.volume_esd                   ? 
_cell.Z_PDB                        8 
_cell.reciprocal_angle_alpha       ? 
_cell.reciprocal_angle_beta        ? 
_cell.reciprocal_angle_gamma       ? 
_cell.reciprocal_angle_alpha_esd   ? 
_cell.reciprocal_angle_beta_esd    ? 
_cell.reciprocal_angle_gamma_esd   ? 
_cell.reciprocal_length_a          ? 
_cell.reciprocal_length_b          ? 
_cell.reciprocal_length_c          ? 
_cell.reciprocal_length_a_esd      ? 
_cell.reciprocal_length_b_esd      ? 
_cell.reciprocal_length_c_esd      ? 
_cell.pdbx_unique_axis             ? 
_cell.pdbx_esd_method              ? 
# 
_symmetry.entry_id                         9KNG 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                92 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 41 21 2' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   9KNG 
_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             2.37 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          48.08 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              ? 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '30%(w/v) PEG 5000 MME, 0.1M Tris 8.0, 0.2M lithium sulfate' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            293 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS PILATUS 6M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2015-01-09 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97875 
_diffrn_radiation_wavelength.wt           1.0 
# 
_diffrn_source.current                     ? 
_diffrn_source.details                     ? 
_diffrn_source.diffrn_id                   1 
_diffrn_source.power                       ? 
_diffrn_source.size                        ? 
_diffrn_source.source                      SYNCHROTRON 
_diffrn_source.target                      ? 
_diffrn_source.type                        'SSRF BEAMLINE BL17U1' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.97875 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   BL17U1 
_diffrn_source.pdbx_synchrotron_site       SSRF 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9KNG 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.50 
_reflns.d_resolution_low                               64.29 
_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                                     47222 
_reflns.observed_criterion                             ? 
_reflns.observed_criterion_F_max                       ? 
_reflns.observed_criterion_F_min                       ? 
_reflns.observed_criterion_I_max                       ? 
_reflns.observed_criterion_I_min                       ? 
_reflns.observed_criterion_sigma_F                     ? 
_reflns.observed_criterion_sigma_I                     ? 
_reflns.percent_possible_obs                           99.9 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                24.0 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          29.3 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               1.00 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.061 
_reflns.pdbx_Rpim_I_all                                0.012 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       1135439 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.999 
_reflns.pdbx_CC_star                                   ? 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.060 
_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                                    1.50 
_reflns_shell.d_res_low                                     1.53 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           33386 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             2275 
_reflns_shell.percent_possible_obs                          99.1 
_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                               14.7 
_reflns_shell.pdbx_chi_squared                              0.82 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     2.8 
_reflns_shell.pdbx_Rrim_I_all                               0.921 
_reflns_shell.pdbx_Rpim_I_all                               0.231 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.861 
_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                                  0.889 
_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]                            -0.43 
_refine.aniso_B[1][2]                            0.00 
_refine.aniso_B[1][3]                            0.00 
_refine.aniso_B[2][2]                            -0.43 
_refine.aniso_B[2][3]                            0.00 
_refine.aniso_B[3][3]                            0.86 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               25.047 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               0.966 
_refine.correlation_coeff_Fo_to_Fc_free          0.948 
_refine.details                                  'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 9KNG 
_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                            1.50 
_refine.ls_d_res_low                             47.07 
_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                     44782 
_refine.ls_number_reflns_R_free                  2317 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.81 
_refine.ls_percent_reflns_R_free                 4.9 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.19357 
_refine.ls_R_factor_R_free                       0.23350 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.19153 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    MASK 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          ? 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               THROUGHOUT 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       'MAXIMUM LIKELIHOOD' 
_refine.pdbx_R_Free_selection_details            RANDOM 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       0.070 
_refine.pdbx_overall_ESU_R_Free                  0.077 
_refine.pdbx_solvent_vdw_probe_radii             1.20 
_refine.pdbx_solvent_ion_probe_radii             0.80 
_refine.pdbx_solvent_shrinkage_radii             0.80 
_refine.pdbx_real_space_R                        ? 
_refine.pdbx_density_correlation                 ? 
_refine.pdbx_pd_number_of_powder_patterns        ? 
_refine.pdbx_pd_number_of_points                 ? 
_refine.pdbx_pd_meas_number_of_points            ? 
_refine.pdbx_pd_proc_ls_prof_R_factor            ? 
_refine.pdbx_pd_proc_ls_prof_wR_factor           ? 
_refine.pdbx_pd_Marquardt_correlation_coeff      ? 
_refine.pdbx_pd_Fsqrd_R_factor                   ? 
_refine.pdbx_pd_ls_matrix_band_width             ? 
_refine.pdbx_overall_phase_error                 ? 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             1.305 
_refine.overall_SU_ML                            0.049 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         1 
_refine_hist.details                          ? 
_refine_hist.d_res_high                       1.50 
_refine_hist.d_res_low                        47.07 
_refine_hist.number_atoms_solvent             196 
_refine_hist.number_atoms_total               2061 
_refine_hist.number_reflns_all                ? 
_refine_hist.number_reflns_obs                ? 
_refine_hist.number_reflns_R_free             ? 
_refine_hist.number_reflns_R_work             ? 
_refine_hist.R_factor_all                     ? 
_refine_hist.R_factor_obs                     ? 
_refine_hist.R_factor_R_free                  ? 
_refine_hist.R_factor_R_work                  ? 
_refine_hist.pdbx_number_residues_total       ? 
_refine_hist.pdbx_B_iso_mean_ligand           ? 
_refine_hist.pdbx_B_iso_mean_solvent          ? 
_refine_hist.pdbx_number_atoms_protein        1853 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         12 
_refine_hist.pdbx_number_atoms_lipid          ? 
_refine_hist.pdbx_number_atoms_carb           ? 
_refine_hist.pdbx_pseudo_atom_details         ? 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.013  0.013  1941 ? r_bond_refined_d             ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.017  1887 ? r_bond_other_d               ? ? 
'X-RAY DIFFRACTION' ? 1.932  1.636  2636 ? r_angle_refined_deg          ? ? 
'X-RAY DIFFRACTION' ? 1.560  1.583  4404 ? r_angle_other_deg            ? ? 
'X-RAY DIFFRACTION' ? 5.194  5.000  247  ? r_dihedral_angle_1_deg       ? ? 
'X-RAY DIFFRACTION' ? 32.646 25.000 86   ? r_dihedral_angle_2_deg       ? ? 
'X-RAY DIFFRACTION' ? 14.182 15.000 381  ? r_dihedral_angle_3_deg       ? ? 
'X-RAY DIFFRACTION' ? 18.397 15.000 5    ? r_dihedral_angle_4_deg       ? ? 
'X-RAY DIFFRACTION' ? 0.098  0.200  255  ? r_chiral_restr               ? ? 
'X-RAY DIFFRACTION' ? 0.009  0.020  2104 ? r_gen_planes_refined         ? ? 
'X-RAY DIFFRACTION' ? 0.001  0.020  345  ? r_gen_planes_other           ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbd_refined                ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbd_other                  ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbtor_refined              ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_nbtor_other                ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_xyhbond_nbd_refined        ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_xyhbond_nbd_other          ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_metal_ion_refined          ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_metal_ion_other            ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_vdw_refined       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_vdw_other         ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_hbond_refined     ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_hbond_other       ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_metal_ion_refined ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_symmetry_metal_ion_other   ? ? 
'X-RAY DIFFRACTION' ? 2.193  2.363  946  ? r_mcbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 2.193  2.360  945  ? r_mcbond_other               ? ? 
'X-RAY DIFFRACTION' ? 3.048  3.535  1183 ? r_mcangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 3.047  3.539  1184 ? r_mcangle_other              ? ? 
'X-RAY DIFFRACTION' ? 3.456  2.792  995  ? r_scbond_it                  ? ? 
'X-RAY DIFFRACTION' ? 3.456  2.792  995  ? r_scbond_other               ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_scangle_it                 ? ? 
'X-RAY DIFFRACTION' ? 5.146  4.032  1446 ? r_scangle_other              ? ? 
'X-RAY DIFFRACTION' ? 6.176  28.840 2262 ? r_long_range_B_refined       ? ? 
'X-RAY DIFFRACTION' ? 6.021  28.303 2213 ? r_long_range_B_other         ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_rigid_bond_restr           ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_sphericity_free            ? ? 
'X-RAY DIFFRACTION' ? ?      ?      ?    ? r_sphericity_bonded          ? ? 
# 
_refine_ls_shell.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_ls_shell.d_res_high                       1.500 
_refine_ls_shell.d_res_low                        1.539 
_refine_ls_shell.number_reflns_all                ? 
_refine_ls_shell.number_reflns_obs                ? 
_refine_ls_shell.number_reflns_R_free             164 
_refine_ls_shell.number_reflns_R_work             3234 
_refine_ls_shell.percent_reflns_obs               99.12 
_refine_ls_shell.percent_reflns_R_free            ? 
_refine_ls_shell.R_factor_all                     ? 
_refine_ls_shell.R_factor_obs                     ? 
_refine_ls_shell.R_factor_R_free_error            ? 
_refine_ls_shell.R_factor_R_work                  0.278 
_refine_ls_shell.redundancy_reflns_all            ? 
_refine_ls_shell.redundancy_reflns_obs            ? 
_refine_ls_shell.wR_factor_all                    ? 
_refine_ls_shell.wR_factor_obs                    ? 
_refine_ls_shell.wR_factor_R_free                 ? 
_refine_ls_shell.wR_factor_R_work                 ? 
_refine_ls_shell.pdbx_R_complete                  ? 
_refine_ls_shell.pdbx_total_number_of_bins_used   20 
_refine_ls_shell.pdbx_phase_error                 ? 
_refine_ls_shell.pdbx_fsc_work                    ? 
_refine_ls_shell.pdbx_fsc_free                    ? 
_refine_ls_shell.R_factor_R_free                  0.305 
# 
_struct.entry_id                     9KNG 
_struct.title                        'Crystal structure of human ERRg LBD in complex with 4034496' 
_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        9KNG 
_struct_keywords.text            'EsRRG, LBD, nuclear receptor, complex structure, TRANSCRIPTION' 
_struct_keywords.pdbx_keywords   TRANSCRIPTION 
# 
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 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 UNP ERR3_HUMAN  P62508 ? 1 
;PAKKPYNKIVSHLLVAEPEKIYAMPDPTVPDSDIKALTTLCDLADRELVVIIGWAKHIPGFSTLSLADQMSLLQSAWMEI
LILGVVYRSLSFEDELVYADDYIMDEDQSKLAGLLDLNNAILQLVKKYKSMKLEKEEFVTLKAIALANSDSMHIEDVEAV
QKLQDVLHEALQDYEAGQHMEDPRRAGKMLMTLPLLRQTSTKAVQHFYNIKLEGKVPMHKLFLEMLEAKV
;
229 
2 UNP NRIP1_HUMAN P48552 ? 2 NNSLLLHLLKSQTIP 376 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 9KNG A 22 ? 251 ? P62508 229 ? 458 ? 229 458 
2 2 9KNG C 1  ? 15  ? P48552 376 ? 390 ? 376 390 
# 
loop_
_struct_ref_seq_dif.align_id 
_struct_ref_seq_dif.pdbx_pdb_id_code 
_struct_ref_seq_dif.mon_id 
_struct_ref_seq_dif.pdbx_pdb_strand_id 
_struct_ref_seq_dif.seq_num 
_struct_ref_seq_dif.pdbx_pdb_ins_code 
_struct_ref_seq_dif.pdbx_seq_db_name 
_struct_ref_seq_dif.pdbx_seq_db_accession_code 
_struct_ref_seq_dif.db_mon_id 
_struct_ref_seq_dif.pdbx_seq_db_seq_num 
_struct_ref_seq_dif.details 
_struct_ref_seq_dif.pdbx_auth_seq_num 
_struct_ref_seq_dif.pdbx_ordinal 
1 9KNG MET A 1  ? UNP P62508 ? ? 'initiating methionine' 208 1  
1 9KNG GLY A 2  ? UNP P62508 ? ? 'expression tag'        209 2  
1 9KNG SER A 3  ? UNP P62508 ? ? 'expression tag'        210 3  
1 9KNG SER A 4  ? UNP P62508 ? ? 'expression tag'        211 4  
1 9KNG HIS A 5  ? UNP P62508 ? ? 'expression tag'        212 5  
1 9KNG HIS A 6  ? UNP P62508 ? ? 'expression tag'        213 6  
1 9KNG HIS A 7  ? UNP P62508 ? ? 'expression tag'        214 7  
1 9KNG HIS A 8  ? UNP P62508 ? ? 'expression tag'        215 8  
1 9KNG HIS A 9  ? UNP P62508 ? ? 'expression tag'        216 9  
1 9KNG HIS A 10 ? UNP P62508 ? ? 'expression tag'        217 10 
1 9KNG SER A 11 ? UNP P62508 ? ? 'expression tag'        218 11 
1 9KNG SER A 12 ? UNP P62508 ? ? 'expression tag'        219 12 
1 9KNG GLY A 13 ? UNP P62508 ? ? 'expression tag'        220 13 
1 9KNG LEU A 14 ? UNP P62508 ? ? 'expression tag'        221 14 
1 9KNG VAL A 15 ? UNP P62508 ? ? 'expression tag'        222 15 
1 9KNG PRO A 16 ? UNP P62508 ? ? 'expression tag'        223 16 
1 9KNG ARG A 17 ? UNP P62508 ? ? 'expression tag'        224 17 
1 9KNG GLY A 18 ? UNP P62508 ? ? 'expression tag'        225 18 
1 9KNG SER A 19 ? UNP P62508 ? ? 'expression tag'        226 19 
1 9KNG HIS A 20 ? UNP P62508 ? ? 'expression tag'        227 20 
1 9KNG MET A 21 ? UNP P62508 ? ? 'expression tag'        228 21 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   tetrameric 
_pdbx_struct_assembly.oligomeric_count     4 
# 
loop_
_pdbx_struct_assembly_prop.biol_id 
_pdbx_struct_assembly_prop.type 
_pdbx_struct_assembly_prop.value 
_pdbx_struct_assembly_prop.details 
1 'ABSA (A^2)' 5350  ? 
1 MORE         -32   ? 
1 'SSA (A^2)'  20770 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1,2 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
loop_
_pdbx_struct_oper_list.id 
_pdbx_struct_oper_list.type 
_pdbx_struct_oper_list.name 
_pdbx_struct_oper_list.symmetry_operation 
_pdbx_struct_oper_list.matrix[1][1] 
_pdbx_struct_oper_list.matrix[1][2] 
_pdbx_struct_oper_list.matrix[1][3] 
_pdbx_struct_oper_list.vector[1] 
_pdbx_struct_oper_list.matrix[2][1] 
_pdbx_struct_oper_list.matrix[2][2] 
_pdbx_struct_oper_list.matrix[2][3] 
_pdbx_struct_oper_list.vector[2] 
_pdbx_struct_oper_list.matrix[3][1] 
_pdbx_struct_oper_list.matrix[3][2] 
_pdbx_struct_oper_list.matrix[3][3] 
_pdbx_struct_oper_list.vector[3] 
1 'identity operation'         1_555 x,y,z        1.0000000000 0.0000000000  0.0000000000 0.0000000000 0.0000000000  1.0000000000 
0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000  0.0000000000   
2 'crystal symmetry operation' 8_554 -y,-x,-z-1/2 0.0000000000 -1.0000000000 0.0000000000 0.0000000000 -1.0000000000 0.0000000000 
0.0000000000 0.0000000000 0.0000000000 0.0000000000 -1.0000000000 -68.9535000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 ASN A 28  ? ALA A 37  ? ASN A 235 ALA A 244 1 ? 10 
HELX_P HELX_P2  AA2 SER A 53  ? LYS A 77  ? SER A 260 LYS A 284 1 ? 25 
HELX_P HELX_P3  AA3 GLY A 81  ? LEU A 85  ? GLY A 288 LEU A 292 5 ? 5  
HELX_P HELX_P4  AA4 SER A 86  ? SER A 110 ? SER A 293 SER A 317 1 ? 25 
HELX_P HELX_P5  AA5 ASP A 126 ? GLY A 134 ? ASP A 333 GLY A 341 1 ? 9  
HELX_P HELX_P6  AA6 LEU A 135 ? MET A 152 ? LEU A 342 MET A 359 1 ? 18 
HELX_P HELX_P7  AA7 GLU A 155 ? ASN A 169 ? GLU A 362 ASN A 376 1 ? 15 
HELX_P HELX_P8  AA8 ASP A 177 ? HIS A 200 ? ASP A 384 HIS A 407 1 ? 24 
HELX_P HELX_P9  AA9 ARG A 205 ? MET A 212 ? ARG A 412 MET A 419 1 ? 8  
HELX_P HELX_P10 AB1 THR A 213 ? GLY A 235 ? THR A 420 GLY A 442 1 ? 23 
HELX_P HELX_P11 AB2 HIS A 240 ? LYS A 250 ? HIS A 447 LYS A 457 1 ? 11 
HELX_P HELX_P12 AB3 LEU B 4   ? SER B 11  ? LEU C 379 SER C 386 1 ? 8  
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
_struct_sheet.id               AA1 
_struct_sheet.type             ? 
_struct_sheet.number_strands   2 
_struct_sheet.details          ? 
# 
_struct_sheet_order.sheet_id     AA1 
_struct_sheet_order.range_id_1   1 
_struct_sheet_order.range_id_2   2 
_struct_sheet_order.offset       ? 
_struct_sheet_order.sense        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 LEU A 117 ? ALA A 120 ? LEU A 324 ALA A 327 
AA1 2 TYR A 123 ? MET A 125 ? TYR A 330 MET A 332 
# 
_pdbx_struct_sheet_hbond.sheet_id                AA1 
_pdbx_struct_sheet_hbond.range_id_1              1 
_pdbx_struct_sheet_hbond.range_id_2              2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id   N 
_pdbx_struct_sheet_hbond.range_1_label_comp_id   LEU 
_pdbx_struct_sheet_hbond.range_1_label_asym_id   A 
_pdbx_struct_sheet_hbond.range_1_label_seq_id    117 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code    ? 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id    N 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id    LEU 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id    A 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id     324 
_pdbx_struct_sheet_hbond.range_2_label_atom_id   O 
_pdbx_struct_sheet_hbond.range_2_label_comp_id   MET 
_pdbx_struct_sheet_hbond.range_2_label_asym_id   A 
_pdbx_struct_sheet_hbond.range_2_label_seq_id    125 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code    ? 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id    O 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id    MET 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id    A 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id     332 
# 
_pdbx_entry_details.entry_id                   9KNG 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.has_protein_modification   N 
# 
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 OD1 A ASP 393 ? A O A HOH 601 ? ? 1.79 
2 1 OD1 A ASP 393 ? A O A HOH 602 ? ? 1.81 
3 1 O   A HOH 604 ? ? O A HOH 762 ? ? 2.02 
4 1 O   A HOH 741 ? ? O A HOH 761 ? ? 2.16 
5 1 O   A HOH 719 ? ? O A HOH 788 ? ? 2.16 
6 1 OD1 A ASP 401 ? B O A HOH 603 ? ? 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     662 
_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     662 
_pdbx_validate_symm_contact.PDB_ins_code_2    ? 
_pdbx_validate_symm_contact.label_alt_id_2    ? 
_pdbx_validate_symm_contact.site_symmetry_2   8_554 
_pdbx_validate_symm_contact.dist              1.98 
# 
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 TYR A 330 ? ? -154.63 78.70 
2 1 ASN A 376 ? ? -98.49  31.27 
# 
_pdbx_struct_special_symmetry.id              1 
_pdbx_struct_special_symmetry.PDB_model_num   1 
_pdbx_struct_special_symmetry.auth_asym_id    A 
_pdbx_struct_special_symmetry.auth_comp_id    HOH 
_pdbx_struct_special_symmetry.auth_seq_id     766 
_pdbx_struct_special_symmetry.PDB_ins_code    ? 
_pdbx_struct_special_symmetry.label_asym_id   D 
_pdbx_struct_special_symmetry.label_comp_id   HOH 
_pdbx_struct_special_symmetry.label_seq_id    . 
# 
loop_
_pdbx_unobs_or_zero_occ_residues.id 
_pdbx_unobs_or_zero_occ_residues.PDB_model_num 
_pdbx_unobs_or_zero_occ_residues.polymer_flag 
_pdbx_unobs_or_zero_occ_residues.occupancy_flag 
_pdbx_unobs_or_zero_occ_residues.auth_asym_id 
_pdbx_unobs_or_zero_occ_residues.auth_comp_id 
_pdbx_unobs_or_zero_occ_residues.auth_seq_id 
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code 
_pdbx_unobs_or_zero_occ_residues.label_asym_id 
_pdbx_unobs_or_zero_occ_residues.label_comp_id 
_pdbx_unobs_or_zero_occ_residues.label_seq_id 
1  1 Y 1 A MET 208 ? A MET 1   
2  1 Y 1 A GLY 209 ? A GLY 2   
3  1 Y 1 A SER 210 ? A SER 3   
4  1 Y 1 A SER 211 ? A SER 4   
5  1 Y 1 A HIS 212 ? A HIS 5   
6  1 Y 1 A HIS 213 ? A HIS 6   
7  1 Y 1 A HIS 214 ? A HIS 7   
8  1 Y 1 A HIS 215 ? A HIS 8   
9  1 Y 1 A HIS 216 ? A HIS 9   
10 1 Y 1 A HIS 217 ? A HIS 10  
11 1 Y 1 A SER 218 ? A SER 11  
12 1 Y 1 A SER 219 ? A SER 12  
13 1 Y 1 A GLY 220 ? A GLY 13  
14 1 Y 1 A LEU 221 ? A LEU 14  
15 1 Y 1 A VAL 222 ? A VAL 15  
16 1 Y 1 A PRO 223 ? A PRO 16  
17 1 Y 1 A ARG 224 ? A ARG 17  
18 1 Y 1 A GLY 225 ? A GLY 18  
19 1 Y 1 A SER 226 ? A SER 19  
20 1 Y 1 A HIS 227 ? A HIS 20  
21 1 Y 1 A MET 228 ? A MET 21  
22 1 Y 1 A PRO 229 ? A PRO 22  
23 1 Y 1 A ALA 230 ? A ALA 23  
24 1 Y 1 A LYS 231 ? A LYS 24  
25 1 Y 1 A LYS 232 ? A LYS 25  
26 1 Y 1 A PRO 233 ? A PRO 26  
27 1 Y 1 A VAL 458 ? A VAL 251 
28 1 Y 1 C ASN 376 ? B ASN 1   
29 1 Y 1 C ASN 377 ? B ASN 2   
30 1 Y 1 C GLN 387 ? B GLN 12  
31 1 Y 1 C THR 388 ? B THR 13  
32 1 Y 1 C ILE 389 ? B ILE 14  
33 1 Y 1 C PRO 390 ? B PRO 15  
# 
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 
A1EGD C1   C N N 1   
A1EGD C2   C Y N 2   
A1EGD C3   C Y N 3   
A1EGD C4   C Y N 4   
A1EGD N1   N N N 5   
A1EGD C5   C Y N 6   
A1EGD N2   N Y N 7   
A1EGD C6   C Y N 8   
A1EGD N3   N N N 9   
A1EGD S1   S Y N 10  
A1EGD C7   C Y N 11  
A1EGD C8   C Y N 12  
A1EGD H1   H N N 13  
A1EGD H2   H N N 14  
A1EGD H3   H N N 15  
A1EGD H4   H N N 16  
A1EGD H5   H N N 17  
A1EGD H6   H N N 18  
A1EGD H7   H N N 19  
A1EGD H8   H N N 20  
A1EGD H9   H N N 21  
ALA   N    N N N 22  
ALA   CA   C N S 23  
ALA   C    C N N 24  
ALA   O    O N N 25  
ALA   CB   C N N 26  
ALA   OXT  O N N 27  
ALA   H    H N N 28  
ALA   H2   H N N 29  
ALA   HA   H N N 30  
ALA   HB1  H N N 31  
ALA   HB2  H N N 32  
ALA   HB3  H N N 33  
ALA   HXT  H N N 34  
ARG   N    N N N 35  
ARG   CA   C N S 36  
ARG   C    C N N 37  
ARG   O    O N N 38  
ARG   CB   C N N 39  
ARG   CG   C N N 40  
ARG   CD   C N N 41  
ARG   NE   N N N 42  
ARG   CZ   C N N 43  
ARG   NH1  N N N 44  
ARG   NH2  N N N 45  
ARG   OXT  O N N 46  
ARG   H    H N N 47  
ARG   H2   H N N 48  
ARG   HA   H N N 49  
ARG   HB2  H N N 50  
ARG   HB3  H N N 51  
ARG   HG2  H N N 52  
ARG   HG3  H N N 53  
ARG   HD2  H N N 54  
ARG   HD3  H N N 55  
ARG   HE   H N N 56  
ARG   HH11 H N N 57  
ARG   HH12 H N N 58  
ARG   HH21 H N N 59  
ARG   HH22 H N N 60  
ARG   HXT  H N N 61  
ASN   N    N N N 62  
ASN   CA   C N S 63  
ASN   C    C N N 64  
ASN   O    O N N 65  
ASN   CB   C N N 66  
ASN   CG   C N N 67  
ASN   OD1  O N N 68  
ASN   ND2  N N N 69  
ASN   OXT  O N N 70  
ASN   H    H N N 71  
ASN   H2   H N N 72  
ASN   HA   H N N 73  
ASN   HB2  H N N 74  
ASN   HB3  H N N 75  
ASN   HD21 H N N 76  
ASN   HD22 H N N 77  
ASN   HXT  H N N 78  
ASP   N    N N N 79  
ASP   CA   C N S 80  
ASP   C    C N N 81  
ASP   O    O N N 82  
ASP   CB   C N N 83  
ASP   CG   C N N 84  
ASP   OD1  O N N 85  
ASP   OD2  O N N 86  
ASP   OXT  O N N 87  
ASP   H    H N N 88  
ASP   H2   H N N 89  
ASP   HA   H N N 90  
ASP   HB2  H N N 91  
ASP   HB3  H N N 92  
ASP   HD2  H N N 93  
ASP   HXT  H N N 94  
CYS   N    N N N 95  
CYS   CA   C N R 96  
CYS   C    C N N 97  
CYS   O    O N N 98  
CYS   CB   C N N 99  
CYS   SG   S N N 100 
CYS   OXT  O N N 101 
CYS   H    H N N 102 
CYS   H2   H N N 103 
CYS   HA   H N N 104 
CYS   HB2  H N N 105 
CYS   HB3  H N N 106 
CYS   HG   H N N 107 
CYS   HXT  H N N 108 
GLN   N    N N N 109 
GLN   CA   C N S 110 
GLN   C    C N N 111 
GLN   O    O N N 112 
GLN   CB   C N N 113 
GLN   CG   C N N 114 
GLN   CD   C N N 115 
GLN   OE1  O N N 116 
GLN   NE2  N N N 117 
GLN   OXT  O N N 118 
GLN   H    H N N 119 
GLN   H2   H N N 120 
GLN   HA   H N N 121 
GLN   HB2  H N N 122 
GLN   HB3  H N N 123 
GLN   HG2  H N N 124 
GLN   HG3  H N N 125 
GLN   HE21 H N N 126 
GLN   HE22 H N N 127 
GLN   HXT  H N N 128 
GLU   N    N N N 129 
GLU   CA   C N S 130 
GLU   C    C N N 131 
GLU   O    O N N 132 
GLU   CB   C N N 133 
GLU   CG   C N N 134 
GLU   CD   C N N 135 
GLU   OE1  O N N 136 
GLU   OE2  O N N 137 
GLU   OXT  O N N 138 
GLU   H    H N N 139 
GLU   H2   H N N 140 
GLU   HA   H N N 141 
GLU   HB2  H N N 142 
GLU   HB3  H N N 143 
GLU   HG2  H N N 144 
GLU   HG3  H N N 145 
GLU   HE2  H N N 146 
GLU   HXT  H N N 147 
GLY   N    N N N 148 
GLY   CA   C N N 149 
GLY   C    C N N 150 
GLY   O    O N N 151 
GLY   OXT  O N N 152 
GLY   H    H N N 153 
GLY   H2   H N N 154 
GLY   HA2  H N N 155 
GLY   HA3  H N N 156 
GLY   HXT  H N N 157 
HIS   N    N N N 158 
HIS   CA   C N S 159 
HIS   C    C N N 160 
HIS   O    O N N 161 
HIS   CB   C N N 162 
HIS   CG   C Y N 163 
HIS   ND1  N Y N 164 
HIS   CD2  C Y N 165 
HIS   CE1  C Y N 166 
HIS   NE2  N Y N 167 
HIS   OXT  O N N 168 
HIS   H    H N N 169 
HIS   H2   H N N 170 
HIS   HA   H N N 171 
HIS   HB2  H N N 172 
HIS   HB3  H N N 173 
HIS   HD1  H N N 174 
HIS   HD2  H N N 175 
HIS   HE1  H N N 176 
HIS   HE2  H N N 177 
HIS   HXT  H N N 178 
HOH   O    O N N 179 
HOH   H1   H N N 180 
HOH   H2   H N N 181 
ILE   N    N N N 182 
ILE   CA   C N S 183 
ILE   C    C N N 184 
ILE   O    O N N 185 
ILE   CB   C N S 186 
ILE   CG1  C N N 187 
ILE   CG2  C N N 188 
ILE   CD1  C N N 189 
ILE   OXT  O N N 190 
ILE   H    H N N 191 
ILE   H2   H N N 192 
ILE   HA   H N N 193 
ILE   HB   H N N 194 
ILE   HG12 H N N 195 
ILE   HG13 H N N 196 
ILE   HG21 H N N 197 
ILE   HG22 H N N 198 
ILE   HG23 H N N 199 
ILE   HD11 H N N 200 
ILE   HD12 H N N 201 
ILE   HD13 H N N 202 
ILE   HXT  H N N 203 
LEU   N    N N N 204 
LEU   CA   C N S 205 
LEU   C    C N N 206 
LEU   O    O N N 207 
LEU   CB   C N N 208 
LEU   CG   C N N 209 
LEU   CD1  C N N 210 
LEU   CD2  C N N 211 
LEU   OXT  O N N 212 
LEU   H    H N N 213 
LEU   H2   H N N 214 
LEU   HA   H N N 215 
LEU   HB2  H N N 216 
LEU   HB3  H N N 217 
LEU   HG   H N N 218 
LEU   HD11 H N N 219 
LEU   HD12 H N N 220 
LEU   HD13 H N N 221 
LEU   HD21 H N N 222 
LEU   HD22 H N N 223 
LEU   HD23 H N N 224 
LEU   HXT  H N N 225 
LYS   N    N N N 226 
LYS   CA   C N S 227 
LYS   C    C N N 228 
LYS   O    O N N 229 
LYS   CB   C N N 230 
LYS   CG   C N N 231 
LYS   CD   C N N 232 
LYS   CE   C N N 233 
LYS   NZ   N N N 234 
LYS   OXT  O N N 235 
LYS   H    H N N 236 
LYS   H2   H N N 237 
LYS   HA   H N N 238 
LYS   HB2  H N N 239 
LYS   HB3  H N N 240 
LYS   HG2  H N N 241 
LYS   HG3  H N N 242 
LYS   HD2  H N N 243 
LYS   HD3  H N N 244 
LYS   HE2  H N N 245 
LYS   HE3  H N N 246 
LYS   HZ1  H N N 247 
LYS   HZ2  H N N 248 
LYS   HZ3  H N N 249 
LYS   HXT  H N N 250 
MET   N    N N N 251 
MET   CA   C N S 252 
MET   C    C N N 253 
MET   O    O N N 254 
MET   CB   C N N 255 
MET   CG   C N N 256 
MET   SD   S N N 257 
MET   CE   C N N 258 
MET   OXT  O N N 259 
MET   H    H N N 260 
MET   H2   H N N 261 
MET   HA   H N N 262 
MET   HB2  H N N 263 
MET   HB3  H N N 264 
MET   HG2  H N N 265 
MET   HG3  H N N 266 
MET   HE1  H N N 267 
MET   HE2  H N N 268 
MET   HE3  H N N 269 
MET   HXT  H N N 270 
PHE   N    N N N 271 
PHE   CA   C N S 272 
PHE   C    C N N 273 
PHE   O    O N N 274 
PHE   CB   C N N 275 
PHE   CG   C Y N 276 
PHE   CD1  C Y N 277 
PHE   CD2  C Y N 278 
PHE   CE1  C Y N 279 
PHE   CE2  C Y N 280 
PHE   CZ   C Y N 281 
PHE   OXT  O N N 282 
PHE   H    H N N 283 
PHE   H2   H N N 284 
PHE   HA   H N N 285 
PHE   HB2  H N N 286 
PHE   HB3  H N N 287 
PHE   HD1  H N N 288 
PHE   HD2  H N N 289 
PHE   HE1  H N N 290 
PHE   HE2  H N N 291 
PHE   HZ   H N N 292 
PHE   HXT  H N N 293 
PRO   N    N N N 294 
PRO   CA   C N S 295 
PRO   C    C N N 296 
PRO   O    O N N 297 
PRO   CB   C N N 298 
PRO   CG   C N N 299 
PRO   CD   C N N 300 
PRO   OXT  O N N 301 
PRO   H    H N N 302 
PRO   HA   H N N 303 
PRO   HB2  H N N 304 
PRO   HB3  H N N 305 
PRO   HG2  H N N 306 
PRO   HG3  H N N 307 
PRO   HD2  H N N 308 
PRO   HD3  H N N 309 
PRO   HXT  H N N 310 
SER   N    N N N 311 
SER   CA   C N S 312 
SER   C    C N N 313 
SER   O    O N N 314 
SER   CB   C N N 315 
SER   OG   O N N 316 
SER   OXT  O N N 317 
SER   H    H N N 318 
SER   H2   H N N 319 
SER   HA   H N N 320 
SER   HB2  H N N 321 
SER   HB3  H N N 322 
SER   HG   H N N 323 
SER   HXT  H N N 324 
THR   N    N N N 325 
THR   CA   C N S 326 
THR   C    C N N 327 
THR   O    O N N 328 
THR   CB   C N R 329 
THR   OG1  O N N 330 
THR   CG2  C N N 331 
THR   OXT  O N N 332 
THR   H    H N N 333 
THR   H2   H N N 334 
THR   HA   H N N 335 
THR   HB   H N N 336 
THR   HG1  H N N 337 
THR   HG21 H N N 338 
THR   HG22 H N N 339 
THR   HG23 H N N 340 
THR   HXT  H N N 341 
TRP   N    N N N 342 
TRP   CA   C N S 343 
TRP   C    C N N 344 
TRP   O    O N N 345 
TRP   CB   C N N 346 
TRP   CG   C Y N 347 
TRP   CD1  C Y N 348 
TRP   CD2  C Y N 349 
TRP   NE1  N Y N 350 
TRP   CE2  C Y N 351 
TRP   CE3  C Y N 352 
TRP   CZ2  C Y N 353 
TRP   CZ3  C Y N 354 
TRP   CH2  C Y N 355 
TRP   OXT  O N N 356 
TRP   H    H N N 357 
TRP   H2   H N N 358 
TRP   HA   H N N 359 
TRP   HB2  H N N 360 
TRP   HB3  H N N 361 
TRP   HD1  H N N 362 
TRP   HE1  H N N 363 
TRP   HE3  H N N 364 
TRP   HZ2  H N N 365 
TRP   HZ3  H N N 366 
TRP   HH2  H N N 367 
TRP   HXT  H N N 368 
TYR   N    N N N 369 
TYR   CA   C N S 370 
TYR   C    C N N 371 
TYR   O    O N N 372 
TYR   CB   C N N 373 
TYR   CG   C Y N 374 
TYR   CD1  C Y N 375 
TYR   CD2  C Y N 376 
TYR   CE1  C Y N 377 
TYR   CE2  C Y N 378 
TYR   CZ   C Y N 379 
TYR   OH   O N N 380 
TYR   OXT  O N N 381 
TYR   H    H N N 382 
TYR   H2   H N N 383 
TYR   HA   H N N 384 
TYR   HB2  H N N 385 
TYR   HB3  H N N 386 
TYR   HD1  H N N 387 
TYR   HD2  H N N 388 
TYR   HE1  H N N 389 
TYR   HE2  H N N 390 
TYR   HH   H N N 391 
TYR   HXT  H N N 392 
VAL   N    N N N 393 
VAL   CA   C N S 394 
VAL   C    C N N 395 
VAL   O    O N N 396 
VAL   CB   C N N 397 
VAL   CG1  C N N 398 
VAL   CG2  C N N 399 
VAL   OXT  O N N 400 
VAL   H    H N N 401 
VAL   H2   H N N 402 
VAL   HA   H N N 403 
VAL   HB   H N N 404 
VAL   HG11 H N N 405 
VAL   HG12 H N N 406 
VAL   HG13 H N N 407 
VAL   HG21 H N N 408 
VAL   HG22 H N N 409 
VAL   HG23 H N N 410 
VAL   HXT  H N N 411 
# 
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 
A1EGD C1  C2   sing N N 1   
A1EGD C2  C8   doub Y N 2   
A1EGD C2  C3   sing Y N 3   
A1EGD C8  C7   sing Y N 4   
A1EGD C3  C4   doub Y N 5   
A1EGD C7  C5   doub Y N 6   
A1EGD C7  S1   sing Y N 7   
A1EGD C4  C5   sing Y N 8   
A1EGD C4  N1   sing N N 9   
A1EGD C5  N2   sing Y N 10  
A1EGD S1  C6   sing Y N 11  
A1EGD N2  C6   doub Y N 12  
A1EGD C6  N3   sing N N 13  
A1EGD C1  H1   sing N N 14  
A1EGD C1  H2   sing N N 15  
A1EGD C1  H3   sing N N 16  
A1EGD C3  H4   sing N N 17  
A1EGD N1  H5   sing N N 18  
A1EGD N1  H6   sing N N 19  
A1EGD N3  H7   sing N N 20  
A1EGD N3  H8   sing N N 21  
A1EGD C8  H9   sing N N 22  
ALA   N   CA   sing N N 23  
ALA   N   H    sing N N 24  
ALA   N   H2   sing N N 25  
ALA   CA  C    sing N N 26  
ALA   CA  CB   sing N N 27  
ALA   CA  HA   sing N N 28  
ALA   C   O    doub N N 29  
ALA   C   OXT  sing N N 30  
ALA   CB  HB1  sing N N 31  
ALA   CB  HB2  sing N N 32  
ALA   CB  HB3  sing N N 33  
ALA   OXT HXT  sing N N 34  
ARG   N   CA   sing N N 35  
ARG   N   H    sing N N 36  
ARG   N   H2   sing N N 37  
ARG   CA  C    sing N N 38  
ARG   CA  CB   sing N N 39  
ARG   CA  HA   sing N N 40  
ARG   C   O    doub N N 41  
ARG   C   OXT  sing N N 42  
ARG   CB  CG   sing N N 43  
ARG   CB  HB2  sing N N 44  
ARG   CB  HB3  sing N N 45  
ARG   CG  CD   sing N N 46  
ARG   CG  HG2  sing N N 47  
ARG   CG  HG3  sing N N 48  
ARG   CD  NE   sing N N 49  
ARG   CD  HD2  sing N N 50  
ARG   CD  HD3  sing N N 51  
ARG   NE  CZ   sing N N 52  
ARG   NE  HE   sing N N 53  
ARG   CZ  NH1  sing N N 54  
ARG   CZ  NH2  doub N N 55  
ARG   NH1 HH11 sing N N 56  
ARG   NH1 HH12 sing N N 57  
ARG   NH2 HH21 sing N N 58  
ARG   NH2 HH22 sing N N 59  
ARG   OXT HXT  sing N N 60  
ASN   N   CA   sing N N 61  
ASN   N   H    sing N N 62  
ASN   N   H2   sing N N 63  
ASN   CA  C    sing N N 64  
ASN   CA  CB   sing N N 65  
ASN   CA  HA   sing N N 66  
ASN   C   O    doub N N 67  
ASN   C   OXT  sing N N 68  
ASN   CB  CG   sing N N 69  
ASN   CB  HB2  sing N N 70  
ASN   CB  HB3  sing N N 71  
ASN   CG  OD1  doub N N 72  
ASN   CG  ND2  sing N N 73  
ASN   ND2 HD21 sing N N 74  
ASN   ND2 HD22 sing N N 75  
ASN   OXT HXT  sing N N 76  
ASP   N   CA   sing N N 77  
ASP   N   H    sing N N 78  
ASP   N   H2   sing N N 79  
ASP   CA  C    sing N N 80  
ASP   CA  CB   sing N N 81  
ASP   CA  HA   sing N N 82  
ASP   C   O    doub N N 83  
ASP   C   OXT  sing N N 84  
ASP   CB  CG   sing N N 85  
ASP   CB  HB2  sing N N 86  
ASP   CB  HB3  sing N N 87  
ASP   CG  OD1  doub N N 88  
ASP   CG  OD2  sing N N 89  
ASP   OD2 HD2  sing N N 90  
ASP   OXT HXT  sing N N 91  
CYS   N   CA   sing N N 92  
CYS   N   H    sing N N 93  
CYS   N   H2   sing N N 94  
CYS   CA  C    sing N N 95  
CYS   CA  CB   sing N N 96  
CYS   CA  HA   sing N N 97  
CYS   C   O    doub N N 98  
CYS   C   OXT  sing N N 99  
CYS   CB  SG   sing N N 100 
CYS   CB  HB2  sing N N 101 
CYS   CB  HB3  sing N N 102 
CYS   SG  HG   sing N N 103 
CYS   OXT HXT  sing N N 104 
GLN   N   CA   sing N N 105 
GLN   N   H    sing N N 106 
GLN   N   H2   sing N N 107 
GLN   CA  C    sing N N 108 
GLN   CA  CB   sing N N 109 
GLN   CA  HA   sing N N 110 
GLN   C   O    doub N N 111 
GLN   C   OXT  sing N N 112 
GLN   CB  CG   sing N N 113 
GLN   CB  HB2  sing N N 114 
GLN   CB  HB3  sing N N 115 
GLN   CG  CD   sing N N 116 
GLN   CG  HG2  sing N N 117 
GLN   CG  HG3  sing N N 118 
GLN   CD  OE1  doub N N 119 
GLN   CD  NE2  sing N N 120 
GLN   NE2 HE21 sing N N 121 
GLN   NE2 HE22 sing N N 122 
GLN   OXT HXT  sing N N 123 
GLU   N   CA   sing N N 124 
GLU   N   H    sing N N 125 
GLU   N   H2   sing N N 126 
GLU   CA  C    sing N N 127 
GLU   CA  CB   sing N N 128 
GLU   CA  HA   sing N N 129 
GLU   C   O    doub N N 130 
GLU   C   OXT  sing N N 131 
GLU   CB  CG   sing N N 132 
GLU   CB  HB2  sing N N 133 
GLU   CB  HB3  sing N N 134 
GLU   CG  CD   sing N N 135 
GLU   CG  HG2  sing N N 136 
GLU   CG  HG3  sing N N 137 
GLU   CD  OE1  doub N N 138 
GLU   CD  OE2  sing N N 139 
GLU   OE2 HE2  sing N N 140 
GLU   OXT HXT  sing N N 141 
GLY   N   CA   sing N N 142 
GLY   N   H    sing N N 143 
GLY   N   H2   sing N N 144 
GLY   CA  C    sing N N 145 
GLY   CA  HA2  sing N N 146 
GLY   CA  HA3  sing N N 147 
GLY   C   O    doub N N 148 
GLY   C   OXT  sing N N 149 
GLY   OXT HXT  sing N N 150 
HIS   N   CA   sing N N 151 
HIS   N   H    sing N N 152 
HIS   N   H2   sing N N 153 
HIS   CA  C    sing N N 154 
HIS   CA  CB   sing N N 155 
HIS   CA  HA   sing N N 156 
HIS   C   O    doub N N 157 
HIS   C   OXT  sing N N 158 
HIS   CB  CG   sing N N 159 
HIS   CB  HB2  sing N N 160 
HIS   CB  HB3  sing N N 161 
HIS   CG  ND1  sing Y N 162 
HIS   CG  CD2  doub Y N 163 
HIS   ND1 CE1  doub Y N 164 
HIS   ND1 HD1  sing N N 165 
HIS   CD2 NE2  sing Y N 166 
HIS   CD2 HD2  sing N N 167 
HIS   CE1 NE2  sing Y N 168 
HIS   CE1 HE1  sing N N 169 
HIS   NE2 HE2  sing N N 170 
HIS   OXT HXT  sing N N 171 
HOH   O   H1   sing N N 172 
HOH   O   H2   sing N N 173 
ILE   N   CA   sing N N 174 
ILE   N   H    sing N N 175 
ILE   N   H2   sing N N 176 
ILE   CA  C    sing N N 177 
ILE   CA  CB   sing N N 178 
ILE   CA  HA   sing N N 179 
ILE   C   O    doub N N 180 
ILE   C   OXT  sing N N 181 
ILE   CB  CG1  sing N N 182 
ILE   CB  CG2  sing N N 183 
ILE   CB  HB   sing N N 184 
ILE   CG1 CD1  sing N N 185 
ILE   CG1 HG12 sing N N 186 
ILE   CG1 HG13 sing N N 187 
ILE   CG2 HG21 sing N N 188 
ILE   CG2 HG22 sing N N 189 
ILE   CG2 HG23 sing N N 190 
ILE   CD1 HD11 sing N N 191 
ILE   CD1 HD12 sing N N 192 
ILE   CD1 HD13 sing N N 193 
ILE   OXT HXT  sing N N 194 
LEU   N   CA   sing N N 195 
LEU   N   H    sing N N 196 
LEU   N   H2   sing N N 197 
LEU   CA  C    sing N N 198 
LEU   CA  CB   sing N N 199 
LEU   CA  HA   sing N N 200 
LEU   C   O    doub N N 201 
LEU   C   OXT  sing N N 202 
LEU   CB  CG   sing N N 203 
LEU   CB  HB2  sing N N 204 
LEU   CB  HB3  sing N N 205 
LEU   CG  CD1  sing N N 206 
LEU   CG  CD2  sing N N 207 
LEU   CG  HG   sing N N 208 
LEU   CD1 HD11 sing N N 209 
LEU   CD1 HD12 sing N N 210 
LEU   CD1 HD13 sing N N 211 
LEU   CD2 HD21 sing N N 212 
LEU   CD2 HD22 sing N N 213 
LEU   CD2 HD23 sing N N 214 
LEU   OXT HXT  sing N N 215 
LYS   N   CA   sing N N 216 
LYS   N   H    sing N N 217 
LYS   N   H2   sing N N 218 
LYS   CA  C    sing N N 219 
LYS   CA  CB   sing N N 220 
LYS   CA  HA   sing N N 221 
LYS   C   O    doub N N 222 
LYS   C   OXT  sing N N 223 
LYS   CB  CG   sing N N 224 
LYS   CB  HB2  sing N N 225 
LYS   CB  HB3  sing N N 226 
LYS   CG  CD   sing N N 227 
LYS   CG  HG2  sing N N 228 
LYS   CG  HG3  sing N N 229 
LYS   CD  CE   sing N N 230 
LYS   CD  HD2  sing N N 231 
LYS   CD  HD3  sing N N 232 
LYS   CE  NZ   sing N N 233 
LYS   CE  HE2  sing N N 234 
LYS   CE  HE3  sing N N 235 
LYS   NZ  HZ1  sing N N 236 
LYS   NZ  HZ2  sing N N 237 
LYS   NZ  HZ3  sing N N 238 
LYS   OXT HXT  sing N N 239 
MET   N   CA   sing N N 240 
MET   N   H    sing N N 241 
MET   N   H2   sing N N 242 
MET   CA  C    sing N N 243 
MET   CA  CB   sing N N 244 
MET   CA  HA   sing N N 245 
MET   C   O    doub N N 246 
MET   C   OXT  sing N N 247 
MET   CB  CG   sing N N 248 
MET   CB  HB2  sing N N 249 
MET   CB  HB3  sing N N 250 
MET   CG  SD   sing N N 251 
MET   CG  HG2  sing N N 252 
MET   CG  HG3  sing N N 253 
MET   SD  CE   sing N N 254 
MET   CE  HE1  sing N N 255 
MET   CE  HE2  sing N N 256 
MET   CE  HE3  sing N N 257 
MET   OXT HXT  sing N N 258 
PHE   N   CA   sing N N 259 
PHE   N   H    sing N N 260 
PHE   N   H2   sing N N 261 
PHE   CA  C    sing N N 262 
PHE   CA  CB   sing N N 263 
PHE   CA  HA   sing N N 264 
PHE   C   O    doub N N 265 
PHE   C   OXT  sing N N 266 
PHE   CB  CG   sing N N 267 
PHE   CB  HB2  sing N N 268 
PHE   CB  HB3  sing N N 269 
PHE   CG  CD1  doub Y N 270 
PHE   CG  CD2  sing Y N 271 
PHE   CD1 CE1  sing Y N 272 
PHE   CD1 HD1  sing N N 273 
PHE   CD2 CE2  doub Y N 274 
PHE   CD2 HD2  sing N N 275 
PHE   CE1 CZ   doub Y N 276 
PHE   CE1 HE1  sing N N 277 
PHE   CE2 CZ   sing Y N 278 
PHE   CE2 HE2  sing N N 279 
PHE   CZ  HZ   sing N N 280 
PHE   OXT HXT  sing N N 281 
PRO   N   CA   sing N N 282 
PRO   N   CD   sing N N 283 
PRO   N   H    sing N N 284 
PRO   CA  C    sing N N 285 
PRO   CA  CB   sing N N 286 
PRO   CA  HA   sing N N 287 
PRO   C   O    doub N N 288 
PRO   C   OXT  sing N N 289 
PRO   CB  CG   sing N N 290 
PRO   CB  HB2  sing N N 291 
PRO   CB  HB3  sing N N 292 
PRO   CG  CD   sing N N 293 
PRO   CG  HG2  sing N N 294 
PRO   CG  HG3  sing N N 295 
PRO   CD  HD2  sing N N 296 
PRO   CD  HD3  sing N N 297 
PRO   OXT HXT  sing N N 298 
SER   N   CA   sing N N 299 
SER   N   H    sing N N 300 
SER   N   H2   sing N N 301 
SER   CA  C    sing N N 302 
SER   CA  CB   sing N N 303 
SER   CA  HA   sing N N 304 
SER   C   O    doub N N 305 
SER   C   OXT  sing N N 306 
SER   CB  OG   sing N N 307 
SER   CB  HB2  sing N N 308 
SER   CB  HB3  sing N N 309 
SER   OG  HG   sing N N 310 
SER   OXT HXT  sing N N 311 
THR   N   CA   sing N N 312 
THR   N   H    sing N N 313 
THR   N   H2   sing N N 314 
THR   CA  C    sing N N 315 
THR   CA  CB   sing N N 316 
THR   CA  HA   sing N N 317 
THR   C   O    doub N N 318 
THR   C   OXT  sing N N 319 
THR   CB  OG1  sing N N 320 
THR   CB  CG2  sing N N 321 
THR   CB  HB   sing N N 322 
THR   OG1 HG1  sing N N 323 
THR   CG2 HG21 sing N N 324 
THR   CG2 HG22 sing N N 325 
THR   CG2 HG23 sing N N 326 
THR   OXT HXT  sing N N 327 
TRP   N   CA   sing N N 328 
TRP   N   H    sing N N 329 
TRP   N   H2   sing N N 330 
TRP   CA  C    sing N N 331 
TRP   CA  CB   sing N N 332 
TRP   CA  HA   sing N N 333 
TRP   C   O    doub N N 334 
TRP   C   OXT  sing N N 335 
TRP   CB  CG   sing N N 336 
TRP   CB  HB2  sing N N 337 
TRP   CB  HB3  sing N N 338 
TRP   CG  CD1  doub Y N 339 
TRP   CG  CD2  sing Y N 340 
TRP   CD1 NE1  sing Y N 341 
TRP   CD1 HD1  sing N N 342 
TRP   CD2 CE2  doub Y N 343 
TRP   CD2 CE3  sing Y N 344 
TRP   NE1 CE2  sing Y N 345 
TRP   NE1 HE1  sing N N 346 
TRP   CE2 CZ2  sing Y N 347 
TRP   CE3 CZ3  doub Y N 348 
TRP   CE3 HE3  sing N N 349 
TRP   CZ2 CH2  doub Y N 350 
TRP   CZ2 HZ2  sing N N 351 
TRP   CZ3 CH2  sing Y N 352 
TRP   CZ3 HZ3  sing N N 353 
TRP   CH2 HH2  sing N N 354 
TRP   OXT HXT  sing N N 355 
TYR   N   CA   sing N N 356 
TYR   N   H    sing N N 357 
TYR   N   H2   sing N N 358 
TYR   CA  C    sing N N 359 
TYR   CA  CB   sing N N 360 
TYR   CA  HA   sing N N 361 
TYR   C   O    doub N N 362 
TYR   C   OXT  sing N N 363 
TYR   CB  CG   sing N N 364 
TYR   CB  HB2  sing N N 365 
TYR   CB  HB3  sing N N 366 
TYR   CG  CD1  doub Y N 367 
TYR   CG  CD2  sing Y N 368 
TYR   CD1 CE1  sing Y N 369 
TYR   CD1 HD1  sing N N 370 
TYR   CD2 CE2  doub Y N 371 
TYR   CD2 HD2  sing N N 372 
TYR   CE1 CZ   doub Y N 373 
TYR   CE1 HE1  sing N N 374 
TYR   CE2 CZ   sing Y N 375 
TYR   CE2 HE2  sing N N 376 
TYR   CZ  OH   sing N N 377 
TYR   OH  HH   sing N N 378 
TYR   OXT HXT  sing N N 379 
VAL   N   CA   sing N N 380 
VAL   N   H    sing N N 381 
VAL   N   H2   sing N N 382 
VAL   CA  C    sing N N 383 
VAL   CA  CB   sing N N 384 
VAL   CA  HA   sing N N 385 
VAL   C   O    doub N N 386 
VAL   C   OXT  sing N N 387 
VAL   CB  CG1  sing N N 388 
VAL   CB  CG2  sing N N 389 
VAL   CB  HB   sing N N 390 
VAL   CG1 HG11 sing N N 391 
VAL   CG1 HG12 sing N N 392 
VAL   CG1 HG13 sing N N 393 
VAL   CG2 HG21 sing N N 394 
VAL   CG2 HG22 sing N N 395 
VAL   CG2 HG23 sing N N 396 
VAL   OXT HXT  sing N N 397 
# 
_pdbx_audit_support.funding_organization   'Not funded' 
_pdbx_audit_support.country                ? 
_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   2GPO 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    9KNG 
_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]   0.015554 
_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]   0.015554 
_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]   0.007251 
_atom_sites.fract_transf_vector[1]      0.00000 
_atom_sites.fract_transf_vector[2]      0.00000 
_atom_sites.fract_transf_vector[3]      0.00000 
_atom_sites.solution_primary            ? 
_atom_sites.solution_secondary          ? 
_atom_sites.solution_hydrogens          ? 
_atom_sites.special_details             ? 
# 
loop_
_atom_type.symbol 
C 
N 
O 
S 
# 
loop_
_atom_site.group_PDB 
_atom_site.id 
_atom_site.type_symbol 
_atom_site.label_atom_id 
_atom_site.label_alt_id 
_atom_site.label_comp_id 
_atom_site.label_asym_id 
_atom_site.label_entity_id 
_atom_site.label_seq_id 
_atom_site.pdbx_PDB_ins_code 
_atom_site.Cartn_x 
_atom_site.Cartn_y 
_atom_site.Cartn_z 
_atom_site.occupancy 
_atom_site.B_iso_or_equiv 
_atom_site.pdbx_formal_charge 
_atom_site.auth_seq_id 
_atom_site.auth_comp_id 
_atom_site.auth_asym_id 
_atom_site.auth_atom_id 
_atom_site.pdbx_PDB_model_num 
ATOM   1    N N   . TYR   A 1 27  ? 6.176   -27.540 -24.272 1.00 53.04 ? 234 TYR   A N   1 
ATOM   2    C CA  . TYR   A 1 27  ? 6.875   -26.321 -24.747 1.00 53.66 ? 234 TYR   A CA  1 
ATOM   3    C C   . TYR   A 1 27  ? 7.179   -25.436 -23.533 1.00 50.73 ? 234 TYR   A C   1 
ATOM   4    O O   . TYR   A 1 27  ? 7.493   -25.932 -22.430 1.00 61.41 ? 234 TYR   A O   1 
ATOM   5    C CB  . TYR   A 1 27  ? 6.059   -25.592 -25.836 1.00 55.81 ? 234 TYR   A CB  1 
ATOM   6    C CG  . TYR   A 1 27  ? 4.567   -25.527 -25.599 1.00 49.98 ? 234 TYR   A CG  1 
ATOM   7    C CD1 . TYR   A 1 27  ? 3.997   -24.707 -24.628 1.00 45.72 ? 234 TYR   A CD1 1 
ATOM   8    C CD2 . TYR   A 1 27  ? 3.714   -26.327 -26.345 1.00 54.01 ? 234 TYR   A CD2 1 
ATOM   9    C CE1 . TYR   A 1 27  ? 2.627   -24.702 -24.391 1.00 46.45 ? 234 TYR   A CE1 1 
ATOM   10   C CE2 . TYR   A 1 27  ? 2.343   -26.314 -26.142 1.00 48.45 ? 234 TYR   A CE2 1 
ATOM   11   C CZ  . TYR   A 1 27  ? 1.796   -25.505 -25.162 1.00 47.53 ? 234 TYR   A CZ  1 
ATOM   12   O OH  . TYR   A 1 27  ? 0.441   -25.545 -24.984 1.00 45.60 ? 234 TYR   A OH  1 
ATOM   13   N N   . ASN   A 1 28  ? 7.031   -24.141 -23.771 1.00 39.48 ? 235 ASN   A N   1 
ATOM   14   C CA  . ASN   A 1 28  ? 7.458   -22.966 -22.983 1.00 31.84 ? 235 ASN   A CA  1 
ATOM   15   C C   . ASN   A 1 28  ? 6.587   -22.802 -21.718 1.00 30.40 ? 235 ASN   A C   1 
ATOM   16   O O   . ASN   A 1 28  ? 5.324   -22.880 -21.804 1.00 30.43 ? 235 ASN   A O   1 
ATOM   17   C CB  . ASN   A 1 28  ? 7.351   -21.783 -23.938 1.00 31.83 ? 235 ASN   A CB  1 
ATOM   18   C CG  . ASN   A 1 28  ? 7.756   -20.502 -23.280 1.00 29.35 ? 235 ASN   A CG  1 
ATOM   19   O OD1 . ASN   A 1 28  ? 6.969   -19.857 -22.596 1.00 24.86 ? 235 ASN   A OD1 1 
ATOM   20   N ND2 . ASN   A 1 28  ? 9.031   -20.200 -23.352 1.00 28.91 ? 235 ASN   A ND2 1 
ATOM   21   N N   . LYS   A 1 29  ? 7.180   -22.587 -20.540 1.00 25.74 ? 236 LYS   A N   1 
ATOM   22   C CA  . LYS   A 1 29  ? 6.392   -22.492 -19.301 1.00 24.36 ? 236 LYS   A CA  1 
ATOM   23   C C   . LYS   A 1 29  ? 5.528   -21.222 -19.279 1.00 23.28 ? 236 LYS   A C   1 
ATOM   24   O O   . LYS   A 1 29  ? 4.366   -21.305 -18.788 1.00 21.14 ? 236 LYS   A O   1 
ATOM   25   C CB  . LYS   A 1 29  ? 7.296   -22.582 -18.067 1.00 25.14 ? 236 LYS   A CB  1 
ATOM   26   C CG  . LYS   A 1 29  ? 6.581   -22.572 -16.720 1.00 26.86 ? 236 LYS   A CG  1 
ATOM   27   C CD  . LYS   A 1 29  ? 5.648   -23.757 -16.566 1.00 29.69 ? 236 LYS   A CD  1 
ATOM   28   C CE  . LYS   A 1 29  ? 4.957   -23.816 -15.222 1.00 33.56 ? 236 LYS   A CE  1 
ATOM   29   N NZ  . LYS   A 1 29  ? 5.869   -24.172 -14.124 1.00 35.63 ? 236 LYS   A NZ  1 
ATOM   30   N N   . ILE   A 1 30  ? 6.033   -20.057 -19.715 1.00 21.32 ? 237 ILE   A N   1 
ATOM   31   C CA  . ILE   A 1 30  ? 5.236   -18.812 -19.757 1.00 19.21 ? 237 ILE   A CA  1 
ATOM   32   C C   . ILE   A 1 30  ? 4.005   -19.094 -20.614 1.00 17.28 ? 237 ILE   A C   1 
ATOM   33   O O   . ILE   A 1 30  ? 2.886   -18.701 -20.224 1.00 17.47 ? 237 ILE   A O   1 
ATOM   34   C CB  . ILE   A 1 30  ? 6.050   -17.600 -20.244 1.00 19.47 ? 237 ILE   A CB  1 
ATOM   35   C CG1 . ILE   A 1 30  ? 7.115   -17.250 -19.188 1.00 21.42 ? 237 ILE   A CG1 1 
ATOM   36   C CG2 . ILE   A 1 30  ? 5.130   -16.445 -20.563 1.00 21.88 ? 237 ILE   A CG2 1 
ATOM   37   C CD1 . ILE   A 1 30  ? 7.989   -16.081 -19.543 1.00 24.47 ? 237 ILE   A CD1 1 
ATOM   38   N N   . VAL   A 1 31  ? 4.145   -19.700 -21.755 1.00 18.56 ? 238 VAL   A N   1 
ATOM   39   C CA  . VAL   A 1 31  ? 2.978   -19.942 -22.653 1.00 19.13 ? 238 VAL   A CA  1 
ATOM   40   C C   . VAL   A 1 31  ? 2.022   -20.864 -21.904 1.00 20.08 ? 238 VAL   A C   1 
ATOM   41   O O   . VAL   A 1 31  ? 0.796   -20.592 -21.907 1.00 19.82 ? 238 VAL   A O   1 
ATOM   42   C CB  . VAL   A 1 31  ? 3.394   -20.518 -24.004 1.00 19.88 ? 238 VAL   A CB  1 
ATOM   43   C CG1 . VAL   A 1 31  ? 2.184   -20.927 -24.828 1.00 22.18 ? 238 VAL   A CG1 1 
ATOM   44   C CG2 . VAL   A 1 31  ? 4.301   -19.532 -24.740 1.00 19.36 ? 238 VAL   A CG2 1 
ATOM   45   N N   . SER   A 1 32  ? 2.497   -21.939 -21.301 1.00 19.94 ? 239 SER   A N   1 
ATOM   46   C CA  . SER   A 1 32  ? 1.559   -22.869 -20.607 1.00 22.07 ? 239 SER   A CA  1 
ATOM   47   C C   . SER   A 1 32  ? 0.871   -22.138 -19.446 1.00 20.24 ? 239 SER   A C   1 
ATOM   48   O O   . SER   A 1 32  ? -0.374  -22.343 -19.160 1.00 20.05 ? 239 SER   A O   1 
ATOM   49   C CB  . SER   A 1 32  ? 2.252   -24.192 -20.188 1.00 24.87 ? 239 SER   A CB  1 
ATOM   50   O OG  . SER   A 1 32  ? 3.084   -23.962 -19.087 1.00 35.85 ? 239 SER   A OG  1 
ATOM   51   N N   . HIS   A 1 33  ? 1.525   -21.262 -18.719 1.00 18.10 ? 240 HIS   A N   1 
ATOM   52   C CA  . HIS   A 1 33  ? 0.985   -20.464 -17.610 1.00 16.01 ? 240 HIS   A CA  1 
ATOM   53   C C   . HIS   A 1 33  ? -0.131  -19.555 -18.157 1.00 18.74 ? 240 HIS   A C   1 
ATOM   54   O O   . HIS   A 1 33  ? -1.167  -19.395 -17.573 1.00 19.09 ? 240 HIS   A O   1 
ATOM   55   C CB  . HIS   A 1 33  ? 2.138   -19.747 -16.884 1.00 17.74 ? 240 HIS   A CB  1 
ATOM   56   C CG  . HIS   A 1 33  ? 1.740   -18.979 -15.685 1.00 17.28 ? 240 HIS   A CG  1 
ATOM   57   N ND1 . HIS   A 1 33  ? 1.305   -19.607 -14.490 1.00 21.63 ? 240 HIS   A ND1 1 
ATOM   58   C CD2 . HIS   A 1 33  ? 1.562   -17.677 -15.445 1.00 21.47 ? 240 HIS   A CD2 1 
ATOM   59   C CE1 . HIS   A 1 33  ? 0.984   -18.686 -13.623 1.00 21.90 ? 240 HIS   A CE1 1 
ATOM   60   N NE2 . HIS   A 1 33  ? 1.103   -17.509 -14.175 1.00 25.88 ? 240 HIS   A NE2 1 
ATOM   61   N N   . LEU   A 1 34  ? 0.134   -18.862 -19.251 1.00 18.60 ? 241 LEU   A N   1 
ATOM   62   C CA  . LEU   A 1 34  ? -0.867  -17.947 -19.792 1.00 18.41 ? 241 LEU   A CA  1 
ATOM   63   C C   . LEU   A 1 34  ? -2.078  -18.765 -20.222 1.00 17.83 ? 241 LEU   A C   1 
ATOM   64   O O   . LEU   A 1 34  ? -3.207  -18.213 -20.030 1.00 19.54 ? 241 LEU   A O   1 
ATOM   65   C CB  . LEU   A 1 34  ? -0.240  -17.197 -20.958 1.00 17.48 ? 241 LEU   A CB  1 
ATOM   66   C CG  . LEU   A 1 34  ? 0.768   -16.133 -20.589 1.00 18.51 ? 241 LEU   A CG  1 
ATOM   67   C CD1 . LEU   A 1 34  ? 1.401   -15.530 -21.843 1.00 20.26 ? 241 LEU   A CD1 1 
ATOM   68   C CD2 . LEU   A 1 34  ? 0.185   -15.047 -19.720 1.00 21.20 ? 241 LEU   A CD2 1 
ATOM   69   N N   . LEU   A 1 35  ? -1.910  -19.958 -20.753 1.00 16.72 ? 242 LEU   A N   1 
ATOM   70   C CA  . LEU   A 1 35  ? -3.077  -20.807 -21.131 1.00 18.54 ? 242 LEU   A CA  1 
ATOM   71   C C   . LEU   A 1 35  ? -3.928  -21.083 -19.904 1.00 22.02 ? 242 LEU   A C   1 
ATOM   72   O O   . LEU   A 1 35  ? -5.163  -20.977 -19.989 1.00 22.55 ? 242 LEU   A O   1 
ATOM   73   C CB  . LEU   A 1 35  ? -2.688  -22.125 -21.748 1.00 19.38 ? 242 LEU   A CB  1 
ATOM   74   C CG  . LEU   A 1 35  ? -2.168  -22.054 -23.182 1.00 24.22 ? 242 LEU   A CG  1 
ATOM   75   C CD1 . LEU   A 1 35  ? -1.613  -23.415 -23.605 1.00 27.04 ? 242 LEU   A CD1 1 
ATOM   76   C CD2 . LEU   A 1 35  ? -3.260  -21.598 -24.175 1.00 25.00 ? 242 LEU   A CD2 1 
ATOM   77   N N   . VAL   A 1 36  ? -3.325  -21.446 -18.778 1.00 21.89 ? 243 VAL   A N   1 
ATOM   78   C CA  . VAL   A 1 36  ? -4.177  -21.795 -17.592 1.00 21.72 ? 243 VAL   A CA  1 
ATOM   79   C C   . VAL   A 1 36  ? -4.782  -20.549 -16.999 1.00 22.57 ? 243 VAL   A C   1 
ATOM   80   O O   . VAL   A 1 36  ? -5.817  -20.694 -16.313 1.00 27.07 ? 243 VAL   A O   1 
ATOM   81   C CB  . VAL   A 1 36  ? -3.458  -22.612 -16.496 1.00 27.13 ? 243 VAL   A CB  1 
ATOM   82   C CG1 . VAL   A 1 36  ? -3.197  -24.021 -16.954 1.00 29.28 ? 243 VAL   A CG1 1 
ATOM   83   C CG2 . VAL   A 1 36  ? -2.212  -21.954 -15.946 1.00 27.90 ? 243 VAL   A CG2 1 
ATOM   84   N N   . ALA   A 1 37  ? -4.198  -19.373 -17.163 1.00 20.02 ? 244 ALA   A N   1 
ATOM   85   C CA  . ALA   A 1 37  ? -4.677  -18.080 -16.656 1.00 21.62 ? 244 ALA   A CA  1 
ATOM   86   C C   . ALA   A 1 37  ? -5.873  -17.548 -17.478 1.00 20.48 ? 244 ALA   A C   1 
ATOM   87   O O   . ALA   A 1 37  ? -6.443  -16.485 -17.075 1.00 22.83 ? 244 ALA   A O   1 
ATOM   88   C CB  . ALA   A 1 37  ? -3.567  -17.081 -16.591 1.00 25.27 ? 244 ALA   A CB  1 
ATOM   89   N N   . GLU   A 1 38  ? -6.147  -18.148 -18.626 1.00 22.22 ? 245 GLU   A N   1 
ATOM   90   C CA  . GLU   A 1 38  ? -7.140  -17.593 -19.579 1.00 25.18 ? 245 GLU   A CA  1 
ATOM   91   C C   . GLU   A 1 38  ? -8.491  -17.610 -18.864 1.00 24.19 ? 245 GLU   A C   1 
ATOM   92   O O   . GLU   A 1 38  ? -8.880  -18.661 -18.363 1.00 27.40 ? 245 GLU   A O   1 
ATOM   93   C CB  . GLU   A 1 38  ? -7.123  -18.415 -20.856 1.00 24.93 ? 245 GLU   A CB  1 
ATOM   94   C CG  . GLU   A 1 38  ? -8.036  -17.810 -21.927 1.00 31.37 ? 245 GLU   A CG  1 
ATOM   95   C CD  . GLU   A 1 38  ? -7.614  -16.467 -22.473 1.00 32.37 ? 245 GLU   A CD  1 
ATOM   96   O OE1 . GLU   A 1 38  ? -6.543  -15.919 -22.113 1.00 24.93 ? 245 GLU   A OE1 1 
ATOM   97   O OE2 . GLU   A 1 38  ? -8.430  -15.900 -23.247 1.00 44.64 ? 245 GLU   A OE2 1 
ATOM   98   N N   . PRO   A 1 39  ? -9.173  -16.461 -18.740 1.00 23.76 ? 246 PRO   A N   1 
ATOM   99   C CA  . PRO   A 1 39  ? -10.515 -16.445 -18.144 1.00 24.77 ? 246 PRO   A CA  1 
ATOM   100  C C   . PRO   A 1 39  ? -11.526 -17.277 -18.918 1.00 24.81 ? 246 PRO   A C   1 
ATOM   101  O O   . PRO   A 1 39  ? -11.396 -17.510 -20.110 1.00 26.52 ? 246 PRO   A O   1 
ATOM   102  C CB  . PRO   A 1 39  ? -10.910 -14.979 -18.166 1.00 25.54 ? 246 PRO   A CB  1 
ATOM   103  C CG  . PRO   A 1 39  ? -9.592  -14.213 -18.209 1.00 29.46 ? 246 PRO   A CG  1 
ATOM   104  C CD  . PRO   A 1 39  ? -8.733  -15.101 -19.071 1.00 26.04 ? 246 PRO   A CD  1 
ATOM   105  N N   . GLU   A 1 40  ? -12.529 -17.719 -18.154 1.00 24.82 ? 247 GLU   A N   1 
ATOM   106  C CA  . GLU   A 1 40  ? -13.711 -18.436 -18.661 1.00 25.16 ? 247 GLU   A CA  1 
ATOM   107  C C   . GLU   A 1 40  ? -14.512 -17.496 -19.581 1.00 23.21 ? 247 GLU   A C   1 
ATOM   108  O O   . GLU   A 1 40  ? -14.440 -16.306 -19.398 1.00 23.52 ? 247 GLU   A O   1 
ATOM   109  C CB  . GLU   A 1 40  ? -14.612 -18.829 -17.481 1.00 29.97 ? 247 GLU   A CB  1 
ATOM   110  C CG  . GLU   A 1 40  ? -13.944 -19.799 -16.493 1.00 32.42 ? 247 GLU   A CG  1 
ATOM   111  C CD  . GLU   A 1 40  ? -13.596 -21.113 -17.166 1.00 39.91 ? 247 GLU   A CD  1 
ATOM   112  O OE1 . GLU   A 1 40  ? -14.464 -21.665 -17.861 1.00 46.10 ? 247 GLU   A OE1 1 
ATOM   113  O OE2 . GLU   A 1 40  ? -12.442 -21.552 -17.044 1.00 51.89 ? 247 GLU   A OE2 1 
ATOM   114  N N   . LYS   A 1 41  ? -15.248 -18.120 -20.475 1.00 26.04 ? 248 LYS   A N   1 
ATOM   115  C CA  . LYS   A 1 41  ? -16.225 -17.435 -21.381 1.00 28.41 ? 248 LYS   A CA  1 
ATOM   116  C C   . LYS   A 1 41  ? -17.265 -16.642 -20.563 1.00 26.08 ? 248 LYS   A C   1 
ATOM   117  O O   . LYS   A 1 41  ? -17.627 -17.031 -19.440 1.00 25.81 ? 248 LYS   A O   1 
ATOM   118  C CB  . LYS   A 1 41  ? -16.954 -18.456 -22.253 1.00 36.44 ? 248 LYS   A CB  1 
ATOM   119  C CG  . LYS   A 1 41  ? -16.120 -19.114 -23.341 1.00 39.08 ? 248 LYS   A CG  1 
ATOM   120  C CD  . LYS   A 1 41  ? -16.909 -20.118 -24.173 1.00 49.80 ? 248 LYS   A CD  1 
ATOM   121  C CE  . LYS   A 1 41  ? -16.146 -20.631 -25.377 1.00 52.73 ? 248 LYS   A CE  1 
ATOM   122  N NZ  . LYS   A 1 41  ? -17.027 -21.425 -26.273 1.00 56.86 ? 248 LYS   A NZ  1 
ATOM   123  N N   . ILE   A 1 42  ? -17.697 -15.502 -21.131 1.00 24.39 ? 249 ILE   A N   1 
ATOM   124  C CA  . ILE   A 1 42  ? -18.710 -14.564 -20.565 1.00 26.13 ? 249 ILE   A CA  1 
ATOM   125  C C   . ILE   A 1 42  ? -19.847 -14.537 -21.595 1.00 25.85 ? 249 ILE   A C   1 
ATOM   126  O O   . ILE   A 1 42  ? -19.575 -14.420 -22.795 1.00 23.27 ? 249 ILE   A O   1 
ATOM   127  C CB  . ILE   A 1 42  ? -18.089 -13.161 -20.323 1.00 27.91 ? 249 ILE   A CB  1 
ATOM   128  C CG1 . ILE   A 1 42  ? -16.953 -13.247 -19.288 1.00 30.31 ? 249 ILE   A CG1 1 
ATOM   129  C CG2 . ILE   A 1 42  ? -19.115 -12.118 -19.916 1.00 31.40 ? 249 ILE   A CG2 1 
ATOM   130  C CD1 . ILE   A 1 42  ? -16.189 -11.963 -19.091 1.00 31.51 ? 249 ILE   A CD1 1 
ATOM   131  N N   . TYR   A 1 43  ? -21.094 -14.685 -21.161 1.00 23.37 ? 250 TYR   A N   1 
ATOM   132  C CA  . TYR   A 1 43  ? -22.262 -14.521 -22.057 1.00 23.96 ? 250 TYR   A CA  1 
ATOM   133  C C   . TYR   A 1 43  ? -22.656 -13.067 -22.115 1.00 17.14 ? 250 TYR   A C   1 
ATOM   134  O O   . TYR   A 1 43  ? -22.539 -12.278 -21.155 1.00 20.19 ? 250 TYR   A O   1 
ATOM   135  C CB  . TYR   A 1 43  ? -23.454 -15.303 -21.514 1.00 27.38 ? 250 TYR   A CB  1 
ATOM   136  C CG  . TYR   A 1 43  ? -23.205 -16.773 -21.380 1.00 32.42 ? 250 TYR   A CG  1 
ATOM   137  C CD1 . TYR   A 1 43  ? -22.656 -17.299 -20.217 1.00 34.62 ? 250 TYR   A CD1 1 
ATOM   138  C CD2 . TYR   A 1 43  ? -23.493 -17.623 -22.421 1.00 30.62 ? 250 TYR   A CD2 1 
ATOM   139  C CE1 . TYR   A 1 43  ? -22.435 -18.664 -20.081 1.00 40.54 ? 250 TYR   A CE1 1 
ATOM   140  C CE2 . TYR   A 1 43  ? -23.327 -18.994 -22.282 1.00 32.55 ? 250 TYR   A CE2 1 
ATOM   141  C CZ  . TYR   A 1 43  ? -22.760 -19.509 -21.132 1.00 37.82 ? 250 TYR   A CZ  1 
ATOM   142  O OH  . TYR   A 1 43  ? -22.561 -20.857 -21.058 1.00 47.68 ? 250 TYR   A OH  1 
ATOM   143  N N   . ALA   A 1 44  ? -23.152 -12.646 -23.311 1.00 19.93 ? 251 ALA   A N   1 
ATOM   144  C CA  . ALA   A 1 44  ? -23.682 -11.271 -23.491 1.00 19.26 ? 251 ALA   A CA  1 
ATOM   145  C C   . ALA   A 1 44  ? -25.060 -11.028 -22.841 1.00 16.28 ? 251 ALA   A C   1 
ATOM   146  O O   . ALA   A 1 44  ? -25.233 -9.960  -22.334 1.00 19.54 ? 251 ALA   A O   1 
ATOM   147  C CB  . ALA   A 1 44  ? -23.803 -10.964 -24.950 1.00 18.85 ? 251 ALA   A CB  1 
ATOM   148  N N   . MET   A 1 45  ? -25.904 -12.021 -22.929 1.00 21.04 ? 252 MET   A N   1 
ATOM   149  C CA  . MET   A 1 45  ? -27.304 -11.950 -22.360 1.00 20.05 ? 252 MET   A CA  1 
ATOM   150  C C   . MET   A 1 45  ? -28.044 -10.670 -22.756 1.00 17.51 ? 252 MET   A C   1 
ATOM   151  O O   . MET   A 1 45  ? -28.399 -9.870  -21.919 1.00 20.38 ? 252 MET   A O   1 
ATOM   152  C CB  . MET   A 1 45  ? -27.277 -12.041 -20.830 1.00 21.82 ? 252 MET   A CB  1 
ATOM   153  C CG  . MET   A 1 45  ? -27.004 -13.424 -20.417 1.00 22.87 ? 252 MET   A CG  1 
ATOM   154  S SD  . MET   A 1 45  ? -26.594 -13.654 -18.639 1.00 23.86 ? 252 MET   A SD  1 
ATOM   155  C CE  . MET   A 1 45  ? -24.886 -13.118 -18.562 1.00 22.52 ? 252 MET   A CE  1 
ATOM   156  N N   . PRO   A 1 46  ? -28.195 -10.446 -24.087 1.00 21.03 ? 253 PRO   A N   1 
ATOM   157  C CA  . PRO   A 1 46  ? -28.979 -9.322  -24.561 1.00 20.01 ? 253 PRO   A CA  1 
ATOM   158  C C   . PRO   A 1 46  ? -30.394 -9.519  -23.986 1.00 19.54 ? 253 PRO   A C   1 
ATOM   159  O O   . PRO   A 1 46  ? -30.805 -10.653 -23.957 1.00 21.61 ? 253 PRO   A O   1 
ATOM   160  C CB  . PRO   A 1 46  ? -28.959 -9.505  -26.077 1.00 20.34 ? 253 PRO   A CB  1 
ATOM   161  C CG  . PRO   A 1 46  ? -28.735 -10.918 -26.306 1.00 19.36 ? 253 PRO   A CG  1 
ATOM   162  C CD  . PRO   A 1 46  ? -27.745 -11.273 -25.178 1.00 18.31 ? 253 PRO   A CD  1 
ATOM   163  N N   . ASP   A 1 47  ? -30.982 -8.426  -23.552 1.00 21.15 ? 254 ASP   A N   1 
ATOM   164  C CA  . ASP   A 1 47  ? -32.284 -8.430  -22.819 1.00 19.36 ? 254 ASP   A CA  1 
ATOM   165  C C   . ASP   A 1 47  ? -33.385 -8.857  -23.793 1.00 21.99 ? 254 ASP   A C   1 
ATOM   166  O O   . ASP   A 1 47  ? -33.716 -8.123  -24.718 1.00 20.59 ? 254 ASP   A O   1 
ATOM   167  C CB  . ASP   A 1 47  ? -32.514 -7.106  -22.171 1.00 21.40 ? 254 ASP   A CB  1 
ATOM   168  C CG  . ASP   A 1 47  ? -33.761 -7.015  -21.311 1.00 22.00 ? 254 ASP   A CG  1 
ATOM   169  O OD1 . ASP   A 1 47  ? -34.685 -7.822  -21.565 1.00 21.32 ? 254 ASP   A OD1 1 
ATOM   170  O OD2 . ASP   A 1 47  ? -33.741 -6.195  -20.438 1.00 25.38 ? 254 ASP   A OD2 1 
ATOM   171  N N   . PRO   A 1 48  ? -34.018 -10.022 -23.606 1.00 21.88 ? 255 PRO   A N   1 
ATOM   172  C CA  . PRO   A 1 48  ? -34.983 -10.524 -24.571 1.00 22.16 ? 255 PRO   A CA  1 
ATOM   173  C C   . PRO   A 1 48  ? -36.303 -9.726  -24.530 1.00 21.29 ? 255 PRO   A C   1 
ATOM   174  O O   . PRO   A 1 48  ? -37.114 -9.936  -25.456 1.00 25.00 ? 255 PRO   A O   1 
ATOM   175  C CB  . PRO   A 1 48  ? -35.181 -11.970 -24.142 1.00 24.06 ? 255 PRO   A CB  1 
ATOM   176  C CG  . PRO   A 1 48  ? -34.885 -11.944 -22.669 1.00 24.97 ? 255 PRO   A CG  1 
ATOM   177  C CD  . PRO   A 1 48  ? -33.792 -10.928 -22.451 1.00 21.93 ? 255 PRO   A CD  1 
ATOM   178  N N   . THR   A 1 49  ? -36.464 -8.831  -23.564 1.00 20.89 ? 256 THR   A N   1 
ATOM   179  C CA  . THR   A 1 49  ? -37.702 -8.018  -23.461 1.00 23.52 ? 256 THR   A CA  1 
ATOM   180  C C   . THR   A 1 49  ? -37.525 -6.737  -24.255 1.00 24.75 ? 256 THR   A C   1 
ATOM   181  O O   . THR   A 1 49  ? -38.531 -5.979  -24.375 1.00 25.30 ? 256 THR   A O   1 
ATOM   182  C CB  . THR   A 1 49  ? -38.092 -7.704  -22.002 1.00 22.70 ? 256 THR   A CB  1 
ATOM   183  O OG1 . THR   A 1 49  ? -37.218 -6.797  -21.358 1.00 26.34 ? 256 THR   A OG1 1 
ATOM   184  C CG2 . THR   A 1 49  ? -38.237 -8.967  -21.174 1.00 24.45 ? 256 THR   A CG2 1 
ATOM   185  N N   . VAL   A 1 50  ? -36.313 -6.408  -24.705 1.00 20.49 ? 257 VAL   A N   1 
ATOM   186  C CA  . VAL   A 1 50  ? -36.034 -5.070  -25.288 1.00 20.47 ? 257 VAL   A CA  1 
ATOM   187  C C   . VAL   A 1 50  ? -36.044 -5.206  -26.796 1.00 18.18 ? 257 VAL   A C   1 
ATOM   188  O O   . VAL   A 1 50  ? -35.539 -6.170  -27.374 1.00 19.23 ? 257 VAL   A O   1 
ATOM   189  C CB  . VAL   A 1 50  ? -34.693 -4.525  -24.774 1.00 20.89 ? 257 VAL   A CB  1 
ATOM   190  C CG1 . VAL   A 1 50  ? -34.273 -3.273  -25.518 1.00 21.76 ? 257 VAL   A CG1 1 
ATOM   191  C CG2 . VAL   A 1 50  ? -34.733 -4.314  -23.265 1.00 21.20 ? 257 VAL   A CG2 1 
ATOM   192  N N   . PRO   A 1 51  ? -36.756 -4.296  -27.527 1.00 22.08 ? 258 PRO   A N   1 
ATOM   193  C CA  . PRO   A 1 51  ? -36.722 -4.345  -28.977 1.00 21.02 ? 258 PRO   A CA  1 
ATOM   194  C C   . PRO   A 1 51  ? -35.302 -4.168  -29.527 1.00 18.56 ? 258 PRO   A C   1 
ATOM   195  O O   . PRO   A 1 51  ? -34.570 -3.348  -28.957 1.00 21.31 ? 258 PRO   A O   1 
ATOM   196  C CB  . PRO   A 1 51  ? -37.647 -3.178  -29.396 1.00 22.15 ? 258 PRO   A CB  1 
ATOM   197  C CG  . PRO   A 1 51  ? -38.488 -2.896  -28.192 1.00 25.00 ? 258 PRO   A CG  1 
ATOM   198  C CD  . PRO   A 1 51  ? -37.638 -3.253  -26.982 1.00 22.67 ? 258 PRO   A CD  1 
ATOM   199  N N   . ASP   A 1 52  ? -35.059 -4.874  -30.583 1.00 23.05 ? 259 ASP   A N   1 
ATOM   200  C CA  . ASP   A 1 52  ? -33.768 -4.820  -31.320 1.00 24.82 ? 259 ASP   A CA  1 
ATOM   201  C C   . ASP   A 1 52  ? -33.618 -3.391  -31.815 1.00 25.90 ? 259 ASP   A C   1 
ATOM   202  O O   . ASP   A 1 52  ? -34.643 -2.771  -32.293 1.00 28.65 ? 259 ASP   A O   1 
ATOM   203  C CB  . ASP   A 1 52  ? -33.691 -5.887  -32.400 1.00 30.12 ? 259 ASP   A CB  1 
ATOM   204  C CG  . ASP   A 1 52  ? -33.236 -7.249  -31.875 1.00 36.17 ? 259 ASP   A CG  1 
ATOM   205  O OD1 . ASP   A 1 52  ? -32.750 -7.330  -30.701 1.00 34.25 ? 259 ASP   A OD1 1 
ATOM   206  O OD2 . ASP   A 1 52  ? -33.366 -8.223  -32.633 1.00 48.09 ? 259 ASP   A OD2 1 
ATOM   207  N N   . SER   A 1 53  ? -32.421 -2.822  -31.648 1.00 27.58 ? 260 SER   A N   1 
ATOM   208  C CA  . SER   A 1 53  ? -32.128 -1.400  -31.928 1.00 25.33 ? 260 SER   A CA  1 
ATOM   209  C C   . SER   A 1 53  ? -30.621 -1.204  -31.867 1.00 28.47 ? 260 SER   A C   1 
ATOM   210  O O   . SER   A 1 53  ? -29.933 -2.101  -31.325 1.00 24.93 ? 260 SER   A O   1 
ATOM   211  C CB  . SER   A 1 53  ? -32.833 -0.425  -31.026 1.00 26.17 ? 260 SER   A CB  1 
ATOM   212  O OG  . SER   A 1 53  ? -32.324 -0.312  -29.714 1.00 26.48 ? 260 SER   A OG  1 
ATOM   213  N N   . ASP   A 1 54  ? -30.128 -0.090  -32.407 1.00 27.57 ? 261 ASP   A N   1 
ATOM   214  C CA  . ASP   A 1 54  ? -28.705 0.291   -32.233 1.00 28.72 ? 261 ASP   A CA  1 
ATOM   215  C C   . ASP   A 1 54  ? -28.421 0.469   -30.739 1.00 28.80 ? 261 ASP   A C   1 
ATOM   216  O O   . ASP   A 1 54  ? -27.399 -0.046  -30.258 1.00 26.62 ? 261 ASP   A O   1 
ATOM   217  C CB  . ASP   A 1 54  ? -28.366 1.500   -33.112 1.00 31.61 ? 261 ASP   A CB  1 
ATOM   218  C CG  . ASP   A 1 54  ? -29.160 2.770   -32.883 1.00 38.28 ? 261 ASP   A CG  1 
ATOM   219  O OD1 . ASP   A 1 54  ? -30.187 2.728   -32.206 1.00 36.59 ? 261 ASP   A OD1 1 
ATOM   220  O OD2 . ASP   A 1 54  ? -28.728 3.793   -33.418 1.00 42.11 ? 261 ASP   A OD2 1 
ATOM   221  N N   . ILE   A 1 55  ? -29.333 1.074   -29.976 1.00 26.30 ? 262 ILE   A N   1 
ATOM   222  C CA  . ILE   A 1 55  ? -29.150 1.369   -28.536 1.00 25.29 ? 262 ILE   A CA  1 
ATOM   223  C C   . ILE   A 1 55  ? -29.037 0.021   -27.808 1.00 24.31 ? 262 ILE   A C   1 
ATOM   224  O O   . ILE   A 1 55  ? -28.174 -0.118  -26.900 1.00 25.47 ? 262 ILE   A O   1 
ATOM   225  C CB  . ILE   A 1 55  ? -30.300 2.231   -27.994 1.00 27.70 ? 262 ILE   A CB  1 
ATOM   226  C CG1 . ILE   A 1 55  ? -30.311 3.616   -28.659 1.00 34.41 ? 262 ILE   A CG1 1 
ATOM   227  C CG2 . ILE   A 1 55  ? -30.230 2.316   -26.480 1.00 31.16 ? 262 ILE   A CG2 1 
ATOM   228  C CD1 . ILE   A 1 55  ? -31.620 4.389   -28.490 1.00 35.98 ? 262 ILE   A CD1 1 
ATOM   229  N N   . LYS   A 1 56  ? -29.859 -0.956  -28.164 1.00 25.01 ? 263 LYS   A N   1 
ATOM   230  C CA  . LYS   A 1 56  ? -29.826 -2.252  -27.449 1.00 22.55 ? 263 LYS   A CA  1 
ATOM   231  C C   . LYS   A 1 56  ? -28.462 -2.922  -27.738 1.00 23.65 ? 263 LYS   A C   1 
ATOM   232  O O   . LYS   A 1 56  ? -27.864 -3.458  -26.809 1.00 23.27 ? 263 LYS   A O   1 
ATOM   233  C CB  . LYS   A 1 56  ? -30.969 -3.164  -27.901 1.00 20.87 ? 263 LYS   A CB  1 
ATOM   234  C CG  . LYS   A 1 56  ? -30.929 -4.560  -27.260 1.00 22.38 ? 263 LYS   A CG  1 
ATOM   235  C CD  . LYS   A 1 56  ? -32.032 -5.477  -27.732 1.00 23.16 ? 263 LYS   A CD  1 
ATOM   236  C CE  . LYS   A 1 56  ? -32.028 -6.855  -27.080 1.00 21.84 ? 263 LYS   A CE  1 
ATOM   237  N NZ  . LYS   A 1 56  ? -33.070 -7.736  -27.678 1.00 22.49 ? 263 LYS   A NZ  1 
ATOM   238  N N   . ALA   A 1 57  ? -28.024 -2.933  -28.978 1.00 22.85 ? 264 ALA   A N   1 
ATOM   239  C CA  . ALA   A 1 57  ? -26.786 -3.655  -29.384 1.00 22.39 ? 264 ALA   A CA  1 
ATOM   240  C C   . ALA   A 1 57  ? -25.602 -2.975  -28.688 1.00 24.68 ? 264 ALA   A C   1 
ATOM   241  O O   . ALA   A 1 57  ? -24.739 -3.702  -28.135 1.00 22.08 ? 264 ALA   A O   1 
ATOM   242  C CB  . ALA   A 1 57  ? -26.635 -3.716  -30.885 1.00 25.40 ? 264 ALA   A CB  1 
ATOM   243  N N   . LEU   A 1 58  ? -25.534 -1.653  -28.712 1.00 22.51 ? 265 LEU   A N   1 
ATOM   244  C CA  . LEU   A 1 58  ? -24.435 -0.890  -28.068 1.00 24.26 ? 265 LEU   A CA  1 
ATOM   245  C C   . LEU   A 1 58  ? -24.494 -1.083  -26.551 1.00 25.37 ? 265 LEU   A C   1 
ATOM   246  O O   . LEU   A 1 58  ? -23.431 -1.313  -25.964 1.00 24.36 ? 265 LEU   A O   1 
ATOM   247  C CB  . LEU   A 1 58  ? -24.466 0.587   -28.483 1.00 24.66 ? 265 LEU   A CB  1 
ATOM   248  C CG  . LEU   A 1 58  ? -24.236 0.797   -29.971 1.00 25.10 ? 265 LEU   A CG  1 
ATOM   249  C CD1 . LEU   A 1 58  ? -24.464 2.256   -30.367 1.00 26.13 ? 265 LEU   A CD1 1 
ATOM   250  C CD2 . LEU   A 1 58  ? -22.810 0.374   -30.360 1.00 25.45 ? 265 LEU   A CD2 1 
ATOM   251  N N   . THR   A 1 59  ? -25.669 -1.034  -25.900 1.00 25.48 ? 266 THR   A N   1 
ATOM   252  C CA  . THR   A 1 59  ? -25.826 -1.324  -24.451 1.00 23.99 ? 266 THR   A CA  1 
ATOM   253  C C   . THR   A 1 59  ? -25.270 -2.727  -24.152 1.00 23.28 ? 266 THR   A C   1 
ATOM   254  O O   . THR   A 1 59  ? -24.497 -2.926  -23.162 1.00 24.18 ? 266 THR   A O   1 
ATOM   255  C CB  . THR   A 1 59  ? -27.295 -1.250  -23.993 1.00 24.18 ? 266 THR   A CB  1 
ATOM   256  O OG1 . THR   A 1 59  ? -27.728 0.095   -24.233 1.00 25.55 ? 266 THR   A OG1 1 
ATOM   257  C CG2 . THR   A 1 59  ? -27.434 -1.564  -22.510 1.00 27.24 ? 266 THR   A CG2 1 
ATOM   258  N N   . THR   A 1 60  ? -25.647 -3.706  -24.937 1.00 20.80 ? 267 THR   A N   1 
ATOM   259  C CA  . THR   A 1 60  ? -25.264 -5.127  -24.726 1.00 19.80 ? 267 THR   A CA  1 
ATOM   260  C C   . THR   A 1 60  ? -23.735 -5.245  -24.819 1.00 20.84 ? 267 THR   A C   1 
ATOM   261  O O   . THR   A 1 60  ? -23.112 -5.805  -23.919 1.00 21.38 ? 267 THR   A O   1 
ATOM   262  C CB  . THR   A 1 60  ? -25.874 -6.070  -25.733 1.00 20.73 ? 267 THR   A CB  1 
ATOM   263  O OG1 . THR   A 1 60  ? -27.306 -5.896  -25.664 1.00 21.92 ? 267 THR   A OG1 1 
ATOM   264  C CG2 . THR   A 1 60  ? -25.501 -7.498  -25.449 1.00 20.13 ? 267 THR   A CG2 1 
ATOM   265  N N   . LEU   A 1 61  ? -23.169 -4.640  -25.848 1.00 21.44 ? 268 LEU   A N   1 
ATOM   266  C CA  . LEU   A 1 61  ? -21.688 -4.704  -26.017 1.00 20.06 ? 268 LEU   A CA  1 
ATOM   267  C C   . LEU   A 1 61  ? -20.946 -3.955  -24.922 1.00 21.53 ? 268 LEU   A C   1 
ATOM   268  O O   . LEU   A 1 61  ? -19.892 -4.482  -24.457 1.00 19.80 ? 268 LEU   A O   1 
ATOM   269  C CB  . LEU   A 1 61  ? -21.289 -4.120  -27.373 1.00 19.92 ? 268 LEU   A CB  1 
ATOM   270  C CG  . LEU   A 1 61  ? -21.676 -4.985  -28.555 1.00 21.07 ? 268 LEU   A CG  1 
ATOM   271  C CD1 . LEU   A 1 61  ? -21.374 -4.259  -29.847 1.00 25.63 ? 268 LEU   A CD1 1 
ATOM   272  C CD2 . LEU   A 1 61  ? -21.030 -6.355  -28.592 1.00 24.09 ? 268 LEU   A CD2 1 
ATOM   273  N N   . CYS   A 1 62  ? -21.380 -2.771  -24.494 1.00 21.57 ? 269 CYS   A N   1 
ATOM   274  C CA  . CYS   A 1 62  ? -20.713 -2.055  -23.394 1.00 23.11 ? 269 CYS   A CA  1 
ATOM   275  C C   . CYS   A 1 62  ? -20.838 -2.807  -22.082 1.00 24.51 ? 269 CYS   A C   1 
ATOM   276  O O   . CYS   A 1 62  ? -19.887 -2.733  -21.269 1.00 24.65 ? 269 CYS   A O   1 
ATOM   277  C CB  . CYS   A 1 62  ? -21.199 -0.629  -23.248 1.00 27.83 ? 269 CYS   A CB  1 
ATOM   278  S SG  . CYS   A 1 62  ? -20.781 0.370   -24.694 1.00 30.21 ? 269 CYS   A SG  1 
ATOM   279  N N   . ASP   A 1 63  ? -21.986 -3.461  -21.814 1.00 23.66 ? 270 ASP   A N   1 
ATOM   280  C CA  . ASP   A 1 63  ? -22.146 -4.303  -20.608 1.00 24.13 ? 270 ASP   A CA  1 
ATOM   281  C C   . ASP   A 1 63  ? -21.161 -5.481  -20.652 1.00 21.74 ? 270 ASP   A C   1 
ATOM   282  O O   . ASP   A 1 63  ? -20.521 -5.788  -19.604 1.00 22.70 ? 270 ASP   A O   1 
ATOM   283  C CB  . ASP   A 1 63  ? -23.609 -4.754  -20.516 1.00 25.98 ? 270 ASP   A CB  1 
ATOM   284  C CG  . ASP   A 1 63  ? -23.824 -5.607  -19.280 1.00 30.25 ? 270 ASP   A CG  1 
ATOM   285  O OD1 . ASP   A 1 63  ? -23.759 -5.026  -18.183 1.00 40.80 ? 270 ASP   A OD1 1 
ATOM   286  O OD2 . ASP   A 1 63  ? -23.945 -6.842  -19.413 1.00 38.16 ? 270 ASP   A OD2 1 
ATOM   287  N N   . LEU   A 1 64  ? -21.037 -6.121  -21.789 1.00 21.50 ? 271 LEU   A N   1 
ATOM   288  C CA  . LEU   A 1 64  ? -20.157 -7.275  -21.987 1.00 19.70 ? 271 LEU   A CA  1 
ATOM   289  C C   . LEU   A 1 64  ? -18.703 -6.801  -21.758 1.00 20.25 ? 271 LEU   A C   1 
ATOM   290  O O   . LEU   A 1 64  ? -17.971 -7.493  -21.053 1.00 21.84 ? 271 LEU   A O   1 
ATOM   291  C CB  . LEU   A 1 64  ? -20.304 -7.768  -23.408 1.00 20.55 ? 271 LEU   A CB  1 
ATOM   292  C CG  . LEU   A 1 64  ? -19.466 -8.978  -23.758 1.00 20.61 ? 271 LEU   A CG  1 
ATOM   293  C CD1 . LEU   A 1 64  ? -19.773 -10.169 -22.856 1.00 24.82 ? 271 LEU   A CD1 1 
ATOM   294  C CD2 . LEU   A 1 64  ? -19.602 -9.347  -25.201 1.00 22.03 ? 271 LEU   A CD2 1 
ATOM   295  N N   . ALA   A 1 65  ? -18.347 -5.637  -22.264 1.00 21.49 ? 272 ALA   A N   1 
ATOM   296  C CA  . ALA   A 1 65  ? -16.951 -5.118  -22.063 1.00 20.53 ? 272 ALA   A CA  1 
ATOM   297  C C   . ALA   A 1 65  ? -16.700 -4.828  -20.597 1.00 24.44 ? 272 ALA   A C   1 
ATOM   298  O O   . ALA   A 1 65  ? -15.595 -5.179  -20.086 1.00 21.97 ? 272 ALA   A O   1 
ATOM   299  C CB  . ALA   A 1 65  ? -16.695 -3.870  -22.867 1.00 19.70 ? 272 ALA   A CB  1 
ATOM   300  N N   . ASP   A 1 66  ? -17.637 -4.177  -19.921 1.00 21.40 ? 273 ASP   A N   1 
ATOM   301  C CA  . ASP   A 1 66  ? -17.494 -3.882  -18.476 1.00 22.34 ? 273 ASP   A CA  1 
ATOM   302  C C   . ASP   A 1 66  ? -17.200 -5.167  -17.685 1.00 24.18 ? 273 ASP   A C   1 
ATOM   303  O O   . ASP   A 1 66  ? -16.263 -5.179  -16.870 1.00 24.92 ? 273 ASP   A O   1 
ATOM   304  C CB  . ASP   A 1 66  ? -18.761 -3.198  -17.963 1.00 25.00 ? 273 ASP   A CB  1 
ATOM   305  C CG  . ASP   A 1 66  ? -18.584 -2.627  -16.586 1.00 27.41 ? 273 ASP   A CG  1 
ATOM   306  O OD1 . ASP   A 1 66  ? -17.870 -1.602  -16.476 1.00 33.34 ? 273 ASP   A OD1 1 
ATOM   307  O OD2 . ASP   A 1 66  ? -19.145 -3.249  -15.638 1.00 35.56 ? 273 ASP   A OD2 1 
ATOM   308  N N   . ARG   A 1 67  ? -17.902 -6.275  -17.924 1.00 20.76 ? 274 ARG   A N   1 
ATOM   309  C CA  . ARG   A 1 67  ? -17.688 -7.535  -17.200 1.00 24.45 ? 274 ARG   A CA  1 
ATOM   310  C C   . ARG   A 1 67  ? -16.329 -8.121  -17.612 1.00 20.72 ? 274 ARG   A C   1 
ATOM   311  O O   . ARG   A 1 67  ? -15.644 -8.697  -16.757 1.00 21.75 ? 274 ARG   A O   1 
ATOM   312  C CB  . ARG   A 1 67  ? -18.901 -8.440  -17.403 1.00 26.77 ? 274 ARG   A CB  1 
ATOM   313  C CG  . ARG   A 1 67  ? -20.146 -7.872  -16.742 1.00 26.86 ? 274 ARG   A CG  1 
ATOM   314  C CD  . ARG   A 1 67  ? -21.284 -8.862  -16.872 1.00 25.88 ? 274 ARG   A CD  1 
ATOM   315  N NE  . ARG   A 1 67  ? -21.885 -8.704  -18.180 1.00 25.03 ? 274 ARG   A NE  1 
ATOM   316  C CZ  . ARG   A 1 67  ? -22.122 -9.673  -19.051 1.00 22.92 ? 274 ARG   A CZ  1 
ATOM   317  N NH1 . ARG   A 1 67  ? -21.904 -10.937 -18.785 1.00 25.43 ? 274 ARG   A NH1 1 
ATOM   318  N NH2 . ARG   A 1 67  ? -22.708 -9.366  -20.201 1.00 25.18 ? 274 ARG   A NH2 1 
ATOM   319  N N   . GLU   A 1 68  ? -16.014 -8.091  -18.902 1.00 22.60 ? 275 GLU   A N   1 
ATOM   320  C CA  . GLU   A 1 68  ? -14.720 -8.669  -19.333 1.00 22.08 ? 275 GLU   A CA  1 
ATOM   321  C C   . GLU   A 1 68  ? -13.586 -7.842  -18.752 1.00 22.38 ? 275 GLU   A C   1 
ATOM   322  O O   . GLU   A 1 68  ? -12.572 -8.505  -18.369 1.00 21.21 ? 275 GLU   A O   1 
ATOM   323  C CB  . GLU   A 1 68  ? -14.570 -8.791  -20.832 1.00 22.98 ? 275 GLU   A CB  1 
ATOM   324  C CG  . GLU   A 1 68  ? -13.381 -9.719  -21.046 1.00 24.34 ? 275 GLU   A CG  1 
ATOM   325  C CD  . GLU   A 1 68  ? -13.033 -10.058 -22.454 1.00 30.01 ? 275 GLU   A CD  1 
ATOM   326  O OE1 . GLU   A 1 68  ? -13.927 -9.856  -23.324 1.00 29.42 ? 275 GLU   A OE1 1 
ATOM   327  O OE2 . GLU   A 1 68  ? -11.899 -10.568 -22.657 1.00 29.62 ? 275 GLU   A OE2 1 
ATOM   328  N N   . LEU   A 1 69  ? -13.735 -6.532  -18.604 1.00 20.47 ? 276 LEU   A N   1 
ATOM   329  C CA  . LEU   A 1 69  ? -12.642 -5.729  -18.010 1.00 19.63 ? 276 LEU   A CA  1 
ATOM   330  C C   . LEU   A 1 69  ? -12.332 -6.233  -16.609 1.00 23.23 ? 276 LEU   A C   1 
ATOM   331  O O   . LEU   A 1 69  ? -11.147 -6.277  -16.228 1.00 21.95 ? 276 LEU   A O   1 
ATOM   332  C CB  . LEU   A 1 69  ? -13.012 -4.260  -18.036 1.00 22.10 ? 276 LEU   A CB  1 
ATOM   333  C CG  . LEU   A 1 69  ? -12.857 -3.616  -19.402 1.00 23.66 ? 276 LEU   A CG  1 
ATOM   334  C CD1 . LEU   A 1 69  ? -13.501 -2.253  -19.422 1.00 24.95 ? 276 LEU   A CD1 1 
ATOM   335  C CD2 . LEU   A 1 69  ? -11.365 -3.475  -19.745 1.00 26.02 ? 276 LEU   A CD2 1 
ATOM   336  N N   . VAL   A 1 70  ? -13.325 -6.592  -15.805 1.00 21.38 ? 277 VAL   A N   1 
ATOM   337  C CA  . VAL   A 1 70  ? -13.032 -7.132  -14.451 1.00 22.48 ? 277 VAL   A CA  1 
ATOM   338  C C   . VAL   A 1 70  ? -12.126 -8.352  -14.560 1.00 20.69 ? 277 VAL   A C   1 
ATOM   339  O O   . VAL   A 1 70  ? -11.120 -8.460  -13.788 1.00 23.32 ? 277 VAL   A O   1 
ATOM   340  C CB  . VAL   A 1 70  ? -14.319 -7.479  -13.677 1.00 24.89 ? 277 VAL   A CB  1 
ATOM   341  C CG1 . VAL   A 1 70  ? -13.986 -8.185  -12.361 1.00 26.57 ? 277 VAL   A CG1 1 
ATOM   342  C CG2 . VAL   A 1 70  ? -15.089 -6.221  -13.389 1.00 25.33 ? 277 VAL   A CG2 1 
ATOM   343  N N   . VAL   A 1 71  ? -12.388 -9.302  -15.442 1.00 20.29 ? 278 VAL   A N   1 
ATOM   344  C CA  A VAL   A 1 71  ? -11.609 -10.566 -15.563 0.50 23.38 ? 278 VAL   A CA  1 
ATOM   345  C CA  B VAL   A 1 71  ? -11.544 -10.538 -15.461 0.50 20.53 ? 278 VAL   A CA  1 
ATOM   346  C C   . VAL   A 1 71  ? -10.217 -10.272 -16.177 1.00 20.19 ? 278 VAL   A C   1 
ATOM   347  O O   . VAL   A 1 71  ? -9.267  -10.969 -15.857 1.00 22.01 ? 278 VAL   A O   1 
ATOM   348  C CB  A VAL   A 1 71  ? -12.488 -11.586 -16.308 0.50 30.59 ? 278 VAL   A CB  1 
ATOM   349  C CB  B VAL   A 1 71  ? -12.253 -11.776 -16.008 0.50 20.93 ? 278 VAL   A CB  1 
ATOM   350  C CG1 A VAL   A 1 71  ? -11.742 -12.442 -17.293 0.50 32.53 ? 278 VAL   A CG1 1 
ATOM   351  C CG1 B VAL   A 1 71  ? -13.500 -12.046 -15.188 0.50 20.75 ? 278 VAL   A CG1 1 
ATOM   352  C CG2 A VAL   A 1 71  ? -13.240 -12.460 -15.311 0.50 31.11 ? 278 VAL   A CG2 1 
ATOM   353  C CG2 B VAL   A 1 71  ? -12.626 -11.598 -17.467 0.50 17.15 ? 278 VAL   A CG2 1 
ATOM   354  N N   . ILE   A 1 72  ? -10.173 -9.289  -17.054 1.00 18.56 ? 279 ILE   A N   1 
ATOM   355  C CA  . ILE   A 1 72  ? -8.846  -8.851  -17.626 1.00 20.52 ? 279 ILE   A CA  1 
ATOM   356  C C   . ILE   A 1 72  ? -7.939  -8.373  -16.501 1.00 21.52 ? 279 ILE   A C   1 
ATOM   357  O O   . ILE   A 1 72  ? -6.703  -8.702  -16.516 1.00 20.04 ? 279 ILE   A O   1 
ATOM   358  C CB  . ILE   A 1 72  ? -9.035  -7.815  -18.731 1.00 18.00 ? 279 ILE   A CB  1 
ATOM   359  C CG1 . ILE   A 1 72  ? -9.551  -8.565  -19.954 1.00 17.95 ? 279 ILE   A CG1 1 
ATOM   360  C CG2 . ILE   A 1 72  ? -7.723  -7.075  -19.042 1.00 17.79 ? 279 ILE   A CG2 1 
ATOM   361  C CD1 . ILE   A 1 72  ? -10.165 -7.627  -20.974 1.00 19.85 ? 279 ILE   A CD1 1 
ATOM   362  N N   . ILE   A 1 73  ? -8.463  -7.587  -15.578 1.00 20.98 ? 280 ILE   A N   1 
ATOM   363  C CA  . ILE   A 1 73  ? -7.624  -7.077  -14.456 1.00 20.71 ? 280 ILE   A CA  1 
ATOM   364  C C   . ILE   A 1 73  ? -7.080  -8.252  -13.645 1.00 22.72 ? 280 ILE   A C   1 
ATOM   365  O O   . ILE   A 1 73  ? -5.836  -8.288  -13.340 1.00 23.16 ? 280 ILE   A O   1 
ATOM   366  C CB  . ILE   A 1 73  ? -8.407  -6.071  -13.608 1.00 22.70 ? 280 ILE   A CB  1 
ATOM   367  C CG1 . ILE   A 1 73  ? -8.700  -4.813  -14.408 1.00 22.98 ? 280 ILE   A CG1 1 
ATOM   368  C CG2 . ILE   A 1 73  ? -7.628  -5.813  -12.319 1.00 25.14 ? 280 ILE   A CG2 1 
ATOM   369  C CD1 . ILE   A 1 73  ? -9.824  -3.981  -13.807 1.00 23.69 ? 280 ILE   A CD1 1 
ATOM   370  N N   . GLY   A 1 74  ? -7.884  -9.261  -13.366 1.00 22.34 ? 281 GLY   A N   1 
ATOM   371  C CA  . GLY   A 1 74  ? -7.436  -10.439 -12.619 1.00 24.21 ? 281 GLY   A CA  1 
ATOM   372  C C   . GLY   A 1 74  ? -6.440  -11.263 -13.421 1.00 24.02 ? 281 GLY   A C   1 
ATOM   373  O O   . GLY   A 1 74  ? -5.449  -11.782 -12.882 1.00 25.75 ? 281 GLY   A O   1 
ATOM   374  N N   . TRP   A 1 75  ? -6.648  -11.372 -14.733 1.00 21.39 ? 282 TRP   A N   1 
ATOM   375  C CA  . TRP   A 1 75  ? -5.749  -12.120 -15.635 1.00 20.68 ? 282 TRP   A CA  1 
ATOM   376  C C   . TRP   A 1 75  ? -4.364  -11.492 -15.615 1.00 18.63 ? 282 TRP   A C   1 
ATOM   377  O O   . TRP   A 1 75  ? -3.351  -12.243 -15.595 1.00 20.66 ? 282 TRP   A O   1 
ATOM   378  C CB  . TRP   A 1 75  ? -6.354  -12.075 -17.028 1.00 19.89 ? 282 TRP   A CB  1 
ATOM   379  C CG  . TRP   A 1 75  ? -5.430  -12.414 -18.158 1.00 17.90 ? 282 TRP   A CG  1 
ATOM   380  C CD1 . TRP   A 1 75  ? -5.048  -13.632 -18.614 1.00 19.16 ? 282 TRP   A CD1 1 
ATOM   381  C CD2 . TRP   A 1 75  ? -4.799  -11.426 -19.001 1.00 19.08 ? 282 TRP   A CD2 1 
ATOM   382  N NE1 . TRP   A 1 75  ? -4.156  -13.452 -19.650 1.00 20.54 ? 282 TRP   A NE1 1 
ATOM   383  C CE2 . TRP   A 1 75  ? -4.025  -12.128 -19.926 1.00 19.73 ? 282 TRP   A CE2 1 
ATOM   384  C CE3 . TRP   A 1 75  ? -4.858  -10.042 -19.039 1.00 20.58 ? 282 TRP   A CE3 1 
ATOM   385  C CZ2 . TRP   A 1 75  ? -3.311  -11.428 -20.926 1.00 17.83 ? 282 TRP   A CZ2 1 
ATOM   386  C CZ3 . TRP   A 1 75  ? -4.131  -9.369  -20.009 1.00 21.46 ? 282 TRP   A CZ3 1 
ATOM   387  C CH2 . TRP   A 1 75  ? -3.319  -10.078 -20.876 1.00 18.03 ? 282 TRP   A CH2 1 
ATOM   388  N N   . ALA   A 1 76  ? -4.324  -10.157 -15.655 1.00 18.52 ? 283 ALA   A N   1 
ATOM   389  C CA  . ALA   A 1 76  ? -3.027  -9.443  -15.807 1.00 19.35 ? 283 ALA   A CA  1 
ATOM   390  C C   . ALA   A 1 76  ? -2.133  -9.791  -14.619 1.00 23.37 ? 283 ALA   A C   1 
ATOM   391  O O   . ALA   A 1 76  ? -0.894  -9.894  -14.774 1.00 20.99 ? 283 ALA   A O   1 
ATOM   392  C CB  . ALA   A 1 76  ? -3.187  -7.986  -15.912 1.00 17.96 ? 283 ALA   A CB  1 
ATOM   393  N N   . LYS   A 1 77  ? -2.746  -10.003 -13.468 1.00 22.08 ? 284 LYS   A N   1 
ATOM   394  C CA  . LYS   A 1 77  ? -1.951  -10.295 -12.248 1.00 22.42 ? 284 LYS   A CA  1 
ATOM   395  C C   . LYS   A 1 77  ? -1.251  -11.655 -12.357 1.00 24.75 ? 284 LYS   A C   1 
ATOM   396  O O   . LYS   A 1 77  ? -0.288  -11.888 -11.548 1.00 24.84 ? 284 LYS   A O   1 
ATOM   397  C CB  . LYS   A 1 77  ? -2.878  -10.247 -11.035 1.00 27.90 ? 284 LYS   A CB  1 
ATOM   398  C CG  . LYS   A 1 77  ? -3.510  -8.890  -10.805 1.00 28.84 ? 284 LYS   A CG  1 
ATOM   399  C CD  . LYS   A 1 77  ? -4.477  -8.942  -9.639  1.00 35.44 ? 284 LYS   A CD  1 
ATOM   400  C CE  . LYS   A 1 77  ? -5.169  -7.634  -9.386  1.00 37.58 ? 284 LYS   A CE  1 
ATOM   401  N NZ  . LYS   A 1 77  ? -5.961  -7.694  -8.131  1.00 39.75 ? 284 LYS   A NZ  1 
ATOM   402  N N   . HIS   A 1 78  ? -1.598  -12.551 -13.276 1.00 22.93 ? 285 HIS   A N   1 
ATOM   403  C CA  . HIS   A 1 78  ? -0.928  -13.858 -13.437 1.00 22.89 ? 285 HIS   A CA  1 
ATOM   404  C C   . HIS   A 1 78  ? 0.294   -13.717 -14.360 1.00 22.13 ? 285 HIS   A C   1 
ATOM   405  O O   . HIS   A 1 78  ? 1.025   -14.686 -14.539 1.00 24.98 ? 285 HIS   A O   1 
ATOM   406  C CB  . HIS   A 1 78  ? -1.854  -14.885 -14.044 1.00 23.56 ? 285 HIS   A CB  1 
ATOM   407  C CG  . HIS   A 1 78  ? -2.889  -15.365 -13.107 1.00 26.12 ? 285 HIS   A CG  1 
ATOM   408  N ND1 . HIS   A 1 78  ? -2.560  -16.224 -12.067 1.00 30.19 ? 285 HIS   A ND1 1 
ATOM   409  C CD2 . HIS   A 1 78  ? -4.229  -15.201 -13.085 1.00 27.94 ? 285 HIS   A CD2 1 
ATOM   410  C CE1 . HIS   A 1 78  ? -3.678  -16.541 -11.418 1.00 28.29 ? 285 HIS   A CE1 1 
ATOM   411  N NE2 . HIS   A 1 78  ? -4.702  -15.934 -12.023 1.00 31.25 ? 285 HIS   A NE2 1 
ATOM   412  N N   . ILE   A 1 79  ? 0.444   -12.576 -15.020 1.00 21.52 ? 286 ILE   A N   1 
ATOM   413  C CA  . ILE   A 1 79  ? 1.528   -12.435 -16.033 1.00 23.14 ? 286 ILE   A CA  1 
ATOM   414  C C   . ILE   A 1 79  ? 2.824   -12.245 -15.257 1.00 21.92 ? 286 ILE   A C   1 
ATOM   415  O O   . ILE   A 1 79  ? 2.900   -11.354 -14.440 1.00 22.51 ? 286 ILE   A O   1 
ATOM   416  C CB  . ILE   A 1 79  ? 1.239   -11.276 -16.977 1.00 20.92 ? 286 ILE   A CB  1 
ATOM   417  C CG1 . ILE   A 1 79  ? -0.015  -11.469 -17.824 1.00 23.14 ? 286 ILE   A CG1 1 
ATOM   418  C CG2 . ILE   A 1 79  ? 2.466   -11.048 -17.881 1.00 22.52 ? 286 ILE   A CG2 1 
ATOM   419  C CD1 . ILE   A 1 79  ? -0.428  -10.227 -18.542 1.00 22.85 ? 286 ILE   A CD1 1 
ATOM   420  N N   . PRO   A 1 80  ? 3.904   -13.014 -15.517 1.00 24.51 ? 287 PRO   A N   1 
ATOM   421  C CA  . PRO   A 1 80  ? 5.087   -12.895 -14.666 1.00 26.35 ? 287 PRO   A CA  1 
ATOM   422  C C   . PRO   A 1 80  ? 5.617   -11.454 -14.650 1.00 25.74 ? 287 PRO   A C   1 
ATOM   423  O O   . PRO   A 1 80  ? 5.891   -10.862 -15.697 1.00 28.53 ? 287 PRO   A O   1 
ATOM   424  C CB  . PRO   A 1 80  ? 6.065   -13.965 -15.218 1.00 27.76 ? 287 PRO   A CB  1 
ATOM   425  C CG  . PRO   A 1 80  ? 5.504   -14.357 -16.561 1.00 30.67 ? 287 PRO   A CG  1 
ATOM   426  C CD  . PRO   A 1 80  ? 4.006   -14.125 -16.466 1.00 26.71 ? 287 PRO   A CD  1 
ATOM   427  N N   . GLY   A 1 81  ? 5.813   -10.913 -13.455 1.00 24.40 ? 288 GLY   A N   1 
ATOM   428  C CA  . GLY   A 1 81  ? 6.345   -9.565  -13.253 1.00 24.59 ? 288 GLY   A CA  1 
ATOM   429  C C   . GLY   A 1 81  ? 5.320   -8.454  -13.200 1.00 26.45 ? 288 GLY   A C   1 
ATOM   430  O O   . GLY   A 1 81  ? 5.646   -7.395  -12.739 1.00 27.69 ? 288 GLY   A O   1 
ATOM   431  N N   . PHE   A 1 82  ? 4.105   -8.646  -13.740 1.00 24.75 ? 289 PHE   A N   1 
ATOM   432  C CA  . PHE   A 1 82  ? 3.143   -7.526  -13.813 1.00 24.35 ? 289 PHE   A CA  1 
ATOM   433  C C   . PHE   A 1 82  ? 2.843   -6.973  -12.402 1.00 23.44 ? 289 PHE   A C   1 
ATOM   434  O O   . PHE   A 1 82  ? 2.835   -5.735  -12.223 1.00 25.99 ? 289 PHE   A O   1 
ATOM   435  C CB  . PHE   A 1 82  ? 1.862   -7.991  -14.531 1.00 21.86 ? 289 PHE   A CB  1 
ATOM   436  C CG  . PHE   A 1 82  ? 0.838   -6.898  -14.673 1.00 21.85 ? 289 PHE   A CG  1 
ATOM   437  C CD1 . PHE   A 1 82  ? 0.862   -5.998  -15.726 1.00 23.41 ? 289 PHE   A CD1 1 
ATOM   438  C CD2 . PHE   A 1 82  ? -0.145  -6.732  -13.716 1.00 23.04 ? 289 PHE   A CD2 1 
ATOM   439  C CE1 . PHE   A 1 82  ? -0.068  -4.976  -15.812 1.00 22.86 ? 289 PHE   A CE1 1 
ATOM   440  C CE2 . PHE   A 1 82  ? -1.084  -5.721  -13.812 1.00 23.00 ? 289 PHE   A CE2 1 
ATOM   441  C CZ  . PHE   A 1 82  ? -1.041  -4.832  -14.841 1.00 23.40 ? 289 PHE   A CZ  1 
ATOM   442  N N   . SER   A 1 83  ? 2.555   -7.869  -11.455 1.00 25.26 ? 290 SER   A N   1 
ATOM   443  C CA  . SER   A 1 83  ? 2.122   -7.485  -10.080 1.00 26.91 ? 290 SER   A CA  1 
ATOM   444  C C   . SER   A 1 83  ? 3.276   -6.866  -9.288  1.00 31.50 ? 290 SER   A C   1 
ATOM   445  O O   . SER   A 1 83  ? 2.991   -6.300  -8.221  1.00 31.54 ? 290 SER   A O   1 
ATOM   446  C CB  . SER   A 1 83  ? 1.564   -8.643  -9.311  1.00 27.95 ? 290 SER   A CB  1 
ATOM   447  O OG  . SER   A 1 83  ? 0.327   -9.039  -9.868  1.00 39.78 ? 290 SER   A OG  1 
ATOM   448  N N   . THR   A 1 84  ? 4.504   -6.950  -9.793  1.00 29.10 ? 291 THR   A N   1 
ATOM   449  C CA  . THR   A 1 84  ? 5.695   -6.350  -9.117  1.00 32.60 ? 291 THR   A CA  1 
ATOM   450  C C   . THR   A 1 84  ? 5.870   -4.894  -9.557  1.00 32.22 ? 291 THR   A C   1 
ATOM   451  O O   . THR   A 1 84  ? 6.533   -4.119  -8.845  1.00 33.37 ? 291 THR   A O   1 
ATOM   452  C CB  . THR   A 1 84  ? 6.922   -7.241  -9.346  1.00 33.76 ? 291 THR   A CB  1 
ATOM   453  O OG1 . THR   A 1 84  ? 7.356   -7.125  -10.699 1.00 46.15 ? 291 THR   A OG1 1 
ATOM   454  C CG2 . THR   A 1 84  ? 6.634   -8.682  -9.013  1.00 32.61 ? 291 THR   A CG2 1 
ATOM   455  N N   . LEU   A 1 85  ? 5.303   -4.477  -10.699 1.00 27.40 ? 292 LEU   A N   1 
ATOM   456  C CA  . LEU   A 1 85  ? 5.247   -3.059  -11.069 1.00 25.33 ? 292 LEU   A CA  1 
ATOM   457  C C   . LEU   A 1 85  ? 4.497   -2.276  -9.981  1.00 23.88 ? 292 LEU   A C   1 
ATOM   458  O O   . LEU   A 1 85  ? 3.637   -2.868  -9.290  1.00 26.55 ? 292 LEU   A O   1 
ATOM   459  C CB  . LEU   A 1 85  ? 4.506   -2.890  -12.401 1.00 26.07 ? 292 LEU   A CB  1 
ATOM   460  C CG  . LEU   A 1 85  ? 5.157   -3.548  -13.614 1.00 25.95 ? 292 LEU   A CG  1 
ATOM   461  C CD1 . LEU   A 1 85  ? 4.199   -3.490  -14.815 1.00 24.93 ? 292 LEU   A CD1 1 
ATOM   462  C CD2 . LEU   A 1 85  ? 6.464   -2.893  -13.964 1.00 27.56 ? 292 LEU   A CD2 1 
ATOM   463  N N   . SER   A 1 86  ? 4.694   -0.959  -9.946  1.00 25.20 ? 293 SER   A N   1 
ATOM   464  C CA  . SER   A 1 86  ? 3.891   -0.068  -9.091  1.00 26.52 ? 293 SER   A CA  1 
ATOM   465  C C   . SER   A 1 86  ? 2.436   -0.184  -9.537  1.00 28.17 ? 293 SER   A C   1 
ATOM   466  O O   . SER   A 1 86  ? 2.173   -0.361  -10.773 1.00 25.87 ? 293 SER   A O   1 
ATOM   467  C CB  . SER   A 1 86  ? 4.357   1.343   -9.158  1.00 29.98 ? 293 SER   A CB  1 
ATOM   468  O OG  . SER   A 1 86  ? 4.018   1.947   -10.390 1.00 30.19 ? 293 SER   A OG  1 
ATOM   469  N N   . LEU   A 1 87  ? 1.502   0.004   -8.624  1.00 27.42 ? 294 LEU   A N   1 
ATOM   470  C CA  . LEU   A 1 87  ? 0.068   0.102   -9.002  1.00 27.01 ? 294 LEU   A CA  1 
ATOM   471  C C   . LEU   A 1 87  ? -0.124  1.189   -10.072 1.00 27.99 ? 294 LEU   A C   1 
ATOM   472  O O   . LEU   A 1 87  ? -0.972  0.979   -10.980 1.00 24.70 ? 294 LEU   A O   1 
ATOM   473  C CB  . LEU   A 1 87  ? -0.749  0.360   -7.728  1.00 29.13 ? 294 LEU   A CB  1 
ATOM   474  C CG  . LEU   A 1 87  ? -0.857  -0.827  -6.778  1.00 31.24 ? 294 LEU   A CG  1 
ATOM   475  C CD1 . LEU   A 1 87  ? -1.385  -0.379  -5.415  1.00 31.79 ? 294 LEU   A CD1 1 
ATOM   476  C CD2 . LEU   A 1 87  ? -1.761  -1.902  -7.326  1.00 31.22 ? 294 LEU   A CD2 1 
ATOM   477  N N   . ALA   A 1 88  ? 0.649   2.278   -10.074 1.00 26.72 ? 295 ALA   A N   1 
ATOM   478  C CA  . ALA   A 1 88  ? 0.524   3.333   -11.099 1.00 26.19 ? 295 ALA   A CA  1 
ATOM   479  C C   . ALA   A 1 88  ? 0.885   2.726   -12.470 1.00 23.25 ? 295 ALA   A C   1 
ATOM   480  O O   . ALA   A 1 88  ? 0.122   2.954   -13.411 1.00 22.68 ? 295 ALA   A O   1 
ATOM   481  C CB  . ALA   A 1 88  ? 1.369   4.529   -10.773 1.00 28.69 ? 295 ALA   A CB  1 
ATOM   482  N N   . ASP   A 1 89  ? 1.967   1.969   -12.537 1.00 23.51 ? 296 ASP   A N   1 
ATOM   483  C CA  . ASP   A 1 89  ? 2.382   1.374   -13.839 1.00 23.18 ? 296 ASP   A CA  1 
ATOM   484  C C   . ASP   A 1 89  ? 1.357   0.303   -14.237 1.00 22.89 ? 296 ASP   A C   1 
ATOM   485  O O   . ASP   A 1 89  ? 1.043   0.218   -15.483 1.00 21.33 ? 296 ASP   A O   1 
ATOM   486  C CB  . ASP   A 1 89  ? 3.829   0.903   -13.783 1.00 23.82 ? 296 ASP   A CB  1 
ATOM   487  C CG  . ASP   A 1 89  ? 4.851   2.042   -13.904 1.00 23.50 ? 296 ASP   A CG  1 
ATOM   488  O OD1 . ASP   A 1 89  ? 4.454   3.161   -14.243 1.00 26.24 ? 296 ASP   A OD1 1 
ATOM   489  O OD2 . ASP   A 1 89  ? 6.060   1.744   -13.765 1.00 26.53 ? 296 ASP   A OD2 1 
ATOM   490  N N   . GLN   A 1 90  ? 0.891   -0.540  -13.321 1.00 22.63 ? 297 GLN   A N   1 
ATOM   491  C CA  . GLN   A 1 90  ? -0.136  -1.567  -13.675 1.00 21.10 ? 297 GLN   A CA  1 
ATOM   492  C C   . GLN   A 1 90  ? -1.352  -0.849  -14.286 1.00 21.14 ? 297 GLN   A C   1 
ATOM   493  O O   . GLN   A 1 90  ? -1.893  -1.275  -15.381 1.00 21.15 ? 297 GLN   A O   1 
ATOM   494  C CB  . GLN   A 1 90  ? -0.579  -2.371  -12.452 1.00 23.02 ? 297 GLN   A CB  1 
ATOM   495  C CG  . GLN   A 1 90  ? 0.524   -3.208  -11.863 1.00 21.68 ? 297 GLN   A CG  1 
ATOM   496  C CD  . GLN   A 1 90  ? 0.105   -3.922  -10.602 1.00 25.16 ? 297 GLN   A CD  1 
ATOM   497  O OE1 . GLN   A 1 90  ? -0.977  -4.507  -10.542 1.00 25.48 ? 297 GLN   A OE1 1 
ATOM   498  N NE2 . GLN   A 1 90  ? 0.964   -3.890  -9.574  1.00 25.05 ? 297 GLN   A NE2 1 
ATOM   499  N N   . MET   A 1 91  ? -1.809  0.232   -13.653 1.00 22.09 ? 298 MET   A N   1 
ATOM   500  C CA  A MET   A 1 91  ? -2.962  1.029   -14.143 0.50 22.32 ? 298 MET   A CA  1 
ATOM   501  C CA  B MET   A 1 91  ? -2.951  1.050   -14.122 0.50 22.87 ? 298 MET   A CA  1 
ATOM   502  C C   . MET   A 1 91  ? -2.638  1.567   -15.547 1.00 21.43 ? 298 MET   A C   1 
ATOM   503  O O   . MET   A 1 91  ? -3.489  1.485   -16.410 1.00 21.99 ? 298 MET   A O   1 
ATOM   504  C CB  A MET   A 1 91  ? -3.298  2.211   -13.232 0.50 24.63 ? 298 MET   A CB  1 
ATOM   505  C CB  B MET   A 1 91  ? -3.179  2.195   -13.127 0.50 26.20 ? 298 MET   A CB  1 
ATOM   506  C CG  A MET   A 1 91  ? -3.931  1.791   -11.950 0.50 25.12 ? 298 MET   A CG  1 
ATOM   507  C CG  B MET   A 1 91  ? -4.267  3.176   -13.491 0.50 27.67 ? 298 MET   A CG  1 
ATOM   508  S SD  A MET   A 1 91  ? -4.474  3.210   -10.923 0.50 28.61 ? 298 MET   A SD  1 
ATOM   509  S SD  B MET   A 1 91  ? -4.909  4.045   -11.998 0.50 33.69 ? 298 MET   A SD  1 
ATOM   510  C CE  A MET   A 1 91  ? -3.430  4.573   -11.417 0.50 28.32 ? 298 MET   A CE  1 
ATOM   511  C CE  B MET   A 1 91  ? -4.804  2.699   -10.819 0.50 31.70 ? 298 MET   A CE  1 
ATOM   512  N N   . SER   A 1 92  ? -1.438  2.103   -15.766 1.00 21.25 ? 299 SER   A N   1 
ATOM   513  C CA  . SER   A 1 92  ? -1.052  2.761   -17.028 1.00 20.19 ? 299 SER   A CA  1 
ATOM   514  C C   . SER   A 1 92  ? -1.098  1.754   -18.197 1.00 18.00 ? 299 SER   A C   1 
ATOM   515  O O   . SER   A 1 92  ? -1.677  2.070   -19.268 1.00 19.93 ? 299 SER   A O   1 
ATOM   516  C CB  . SER   A 1 92  ? 0.309   3.397   -16.899 1.00 22.56 ? 299 SER   A CB  1 
ATOM   517  O OG  . SER   A 1 92  ? 0.224   4.536   -16.037 1.00 24.97 ? 299 SER   A OG  1 
ATOM   518  N N   . LEU   A 1 93  ? -0.586  0.569   -17.947 1.00 19.73 ? 300 LEU   A N   1 
ATOM   519  C CA  . LEU   A 1 93  ? -0.495  -0.472  -19.001 1.00 18.08 ? 300 LEU   A CA  1 
ATOM   520  C C   . LEU   A 1 93  ? -1.933  -0.871  -19.346 1.00 18.92 ? 300 LEU   A C   1 
ATOM   521  O O   . LEU   A 1 93  ? -2.286  -0.953  -20.522 1.00 17.86 ? 300 LEU   A O   1 
ATOM   522  C CB  . LEU   A 1 93  ? 0.277   -1.682  -18.517 1.00 18.77 ? 300 LEU   A CB  1 
ATOM   523  C CG  . LEU   A 1 93  ? 1.815   -1.564  -18.464 1.00 23.71 ? 300 LEU   A CG  1 
ATOM   524  C CD1 . LEU   A 1 93  ? 2.418   -2.864  -17.967 1.00 25.99 ? 300 LEU   A CD1 1 
ATOM   525  C CD2 . LEU   A 1 93  ? 2.379   -1.188  -19.761 1.00 29.40 ? 300 LEU   A CD2 1 
ATOM   526  N N   . LEU   A 1 94  ? -2.761  -1.100  -18.323 1.00 19.67 ? 301 LEU   A N   1 
ATOM   527  C CA  . LEU   A 1 94  ? -4.148  -1.509  -18.604 1.00 19.01 ? 301 LEU   A CA  1 
ATOM   528  C C   . LEU   A 1 94  ? -4.938  -0.368  -19.241 1.00 18.39 ? 301 LEU   A C   1 
ATOM   529  O O   . LEU   A 1 94  ? -5.720  -0.657  -20.177 1.00 18.61 ? 301 LEU   A O   1 
ATOM   530  C CB  . LEU   A 1 94  ? -4.814  -1.988  -17.318 1.00 19.95 ? 301 LEU   A CB  1 
ATOM   531  C CG  . LEU   A 1 94  ? -4.380  -3.357  -16.843 1.00 20.01 ? 301 LEU   A CG  1 
ATOM   532  C CD1 . LEU   A 1 94  ? -4.696  -3.558  -15.365 1.00 22.92 ? 301 LEU   A CD1 1 
ATOM   533  C CD2 . LEU   A 1 94  ? -5.022  -4.441  -17.675 1.00 20.66 ? 301 LEU   A CD2 1 
ATOM   534  N N   . GLN   A 1 95  ? -4.753  0.887   -18.862 1.00 18.96 ? 302 GLN   A N   1 
ATOM   535  C CA  . GLN   A 1 95  ? -5.453  2.025   -19.483 1.00 20.94 ? 302 GLN   A CA  1 
ATOM   536  C C   . GLN   A 1 95  ? -5.075  2.176   -20.967 1.00 20.95 ? 302 GLN   A C   1 
ATOM   537  O O   . GLN   A 1 95  ? -5.896  2.607   -21.732 1.00 21.68 ? 302 GLN   A O   1 
ATOM   538  C CB  . GLN   A 1 95  ? -5.171  3.287   -18.683 1.00 22.73 ? 302 GLN   A CB  1 
ATOM   539  C CG  . GLN   A 1 95  ? -5.943  3.290   -17.354 1.00 24.62 ? 302 GLN   A CG  1 
ATOM   540  C CD  . GLN   A 1 95  ? -5.541  4.456   -16.478 1.00 30.86 ? 302 GLN   A CD  1 
ATOM   541  O OE1 . GLN   A 1 95  ? -4.414  4.937   -16.529 1.00 32.60 ? 302 GLN   A OE1 1 
ATOM   542  N NE2 . GLN   A 1 95  ? -6.457  4.858   -15.610 1.00 37.01 ? 302 GLN   A NE2 1 
ATOM   543  N N   . SER   A 1 96  ? -3.852  1.810   -21.349 1.00 18.84 ? 303 SER   A N   1 
ATOM   544  C CA  . SER   A 1 96  ? -3.450  1.917   -22.762 1.00 18.94 ? 303 SER   A CA  1 
ATOM   545  C C   . SER   A 1 96  ? -3.876  0.664   -23.543 1.00 17.51 ? 303 SER   A C   1 
ATOM   546  O O   . SER   A 1 96  ? -4.174  0.817   -24.730 1.00 21.14 ? 303 SER   A O   1 
ATOM   547  C CB  . SER   A 1 96  ? -1.973  2.116   -22.838 1.00 20.85 ? 303 SER   A CB  1 
ATOM   548  O OG  . SER   A 1 96  ? -1.692  3.474   -22.515 1.00 23.63 ? 303 SER   A OG  1 
ATOM   549  N N   . ALA   A 1 97  ? -3.942  -0.516  -22.943 1.00 16.01 ? 304 ALA   A N   1 
ATOM   550  C CA  . ALA   A 1 97  ? -4.082  -1.761  -23.728 1.00 16.58 ? 304 ALA   A CA  1 
ATOM   551  C C   . ALA   A 1 97  ? -5.479  -2.397  -23.676 1.00 16.75 ? 304 ALA   A C   1 
ATOM   552  O O   . ALA   A 1 97  ? -5.695  -3.384  -24.356 1.00 17.58 ? 304 ALA   A O   1 
ATOM   553  C CB  . ALA   A 1 97  ? -3.110  -2.781  -23.222 1.00 18.89 ? 304 ALA   A CB  1 
ATOM   554  N N   . TRP   A 1 98  ? -6.337  -1.954  -22.767 1.00 18.27 ? 305 TRP   A N   1 
ATOM   555  C CA  . TRP   A 1 98  ? -7.585  -2.706  -22.483 1.00 19.14 ? 305 TRP   A CA  1 
ATOM   556  C C   . TRP   A 1 98  ? -8.387  -3.024  -23.757 1.00 16.50 ? 305 TRP   A C   1 
ATOM   557  O O   . TRP   A 1 98  ? -8.872  -4.162  -23.845 1.00 17.56 ? 305 TRP   A O   1 
ATOM   558  C CB  . TRP   A 1 98  ? -8.469  -1.943  -21.494 1.00 20.16 ? 305 TRP   A CB  1 
ATOM   559  C CG  . TRP   A 1 98  ? -8.982  -0.613  -21.968 1.00 21.06 ? 305 TRP   A CG  1 
ATOM   560  C CD1 . TRP   A 1 98  ? -8.328  0.572   -22.007 1.00 24.83 ? 305 TRP   A CD1 1 
ATOM   561  C CD2 . TRP   A 1 98  ? -10.295 -0.319  -22.494 1.00 22.92 ? 305 TRP   A CD2 1 
ATOM   562  N NE1 . TRP   A 1 98  ? -9.102  1.561   -22.550 1.00 25.97 ? 305 TRP   A NE1 1 
ATOM   563  C CE2 . TRP   A 1 98  ? -10.328 1.043   -22.851 1.00 22.27 ? 305 TRP   A CE2 1 
ATOM   564  C CE3 . TRP   A 1 98  ? -11.445 -1.101  -22.691 1.00 23.80 ? 305 TRP   A CE3 1 
ATOM   565  C CZ2 . TRP   A 1 98  ? -11.491 1.651   -23.340 1.00 26.43 ? 305 TRP   A CZ2 1 
ATOM   566  C CZ3 . TRP   A 1 98  ? -12.587 -0.497  -23.180 1.00 23.47 ? 305 TRP   A CZ3 1 
ATOM   567  C CH2 . TRP   A 1 98  ? -12.581 0.843   -23.550 1.00 25.72 ? 305 TRP   A CH2 1 
ATOM   568  N N   . MET   A 1 99  ? -8.506  -2.074  -24.685 1.00 16.89 ? 306 MET   A N   1 
ATOM   569  C CA  . MET   A 1 99  ? -9.375  -2.271  -25.871 1.00 17.02 ? 306 MET   A CA  1 
ATOM   570  C C   . MET   A 1 99  ? -8.680  -3.240  -26.851 1.00 15.38 ? 306 MET   A C   1 
ATOM   571  O O   . MET   A 1 99  ? -9.289  -4.083  -27.472 1.00 16.09 ? 306 MET   A O   1 
ATOM   572  C CB  . MET   A 1 99  ? -9.772  -0.950  -26.531 1.00 18.71 ? 306 MET   A CB  1 
ATOM   573  C CG  . MET   A 1 99  ? -10.597 -1.142  -27.775 1.00 19.80 ? 306 MET   A CG  1 
ATOM   574  S SD  . MET   A 1 99  ? -12.249 -1.952  -27.459 1.00 21.55 ? 306 MET   A SD  1 
ATOM   575  C CE  . MET   A 1 99  ? -13.142 -0.492  -26.964 1.00 26.64 ? 306 MET   A CE  1 
ATOM   576  N N   . GLU   A 1 100 ? -7.347  -3.252  -26.896 1.00 16.13 ? 307 GLU   A N   1 
ATOM   577  C CA  . GLU   A 1 100 ? -6.622  -4.265  -27.672 1.00 15.67 ? 307 GLU   A CA  1 
ATOM   578  C C   . GLU   A 1 100 ? -6.897  -5.661  -27.129 1.00 14.71 ? 307 GLU   A C   1 
ATOM   579  O O   . GLU   A 1 100 ? -7.028  -6.623  -27.901 1.00 15.52 ? 307 GLU   A O   1 
ATOM   580  C CB  . GLU   A 1 100 ? -5.102  -3.970  -27.696 1.00 15.39 ? 307 GLU   A CB  1 
ATOM   581  C CG  . GLU   A 1 100 ? -4.749  -2.709  -28.461 1.00 15.59 ? 307 GLU   A CG  1 
ATOM   582  C CD  . GLU   A 1 100 ? -3.257  -2.475  -28.650 1.00 17.95 ? 307 GLU   A CD  1 
ATOM   583  O OE1 . GLU   A 1 100 ? -2.506  -3.469  -28.707 1.00 19.88 ? 307 GLU   A OE1 1 
ATOM   584  O OE2 . GLU   A 1 100 ? -2.875  -1.270  -28.808 1.00 21.12 ? 307 GLU   A OE2 1 
ATOM   585  N N   . ILE   A 1 101 ? -6.904  -5.787  -25.799 1.00 15.53 ? 308 ILE   A N   1 
ATOM   586  C CA  . ILE   A 1 101 ? -7.143  -7.099  -25.162 1.00 14.88 ? 308 ILE   A CA  1 
ATOM   587  C C   . ILE   A 1 101 ? -8.585  -7.567  -25.466 1.00 16.30 ? 308 ILE   A C   1 
ATOM   588  O O   . ILE   A 1 101 ? -8.739  -8.694  -25.874 1.00 17.85 ? 308 ILE   A O   1 
ATOM   589  C CB  . ILE   A 1 101 ? -6.829  -7.035  -23.664 1.00 17.33 ? 308 ILE   A CB  1 
ATOM   590  C CG1 . ILE   A 1 101 ? -5.352  -6.660  -23.475 1.00 19.47 ? 308 ILE   A CG1 1 
ATOM   591  C CG2 . ILE   A 1 101 ? -7.125  -8.368  -23.021 1.00 20.85 ? 308 ILE   A CG2 1 
ATOM   592  C CD1 . ILE   A 1 101 ? -5.037  -6.202  -22.082 1.00 21.86 ? 308 ILE   A CD1 1 
ATOM   593  N N   . LEU   A 1 102 ? -9.544  -6.656  -25.331 1.00 17.56 ? 309 LEU   A N   1 
ATOM   594  C CA  . LEU   A 1 102 ? -10.969 -6.998  -25.661 1.00 17.80 ? 309 LEU   A CA  1 
ATOM   595  C C   . LEU   A 1 102 ? -11.064 -7.457  -27.137 1.00 16.47 ? 309 LEU   A C   1 
ATOM   596  O O   . LEU   A 1 102 ? -11.623 -8.518  -27.466 1.00 17.16 ? 309 LEU   A O   1 
ATOM   597  C CB  . LEU   A 1 102 ? -11.839 -5.775  -25.420 1.00 17.52 ? 309 LEU   A CB  1 
ATOM   598  C CG  . LEU   A 1 102 ? -12.144 -5.371  -23.980 1.00 20.61 ? 309 LEU   A CG  1 
ATOM   599  C CD1 . LEU   A 1 102 ? -12.951 -4.088  -23.980 1.00 21.48 ? 309 LEU   A CD1 1 
ATOM   600  C CD2 . LEU   A 1 102 ? -12.892 -6.439  -23.218 1.00 21.08 ? 309 LEU   A CD2 1 
ATOM   601  N N   . ILE   A 1 103 ? -10.428 -6.708  -28.052 1.00 16.68 ? 310 ILE   A N   1 
ATOM   602  C CA  . ILE   A 1 103 ? -10.560 -6.980  -29.489 1.00 17.07 ? 310 ILE   A CA  1 
ATOM   603  C C   . ILE   A 1 103 ? -9.882  -8.308  -29.790 1.00 17.36 ? 310 ILE   A C   1 
ATOM   604  O O   . ILE   A 1 103 ? -10.420 -9.093  -30.545 1.00 16.33 ? 310 ILE   A O   1 
ATOM   605  C CB  . ILE   A 1 103 ? -9.999  -5.830  -30.340 1.00 17.92 ? 310 ILE   A CB  1 
ATOM   606  C CG1 . ILE   A 1 103 ? -10.968 -4.661  -30.272 1.00 19.53 ? 310 ILE   A CG1 1 
ATOM   607  C CG2 . ILE   A 1 103 ? -9.695  -6.298  -31.752 1.00 19.75 ? 310 ILE   A CG2 1 
ATOM   608  C CD1 . ILE   A 1 103 ? -10.445 -3.373  -30.850 1.00 23.23 ? 310 ILE   A CD1 1 
ATOM   609  N N   . LEU   A 1 104 ? -8.677  -8.591  -29.245 1.00 16.43 ? 311 LEU   A N   1 
ATOM   610  C CA  . LEU   A 1 104 ? -8.037  -9.885  -29.534 1.00 16.71 ? 311 LEU   A CA  1 
ATOM   611  C C   . LEU   A 1 104 ? -8.950  -11.034 -29.137 1.00 15.71 ? 311 LEU   A C   1 
ATOM   612  O O   . LEU   A 1 104 ? -8.904  -12.036 -29.822 1.00 15.96 ? 311 LEU   A O   1 
ATOM   613  C CB  . LEU   A 1 104 ? -6.688  -9.971  -28.794 1.00 20.43 ? 311 LEU   A CB  1 
ATOM   614  C CG  . LEU   A 1 104 ? -5.480  -9.506  -29.560 1.00 22.51 ? 311 LEU   A CG  1 
ATOM   615  C CD1 . LEU   A 1 104 ? -4.267  -9.756  -28.668 1.00 19.93 ? 311 LEU   A CD1 1 
ATOM   616  C CD2 . LEU   A 1 104 ? -5.324  -10.236 -30.897 1.00 22.16 ? 311 LEU   A CD2 1 
ATOM   617  N N   . GLY   A 1 105 ? -9.666  -10.909 -28.023 1.00 16.65 ? 312 GLY   A N   1 
ATOM   618  C CA  . GLY   A 1 105 ? -10.620 -11.950 -27.583 1.00 17.30 ? 312 GLY   A CA  1 
ATOM   619  C C   . GLY   A 1 105 ? -11.679 -12.183 -28.660 1.00 17.07 ? 312 GLY   A C   1 
ATOM   620  O O   . GLY   A 1 105 ? -11.900 -13.338 -29.068 1.00 17.82 ? 312 GLY   A O   1 
ATOM   621  N N   . VAL   A 1 106 ? -12.254 -11.105 -29.163 1.00 16.42 ? 313 VAL   A N   1 
ATOM   622  C CA  . VAL   A 1 106 ? -13.322 -11.244 -30.209 1.00 16.60 ? 313 VAL   A CA  1 
ATOM   623  C C   . VAL   A 1 106 ? -12.726 -11.893 -31.452 1.00 16.16 ? 313 VAL   A C   1 
ATOM   624  O O   . VAL   A 1 106 ? -13.261 -12.834 -32.060 1.00 18.93 ? 313 VAL   A O   1 
ATOM   625  C CB  . VAL   A 1 106 ? -13.929 -9.881  -30.544 1.00 17.71 ? 313 VAL   A CB  1 
ATOM   626  C CG1 . VAL   A 1 106 ? -14.961 -10.001 -31.672 1.00 20.15 ? 313 VAL   A CG1 1 
ATOM   627  C CG2 . VAL   A 1 106 ? -14.530 -9.192  -29.367 1.00 19.34 ? 313 VAL   A CG2 1 
ATOM   628  N N   . VAL   A 1 107 ? -11.518 -11.460 -31.833 1.00 16.31 ? 314 VAL   A N   1 
ATOM   629  C CA  . VAL   A 1 107 ? -10.831 -11.982 -33.027 1.00 17.91 ? 314 VAL   A CA  1 
ATOM   630  C C   . VAL   A 1 107 ? -10.587 -13.486 -32.872 1.00 18.98 ? 314 VAL   A C   1 
ATOM   631  O O   . VAL   A 1 107 ? -10.936 -14.241 -33.787 1.00 19.82 ? 314 VAL   A O   1 
ATOM   632  C CB  . VAL   A 1 107 ? -9.533  -11.171 -33.226 1.00 17.42 ? 314 VAL   A CB  1 
ATOM   633  C CG1 . VAL   A 1 107 ? -8.586  -11.881 -34.150 1.00 18.27 ? 314 VAL   A CG1 1 
ATOM   634  C CG2 . VAL   A 1 107 ? -9.783  -9.752  -33.688 1.00 18.39 ? 314 VAL   A CG2 1 
ATOM   635  N N   . TYR   A 1 108 ? -10.044 -13.940 -31.754 1.00 16.84 ? 315 TYR   A N   1 
ATOM   636  C CA  . TYR   A 1 108 ? -9.742  -15.365 -31.519 1.00 18.88 ? 315 TYR   A CA  1 
ATOM   637  C C   . TYR   A 1 108 ? -11.033 -16.219 -31.620 1.00 17.78 ? 315 TYR   A C   1 
ATOM   638  O O   . TYR   A 1 108 ? -11.044 -17.258 -32.293 1.00 19.85 ? 315 TYR   A O   1 
ATOM   639  C CB  . TYR   A 1 108 ? -8.991  -15.616 -30.202 1.00 19.44 ? 315 TYR   A CB  1 
ATOM   640  C CG  . TYR   A 1 108 ? -8.572  -17.048 -30.113 1.00 20.24 ? 315 TYR   A CG  1 
ATOM   641  C CD1 . TYR   A 1 108 ? -7.522  -17.496 -30.887 1.00 21.35 ? 315 TYR   A CD1 1 
ATOM   642  C CD2 . TYR   A 1 108 ? -9.302  -17.983 -29.413 1.00 22.36 ? 315 TYR   A CD2 1 
ATOM   643  C CE1 . TYR   A 1 108 ? -7.154  -18.820 -30.941 1.00 24.57 ? 315 TYR   A CE1 1 
ATOM   644  C CE2 . TYR   A 1 108 ? -8.915  -19.323 -29.421 1.00 22.81 ? 315 TYR   A CE2 1 
ATOM   645  C CZ  . TYR   A 1 108 ? -7.849  -19.729 -30.193 1.00 22.55 ? 315 TYR   A CZ  1 
ATOM   646  O OH  . TYR   A 1 108 ? -7.441  -21.035 -30.244 1.00 29.10 ? 315 TYR   A OH  1 
ATOM   647  N N   . ARG   A 1 109 ? -12.094 -15.724 -30.984 1.00 18.96 ? 316 ARG   A N   1 
ATOM   648  C CA  . ARG   A 1 109 ? -13.373 -16.475 -30.952 1.00 17.68 ? 316 ARG   A CA  1 
ATOM   649  C C   . ARG   A 1 109 ? -13.931 -16.583 -32.363 1.00 21.06 ? 316 ARG   A C   1 
ATOM   650  O O   . ARG   A 1 109 ? -14.758 -17.494 -32.620 1.00 20.37 ? 316 ARG   A O   1 
ATOM   651  C CB  . ARG   A 1 109 ? -14.357 -15.803 -30.034 1.00 18.25 ? 316 ARG   A CB  1 
ATOM   652  C CG  . ARG   A 1 109 ? -13.958 -15.940 -28.574 1.00 18.45 ? 316 ARG   A CG  1 
ATOM   653  C CD  . ARG   A 1 109 ? -15.015 -15.464 -27.640 1.00 19.23 ? 316 ARG   A CD  1 
ATOM   654  N NE  . ARG   A 1 109 ? -15.303 -14.039 -27.647 1.00 18.54 ? 316 ARG   A NE  1 
ATOM   655  C CZ  . ARG   A 1 109 ? -14.653 -13.101 -26.977 1.00 19.42 ? 316 ARG   A CZ  1 
ATOM   656  N NH1 . ARG   A 1 109 ? -13.559 -13.436 -26.281 1.00 21.96 ? 316 ARG   A NH1 1 
ATOM   657  N NH2 . ARG   A 1 109 ? -15.063 -11.869 -26.987 1.00 19.99 ? 316 ARG   A NH2 1 
ATOM   658  N N   . SER   A 1 110 ? -13.531 -15.693 -33.262 1.00 17.42 ? 317 SER   A N   1 
ATOM   659  C CA  . SER   A 1 110 ? -14.132 -15.606 -34.615 1.00 18.53 ? 317 SER   A CA  1 
ATOM   660  C C   . SER   A 1 110 ? -13.369 -16.414 -35.659 1.00 20.12 ? 317 SER   A C   1 
ATOM   661  O O   . SER   A 1 110 ? -13.808 -16.378 -36.820 1.00 19.65 ? 317 SER   A O   1 
ATOM   662  C CB  . SER   A 1 110 ? -14.246 -14.153 -34.983 1.00 16.57 ? 317 SER   A CB  1 
ATOM   663  O OG  . SER   A 1 110 ? -14.973 -13.425 -34.021 1.00 17.57 ? 317 SER   A OG  1 
ATOM   664  N N   . LEU   A 1 111 ? -12.229 -17.024 -35.363 1.00 19.41 ? 318 LEU   A N   1 
ATOM   665  C CA  . LEU   A 1 111 ? -11.346 -17.610 -36.387 1.00 21.64 ? 318 LEU   A CA  1 
ATOM   666  C C   . LEU   A 1 111 ? -12.030 -18.748 -37.172 1.00 23.49 ? 318 LEU   A C   1 
ATOM   667  O O   . LEU   A 1 111 ? -11.699 -18.884 -38.361 1.00 27.88 ? 318 LEU   A O   1 
ATOM   668  C CB  . LEU   A 1 111 ? -10.059 -18.133 -35.773 1.00 20.97 ? 318 LEU   A CB  1 
ATOM   669  C CG  . LEU   A 1 111 ? -9.164  -17.084 -35.117 1.00 23.02 ? 318 LEU   A CG  1 
ATOM   670  C CD1 . LEU   A 1 111 ? -7.993  -17.793 -34.473 1.00 24.42 ? 318 LEU   A CD1 1 
ATOM   671  C CD2 . LEU   A 1 111 ? -8.712  -16.032 -36.126 1.00 24.68 ? 318 LEU   A CD2 1 
ATOM   672  N N   . SER   A 1 112 ? -12.964 -19.485 -36.555 1.00 24.44 ? 319 SER   A N   1 
ATOM   673  C CA  A SER   A 1 112 ? -13.658 -20.617 -37.231 0.50 26.45 ? 319 SER   A CA  1 
ATOM   674  C CA  B SER   A 1 112 ? -13.666 -20.617 -37.223 0.50 27.01 ? 319 SER   A CA  1 
ATOM   675  C C   . SER   A 1 112 ? -14.880 -20.121 -38.021 1.00 27.09 ? 319 SER   A C   1 
ATOM   676  O O   . SER   A 1 112 ? -15.565 -20.987 -38.668 1.00 31.93 ? 319 SER   A O   1 
ATOM   677  C CB  A SER   A 1 112 ? -14.034 -21.709 -36.248 0.50 26.14 ? 319 SER   A CB  1 
ATOM   678  C CB  B SER   A 1 112 ? -14.072 -21.668 -36.221 0.50 27.22 ? 319 SER   A CB  1 
ATOM   679  O OG  A SER   A 1 112 ? -14.955 -21.260 -35.267 0.50 25.75 ? 319 SER   A OG  1 
ATOM   680  O OG  B SER   A 1 112 ? -12.927 -22.368 -35.753 0.50 28.99 ? 319 SER   A OG  1 
ATOM   681  N N   . PHE   A 1 113 ? -15.213 -18.845 -37.947 1.00 24.93 ? 320 PHE   A N   1 
ATOM   682  C CA  . PHE   A 1 113 ? -16.426 -18.261 -38.583 1.00 26.94 ? 320 PHE   A CA  1 
ATOM   683  C C   . PHE   A 1 113 ? -16.047 -17.512 -39.869 1.00 26.91 ? 320 PHE   A C   1 
ATOM   684  O O   . PHE   A 1 113 ? -14.857 -17.228 -40.164 1.00 26.23 ? 320 PHE   A O   1 
ATOM   685  C CB  . PHE   A 1 113 ? -17.174 -17.383 -37.576 1.00 27.57 ? 320 PHE   A CB  1 
ATOM   686  C CG  . PHE   A 1 113 ? -17.756 -18.179 -36.429 1.00 27.27 ? 320 PHE   A CG  1 
ATOM   687  C CD1 . PHE   A 1 113 ? -16.942 -18.742 -35.452 1.00 24.64 ? 320 PHE   A CD1 1 
ATOM   688  C CD2 . PHE   A 1 113 ? -19.129 -18.359 -36.313 1.00 29.45 ? 320 PHE   A CD2 1 
ATOM   689  C CE1 . PHE   A 1 113 ? -17.467 -19.479 -34.398 1.00 28.28 ? 320 PHE   A CE1 1 
ATOM   690  C CE2 . PHE   A 1 113 ? -19.654 -19.080 -35.248 1.00 31.07 ? 320 PHE   A CE2 1 
ATOM   691  C CZ  . PHE   A 1 113 ? -18.828 -19.646 -34.289 1.00 28.33 ? 320 PHE   A CZ  1 
ATOM   692  N N   . GLU   A 1 114 ? -17.047 -17.154 -40.659 1.00 27.90 ? 321 GLU   A N   1 
ATOM   693  C CA  . GLU   A 1 114 ? -16.847 -16.444 -41.939 1.00 30.37 ? 321 GLU   A CA  1 
ATOM   694  C C   . GLU   A 1 114 ? -17.634 -15.148 -41.935 1.00 29.45 ? 321 GLU   A C   1 
ATOM   695  O O   . GLU   A 1 114 ? -18.870 -15.161 -41.909 1.00 27.72 ? 321 GLU   A O   1 
ATOM   696  C CB  . GLU   A 1 114 ? -17.255 -17.327 -43.117 1.00 37.23 ? 321 GLU   A CB  1 
ATOM   697  C CG  . GLU   A 1 114 ? -16.285 -18.476 -43.312 1.00 42.91 ? 321 GLU   A CG  1 
ATOM   698  C CD  . GLU   A 1 114 ? -16.221 -19.040 -44.719 1.00 56.30 ? 321 GLU   A CD  1 
ATOM   699  O OE1 . GLU   A 1 114 ? -16.206 -18.241 -45.696 1.00 59.65 ? 321 GLU   A OE1 1 
ATOM   700  O OE2 . GLU   A 1 114 ? -16.183 -20.280 -44.834 1.00 65.54 ? 321 GLU   A OE2 1 
ATOM   701  N N   . ASP   A 1 115 ? -16.941 -14.030 -41.902 1.00 25.51 ? 322 ASP   A N   1 
ATOM   702  C CA  . ASP   A 1 115 ? -17.573 -12.697 -41.979 1.00 25.10 ? 322 ASP   A CA  1 
ATOM   703  C C   . ASP   A 1 115 ? -18.545 -12.467 -40.814 1.00 24.46 ? 322 ASP   A C   1 
ATOM   704  O O   . ASP   A 1 115 ? -19.455 -11.614 -40.926 1.00 28.42 ? 322 ASP   A O   1 
ATOM   705  C CB  . ASP   A 1 115 ? -18.231 -12.460 -43.351 1.00 28.80 ? 322 ASP   A CB  1 
ATOM   706  C CG  . ASP   A 1 115 ? -17.366 -12.817 -44.553 1.00 36.38 ? 322 ASP   A CG  1 
ATOM   707  O OD1 . ASP   A 1 115 ? -16.156 -12.544 -44.533 1.00 38.72 ? 322 ASP   A OD1 1 
ATOM   708  O OD2 . ASP   A 1 115 ? -17.917 -13.407 -45.498 1.00 39.32 ? 322 ASP   A OD2 1 
ATOM   709  N N   . GLU   A 1 116 ? -18.284 -13.109 -39.672 1.00 26.19 ? 323 GLU   A N   1 
ATOM   710  C CA  . GLU   A 1 116 ? -19.071 -12.945 -38.432 1.00 26.83 ? 323 GLU   A CA  1 
ATOM   711  C C   . GLU   A 1 116 ? -18.135 -12.740 -37.242 1.00 23.02 ? 323 GLU   A C   1 
ATOM   712  O O   . GLU   A 1 116 ? -17.088 -13.362 -37.247 1.00 23.88 ? 323 GLU   A O   1 
ATOM   713  C CB  . GLU   A 1 116 ? -19.884 -14.210 -38.199 1.00 29.98 ? 323 GLU   A CB  1 
ATOM   714  C CG  . GLU   A 1 116 ? -20.995 -14.330 -39.209 1.00 34.92 ? 323 GLU   A CG  1 
ATOM   715  C CD  . GLU   A 1 116 ? -21.986 -15.374 -38.766 1.00 35.78 ? 323 GLU   A CD  1 
ATOM   716  O OE1 . GLU   A 1 116 ? -21.565 -16.513 -38.497 1.00 33.91 ? 323 GLU   A OE1 1 
ATOM   717  O OE2 . GLU   A 1 116 ? -23.160 -15.024 -38.675 1.00 48.30 ? 323 GLU   A OE2 1 
ATOM   718  N N   . LEU   A 1 117 ? -18.531 -11.887 -36.324 1.00 21.64 ? 324 LEU   A N   1 
ATOM   719  C CA  . LEU   A 1 117 ? -17.727 -11.623 -35.086 1.00 19.59 ? 324 LEU   A CA  1 
ATOM   720  C C   . LEU   A 1 117 ? -18.403 -12.245 -33.868 1.00 21.26 ? 324 LEU   A C   1 
ATOM   721  O O   . LEU   A 1 117 ? -19.557 -11.869 -33.545 1.00 20.66 ? 324 LEU   A O   1 
ATOM   722  C CB  . LEU   A 1 117 ? -17.525 -10.125 -34.892 1.00 19.42 ? 324 LEU   A CB  1 
ATOM   723  C CG  . LEU   A 1 117 ? -16.658 -9.462  -35.962 1.00 21.25 ? 324 LEU   A CG  1 
ATOM   724  C CD1 . LEU   A 1 117 ? -16.543 -7.977  -35.684 1.00 21.85 ? 324 LEU   A CD1 1 
ATOM   725  C CD2 . LEU   A 1 117 ? -15.307 -10.161 -36.043 1.00 21.07 ? 324 LEU   A CD2 1 
ATOM   726  N N   . VAL   A 1 118 ? -17.674 -13.129 -33.216 1.00 18.49 ? 325 VAL   A N   1 
ATOM   727  C CA  . VAL   A 1 118 ? -18.182 -13.838 -32.020 1.00 18.47 ? 325 VAL   A CA  1 
ATOM   728  C C   . VAL   A 1 118 ? -17.899 -12.981 -30.793 1.00 18.71 ? 325 VAL   A C   1 
ATOM   729  O O   . VAL   A 1 118 ? -16.840 -13.240 -30.101 1.00 19.35 ? 325 VAL   A O   1 
ATOM   730  C CB  . VAL   A 1 118 ? -17.643 -15.271 -31.952 1.00 20.19 ? 325 VAL   A CB  1 
ATOM   731  C CG1 . VAL   A 1 118 ? -18.237 -16.038 -30.782 1.00 22.25 ? 325 VAL   A CG1 1 
ATOM   732  C CG2 . VAL   A 1 118 ? -17.862 -16.032 -33.245 1.00 20.44 ? 325 VAL   A CG2 1 
ATOM   733  N N   . TYR   A 1 119 ? -18.660 -11.951 -30.481 1.00 17.97 ? 326 TYR   A N   1 
ATOM   734  C CA  . TYR   A 1 119 ? -18.484 -11.171 -29.262 1.00 18.82 ? 326 TYR   A CA  1 
ATOM   735  C C   . TYR   A 1 119 ? -18.645 -12.125 -28.066 1.00 19.80 ? 326 TYR   A C   1 
ATOM   736  O O   . TYR   A 1 119 ? -17.946 -12.025 -27.062 1.00 18.96 ? 326 TYR   A O   1 
ATOM   737  C CB  . TYR   A 1 119 ? -19.395 -9.943  -29.291 1.00 18.55 ? 326 TYR   A CB  1 
ATOM   738  C CG  . TYR   A 1 119 ? -18.880 -8.806  -30.152 1.00 20.45 ? 326 TYR   A CG  1 
ATOM   739  C CD1 . TYR   A 1 119 ? -19.162 -8.658  -31.502 1.00 26.54 ? 326 TYR   A CD1 1 
ATOM   740  C CD2 . TYR   A 1 119 ? -18.021 -7.904  -29.594 1.00 19.30 ? 326 TYR   A CD2 1 
ATOM   741  C CE1 . TYR   A 1 119 ? -18.611 -7.583  -32.218 1.00 24.85 ? 326 TYR   A CE1 1 
ATOM   742  C CE2 . TYR   A 1 119 ? -17.504 -6.811  -30.261 1.00 24.36 ? 326 TYR   A CE2 1 
ATOM   743  C CZ  . TYR   A 1 119 ? -17.765 -6.685  -31.600 1.00 28.48 ? 326 TYR   A CZ  1 
ATOM   744  O OH  . TYR   A 1 119 ? -17.218 -5.591  -32.224 1.00 27.80 ? 326 TYR   A OH  1 
ATOM   745  N N   . ALA   A 1 120 ? -19.620 -13.022 -28.176 1.00 18.98 ? 327 ALA   A N   1 
ATOM   746  C CA  . ALA   A 1 120 ? -19.928 -14.070 -27.176 1.00 20.01 ? 327 ALA   A CA  1 
ATOM   747  C C   . ALA   A 1 120 ? -20.654 -15.211 -27.895 1.00 21.86 ? 327 ALA   A C   1 
ATOM   748  O O   . ALA   A 1 120 ? -21.154 -15.027 -29.061 1.00 21.27 ? 327 ALA   A O   1 
ATOM   749  C CB  . ALA   A 1 120 ? -20.688 -13.510 -26.010 1.00 20.13 ? 327 ALA   A CB  1 
ATOM   750  N N   . ASP   A 1 121 ? -20.788 -16.380 -27.245 1.00 23.22 ? 328 ASP   A N   1 
ATOM   751  C CA  . ASP   A 1 121 ? -21.410 -17.541 -27.920 1.00 26.78 ? 328 ASP   A CA  1 
ATOM   752  C C   . ASP   A 1 121 ? -22.880 -17.208 -28.226 1.00 22.85 ? 328 ASP   A C   1 
ATOM   753  O O   . ASP   A 1 121 ? -23.387 -17.703 -29.231 1.00 25.77 ? 328 ASP   A O   1 
ATOM   754  C CB  . ASP   A 1 121 ? -21.332 -18.790 -27.034 1.00 29.64 ? 328 ASP   A CB  1 
ATOM   755  C CG  . ASP   A 1 121 ? -19.955 -19.426 -26.950 1.00 35.45 ? 328 ASP   A CG  1 
ATOM   756  O OD1 . ASP   A 1 121 ? -19.020 -18.899 -27.565 1.00 35.83 ? 328 ASP   A OD1 1 
ATOM   757  O OD2 . ASP   A 1 121 ? -19.834 -20.449 -26.248 1.00 42.68 ? 328 ASP   A OD2 1 
ATOM   758  N N   . ASP   A 1 122 ? -23.484 -16.364 -27.394 1.00 23.62 ? 329 ASP   A N   1 
ATOM   759  C CA  . ASP   A 1 122 ? -24.877 -15.871 -27.615 1.00 23.30 ? 329 ASP   A CA  1 
ATOM   760  C C   . ASP   A 1 122 ? -24.900 -14.472 -28.261 1.00 26.28 ? 329 ASP   A C   1 
ATOM   761  O O   . ASP   A 1 122 ? -25.922 -13.784 -28.154 1.00 25.38 ? 329 ASP   A O   1 
ATOM   762  C CB  . ASP   A 1 122 ? -25.664 -15.797 -26.290 1.00 23.83 ? 329 ASP   A CB  1 
ATOM   763  C CG  . ASP   A 1 122 ? -25.113 -14.862 -25.232 1.00 24.53 ? 329 ASP   A CG  1 
ATOM   764  O OD1 . ASP   A 1 122 ? -23.876 -14.460 -25.328 1.00 22.43 ? 329 ASP   A OD1 1 
ATOM   765  O OD2 . ASP   A 1 122 ? -25.816 -14.463 -24.272 1.00 23.70 ? 329 ASP   A OD2 1 
ATOM   766  N N   . TYR   A 1 123 ? -23.828 -14.023 -28.910 1.00 23.61 ? 330 TYR   A N   1 
ATOM   767  C CA  . TYR   A 1 123 ? -23.871 -12.668 -29.509 1.00 20.24 ? 330 TYR   A CA  1 
ATOM   768  C C   . TYR   A 1 123 ? -22.887 -12.593 -30.676 1.00 24.73 ? 330 TYR   A C   1 
ATOM   769  O O   . TYR   A 1 123 ? -21.688 -12.214 -30.514 1.00 20.94 ? 330 TYR   A O   1 
ATOM   770  C CB  . TYR   A 1 123 ? -23.623 -11.570 -28.485 1.00 21.06 ? 330 TYR   A CB  1 
ATOM   771  C CG  . TYR   A 1 123 ? -24.311 -10.288 -28.843 1.00 22.90 ? 330 TYR   A CG  1 
ATOM   772  C CD1 . TYR   A 1 123 ? -25.690 -10.192 -28.736 1.00 23.33 ? 330 TYR   A CD1 1 
ATOM   773  C CD2 . TYR   A 1 123 ? -23.639 -9.181  -29.331 1.00 26.12 ? 330 TYR   A CD2 1 
ATOM   774  C CE1 . TYR   A 1 123 ? -26.349 -9.010  -29.024 1.00 22.64 ? 330 TYR   A CE1 1 
ATOM   775  C CE2 . TYR   A 1 123 ? -24.288 -8.000  -29.659 1.00 23.65 ? 330 TYR   A CE2 1 
ATOM   776  C CZ  . TYR   A 1 123 ? -25.672 -7.924  -29.541 1.00 24.10 ? 330 TYR   A CZ  1 
ATOM   777  O OH  . TYR   A 1 123 ? -26.333 -6.784  -29.892 1.00 26.76 ? 330 TYR   A OH  1 
ATOM   778  N N   . ILE   A 1 124 ? -23.317 -13.141 -31.793 1.00 22.76 ? 331 ILE   A N   1 
ATOM   779  C CA  . ILE   A 1 124 ? -22.530 -13.283 -33.041 1.00 21.82 ? 331 ILE   A CA  1 
ATOM   780  C C   . ILE   A 1 124 ? -23.068 -12.271 -34.040 1.00 24.73 ? 331 ILE   A C   1 
ATOM   781  O O   . ILE   A 1 124 ? -24.251 -12.372 -34.434 1.00 24.68 ? 331 ILE   A O   1 
ATOM   782  C CB  . ILE   A 1 124 ? -22.507 -14.721 -33.570 1.00 24.01 ? 331 ILE   A CB  1 
ATOM   783  C CG1 . ILE   A 1 124 ? -21.987 -15.726 -32.524 1.00 23.88 ? 331 ILE   A CG1 1 
ATOM   784  C CG2 . ILE   A 1 124 ? -21.722 -14.799 -34.876 1.00 25.87 ? 331 ILE   A CG2 1 
ATOM   785  C CD1 . ILE   A 1 124 ? -22.112 -17.158 -32.960 1.00 27.51 ? 331 ILE   A CD1 1 
ATOM   786  N N   . MET   A 1 125 ? -22.242 -11.318 -34.463 1.00 22.91 ? 332 MET   A N   1 
ATOM   787  C CA  A MET   A 1 125 ? -22.691 -10.187 -35.307 0.50 24.46 ? 332 MET   A CA  1 
ATOM   788  C CA  B MET   A 1 125 ? -22.698 -10.192 -35.320 0.50 22.62 ? 332 MET   A CA  1 
ATOM   789  C C   . MET   A 1 125 ? -22.253 -10.417 -36.754 1.00 26.17 ? 332 MET   A C   1 
ATOM   790  O O   . MET   A 1 125 ? -21.029 -10.591 -37.001 1.00 26.73 ? 332 MET   A O   1 
ATOM   791  C CB  A MET   A 1 125 ? -22.130 -8.875  -34.766 0.50 25.64 ? 332 MET   A CB  1 
ATOM   792  C CB  B MET   A 1 125 ? -22.141 -8.850  -34.869 0.50 21.40 ? 332 MET   A CB  1 
ATOM   793  C CG  A MET   A 1 125 ? -22.771 -7.661  -35.381 0.50 27.67 ? 332 MET   A CG  1 
ATOM   794  C CG  B MET   A 1 125 ? -22.569 -8.445  -33.501 0.50 20.65 ? 332 MET   A CG  1 
ATOM   795  S SD  A MET   A 1 125 ? -22.550 -6.153  -34.423 0.50 28.54 ? 332 MET   A SD  1 
ATOM   796  S SD  B MET   A 1 125 ? -22.010 -6.808  -33.092 0.50 22.44 ? 332 MET   A SD  1 
ATOM   797  C CE  A MET   A 1 125 ? -22.148 -6.815  -32.810 0.50 29.91 ? 332 MET   A CE  1 
ATOM   798  C CE  B MET   A 1 125 ? -23.454 -5.910  -33.649 0.50 21.19 ? 332 MET   A CE  1 
ATOM   799  N N   . ASP   A 1 126 ? -23.225 -10.436 -37.660 1.00 26.85 ? 333 ASP   A N   1 
ATOM   800  C CA  . ASP   A 1 126 ? -22.979 -10.446 -39.119 1.00 28.92 ? 333 ASP   A CA  1 
ATOM   801  C C   . ASP   A 1 126 ? -23.011 -8.996  -39.608 1.00 24.58 ? 333 ASP   A C   1 
ATOM   802  O O   . ASP   A 1 126 ? -23.155 -8.043  -38.827 1.00 26.00 ? 333 ASP   A O   1 
ATOM   803  C CB  . ASP   A 1 126 ? -23.928 -11.396 -39.861 1.00 32.35 ? 333 ASP   A CB  1 
ATOM   804  C CG  . ASP   A 1 126 ? -25.380 -10.955 -39.856 1.00 33.75 ? 333 ASP   A CG  1 
ATOM   805  O OD1 . ASP   A 1 126 ? -25.652 -9.828  -39.420 1.00 35.77 ? 333 ASP   A OD1 1 
ATOM   806  O OD2 . ASP   A 1 126 ? -26.234 -11.793 -40.269 1.00 45.30 ? 333 ASP   A OD2 1 
ATOM   807  N N   . GLU   A 1 127 ? -22.832 -8.829  -40.913 1.00 30.41 ? 334 GLU   A N   1 
ATOM   808  C CA  . GLU   A 1 127 ? -22.722 -7.499  -41.557 1.00 33.34 ? 334 GLU   A CA  1 
ATOM   809  C C   . GLU   A 1 127 ? -24.006 -6.684  -41.334 1.00 29.39 ? 334 GLU   A C   1 
ATOM   810  O O   . GLU   A 1 127 ? -23.919 -5.511  -40.934 1.00 28.90 ? 334 GLU   A O   1 
ATOM   811  C CB  . GLU   A 1 127 ? -22.372 -7.701  -43.036 1.00 36.96 ? 334 GLU   A CB  1 
ATOM   812  C CG  . GLU   A 1 127 ? -22.147 -6.384  -43.757 1.00 42.29 ? 334 GLU   A CG  1 
ATOM   813  C CD  . GLU   A 1 127 ? -21.619 -6.490  -45.179 1.00 49.72 ? 334 GLU   A CD  1 
ATOM   814  O OE1 . GLU   A 1 127 ? -22.365 -6.116  -46.092 1.00 54.91 ? 334 GLU   A OE1 1 
ATOM   815  O OE2 . GLU   A 1 127 ? -20.458 -6.925  -45.362 1.00 52.84 ? 334 GLU   A OE2 1 
ATOM   816  N N   . ASP   A 1 128 ? -25.177 -7.284  -41.537 1.00 34.37 ? 335 ASP   A N   1 
ATOM   817  C CA  . ASP   A 1 128 ? -26.474 -6.596  -41.307 1.00 39.48 ? 335 ASP   A CA  1 
ATOM   818  C C   . ASP   A 1 128 ? -26.533 -6.091  -39.868 1.00 32.48 ? 335 ASP   A C   1 
ATOM   819  O O   . ASP   A 1 128 ? -26.886 -4.907  -39.653 1.00 35.27 ? 335 ASP   A O   1 
ATOM   820  C CB  . ASP   A 1 128 ? -27.669 -7.510  -41.600 1.00 42.43 ? 335 ASP   A CB  1 
ATOM   821  C CG  . ASP   A 1 128 ? -27.852 -7.838  -43.072 1.00 48.34 ? 335 ASP   A CG  1 
ATOM   822  O OD1 . ASP   A 1 128 ? -27.175 -7.208  -43.915 1.00 53.14 ? 335 ASP   A OD1 1 
ATOM   823  O OD2 . ASP   A 1 128 ? -28.641 -8.748  -43.360 1.00 56.32 ? 335 ASP   A OD2 1 
ATOM   824  N N   . GLN   A 1 129 ? -26.144 -6.924  -38.895 1.00 31.63 ? 336 GLN   A N   1 
ATOM   825  C CA  . GLN   A 1 129 ? -26.229 -6.528  -37.477 1.00 30.69 ? 336 GLN   A CA  1 
ATOM   826  C C   . GLN   A 1 129 ? -25.232 -5.402  -37.233 1.00 26.44 ? 336 GLN   A C   1 
ATOM   827  O O   . GLN   A 1 129 ? -25.482 -4.505  -36.425 1.00 26.94 ? 336 GLN   A O   1 
ATOM   828  C CB  . GLN   A 1 129 ? -26.036 -7.759  -36.582 1.00 34.60 ? 336 GLN   A CB  1 
ATOM   829  C CG  . GLN   A 1 129 ? -27.162 -8.793  -36.743 1.00 38.26 ? 336 GLN   A CG  1 
ATOM   830  C CD  . GLN   A 1 129 ? -26.803 -10.146 -36.166 1.00 47.60 ? 336 GLN   A CD  1 
ATOM   831  O OE1 . GLN   A 1 129 ? -25.912 -10.854 -36.648 1.00 40.22 ? 336 GLN   A OE1 1 
ATOM   832  N NE2 . GLN   A 1 129 ? -27.527 -10.536 -35.126 1.00 59.07 ? 336 GLN   A NE2 1 
ATOM   833  N N   . SER   A 1 130 ? -24.059 -5.467  -37.869 1.00 26.01 ? 337 SER   A N   1 
ATOM   834  C CA  . SER   A 1 130 ? -23.056 -4.397  -37.663 1.00 27.17 ? 337 SER   A CA  1 
ATOM   835  C C   . SER   A 1 130 ? -23.607 -3.063  -38.202 1.00 25.30 ? 337 SER   A C   1 
ATOM   836  O O   . SER   A 1 130 ? -23.498 -2.046  -37.509 1.00 28.11 ? 337 SER   A O   1 
ATOM   837  C CB  . SER   A 1 130 ? -21.728 -4.758  -38.289 1.00 26.60 ? 337 SER   A CB  1 
ATOM   838  O OG  . SER   A 1 130 ? -21.195 -5.929  -37.707 1.00 29.93 ? 337 SER   A OG  1 
ATOM   839  N N   . LYS   A 1 131 ? -24.228 -3.090  -39.385 1.00 32.20 ? 338 LYS   A N   1 
ATOM   840  C CA  . LYS   A 1 131 ? -24.865 -1.871  -39.971 1.00 34.50 ? 338 LYS   A CA  1 
ATOM   841  C C   . LYS   A 1 131 ? -25.957 -1.335  -39.035 1.00 31.48 ? 338 LYS   A C   1 
ATOM   842  O O   . LYS   A 1 131 ? -25.910 -0.122  -38.721 1.00 34.05 ? 338 LYS   A O   1 
ATOM   843  C CB  . LYS   A 1 131 ? -25.489 -2.192  -41.332 1.00 37.51 ? 338 LYS   A CB  1 
ATOM   844  C CG  . LYS   A 1 131 ? -24.520 -2.434  -42.476 1.00 44.99 ? 338 LYS   A CG  1 
ATOM   845  C CD  . LYS   A 1 131 ? -25.225 -2.846  -43.758 1.00 46.96 ? 338 LYS   A CD  1 
ATOM   846  C CE  . LYS   A 1 131 ? -24.274 -3.120  -44.903 1.00 48.86 ? 338 LYS   A CE  1 
ATOM   847  N NZ  . LYS   A 1 131 ? -24.949 -3.875  -45.979 1.00 52.30 ? 338 LYS   A NZ  1 
ATOM   848  N N   . LEU   A 1 132 ? -26.832 -2.210  -38.522 1.00 33.74 ? 339 LEU   A N   1 
ATOM   849  C CA  . LEU   A 1 132 ? -27.912 -1.826  -37.569 1.00 35.27 ? 339 LEU   A CA  1 
ATOM   850  C C   . LEU   A 1 132 ? -27.314 -1.175  -36.314 1.00 34.81 ? 339 LEU   A C   1 
ATOM   851  O O   . LEU   A 1 132 ? -27.909 -0.229  -35.805 1.00 35.45 ? 339 LEU   A O   1 
ATOM   852  C CB  . LEU   A 1 132 ? -28.779 -3.047  -37.237 1.00 35.71 ? 339 LEU   A CB  1 
ATOM   853  C CG  . LEU   A 1 132 ? -29.653 -3.570  -38.386 1.00 45.45 ? 339 LEU   A CG  1 
ATOM   854  C CD1 . LEU   A 1 132 ? -30.199 -4.969  -38.084 1.00 43.23 ? 339 LEU   A CD1 1 
ATOM   855  C CD2 . LEU   A 1 132 ? -30.801 -2.607  -38.694 1.00 44.45 ? 339 LEU   A CD2 1 
ATOM   856  N N   . ALA   A 1 133 ? -26.137 -1.614  -35.821 1.00 29.15 ? 340 ALA   A N   1 
ATOM   857  C CA  . ALA   A 1 133 ? -25.526 -1.042  -34.602 1.00 30.09 ? 340 ALA   A CA  1 
ATOM   858  C C   . ALA   A 1 133 ? -24.616 0.175   -34.892 1.00 26.55 ? 340 ALA   A C   1 
ATOM   859  O O   . ALA   A 1 133 ? -24.142 0.781   -33.919 1.00 31.21 ? 340 ALA   A O   1 
ATOM   860  C CB  . ALA   A 1 133 ? -24.781 -2.151  -33.897 1.00 28.58 ? 340 ALA   A CB  1 
ATOM   861  N N   . GLY   A 1 134 ? -24.453 0.565   -36.166 1.00 28.21 ? 341 GLY   A N   1 
ATOM   862  C CA  . GLY   A 1 134 ? -23.552 1.659   -36.609 1.00 27.00 ? 341 GLY   A CA  1 
ATOM   863  C C   . GLY   A 1 134 ? -22.075 1.292   -36.503 1.00 26.80 ? 341 GLY   A C   1 
ATOM   864  O O   . GLY   A 1 134 ? -21.244 2.199   -36.303 1.00 27.07 ? 341 GLY   A O   1 
ATOM   865  N N   . LEU   A 1 135 ? -21.789 -0.011  -36.564 1.00 27.37 ? 342 LEU   A N   1 
ATOM   866  C CA  . LEU   A 1 135 ? -20.442 -0.583  -36.317 1.00 26.14 ? 342 LEU   A CA  1 
ATOM   867  C C   . LEU   A 1 135 ? -19.857 -1.191  -37.591 1.00 28.12 ? 342 LEU   A C   1 
ATOM   868  O O   . LEU   A 1 135 ? -18.894 -1.970  -37.468 1.00 27.27 ? 342 LEU   A O   1 
ATOM   869  C CB  . LEU   A 1 135 ? -20.556 -1.647  -35.206 1.00 25.10 ? 342 LEU   A CB  1 
ATOM   870  C CG  . LEU   A 1 135 ? -20.860 -1.116  -33.805 1.00 26.52 ? 342 LEU   A CG  1 
ATOM   871  C CD1 . LEU   A 1 135 ? -21.001 -2.251  -32.794 1.00 26.67 ? 342 LEU   A CD1 1 
ATOM   872  C CD2 . LEU   A 1 135 ? -19.821 -0.149  -33.323 1.00 29.57 ? 342 LEU   A CD2 1 
ATOM   873  N N   . LEU   A 1 136 ? -20.356 -0.888  -38.796 1.00 27.55 ? 343 LEU   A N   1 
ATOM   874  C CA  . LEU   A 1 136 ? -19.847 -1.604  -39.994 1.00 27.95 ? 343 LEU   A CA  1 
ATOM   875  C C   . LEU   A 1 136 ? -18.348 -1.305  -40.157 1.00 26.11 ? 343 LEU   A C   1 
ATOM   876  O O   . LEU   A 1 136 ? -17.570 -2.250  -40.409 1.00 26.61 ? 343 LEU   A O   1 
ATOM   877  C CB  . LEU   A 1 136 ? -20.627 -1.182  -41.238 1.00 32.03 ? 343 LEU   A CB  1 
ATOM   878  C CG  . LEU   A 1 136 ? -20.258 -1.950  -42.500 1.00 33.34 ? 343 LEU   A CG  1 
ATOM   879  C CD1 . LEU   A 1 136 ? -20.497 -3.443  -42.354 1.00 35.34 ? 343 LEU   A CD1 1 
ATOM   880  C CD2 . LEU   A 1 136 ? -21.006 -1.394  -43.707 1.00 36.52 ? 343 LEU   A CD2 1 
ATOM   881  N N   . ASP   A 1 137 ? -17.929 -0.042  -40.057 1.00 28.39 ? 344 ASP   A N   1 
ATOM   882  C CA  . ASP   A 1 137 ? -16.505 0.303   -40.327 1.00 29.07 ? 344 ASP   A CA  1 
ATOM   883  C C   . ASP   A 1 137 ? -15.617 -0.347  -39.255 1.00 27.94 ? 344 ASP   A C   1 
ATOM   884  O O   . ASP   A 1 137 ? -14.595 -0.960  -39.627 1.00 28.27 ? 344 ASP   A O   1 
ATOM   885  C CB  . ASP   A 1 137 ? -16.310 1.812   -40.440 1.00 32.33 ? 344 ASP   A CB  1 
ATOM   886  C CG  . ASP   A 1 137 ? -16.940 2.417   -41.690 1.00 36.22 ? 344 ASP   A CG  1 
ATOM   887  O OD1 . ASP   A 1 137 ? -17.317 1.641   -42.602 1.00 38.67 ? 344 ASP   A OD1 1 
ATOM   888  O OD2 . ASP   A 1 137 ? -17.052 3.666   -41.727 1.00 43.89 ? 344 ASP   A OD2 1 
ATOM   889  N N   . LEU   A 1 138 ? -16.021 -0.282  -37.987 1.00 27.25 ? 345 LEU   A N   1 
ATOM   890  C CA  . LEU   A 1 138 ? -15.207 -0.883  -36.891 1.00 25.18 ? 345 LEU   A CA  1 
ATOM   891  C C   . LEU   A 1 138 ? -15.149 -2.406  -37.057 1.00 23.09 ? 345 LEU   A C   1 
ATOM   892  O O   . LEU   A 1 138 ? -14.075 -3.006  -36.923 1.00 24.29 ? 345 LEU   A O   1 
ATOM   893  C CB  . LEU   A 1 138 ? -15.785 -0.524  -35.531 1.00 26.64 ? 345 LEU   A CB  1 
ATOM   894  C CG  . LEU   A 1 138 ? -15.068 -1.143  -34.343 1.00 26.34 ? 345 LEU   A CG  1 
ATOM   895  C CD1 . LEU   A 1 138 ? -13.591 -0.733  -34.293 1.00 27.24 ? 345 LEU   A CD1 1 
ATOM   896  C CD2 . LEU   A 1 138 ? -15.757 -0.738  -33.057 1.00 27.43 ? 345 LEU   A CD2 1 
ATOM   897  N N   . ASN   A 1 139 ? -16.282 -3.051  -37.306 1.00 23.61 ? 346 ASN   A N   1 
ATOM   898  C CA  . ASN   A 1 139 ? -16.333 -4.523  -37.373 1.00 21.86 ? 346 ASN   A CA  1 
ATOM   899  C C   . ASN   A 1 139 ? -15.594 -4.986  -38.631 1.00 21.77 ? 346 ASN   A C   1 
ATOM   900  O O   . ASN   A 1 139 ? -15.019 -6.090  -38.625 1.00 21.16 ? 346 ASN   A O   1 
ATOM   901  C CB  . ASN   A 1 139 ? -17.761 -5.061  -37.198 1.00 23.67 ? 346 ASN   A CB  1 
ATOM   902  C CG  . ASN   A 1 139 ? -18.204 -5.121  -35.744 1.00 25.38 ? 346 ASN   A CG  1 
ATOM   903  O OD1 . ASN   A 1 139 ? -17.459 -4.773  -34.839 1.00 28.54 ? 346 ASN   A OD1 1 
ATOM   904  N ND2 . ASN   A 1 139 ? -19.455 -5.459  -35.501 1.00 25.07 ? 346 ASN   A ND2 1 
ATOM   905  N N   . ASN   A 1 140 ? -15.570 -4.182  -39.699 1.00 23.81 ? 347 ASN   A N   1 
ATOM   906  C CA  . ASN   A 1 140 ? -14.816 -4.567  -40.908 1.00 22.86 ? 347 ASN   A CA  1 
ATOM   907  C C   . ASN   A 1 140 ? -13.309 -4.544  -40.595 1.00 19.23 ? 347 ASN   A C   1 
ATOM   908  O O   . ASN   A 1 140 ? -12.620 -5.418  -41.071 1.00 21.03 ? 347 ASN   A O   1 
ATOM   909  C CB  . ASN   A 1 140 ? -15.151 -3.658  -42.082 1.00 24.83 ? 347 ASN   A CB  1 
ATOM   910  C CG  . ASN   A 1 140 ? -16.364 -4.138  -42.837 1.00 27.25 ? 347 ASN   A CG  1 
ATOM   911  O OD1 . ASN   A 1 140 ? -16.761 -5.298  -42.722 1.00 31.55 ? 347 ASN   A OD1 1 
ATOM   912  N ND2 . ASN   A 1 140 ? -16.959 -3.253  -43.615 1.00 31.84 ? 347 ASN   A ND2 1 
ATOM   913  N N   . ALA   A 1 141 ? -12.855 -3.608  -39.765 1.00 20.36 ? 348 ALA   A N   1 
ATOM   914  C CA  . ALA   A 1 141 ? -11.424 -3.584  -39.360 1.00 22.30 ? 348 ALA   A CA  1 
ATOM   915  C C   . ALA   A 1 141 ? -11.129 -4.794  -38.456 1.00 20.46 ? 348 ALA   A C   1 
ATOM   916  O O   . ALA   A 1 141 ? -10.073 -5.420  -38.603 1.00 21.15 ? 348 ALA   A O   1 
ATOM   917  C CB  . ALA   A 1 141 ? -11.092 -2.311  -38.645 1.00 23.57 ? 348 ALA   A CB  1 
ATOM   918  N N   . ILE   A 1 142 ? -12.050 -5.152  -37.564 1.00 19.49 ? 349 ILE   A N   1 
ATOM   919  C CA  . ILE   A 1 142 ? -11.845 -6.352  -36.711 1.00 18.61 ? 349 ILE   A CA  1 
ATOM   920  C C   . ILE   A 1 142 ? -11.803 -7.579  -37.613 1.00 18.01 ? 349 ILE   A C   1 
ATOM   921  O O   . ILE   A 1 142 ? -10.968 -8.470  -37.430 1.00 19.69 ? 349 ILE   A O   1 
ATOM   922  C CB  . ILE   A 1 142 ? -12.898 -6.437  -35.593 1.00 18.51 ? 349 ILE   A CB  1 
ATOM   923  C CG1 . ILE   A 1 142 ? -12.804 -5.234  -34.656 1.00 19.32 ? 349 ILE   A CG1 1 
ATOM   924  C CG2 . ILE   A 1 142 ? -12.770 -7.773  -34.884 1.00 21.23 ? 349 ILE   A CG2 1 
ATOM   925  C CD1 . ILE   A 1 142 ? -13.883 -5.143  -33.594 1.00 20.85 ? 349 ILE   A CD1 1 
ATOM   926  N N   . LEU   A 1 143 ? -12.680 -7.660  -38.626 1.00 18.84 ? 350 LEU   A N   1 
ATOM   927  C CA  . LEU   A 1 143 ? -12.635 -8.807  -39.554 1.00 18.80 ? 350 LEU   A CA  1 
ATOM   928  C C   . LEU   A 1 143 ? -11.351 -8.862  -40.391 1.00 16.94 ? 350 LEU   A C   1 
ATOM   929  O O   . LEU   A 1 143 ? -10.948 -9.911  -40.808 1.00 18.93 ? 350 LEU   A O   1 
ATOM   930  C CB  . LEU   A 1 143 ? -13.849 -8.735  -40.489 1.00 19.85 ? 350 LEU   A CB  1 
ATOM   931  C CG  . LEU   A 1 143 ? -15.152 -9.161  -39.819 1.00 20.53 ? 350 LEU   A CG  1 
ATOM   932  C CD1 . LEU   A 1 143 ? -16.355 -8.753  -40.660 1.00 23.94 ? 350 LEU   A CD1 1 
ATOM   933  C CD2 . LEU   A 1 143 ? -15.188 -10.654 -39.603 1.00 20.75 ? 350 LEU   A CD2 1 
ATOM   934  N N   . GLN   A 1 144 ? -10.706 -7.716  -40.615 1.00 18.11 ? 351 GLN   A N   1 
ATOM   935  C CA  . GLN   A 1 144 ? -9.370  -7.683  -41.272 1.00 18.31 ? 351 GLN   A CA  1 
ATOM   936  C C   . GLN   A 1 144 ? -8.342  -8.402  -40.382 1.00 18.71 ? 351 GLN   A C   1 
ATOM   937  O O   . GLN   A 1 144 ? -7.488  -9.143  -40.893 1.00 20.22 ? 351 GLN   A O   1 
ATOM   938  C CB  . GLN   A 1 144 ? -8.989  -6.234  -41.590 1.00 21.60 ? 351 GLN   A CB  1 
ATOM   939  C CG  . GLN   A 1 144 ? -7.820  -6.102  -42.538 1.00 22.91 ? 351 GLN   A CG  1 
ATOM   940  C CD  . GLN   A 1 144 ? -7.533  -4.630  -42.800 1.00 24.17 ? 351 GLN   A CD  1 
ATOM   941  O OE1 . GLN   A 1 144 ? -8.155  -3.715  -42.243 1.00 28.74 ? 351 GLN   A OE1 1 
ATOM   942  N NE2 . GLN   A 1 144 ? -6.574  -4.401  -43.663 1.00 28.71 ? 351 GLN   A NE2 1 
ATOM   943  N N   . LEU   A 1 145 ? -8.353  -8.128  -39.056 1.00 16.79 ? 352 LEU   A N   1 
ATOM   944  C CA  . LEU   A 1 145 ? -7.510  -8.875  -38.108 1.00 17.57 ? 352 LEU   A CA  1 
ATOM   945  C C   . LEU   A 1 145 ? -7.788  -10.376 -38.157 1.00 17.06 ? 352 LEU   A C   1 
ATOM   946  O O   . LEU   A 1 145 ? -6.852  -11.166 -38.206 1.00 18.39 ? 352 LEU   A O   1 
ATOM   947  C CB  . LEU   A 1 145 ? -7.736  -8.375  -36.678 1.00 19.66 ? 352 LEU   A CB  1 
ATOM   948  C CG  . LEU   A 1 145 ? -7.165  -7.020  -36.270 1.00 20.08 ? 352 LEU   A CG  1 
ATOM   949  C CD1 . LEU   A 1 145 ? -7.876  -6.524  -35.013 1.00 21.02 ? 352 LEU   A CD1 1 
ATOM   950  C CD2 . LEU   A 1 145 ? -5.662  -7.157  -36.013 1.00 21.33 ? 352 LEU   A CD2 1 
ATOM   951  N N   . VAL   A 1 146 ? -9.085  -10.725 -38.182 1.00 16.90 ? 353 VAL   A N   1 
ATOM   952  C CA  . VAL   A 1 146 ? -9.447  -12.153 -38.256 1.00 17.94 ? 353 VAL   A CA  1 
ATOM   953  C C   . VAL   A 1 146 ? -8.857  -12.754 -39.519 1.00 18.12 ? 353 VAL   A C   1 
ATOM   954  O O   . VAL   A 1 146 ? -8.305  -13.854 -39.460 1.00 19.06 ? 353 VAL   A O   1 
ATOM   955  C CB  . VAL   A 1 146 ? -10.969 -12.293 -38.159 1.00 17.42 ? 353 VAL   A CB  1 
ATOM   956  C CG1 . VAL   A 1 146 ? -11.410 -13.715 -38.491 1.00 18.30 ? 353 VAL   A CG1 1 
ATOM   957  C CG2 . VAL   A 1 146 ? -11.487 -11.847 -36.823 1.00 17.85 ? 353 VAL   A CG2 1 
ATOM   958  N N   . LYS   A 1 147 ? -9.022  -12.099 -40.671 1.00 19.26 ? 354 LYS   A N   1 
ATOM   959  C CA  . LYS   A 1 147 ? -8.557  -12.661 -41.970 1.00 21.42 ? 354 LYS   A CA  1 
ATOM   960  C C   . LYS   A 1 147 ? -7.069  -12.980 -41.886 1.00 20.31 ? 354 LYS   A C   1 
ATOM   961  O O   . LYS   A 1 147 ? -6.654  -14.086 -42.292 1.00 20.11 ? 354 LYS   A O   1 
ATOM   962  C CB  . LYS   A 1 147 ? -8.845  -11.678 -43.105 1.00 23.64 ? 354 LYS   A CB  1 
ATOM   963  C CG  . LYS   A 1 147 ? -8.309  -12.052 -44.482 1.00 32.66 ? 354 LYS   A CG  1 
ATOM   964  C CD  . LYS   A 1 147 ? -8.603  -10.929 -45.470 1.00 37.52 ? 354 LYS   A CD  1 
ATOM   965  C CE  . LYS   A 1 147 ? -7.410  -10.508 -46.302 1.00 49.51 ? 354 LYS   A CE  1 
ATOM   966  N NZ  . LYS   A 1 147 ? -7.612  -10.765 -47.746 1.00 54.65 ? 354 LYS   A NZ  1 
ATOM   967  N N   . LYS   A 1 148 ? -6.274  -12.061 -41.346 1.00 19.81 ? 355 LYS   A N   1 
ATOM   968  C CA  . LYS   A 1 148 ? -4.816  -12.285 -41.329 1.00 20.10 ? 355 LYS   A CA  1 
ATOM   969  C C   . LYS   A 1 148 ? -4.453  -13.389 -40.343 1.00 19.06 ? 355 LYS   A C   1 
ATOM   970  O O   . LYS   A 1 148 ? -3.643  -14.252 -40.622 1.00 19.27 ? 355 LYS   A O   1 
ATOM   971  C CB  . LYS   A 1 148 ? -4.117  -10.993 -40.961 1.00 19.83 ? 355 LYS   A CB  1 
ATOM   972  C CG  . LYS   A 1 148 ? -2.619  -11.053 -41.180 1.00 23.41 ? 355 LYS   A CG  1 
ATOM   973  C CD  . LYS   A 1 148 ? -1.954  -9.917  -40.516 1.00 22.71 ? 355 LYS   A CD  1 
ATOM   974  C CE  . LYS   A 1 148 ? -2.267  -8.565  -41.108 1.00 22.48 ? 355 LYS   A CE  1 
ATOM   975  N NZ  . LYS   A 1 148 ? -1.523  -7.514  -40.341 1.00 19.77 ? 355 LYS   A NZ  1 
ATOM   976  N N   . TYR   A 1 149 ? -5.122  -13.458 -39.194 1.00 17.42 ? 356 TYR   A N   1 
ATOM   977  C CA  . TYR   A 1 149 ? -4.798  -14.555 -38.258 1.00 17.48 ? 356 TYR   A CA  1 
ATOM   978  C C   . TYR   A 1 149 ? -5.279  -15.892 -38.815 1.00 18.54 ? 356 TYR   A C   1 
ATOM   979  O O   . TYR   A 1 149 ? -4.653  -16.881 -38.535 1.00 19.51 ? 356 TYR   A O   1 
ATOM   980  C CB  . TYR   A 1 149 ? -5.361  -14.274 -36.871 1.00 17.25 ? 356 TYR   A CB  1 
ATOM   981  C CG  . TYR   A 1 149 ? -4.608  -13.265 -36.045 1.00 15.22 ? 356 TYR   A CG  1 
ATOM   982  C CD1 . TYR   A 1 149 ? -3.227  -13.251 -35.931 1.00 15.71 ? 356 TYR   A CD1 1 
ATOM   983  C CD2 . TYR   A 1 149 ? -5.274  -12.237 -35.437 1.00 17.47 ? 356 TYR   A CD2 1 
ATOM   984  C CE1 . TYR   A 1 149 ? -2.592  -12.342 -35.107 1.00 15.84 ? 356 TYR   A CE1 1 
ATOM   985  C CE2 . TYR   A 1 149 ? -4.645  -11.315 -34.608 1.00 16.47 ? 356 TYR   A CE2 1 
ATOM   986  C CZ  . TYR   A 1 149 ? -3.273  -11.333 -34.502 1.00 14.82 ? 356 TYR   A CZ  1 
ATOM   987  O OH  . TYR   A 1 149 ? -2.726  -10.335 -33.737 1.00 16.81 ? 356 TYR   A OH  1 
ATOM   988  N N   . LYS   A 1 150 ? -6.392  -15.921 -39.542 1.00 18.17 ? 357 LYS   A N   1 
ATOM   989  C CA  . LYS   A 1 150 ? -6.826  -17.201 -40.159 1.00 21.11 ? 357 LYS   A CA  1 
ATOM   990  C C   . LYS   A 1 150 ? -5.776  -17.674 -41.162 1.00 21.35 ? 357 LYS   A C   1 
ATOM   991  O O   . LYS   A 1 150 ? -5.417  -18.850 -41.173 1.00 22.92 ? 357 LYS   A O   1 
ATOM   992  C CB  . LYS   A 1 150 ? -8.152  -17.026 -40.888 1.00 24.03 ? 357 LYS   A CB  1 
ATOM   993  C CG  . LYS   A 1 150 ? -9.414  -16.987 -40.053 1.00 28.86 ? 357 LYS   A CG  1 
ATOM   994  C CD  . LYS   A 1 150 ? -10.607 -17.314 -40.989 1.00 36.99 ? 357 LYS   A CD  1 
ATOM   995  C CE  . LYS   A 1 150 ? -11.808 -16.423 -40.828 1.00 38.26 ? 357 LYS   A CE  1 
ATOM   996  N NZ  . LYS   A 1 150 ? -12.761 -16.592 -41.956 1.00 36.75 ? 357 LYS   A NZ  1 
ATOM   997  N N   . SER   A 1 151 ? -5.277  -16.791 -42.004 1.00 21.40 ? 358 SER   A N   1 
ATOM   998  C CA  . SER   A 1 151 ? -4.283  -17.179 -43.026 1.00 21.24 ? 358 SER   A CA  1 
ATOM   999  C C   . SER   A 1 151 ? -2.960  -17.608 -42.387 1.00 23.61 ? 358 SER   A C   1 
ATOM   1000 O O   . SER   A 1 151 ? -2.268  -18.488 -42.931 1.00 26.28 ? 358 SER   A O   1 
ATOM   1001 C CB  . SER   A 1 151 ? -4.095  -16.091 -44.041 1.00 25.09 ? 358 SER   A CB  1 
ATOM   1002 O OG  . SER   A 1 151 ? -3.569  -14.942 -43.469 1.00 31.01 ? 358 SER   A OG  1 
ATOM   1003 N N   . MET   A 1 152 ? -2.650  -17.083 -41.195 1.00 19.35 ? 359 MET   A N   1 
ATOM   1004 C CA  . MET   A 1 152 ? -1.429  -17.461 -40.447 1.00 21.22 ? 359 MET   A CA  1 
ATOM   1005 C C   . MET   A 1 152 ? -1.696  -18.658 -39.517 1.00 18.73 ? 359 MET   A C   1 
ATOM   1006 O O   . MET   A 1 152 ? -0.780  -19.092 -38.845 1.00 19.74 ? 359 MET   A O   1 
ATOM   1007 C CB  . MET   A 1 152 ? -0.941  -16.271 -39.619 1.00 23.27 ? 359 MET   A CB  1 
ATOM   1008 C CG  . MET   A 1 152 ? -0.625  -15.075 -40.462 1.00 23.84 ? 359 MET   A CG  1 
ATOM   1009 S SD  . MET   A 1 152 ? -0.122  -13.682 -39.424 1.00 31.25 ? 359 MET   A SD  1 
ATOM   1010 C CE  . MET   A 1 152 ? 1.413   -14.414 -38.880 1.00 35.30 ? 359 MET   A CE  1 
ATOM   1011 N N   . LYS   A 1 153 ? -2.899  -19.197 -39.478 1.00 19.27 ? 360 LYS   A N   1 
ATOM   1012 C CA  . LYS   A 1 153 ? -3.311  -20.324 -38.605 1.00 20.46 ? 360 LYS   A CA  1 
ATOM   1013 C C   . LYS   A 1 153 ? -2.895  -20.034 -37.160 1.00 18.54 ? 360 LYS   A C   1 
ATOM   1014 O O   . LYS   A 1 153 ? -2.224  -20.853 -36.508 1.00 19.16 ? 360 LYS   A O   1 
ATOM   1015 C CB  . LYS   A 1 153 ? -2.738  -21.648 -39.126 1.00 23.20 ? 360 LYS   A CB  1 
ATOM   1016 C CG  . LYS   A 1 153 ? -3.045  -21.951 -40.598 1.00 28.08 ? 360 LYS   A CG  1 
ATOM   1017 C CD  . LYS   A 1 153 ? -2.458  -23.258 -41.067 1.00 31.70 ? 360 LYS   A CD  1 
ATOM   1018 C CE  . LYS   A 1 153 ? -2.812  -23.565 -42.502 1.00 39.70 ? 360 LYS   A CE  1 
ATOM   1019 N NZ  . LYS   A 1 153 ? -4.205  -24.075 -42.597 1.00 46.30 ? 360 LYS   A NZ  1 
ATOM   1020 N N   . LEU   A 1 154 ? -3.372  -18.909 -36.651 1.00 17.83 ? 361 LEU   A N   1 
ATOM   1021 C CA  . LEU   A 1 154 ? -3.127  -18.531 -35.241 1.00 18.82 ? 361 LEU   A CA  1 
ATOM   1022 C C   . LEU   A 1 154 ? -3.568  -19.636 -34.284 1.00 17.51 ? 361 LEU   A C   1 
ATOM   1023 O O   . LEU   A 1 154 ? -4.734  -20.055 -34.334 1.00 18.88 ? 361 LEU   A O   1 
ATOM   1024 C CB  . LEU   A 1 154 ? -3.813  -17.212 -34.916 1.00 18.43 ? 361 LEU   A CB  1 
ATOM   1025 C CG  . LEU   A 1 154 ? -3.535  -16.660 -33.524 1.00 18.12 ? 361 LEU   A CG  1 
ATOM   1026 C CD1 . LEU   A 1 154 ? -2.112  -16.121 -33.438 1.00 18.78 ? 361 LEU   A CD1 1 
ATOM   1027 C CD2 . LEU   A 1 154 ? -4.519  -15.568 -33.190 1.00 19.65 ? 361 LEU   A CD2 1 
ATOM   1028 N N   . GLU   A 1 155 ? -2.663  -20.017 -33.392 1.00 16.51 ? 362 GLU   A N   1 
ATOM   1029 C CA  . GLU   A 1 155 ? -2.940  -21.058 -32.364 1.00 17.02 ? 362 GLU   A CA  1 
ATOM   1030 C C   . GLU   A 1 155 ? -3.311  -20.379 -31.051 1.00 17.80 ? 362 GLU   A C   1 
ATOM   1031 O O   . GLU   A 1 155 ? -2.915  -19.205 -30.769 1.00 17.28 ? 362 GLU   A O   1 
ATOM   1032 C CB  . GLU   A 1 155 ? -1.668  -21.865 -32.125 1.00 18.33 ? 362 GLU   A CB  1 
ATOM   1033 C CG  . GLU   A 1 155 ? -1.238  -22.631 -33.338 1.00 19.59 ? 362 GLU   A CG  1 
ATOM   1034 C CD  . GLU   A 1 155 ? 0.204   -23.051 -33.462 1.00 20.60 ? 362 GLU   A CD  1 
ATOM   1035 O OE1 . GLU   A 1 155 ? 0.987   -22.821 -32.537 1.00 24.35 ? 362 GLU   A OE1 1 
ATOM   1036 O OE2 . GLU   A 1 155 ? 0.494   -23.649 -34.512 1.00 25.74 ? 362 GLU   A OE2 1 
ATOM   1037 N N   . LYS   A 1 156 ? -4.016  -21.061 -30.147 1.00 17.19 ? 363 LYS   A N   1 
ATOM   1038 C CA  . LYS   A 1 156 ? -4.350  -20.453 -28.840 1.00 17.68 ? 363 LYS   A CA  1 
ATOM   1039 C C   . LYS   A 1 156 ? -3.066  -20.040 -28.087 1.00 16.29 ? 363 LYS   A C   1 
ATOM   1040 O O   . LYS   A 1 156 ? -3.095  -19.020 -27.423 1.00 16.97 ? 363 LYS   A O   1 
ATOM   1041 C CB  . LYS   A 1 156 ? -5.165  -21.456 -28.003 1.00 20.05 ? 363 LYS   A CB  1 
ATOM   1042 C CG  . LYS   A 1 156 ? -5.852  -20.777 -26.829 1.00 23.17 ? 363 LYS   A CG  1 
ATOM   1043 C CD  . LYS   A 1 156 ? -6.819  -21.648 -26.050 1.00 29.89 ? 363 LYS   A CD  1 
ATOM   1044 C CE  . LYS   A 1 156 ? -7.676  -20.813 -25.128 1.00 35.17 ? 363 LYS   A CE  1 
ATOM   1045 N NZ  . LYS   A 1 156 ? -8.433  -21.663 -24.174 1.00 42.43 ? 363 LYS   A NZ  1 
ATOM   1046 N N   . GLU   A 1 157 ? -2.013  -20.843 -28.185 1.00 17.59 ? 364 GLU   A N   1 
ATOM   1047 C CA  . GLU   A 1 157 ? -0.732  -20.527 -27.520 1.00 17.77 ? 364 GLU   A CA  1 
ATOM   1048 C C   . GLU   A 1 157 ? -0.238  -19.117 -27.954 1.00 16.67 ? 364 GLU   A C   1 
ATOM   1049 O O   . GLU   A 1 157 ? 0.272   -18.364 -27.133 1.00 17.05 ? 364 GLU   A O   1 
ATOM   1050 C CB  . GLU   A 1 157 ? 0.297   -21.574 -27.827 1.00 19.25 ? 364 GLU   A CB  1 
ATOM   1051 C CG  . GLU   A 1 157 ? 0.076   -22.956 -27.195 1.00 22.29 ? 364 GLU   A CG  1 
ATOM   1052 C CD  . GLU   A 1 157 ? -0.998  -23.858 -27.765 1.00 24.85 ? 364 GLU   A CD  1 
ATOM   1053 O OE1 . GLU   A 1 157 ? -1.581  -23.526 -28.805 1.00 22.47 ? 364 GLU   A OE1 1 
ATOM   1054 O OE2 . GLU   A 1 157 ? -1.258  -24.935 -27.160 1.00 29.24 ? 364 GLU   A OE2 1 
ATOM   1055 N N   . GLU   A 1 158 ? -0.301  -18.865 -29.243 1.00 16.83 ? 365 GLU   A N   1 
ATOM   1056 C CA  . GLU   A 1 158 ? 0.176   -17.603 -29.854 1.00 17.02 ? 365 GLU   A CA  1 
ATOM   1057 C C   . GLU   A 1 158 ? -0.760  -16.482 -29.452 1.00 16.16 ? 365 GLU   A C   1 
ATOM   1058 O O   . GLU   A 1 158 ? -0.336  -15.371 -29.116 1.00 16.57 ? 365 GLU   A O   1 
ATOM   1059 C CB  . GLU   A 1 158 ? 0.257   -17.786 -31.367 1.00 16.84 ? 365 GLU   A CB  1 
ATOM   1060 C CG  . GLU   A 1 158 ? 1.222   -18.854 -31.783 1.00 17.06 ? 365 GLU   A CG  1 
ATOM   1061 C CD  . GLU   A 1 158 ? 1.212   -19.253 -33.233 1.00 17.60 ? 365 GLU   A CD  1 
ATOM   1062 O OE1 . GLU   A 1 158 ? 0.134   -19.433 -33.773 1.00 18.24 ? 365 GLU   A OE1 1 
ATOM   1063 O OE2 . GLU   A 1 158 ? 2.322   -19.469 -33.806 1.00 19.11 ? 365 GLU   A OE2 1 
ATOM   1064 N N   . PHE   A 1 159 ? -2.063  -16.722 -29.501 1.00 16.82 ? 366 PHE   A N   1 
ATOM   1065 C CA  . PHE   A 1 159 ? -3.063  -15.743 -29.045 1.00 15.81 ? 366 PHE   A CA  1 
ATOM   1066 C C   . PHE   A 1 159 ? -2.774  -15.252 -27.624 1.00 14.66 ? 366 PHE   A C   1 
ATOM   1067 O O   . PHE   A 1 159 ? -2.771  -14.051 -27.360 1.00 15.27 ? 366 PHE   A O   1 
ATOM   1068 C CB  . PHE   A 1 159 ? -4.454  -16.392 -29.150 1.00 16.48 ? 366 PHE   A CB  1 
ATOM   1069 C CG  . PHE   A 1 159 ? -5.564  -15.753 -28.356 1.00 16.47 ? 366 PHE   A CG  1 
ATOM   1070 C CD1 . PHE   A 1 159 ? -5.964  -14.410 -28.549 1.00 18.22 ? 366 PHE   A CD1 1 
ATOM   1071 C CD2 . PHE   A 1 159 ? -6.195  -16.498 -27.376 1.00 19.71 ? 366 PHE   A CD2 1 
ATOM   1072 C CE1 . PHE   A 1 159 ? -6.991  -13.899 -27.768 1.00 18.36 ? 366 PHE   A CE1 1 
ATOM   1073 C CE2 . PHE   A 1 159 ? -7.211  -15.967 -26.596 1.00 20.81 ? 366 PHE   A CE2 1 
ATOM   1074 C CZ  . PHE   A 1 159 ? -7.591  -14.671 -26.802 1.00 20.20 ? 366 PHE   A CZ  1 
ATOM   1075 N N   . VAL   A 1 160 ? -2.650  -16.177 -26.672 1.00 15.98 ? 367 VAL   A N   1 
ATOM   1076 C CA  . VAL   A 1 160 ? -2.504  -15.733 -25.273 1.00 15.36 ? 367 VAL   A CA  1 
ATOM   1077 C C   . VAL   A 1 160 ? -1.168  -14.985 -25.076 1.00 15.47 ? 367 VAL   A C   1 
ATOM   1078 O O   . VAL   A 1 160 ? -1.134  -14.003 -24.281 1.00 15.37 ? 367 VAL   A O   1 
ATOM   1079 C CB  . VAL   A 1 160 ? -2.659  -16.869 -24.242 1.00 16.55 ? 367 VAL   A CB  1 
ATOM   1080 C CG1 . VAL   A 1 160 ? -4.086  -17.411 -24.285 1.00 17.44 ? 367 VAL   A CG1 1 
ATOM   1081 C CG2 . VAL   A 1 160 ? -1.627  -17.982 -24.344 1.00 16.42 ? 367 VAL   A CG2 1 
ATOM   1082 N N   . THR   A 1 161 ? -0.141  -15.401 -25.829 1.00 16.21 ? 368 THR   A N   1 
ATOM   1083 C CA  . THR   A 1 161 ? 1.165   -14.726 -25.690 1.00 15.33 ? 368 THR   A CA  1 
ATOM   1084 C C   . THR   A 1 161 ? 1.104   -13.322 -26.326 1.00 15.48 ? 368 THR   A C   1 
ATOM   1085 O O   . THR   A 1 161 ? 1.624   -12.340 -25.740 1.00 15.20 ? 368 THR   A O   1 
ATOM   1086 C CB  . THR   A 1 161 ? 2.258   -15.580 -26.292 1.00 15.90 ? 368 THR   A CB  1 
ATOM   1087 O OG1 . THR   A 1 161 ? 2.221   -16.900 -25.741 1.00 16.36 ? 368 THR   A OG1 1 
ATOM   1088 C CG2 . THR   A 1 161 ? 3.625   -14.989 -26.050 1.00 18.85 ? 368 THR   A CG2 1 
ATOM   1089 N N   . LEU   A 1 162 ? 0.432   -13.185 -27.461 1.00 15.52 ? 369 LEU   A N   1 
ATOM   1090 C CA  . LEU   A 1 162 ? 0.278   -11.854 -28.078 1.00 16.47 ? 369 LEU   A CA  1 
ATOM   1091 C C   . LEU   A 1 162 ? -0.591  -10.955 -27.219 1.00 15.12 ? 369 LEU   A C   1 
ATOM   1092 O O   . LEU   A 1 162 ? -0.364  -9.742  -27.186 1.00 16.10 ? 369 LEU   A O   1 
ATOM   1093 C CB  . LEU   A 1 162 ? -0.356  -11.963 -29.476 1.00 17.01 ? 369 LEU   A CB  1 
ATOM   1094 C CG  . LEU   A 1 162 ? 0.593   -12.420 -30.551 1.00 18.18 ? 369 LEU   A CG  1 
ATOM   1095 C CD1 . LEU   A 1 162 ? -0.190  -12.795 -31.812 1.00 19.84 ? 369 LEU   A CD1 1 
ATOM   1096 C CD2 . LEU   A 1 162 ? 1.637   -11.364 -30.836 1.00 18.45 ? 369 LEU   A CD2 1 
ATOM   1097 N N   . LYS   A 1 163 ? -1.606  -11.453 -26.533 1.00 14.85 ? 370 LYS   A N   1 
ATOM   1098 C CA  . LYS   A 1 163 ? -2.414  -10.597 -25.651 1.00 16.42 ? 370 LYS   A CA  1 
ATOM   1099 C C   . LYS   A 1 163 ? -1.557  -10.045 -24.493 1.00 14.00 ? 370 LYS   A C   1 
ATOM   1100 O O   . LYS   A 1 163 ? -1.645  -8.824  -24.164 1.00 14.71 ? 370 LYS   A O   1 
ATOM   1101 C CB  . LYS   A 1 163 ? -3.544  -11.477 -25.115 1.00 21.31 ? 370 LYS   A CB  1 
ATOM   1102 C CG  . LYS   A 1 163 ? -4.750  -10.798 -24.571 1.00 26.17 ? 370 LYS   A CG  1 
ATOM   1103 C CD  . LYS   A 1 163 ? -6.026  -11.702 -24.620 1.00 21.05 ? 370 LYS   A CD  1 
ATOM   1104 C CE  . LYS   A 1 163 ? -5.915  -13.134 -24.196 1.00 23.26 ? 370 LYS   A CE  1 
ATOM   1105 N NZ  . LYS   A 1 163 ? -7.093  -13.559 -23.381 1.00 29.98 ? 370 LYS   A NZ  1 
ATOM   1106 N N   . ALA   A 1 164 ? -0.709  -10.896 -23.920 1.00 14.48 ? 371 ALA   A N   1 
ATOM   1107 C CA  . ALA   A 1 164 ? 0.229   -10.413 -22.866 1.00 15.41 ? 371 ALA   A CA  1 
ATOM   1108 C C   . ALA   A 1 164 ? 1.252   -9.399  -23.438 1.00 13.69 ? 371 ALA   A C   1 
ATOM   1109 O O   . ALA   A 1 164 ? 1.502   -8.348  -22.824 1.00 13.60 ? 371 ALA   A O   1 
ATOM   1110 C CB  . ALA   A 1 164 ? 0.907   -11.605 -22.218 1.00 15.38 ? 371 ALA   A CB  1 
ATOM   1111 N N   . ILE   A 1 165 ? 1.776   -9.648  -24.646 1.00 13.85 ? 372 ILE   A N   1 
ATOM   1112 C CA  . ILE   A 1 165 ? 2.706   -8.692  -25.284 1.00 14.71 ? 372 ILE   A CA  1 
ATOM   1113 C C   . ILE   A 1 165 ? 2.014   -7.368  -25.536 1.00 14.30 ? 372 ILE   A C   1 
ATOM   1114 O O   . ILE   A 1 165 ? 2.566   -6.296  -25.328 1.00 15.14 ? 372 ILE   A O   1 
ATOM   1115 C CB  . ILE   A 1 165 ? 3.313   -9.304  -26.545 1.00 14.22 ? 372 ILE   A CB  1 
ATOM   1116 C CG1 . ILE   A 1 165 ? 4.268   -10.457 -26.232 1.00 14.75 ? 372 ILE   A CG1 1 
ATOM   1117 C CG2 . ILE   A 1 165 ? 4.007   -8.229  -27.367 1.00 14.98 ? 372 ILE   A CG2 1 
ATOM   1118 C CD1 . ILE   A 1 165 ? 4.700   -11.266 -27.413 1.00 16.40 ? 372 ILE   A CD1 1 
ATOM   1119 N N   . ALA   A 1 166 ? 0.761   -7.412  -26.006 1.00 14.61 ? 373 ALA   A N   1 
ATOM   1120 C CA  . ALA   A 1 166 ? -0.006  -6.173  -26.282 1.00 14.87 ? 373 ALA   A CA  1 
ATOM   1121 C C   . ALA   A 1 166 ? -0.140  -5.333  -24.999 1.00 14.15 ? 373 ALA   A C   1 
ATOM   1122 O O   . ALA   A 1 166 ? -0.009  -4.120  -25.025 1.00 15.60 ? 373 ALA   A O   1 
ATOM   1123 C CB  . ALA   A 1 166 ? -1.366  -6.459  -26.868 1.00 16.77 ? 373 ALA   A CB  1 
ATOM   1124 N N   . LEU   A 1 167 ? -0.377  -6.004  -23.863 1.00 14.32 ? 374 LEU   A N   1 
ATOM   1125 C CA  . LEU   A 1 167 ? -0.428  -5.293  -22.575 1.00 14.91 ? 374 LEU   A CA  1 
ATOM   1126 C C   . LEU   A 1 167 ? 0.926   -4.642  -22.270 1.00 14.90 ? 374 LEU   A C   1 
ATOM   1127 O O   . LEU   A 1 167 ? 0.966   -3.443  -21.963 1.00 15.58 ? 374 LEU   A O   1 
ATOM   1128 C CB  . LEU   A 1 167 ? -0.855  -6.288  -21.486 1.00 15.30 ? 374 LEU   A CB  1 
ATOM   1129 C CG  . LEU   A 1 167 ? -0.877  -5.655  -20.083 1.00 18.79 ? 374 LEU   A CG  1 
ATOM   1130 C CD1 . LEU   A 1 167 ? -1.860  -4.488  -19.970 1.00 20.08 ? 374 LEU   A CD1 1 
ATOM   1131 C CD2 . LEU   A 1 167 ? -1.185  -6.730  -19.066 1.00 19.98 ? 374 LEU   A CD2 1 
ATOM   1132 N N   . ALA   A 1 168 ? 1.990   -5.416  -22.379 1.00 14.20 ? 375 ALA   A N   1 
ATOM   1133 C CA  . ALA   A 1 168 ? 3.336   -4.950  -21.993 1.00 15.82 ? 375 ALA   A CA  1 
ATOM   1134 C C   . ALA   A 1 168 ? 3.839   -3.851  -22.936 1.00 15.74 ? 375 ALA   A C   1 
ATOM   1135 O O   . ALA   A 1 168 ? 4.517   -2.899  -22.514 1.00 16.72 ? 375 ALA   A O   1 
ATOM   1136 C CB  . ALA   A 1 168 ? 4.283   -6.108  -21.940 1.00 16.80 ? 375 ALA   A CB  1 
ATOM   1137 N N   . ASN   A 1 169 ? 3.485   -3.935  -24.223 1.00 15.20 ? 376 ASN   A N   1 
ATOM   1138 C CA  . ASN   A 1 169 ? 3.946   -3.032  -25.303 1.00 15.08 ? 376 ASN   A CA  1 
ATOM   1139 C C   . ASN   A 1 169 ? 2.923   -1.939  -25.619 1.00 17.07 ? 376 ASN   A C   1 
ATOM   1140 O O   . ASN   A 1 169 ? 2.865   -1.475  -26.766 1.00 17.59 ? 376 ASN   A O   1 
ATOM   1141 C CB  . ASN   A 1 169 ? 4.264   -3.867  -26.543 1.00 15.12 ? 376 ASN   A CB  1 
ATOM   1142 C CG  . ASN   A 1 169 ? 5.097   -3.154  -27.574 1.00 16.32 ? 376 ASN   A CG  1 
ATOM   1143 O OD1 . ASN   A 1 169 ? 6.104   -2.576  -27.202 1.00 17.49 ? 376 ASN   A OD1 1 
ATOM   1144 N ND2 . ASN   A 1 169 ? 4.719   -3.273  -28.850 1.00 15.39 ? 376 ASN   A ND2 1 
ATOM   1145 N N   . SER   A 1 170 ? 2.140   -1.480  -24.641 1.00 18.60 ? 377 SER   A N   1 
ATOM   1146 C CA  . SER   A 1 170 ? 0.985   -0.631  -24.966 1.00 18.28 ? 377 SER   A CA  1 
ATOM   1147 C C   . SER   A 1 170 ? 1.326   0.851   -25.112 1.00 15.83 ? 377 SER   A C   1 
ATOM   1148 O O   . SER   A 1 170 ? 0.457   1.586   -25.522 1.00 18.98 ? 377 SER   A O   1 
ATOM   1149 C CB  . SER   A 1 170 ? -0.165  -0.849  -24.044 1.00 22.91 ? 377 SER   A CB  1 
ATOM   1150 O OG  . SER   A 1 170 ? 0.337   -0.727  -22.757 1.00 23.91 ? 377 SER   A OG  1 
ATOM   1151 N N   . ASP   A 1 171 ? 2.570   1.229   -24.856 1.00 17.02 ? 378 ASP   A N   1 
ATOM   1152 C CA  . ASP   A 1 171 ? 3.082   2.606   -25.144 1.00 16.88 ? 378 ASP   A CA  1 
ATOM   1153 C C   . ASP   A 1 171 ? 2.355   3.727   -24.373 1.00 17.08 ? 378 ASP   A C   1 
ATOM   1154 O O   . ASP   A 1 171 ? 2.246   4.862   -24.884 1.00 21.30 ? 378 ASP   A O   1 
ATOM   1155 C CB  . ASP   A 1 171 ? 3.035   2.894   -26.637 1.00 16.15 ? 378 ASP   A CB  1 
ATOM   1156 C CG  . ASP   A 1 171 ? 3.999   2.040   -27.431 1.00 17.28 ? 378 ASP   A CG  1 
ATOM   1157 O OD1 . ASP   A 1 171 ? 5.187   2.050   -27.077 1.00 19.12 ? 378 ASP   A OD1 1 
ATOM   1158 O OD2 . ASP   A 1 171 ? 3.563   1.381   -28.422 1.00 16.67 ? 378 ASP   A OD2 1 
ATOM   1159 N N   . SER   A 1 172 ? 2.029   3.434   -23.115 1.00 18.70 ? 379 SER   A N   1 
ATOM   1160 C CA  . SER   A 1 172 ? 1.610   4.508   -22.181 1.00 19.44 ? 379 SER   A CA  1 
ATOM   1161 C C   . SER   A 1 172 ? 2.665   5.620   -22.143 1.00 21.69 ? 379 SER   A C   1 
ATOM   1162 O O   . SER   A 1 172 ? 3.854   5.321   -22.058 1.00 23.02 ? 379 SER   A O   1 
ATOM   1163 C CB  . SER   A 1 172 ? 1.335   3.932   -20.851 1.00 21.22 ? 379 SER   A CB  1 
ATOM   1164 O OG  . SER   A 1 172 ? 1.003   5.016   -19.950 1.00 24.83 ? 379 SER   A OG  1 
ATOM   1165 N N   . MET   A 1 173 ? 2.162   6.853   -22.089 1.00 24.47 ? 380 MET   A N   1 
ATOM   1166 C CA  . MET   A 1 173 ? 3.055   8.028   -21.875 1.00 27.19 ? 380 MET   A CA  1 
ATOM   1167 C C   . MET   A 1 173 ? 3.375   8.222   -20.388 1.00 30.60 ? 380 MET   A C   1 
ATOM   1168 O O   . MET   A 1 173 ? 4.205   9.124   -20.081 1.00 34.87 ? 380 MET   A O   1 
ATOM   1169 C CB  . MET   A 1 173 ? 2.406   9.286   -22.421 1.00 32.92 ? 380 MET   A CB  1 
ATOM   1170 C CG  . MET   A 1 173 ? 2.388   9.273   -23.899 1.00 40.38 ? 380 MET   A CG  1 
ATOM   1171 S SD  . MET   A 1 173 ? 1.859   10.860  -24.462 1.00 48.30 ? 380 MET   A SD  1 
ATOM   1172 C CE  . MET   A 1 173 ? 0.111   10.754  -24.070 1.00 40.06 ? 380 MET   A CE  1 
ATOM   1173 N N   . HIS   A 1 174 ? 2.747   7.468   -19.497 1.00 27.83 ? 381 HIS   A N   1 
ATOM   1174 C CA  . HIS   A 1 174 ? 2.789   7.747   -18.032 1.00 28.21 ? 381 HIS   A CA  1 
ATOM   1175 C C   . HIS   A 1 174 ? 3.644   6.751   -17.247 1.00 31.48 ? 381 HIS   A C   1 
ATOM   1176 O O   . HIS   A 1 174 ? 3.555   6.775   -16.007 1.00 33.17 ? 381 HIS   A O   1 
ATOM   1177 C CB  . HIS   A 1 174 ? 1.345   7.813   -17.506 1.00 29.21 ? 381 HIS   A CB  1 
ATOM   1178 C CG  . HIS   A 1 174 ? 0.472   8.733   -18.288 1.00 30.04 ? 381 HIS   A CG  1 
ATOM   1179 N ND1 . HIS   A 1 174 ? 0.773   10.092  -18.462 1.00 34.48 ? 381 HIS   A ND1 1 
ATOM   1180 C CD2 . HIS   A 1 174 ? -0.716  8.520   -18.913 1.00 33.87 ? 381 HIS   A CD2 1 
ATOM   1181 C CE1 . HIS   A 1 174 ? -0.158  10.646  -19.218 1.00 36.32 ? 381 HIS   A CE1 1 
ATOM   1182 N NE2 . HIS   A 1 174 ? -1.099  9.710   -19.484 1.00 37.00 ? 381 HIS   A NE2 1 
ATOM   1183 N N   . ILE   A 1 175 ? 4.517   5.949   -17.865 1.00 27.63 ? 382 ILE   A N   1 
ATOM   1184 C CA  . ILE   A 1 175 ? 5.240   4.888   -17.116 1.00 27.33 ? 382 ILE   A CA  1 
ATOM   1185 C C   . ILE   A 1 175 ? 6.257   5.504   -16.151 1.00 29.23 ? 382 ILE   A C   1 
ATOM   1186 O O   . ILE   A 1 175 ? 7.017   6.387   -16.597 1.00 33.01 ? 382 ILE   A O   1 
ATOM   1187 C CB  . ILE   A 1 175 ? 5.906   3.930   -18.121 1.00 29.42 ? 382 ILE   A CB  1 
ATOM   1188 C CG1 . ILE   A 1 175 ? 4.838   3.226   -18.968 1.00 31.49 ? 382 ILE   A CG1 1 
ATOM   1189 C CG2 . ILE   A 1 175 ? 6.840   2.966   -17.464 1.00 27.70 ? 382 ILE   A CG2 1 
ATOM   1190 C CD1 . ILE   A 1 175 ? 3.869   2.407   -18.181 1.00 34.45 ? 382 ILE   A CD1 1 
ATOM   1191 N N   . GLU   A 1 176 ? 6.342   4.967   -14.937 1.00 29.97 ? 383 GLU   A N   1 
ATOM   1192 C CA  . GLU   A 1 176 ? 7.349   5.372   -13.908 1.00 29.87 ? 383 GLU   A CA  1 
ATOM   1193 C C   . GLU   A 1 176 ? 8.634   4.605   -14.194 1.00 31.99 ? 383 GLU   A C   1 
ATOM   1194 O O   . GLU   A 1 176 ? 9.669   5.250   -14.397 1.00 36.64 ? 383 GLU   A O   1 
ATOM   1195 C CB  . GLU   A 1 176 ? 6.858   5.087   -12.493 1.00 29.82 ? 383 GLU   A CB  1 
ATOM   1196 C CG  . GLU   A 1 176 ? 5.607   5.854   -12.088 1.00 33.73 ? 383 GLU   A CG  1 
ATOM   1197 C CD  . GLU   A 1 176 ? 5.000   5.475   -10.738 1.00 33.80 ? 383 GLU   A CD  1 
ATOM   1198 O OE1 . GLU   A 1 176 ? 5.309   4.395   -10.201 1.00 33.58 ? 383 GLU   A OE1 1 
ATOM   1199 O OE2 . GLU   A 1 176 ? 4.159   6.258   -10.244 1.00 36.38 ? 383 GLU   A OE2 1 
ATOM   1200 N N   . ASP   A 1 177 ? 8.563   3.279   -14.211 1.00 26.45 ? 384 ASP   A N   1 
ATOM   1201 C CA  . ASP   A 1 177 ? 9.731   2.381   -14.313 1.00 28.27 ? 384 ASP   A CA  1 
ATOM   1202 C C   . ASP   A 1 177 ? 9.803   1.869   -15.762 1.00 26.22 ? 384 ASP   A C   1 
ATOM   1203 O O   . ASP   A 1 177 ? 9.348   0.733   -16.017 1.00 26.66 ? 384 ASP   A O   1 
ATOM   1204 C CB  . ASP   A 1 177 ? 9.647   1.289   -13.247 1.00 27.56 ? 384 ASP   A CB  1 
ATOM   1205 C CG  . ASP   A 1 177 ? 10.958  0.556   -13.061 1.00 29.83 ? 384 ASP   A CG  1 
ATOM   1206 O OD1 . ASP   A 1 177 ? 11.829  0.693   -13.977 1.00 31.37 ? 384 ASP   A OD1 1 
ATOM   1207 O OD2 . ASP   A 1 177 ? 11.085  -0.177  -12.040 1.00 32.08 ? 384 ASP   A OD2 1 
ATOM   1208 N N   . VAL   A 1 178 ? 10.352  2.684   -16.641 1.00 28.58 ? 385 VAL   A N   1 
ATOM   1209 C CA  . VAL   A 1 178 ? 10.580  2.353   -18.078 1.00 27.72 ? 385 VAL   A CA  1 
ATOM   1210 C C   . VAL   A 1 178 ? 11.361  1.042   -18.196 1.00 29.69 ? 385 VAL   A C   1 
ATOM   1211 O O   . VAL   A 1 178 ? 10.951  0.164   -19.001 1.00 26.49 ? 385 VAL   A O   1 
ATOM   1212 C CB  . VAL   A 1 178 ? 11.217  3.543   -18.814 1.00 31.09 ? 385 VAL   A CB  1 
ATOM   1213 C CG1 . VAL   A 1 178 ? 11.684  3.139   -20.199 1.00 32.82 ? 385 VAL   A CG1 1 
ATOM   1214 C CG2 . VAL   A 1 178 ? 10.265  4.725   -18.900 1.00 31.36 ? 385 VAL   A CG2 1 
ATOM   1215 N N   . GLU   A 1 179 ? 12.412  0.828   -17.406 1.00 29.16 ? 386 GLU   A N   1 
ATOM   1216 C CA  . GLU   A 1 179 ? 13.259  -0.383  -17.478 1.00 29.98 ? 386 GLU   A CA  1 
ATOM   1217 C C   . GLU   A 1 179 ? 12.458  -1.625  -17.108 1.00 26.04 ? 386 GLU   A C   1 
ATOM   1218 O O   . GLU   A 1 179 ? 12.674  -2.687  -17.732 1.00 27.15 ? 386 GLU   A O   1 
ATOM   1219 C CB  . GLU   A 1 179 ? 14.462  -0.285  -16.525 1.00 39.06 ? 386 GLU   A CB  1 
ATOM   1220 C CG  . GLU   A 1 179 ? 15.766  0.040   -17.221 1.00 49.16 ? 386 GLU   A CG  1 
ATOM   1221 C CD  . GLU   A 1 179 ? 16.016  1.502   -17.546 1.00 58.12 ? 386 GLU   A CD  1 
ATOM   1222 O OE1 . GLU   A 1 179 ? 17.192  1.846   -17.800 1.00 65.05 ? 386 GLU   A OE1 1 
ATOM   1223 O OE2 . GLU   A 1 179 ? 15.052  2.295   -17.536 1.00 68.20 ? 386 GLU   A OE2 1 
ATOM   1224 N N   . ALA   A 1 180 ? 11.596  -1.573  -16.083 1.00 25.59 ? 387 ALA   A N   1 
ATOM   1225 C CA  . ALA   A 1 180 ? 10.860  -2.773  -15.627 1.00 24.68 ? 387 ALA   A CA  1 
ATOM   1226 C C   . ALA   A 1 180 ? 9.823   -3.165  -16.708 1.00 20.18 ? 387 ALA   A C   1 
ATOM   1227 O O   . ALA   A 1 180 ? 9.610   -4.364  -16.920 1.00 22.31 ? 387 ALA   A O   1 
ATOM   1228 C CB  . ALA   A 1 180 ? 10.192  -2.553  -14.288 1.00 23.71 ? 387 ALA   A CB  1 
ATOM   1229 N N   . VAL   A 1 181 ? 9.263   -2.153  -17.340 1.00 21.97 ? 388 VAL   A N   1 
ATOM   1230 C CA  . VAL   A 1 181 ? 8.246   -2.404  -18.415 1.00 20.88 ? 388 VAL   A CA  1 
ATOM   1231 C C   . VAL   A 1 181 ? 8.960   -2.969  -19.656 1.00 23.76 ? 388 VAL   A C   1 
ATOM   1232 O O   . VAL   A 1 181 ? 8.490   -3.979  -20.259 1.00 21.40 ? 388 VAL   A O   1 
ATOM   1233 C CB  . VAL   A 1 181 ? 7.408   -1.165  -18.712 1.00 19.78 ? 388 VAL   A CB  1 
ATOM   1234 C CG1 . VAL   A 1 181 ? 6.510   -1.419  -19.925 1.00 19.98 ? 388 VAL   A CG1 1 
ATOM   1235 C CG2 . VAL   A 1 181 ? 6.485   -0.798  -17.552 1.00 20.30 ? 388 VAL   A CG2 1 
ATOM   1236 N N   . GLN   A 1 182 ? 10.147  -2.452  -19.956 1.00 22.46 ? 389 GLN   A N   1 
ATOM   1237 C CA  . GLN   A 1 182 ? 10.952  -3.087  -21.035 1.00 22.03 ? 389 GLN   A CA  1 
ATOM   1238 C C   . GLN   A 1 182 ? 11.265  -4.540  -20.682 1.00 19.68 ? 389 GLN   A C   1 
ATOM   1239 O O   . GLN   A 1 182 ? 11.275  -5.400  -21.576 1.00 21.48 ? 389 GLN   A O   1 
ATOM   1240 C CB  . GLN   A 1 182 ? 12.250  -2.308  -21.255 1.00 25.61 ? 389 GLN   A CB  1 
ATOM   1241 C CG  . GLN   A 1 182 ? 13.106  -2.873  -22.378 1.00 27.88 ? 389 GLN   A CG  1 
ATOM   1242 C CD  . GLN   A 1 182 ? 12.395  -2.772  -23.708 1.00 30.53 ? 389 GLN   A CD  1 
ATOM   1243 O OE1 . GLN   A 1 182 ? 11.963  -1.683  -24.116 1.00 31.42 ? 389 GLN   A OE1 1 
ATOM   1244 N NE2 . GLN   A 1 182 ? 12.291  -3.908  -24.406 1.00 27.38 ? 389 GLN   A NE2 1 
ATOM   1245 N N   . LYS   A 1 183 ? 11.648  -4.834  -19.430 1.00 20.06 ? 390 LYS   A N   1 
ATOM   1246 C CA  . LYS   A 1 183 ? 11.962  -6.213  -19.010 1.00 21.57 ? 390 LYS   A CA  1 
ATOM   1247 C C   . LYS   A 1 183 ? 10.732  -7.132  -19.194 1.00 19.93 ? 390 LYS   A C   1 
ATOM   1248 O O   . LYS   A 1 183 ? 10.879  -8.273  -19.643 1.00 22.14 ? 390 LYS   A O   1 
ATOM   1249 C CB  . LYS   A 1 183 ? 12.471  -6.211  -17.572 1.00 28.62 ? 390 LYS   A CB  1 
ATOM   1250 C CG  . LYS   A 1 183 ? 12.869  -7.574  -17.055 1.00 31.45 ? 390 LYS   A CG  1 
ATOM   1251 C CD  . LYS   A 1 183 ? 12.982  -7.584  -15.533 1.00 41.68 ? 390 LYS   A CD  1 
ATOM   1252 C CE  . LYS   A 1 183 ? 12.894  -6.184  -14.939 1.00 46.95 ? 390 LYS   A CE  1 
ATOM   1253 N NZ  . LYS   A 1 183 ? 12.483  -6.165  -13.520 1.00 45.91 ? 390 LYS   A NZ  1 
ATOM   1254 N N   . LEU   A 1 184 ? 9.530   -6.633  -18.883 1.00 20.78 ? 391 LEU   A N   1 
ATOM   1255 C CA  . LEU   A 1 184 ? 8.274   -7.399  -19.071 1.00 21.21 ? 391 LEU   A CA  1 
ATOM   1256 C C   . LEU   A 1 184 ? 8.060   -7.709  -20.575 1.00 17.59 ? 391 LEU   A C   1 
ATOM   1257 O O   . LEU   A 1 184 ? 7.810   -8.891  -20.942 1.00 18.42 ? 391 LEU   A O   1 
ATOM   1258 C CB  . LEU   A 1 184 ? 7.142   -6.570  -18.493 1.00 20.97 ? 391 LEU   A CB  1 
ATOM   1259 C CG  . LEU   A 1 184 ? 5.768   -7.205  -18.640 1.00 20.98 ? 391 LEU   A CG  1 
ATOM   1260 C CD1 . LEU   A 1 184 ? 5.695   -8.551  -17.955 1.00 23.48 ? 391 LEU   A CD1 1 
ATOM   1261 C CD2 . LEU   A 1 184 ? 4.689   -6.271  -18.148 1.00 22.25 ? 391 LEU   A CD2 1 
ATOM   1262 N N   . GLN   A 1 185 ? 8.255   -6.687  -21.389 1.00 16.81 ? 392 GLN   A N   1 
ATOM   1263 C CA  . GLN   A 1 185 ? 8.207   -6.913  -22.853 1.00 17.69 ? 392 GLN   A CA  1 
ATOM   1264 C C   . GLN   A 1 185 ? 9.194   -8.000  -23.249 1.00 18.25 ? 392 GLN   A C   1 
ATOM   1265 O O   . GLN   A 1 185 ? 8.856   -8.919  -24.004 1.00 17.75 ? 392 GLN   A O   1 
ATOM   1266 C CB  . GLN   A 1 185 ? 8.505   -5.641  -23.610 1.00 17.95 ? 392 GLN   A CB  1 
ATOM   1267 C CG  . GLN   A 1 185 ? 7.481   -4.529  -23.440 1.00 18.93 ? 392 GLN   A CG  1 
ATOM   1268 C CD  . GLN   A 1 185 ? 7.919   -3.204  -24.018 1.00 21.90 ? 392 GLN   A CD  1 
ATOM   1269 O OE1 . GLN   A 1 185 ? 8.922   -3.085  -24.745 1.00 23.68 ? 392 GLN   A OE1 1 
ATOM   1270 N NE2 . GLN   A 1 185 ? 7.203   -2.154  -23.675 1.00 19.82 ? 392 GLN   A NE2 1 
ATOM   1271 N N   . ASP   A 1 186 ? 10.430  -7.918  -22.735 1.00 18.15 ? 393 ASP   A N   1 
ATOM   1272 C CA  A ASP   A 1 186 ? 11.477  -8.847  -23.201 0.50 19.67 ? 393 ASP   A CA  1 
ATOM   1273 C CA  B ASP   A 1 186 ? 11.505  -8.832  -23.169 0.50 18.80 ? 393 ASP   A CA  1 
ATOM   1274 C C   . ASP   A 1 186 ? 11.131  -10.268 -22.772 1.00 15.75 ? 393 ASP   A C   1 
ATOM   1275 O O   . ASP   A 1 186 ? 11.346  -11.211 -23.534 1.00 18.44 ? 393 ASP   A O   1 
ATOM   1276 C CB  A ASP   A 1 186 ? 12.844  -8.466  -22.641 0.50 20.65 ? 393 ASP   A CB  1 
ATOM   1277 C CB  B ASP   A 1 186 ? 12.834  -8.340  -22.571 0.50 18.20 ? 393 ASP   A CB  1 
ATOM   1278 C CG  A ASP   A 1 186 ? 13.961  -9.276  -23.274 0.50 23.67 ? 393 ASP   A CG  1 
ATOM   1279 C CG  B ASP   A 1 186 ? 13.389  -7.072  -23.214 0.50 18.96 ? 393 ASP   A CG  1 
ATOM   1280 O OD1 A ASP   A 1 186 ? 14.105  -9.201  -24.504 0.50 25.43 ? 393 ASP   A OD1 1 
ATOM   1281 O OD1 B ASP   A 1 186 ? 12.898  -6.722  -24.262 0.50 20.16 ? 393 ASP   A OD1 1 
ATOM   1282 O OD2 A ASP   A 1 186 ? 14.672  -9.985  -22.533 0.50 26.60 ? 393 ASP   A OD2 1 
ATOM   1283 O OD2 B ASP   A 1 186 ? 14.327  -6.412  -22.625 0.50 22.70 ? 393 ASP   A OD2 1 
ATOM   1284 N N   . VAL   A 1 187 ? 10.650  -10.433 -21.539 1.00 17.62 ? 394 VAL   A N   1 
ATOM   1285 C CA  . VAL   A 1 187 ? 10.305  -11.791 -21.062 1.00 18.39 ? 394 VAL   A CA  1 
ATOM   1286 C C   . VAL   A 1 187 ? 9.221   -12.435 -21.962 1.00 16.39 ? 394 VAL   A C   1 
ATOM   1287 O O   . VAL   A 1 187 ? 9.281   -13.617 -22.262 1.00 17.59 ? 394 VAL   A O   1 
ATOM   1288 C CB  . VAL   A 1 187 ? 9.892   -11.645 -19.582 1.00 20.89 ? 394 VAL   A CB  1 
ATOM   1289 C CG1 . VAL   A 1 187 ? 9.074   -12.800 -19.092 1.00 25.59 ? 394 VAL   A CG1 1 
ATOM   1290 C CG2 . VAL   A 1 187 ? 11.134  -11.408 -18.731 1.00 22.71 ? 394 VAL   A CG2 1 
ATOM   1291 N N   . LEU   A 1 188 ? 8.228   -11.631 -22.319 1.00 16.64 ? 395 LEU   A N   1 
ATOM   1292 C CA  . LEU   A 1 188 ? 7.098   -12.158 -23.117 1.00 16.71 ? 395 LEU   A CA  1 
ATOM   1293 C C   . LEU   A 1 188 ? 7.471   -12.373 -24.576 1.00 15.64 ? 395 LEU   A C   1 
ATOM   1294 O O   . LEU   A 1 188 ? 7.081   -13.404 -25.172 1.00 15.83 ? 395 LEU   A O   1 
ATOM   1295 C CB  . LEU   A 1 188 ? 5.929   -11.200 -22.975 1.00 17.65 ? 395 LEU   A CB  1 
ATOM   1296 C CG  . LEU   A 1 188 ? 5.329   -11.094 -21.552 1.00 18.53 ? 395 LEU   A CG  1 
ATOM   1297 C CD1 . LEU   A 1 188 ? 4.367   -9.918  -21.487 1.00 19.36 ? 395 LEU   A CD1 1 
ATOM   1298 C CD2 . LEU   A 1 188 ? 4.663   -12.420 -21.149 1.00 17.95 ? 395 LEU   A CD2 1 
ATOM   1299 N N   . HIS   A 1 189 ? 8.267   -11.460 -25.097 1.00 16.29 ? 396 HIS   A N   1 
ATOM   1300 C CA  . HIS   A 1 189 ? 8.888   -11.633 -26.436 1.00 16.02 ? 396 HIS   A CA  1 
ATOM   1301 C C   . HIS   A 1 189 ? 9.720   -12.917 -26.530 1.00 14.51 ? 396 HIS   A C   1 
ATOM   1302 O O   . HIS   A 1 189 ? 9.574   -13.728 -27.448 1.00 16.09 ? 396 HIS   A O   1 
ATOM   1303 C CB  . HIS   A 1 189 ? 9.623   -10.373 -26.813 1.00 16.08 ? 396 HIS   A CB  1 
ATOM   1304 C CG  . HIS   A 1 189 ? 10.318  -10.441 -28.130 1.00 15.36 ? 396 HIS   A CG  1 
ATOM   1305 N ND1 . HIS   A 1 189 ? 11.328  -9.548  -28.389 1.00 20.31 ? 396 HIS   A ND1 1 
ATOM   1306 C CD2 . HIS   A 1 189 ? 10.229  -11.250 -29.198 1.00 17.17 ? 396 HIS   A CD2 1 
ATOM   1307 C CE1 . HIS   A 1 189 ? 11.803  -9.836  -29.589 1.00 18.18 ? 396 HIS   A CE1 1 
ATOM   1308 N NE2 . HIS   A 1 189 ? 11.196  -10.860 -30.102 1.00 18.48 ? 396 HIS   A NE2 1 
ATOM   1309 N N   . GLU   A 1 190 ? 10.557  -13.133 -25.509 1.00 15.30 ? 397 GLU   A N   1 
ATOM   1310 C CA  . GLU   A 1 190 ? 11.360  -14.372 -25.436 1.00 16.56 ? 397 GLU   A CA  1 
ATOM   1311 C C   . GLU   A 1 190 ? 10.467  -15.605 -25.396 1.00 15.71 ? 397 GLU   A C   1 
ATOM   1312 O O   . GLU   A 1 190 ? 10.755  -16.559 -26.090 1.00 17.69 ? 397 GLU   A O   1 
ATOM   1313 C CB  . GLU   A 1 190 ? 12.253  -14.301 -24.203 1.00 18.27 ? 397 GLU   A CB  1 
ATOM   1314 C CG  . GLU   A 1 190 ? 13.067  -15.538 -24.033 1.00 20.27 ? 397 GLU   A CG  1 
ATOM   1315 C CD  . GLU   A 1 190 ? 13.992  -15.553 -22.824 1.00 22.71 ? 397 GLU   A CD  1 
ATOM   1316 O OE1 . GLU   A 1 190 ? 13.688  -14.954 -21.761 1.00 24.50 ? 397 GLU   A OE1 1 
ATOM   1317 O OE2 . GLU   A 1 190 ? 15.029  -16.226 -22.964 1.00 27.28 ? 397 GLU   A OE2 1 
ATOM   1318 N N   . ALA   A 1 191 ? 9.361   -15.555 -24.647 1.00 16.14 ? 398 ALA   A N   1 
ATOM   1319 C CA  . ALA   A 1 191 ? 8.452   -16.724 -24.652 1.00 17.93 ? 398 ALA   A CA  1 
ATOM   1320 C C   . ALA   A 1 191 ? 7.868   -16.993 -26.031 1.00 15.53 ? 398 ALA   A C   1 
ATOM   1321 O O   . ALA   A 1 191 ? 7.841   -18.113 -26.470 1.00 17.26 ? 398 ALA   A O   1 
ATOM   1322 C CB  . ALA   A 1 191 ? 7.352   -16.503 -23.659 1.00 18.76 ? 398 ALA   A CB  1 
ATOM   1323 N N   . LEU   A 1 192 ? 7.416   -15.944 -26.743 1.00 15.71 ? 399 LEU   A N   1 
ATOM   1324 C CA  . LEU   A 1 192 ? 6.913   -16.145 -28.110 1.00 16.70 ? 399 LEU   A CA  1 
ATOM   1325 C C   . LEU   A 1 192 ? 8.010   -16.746 -29.008 1.00 14.89 ? 399 LEU   A C   1 
ATOM   1326 O O   . LEU   A 1 192 ? 7.742   -17.688 -29.745 1.00 16.28 ? 399 LEU   A O   1 
ATOM   1327 C CB  . LEU   A 1 192 ? 6.431   -14.806 -28.634 1.00 15.94 ? 399 LEU   A CB  1 
ATOM   1328 C CG  . LEU   A 1 192 ? 5.886   -14.832 -30.055 1.00 16.53 ? 399 LEU   A CG  1 
ATOM   1329 C CD1 . LEU   A 1 192 ? 4.605   -15.618 -30.160 1.00 18.00 ? 399 LEU   A CD1 1 
ATOM   1330 C CD2 . LEU   A 1 192 ? 5.727   -13.398 -30.615 1.00 16.53 ? 399 LEU   A CD2 1 
ATOM   1331 N N   . GLN   A 1 193 ? 9.204   -16.176 -28.942 1.00 17.31 ? 400 GLN   A N   1 
ATOM   1332 C CA  . GLN   A 1 193 ? 10.306  -16.624 -29.822 1.00 16.99 ? 400 GLN   A CA  1 
ATOM   1333 C C   . GLN   A 1 193 ? 10.699  -18.096 -29.517 1.00 16.89 ? 400 GLN   A C   1 
ATOM   1334 O O   . GLN   A 1 193 ? 10.845  -18.888 -30.441 1.00 17.68 ? 400 GLN   A O   1 
ATOM   1335 C CB  . GLN   A 1 193 ? 11.536  -15.749 -29.669 1.00 18.95 ? 400 GLN   A CB  1 
ATOM   1336 C CG  . GLN   A 1 193 ? 12.589  -16.071 -30.708 1.00 21.58 ? 400 GLN   A CG  1 
ATOM   1337 C CD  . GLN   A 1 193 ? 12.035  -15.990 -32.118 1.00 21.92 ? 400 GLN   A CD  1 
ATOM   1338 O OE1 . GLN   A 1 193 ? 11.976  -14.897 -32.665 1.00 22.42 ? 400 GLN   A OE1 1 
ATOM   1339 N NE2 . GLN   A 1 193 ? 11.691  -17.144 -32.736 1.00 22.05 ? 400 GLN   A NE2 1 
ATOM   1340 N N   . ASP   A 1 194 ? 10.735  -18.444 -28.219 1.00 17.51 ? 401 ASP   A N   1 
ATOM   1341 C CA  A ASP   A 1 194 ? 11.075  -19.828 -27.808 0.50 18.52 ? 401 ASP   A CA  1 
ATOM   1342 C CA  B ASP   A 1 194 ? 11.026  -19.824 -27.757 0.50 20.30 ? 401 ASP   A CA  1 
ATOM   1343 C C   . ASP   A 1 194 ? 9.939   -20.759 -28.259 1.00 18.83 ? 401 ASP   A C   1 
ATOM   1344 O O   . ASP   A 1 194 ? 10.196  -21.892 -28.786 1.00 20.79 ? 401 ASP   A O   1 
ATOM   1345 C CB  A ASP   A 1 194 ? 11.421  -19.871 -26.309 0.50 17.79 ? 401 ASP   A CB  1 
ATOM   1346 C CB  B ASP   A 1 194 ? 11.003  -19.940 -26.230 0.50 22.60 ? 401 ASP   A CB  1 
ATOM   1347 C CG  A ASP   A 1 194 ? 11.751  -21.253 -25.763 0.50 17.98 ? 401 ASP   A CG  1 
ATOM   1348 C CG  B ASP   A 1 194 ? 12.246  -19.407 -25.564 0.50 25.74 ? 401 ASP   A CG  1 
ATOM   1349 O OD1 A ASP   A 1 194 ? 12.864  -21.774 -26.043 0.50 22.18 ? 401 ASP   A OD1 1 
ATOM   1350 O OD1 B ASP   A 1 194 ? 13.193  -19.068 -26.303 0.50 28.20 ? 401 ASP   A OD1 1 
ATOM   1351 O OD2 A ASP   A 1 194 ? 10.917  -21.793 -25.056 0.50 19.89 ? 401 ASP   A OD2 1 
ATOM   1352 O OD2 B ASP   A 1 194 ? 12.266  -19.348 -24.317 0.50 28.24 ? 401 ASP   A OD2 1 
ATOM   1353 N N   . TYR   A 1 195 ? 8.690   -20.351 -28.073 1.00 18.87 ? 402 TYR   A N   1 
ATOM   1354 C CA  . TYR   A 1 195 ? 7.551   -21.154 -28.557 1.00 18.66 ? 402 TYR   A CA  1 
ATOM   1355 C C   . TYR   A 1 195 ? 7.698   -21.414 -30.045 1.00 18.86 ? 402 TYR   A C   1 
ATOM   1356 O O   . TYR   A 1 195 ? 7.586   -22.556 -30.531 1.00 19.65 ? 402 TYR   A O   1 
ATOM   1357 C CB  . TYR   A 1 195 ? 6.189   -20.498 -28.223 1.00 17.88 ? 402 TYR   A CB  1 
ATOM   1358 C CG  . TYR   A 1 195 ? 5.016   -21.268 -28.773 1.00 18.75 ? 402 TYR   A CG  1 
ATOM   1359 C CD1 . TYR   A 1 195 ? 4.532   -22.373 -28.072 1.00 20.67 ? 402 TYR   A CD1 1 
ATOM   1360 C CD2 . TYR   A 1 195 ? 4.447   -20.998 -29.999 1.00 19.66 ? 402 TYR   A CD2 1 
ATOM   1361 C CE1 . TYR   A 1 195 ? 3.532   -23.163 -28.611 1.00 23.15 ? 402 TYR   A CE1 1 
ATOM   1362 C CE2 . TYR   A 1 195 ? 3.400   -21.726 -30.532 1.00 21.21 ? 402 TYR   A CE2 1 
ATOM   1363 C CZ  . TYR   A 1 195 ? 2.932   -22.817 -29.814 1.00 23.10 ? 402 TYR   A CZ  1 
ATOM   1364 O OH  . TYR   A 1 195 ? 1.896   -23.548 -30.309 1.00 26.84 ? 402 TYR   A OH  1 
ATOM   1365 N N   . GLU   A 1 196 ? 7.930   -20.358 -30.836 1.00 17.21 ? 403 GLU   A N   1 
ATOM   1366 C CA  . GLU   A 1 196 ? 7.992   -20.523 -32.309 1.00 17.68 ? 403 GLU   A CA  1 
ATOM   1367 C C   . GLU   A 1 196 ? 9.222   -21.331 -32.743 1.00 18.23 ? 403 GLU   A C   1 
ATOM   1368 O O   . GLU   A 1 196 ? 9.083   -22.073 -33.723 1.00 18.73 ? 403 GLU   A O   1 
ATOM   1369 C CB  . GLU   A 1 196 ? 8.008   -19.149 -32.996 1.00 17.51 ? 403 GLU   A CB  1 
ATOM   1370 C CG  . GLU   A 1 196 ? 6.739   -18.354 -32.746 1.00 17.23 ? 403 GLU   A CG  1 
ATOM   1371 C CD  . GLU   A 1 196 ? 5.447   -18.948 -33.227 1.00 18.46 ? 403 GLU   A CD  1 
ATOM   1372 O OE1 . GLU   A 1 196 ? 5.475   -19.906 -34.023 1.00 19.89 ? 403 GLU   A OE1 1 
ATOM   1373 O OE2 . GLU   A 1 196 ? 4.372   -18.378 -32.835 1.00 17.90 ? 403 GLU   A OE2 1 
ATOM   1374 N N   . ALA   A 1 197 ? 10.315  -21.211 -31.996 1.00 18.55 ? 404 ALA   A N   1 
ATOM   1375 C CA  . ALA   A 1 197 ? 11.540  -21.936 -32.376 1.00 20.80 ? 404 ALA   A CA  1 
ATOM   1376 C C   . ALA   A 1 197 ? 11.296  -23.441 -32.239 1.00 22.92 ? 404 ALA   A C   1 
ATOM   1377 O O   . ALA   A 1 197 ? 11.772  -24.213 -33.092 1.00 27.19 ? 404 ALA   A O   1 
ATOM   1378 C CB  . ALA   A 1 197 ? 12.693  -21.443 -31.548 1.00 21.54 ? 404 ALA   A CB  1 
ATOM   1379 N N   . GLY   A 1 198 ? 10.528  -23.813 -31.235 1.00 21.04 ? 405 GLY   A N   1 
ATOM   1380 C CA  . GLY   A 1 198 ? 10.210  -25.234 -30.970 1.00 22.42 ? 405 GLY   A CA  1 
ATOM   1381 C C   . GLY   A 1 198 ? 9.086   -25.795 -31.792 1.00 26.23 ? 405 GLY   A C   1 
ATOM   1382 O O   . GLY   A 1 198 ? 9.158   -26.968 -32.265 1.00 28.13 ? 405 GLY   A O   1 
ATOM   1383 N N   . GLN   A 1 199 ? 8.023   -25.039 -32.014 1.00 22.43 ? 406 GLN   A N   1 
ATOM   1384 C CA  A GLN   A 1 199 ? 6.779   -25.593 -32.580 0.50 22.07 ? 406 GLN   A CA  1 
ATOM   1385 C CA  B GLN   A 1 199 ? 6.753   -25.553 -32.577 0.50 21.33 ? 406 GLN   A CA  1 
ATOM   1386 C C   . GLN   A 1 199 ? 6.730   -25.333 -34.093 1.00 21.00 ? 406 GLN   A C   1 
ATOM   1387 O O   . GLN   A 1 199 ? 5.975   -26.006 -34.789 1.00 22.86 ? 406 GLN   A O   1 
ATOM   1388 C CB  A GLN   A 1 199 ? 5.606   -25.029 -31.778 0.50 24.85 ? 406 GLN   A CB  1 
ATOM   1389 C CB  B GLN   A 1 199 ? 5.565   -24.855 -31.906 0.50 23.03 ? 406 GLN   A CB  1 
ATOM   1390 C CG  A GLN   A 1 199 ? 5.767   -25.255 -30.271 0.50 25.58 ? 406 GLN   A CG  1 
ATOM   1391 C CG  B GLN   A 1 199 ? 4.186   -25.343 -32.351 0.50 23.10 ? 406 GLN   A CG  1 
ATOM   1392 C CD  A GLN   A 1 199 ? 5.941   -26.714 -29.916 0.50 29.02 ? 406 GLN   A CD  1 
ATOM   1393 C CD  B GLN   A 1 199 ? 3.683   -26.614 -31.684 0.50 25.16 ? 406 GLN   A CD  1 
ATOM   1394 O OE1 A GLN   A 1 199 ? 5.169   -27.565 -30.333 0.50 34.85 ? 406 GLN   A OE1 1 
ATOM   1395 O OE1 B GLN   A 1 199 ? 4.269   -27.117 -30.733 0.50 27.49 ? 406 GLN   A OE1 1 
ATOM   1396 N NE2 A GLN   A 1 199 ? 6.997   -27.013 -29.178 0.50 31.36 ? 406 GLN   A NE2 1 
ATOM   1397 N NE2 B GLN   A 1 199 ? 2.548   -27.100 -32.153 0.50 30.22 ? 406 GLN   A NE2 1 
ATOM   1398 N N   . HIS   A 1 200 ? 7.485   -24.333 -34.590 1.00 19.53 ? 407 HIS   A N   1 
ATOM   1399 C CA  . HIS   A 1 200 ? 7.364   -23.897 -35.989 1.00 18.80 ? 407 HIS   A CA  1 
ATOM   1400 C C   . HIS   A 1 200 ? 8.745   -23.771 -36.629 1.00 22.97 ? 407 HIS   A C   1 
ATOM   1401 O O   . HIS   A 1 200 ? 9.069   -22.738 -37.270 1.00 20.22 ? 407 HIS   A O   1 
ATOM   1402 C CB  . HIS   A 1 200 ? 6.565   -22.581 -36.073 1.00 18.11 ? 407 HIS   A CB  1 
ATOM   1403 C CG  . HIS   A 1 200 ? 5.112   -22.839 -35.962 1.00 17.67 ? 407 HIS   A CG  1 
ATOM   1404 N ND1 . HIS   A 1 200 ? 4.373   -23.292 -37.030 1.00 19.23 ? 407 HIS   A ND1 1 
ATOM   1405 C CD2 . HIS   A 1 200 ? 4.279   -22.766 -34.898 1.00 18.62 ? 407 HIS   A CD2 1 
ATOM   1406 C CE1 . HIS   A 1 200 ? 3.129   -23.448 -36.641 1.00 20.17 ? 407 HIS   A CE1 1 
ATOM   1407 N NE2 . HIS   A 1 200 ? 3.033   -23.130 -35.331 1.00 19.05 ? 407 HIS   A NE2 1 
ATOM   1408 N N   . MET   A 1 201 ? 9.462   -24.882 -36.661 1.00 23.09 ? 408 MET   A N   1 
ATOM   1409 C CA  . MET   A 1 201 ? 10.781  -24.895 -37.309 1.00 25.29 ? 408 MET   A CA  1 
ATOM   1410 C C   . MET   A 1 201 ? 10.691  -24.649 -38.813 1.00 22.95 ? 408 MET   A C   1 
ATOM   1411 O O   . MET   A 1 201 ? 11.708  -24.228 -39.376 1.00 25.26 ? 408 MET   A O   1 
ATOM   1412 C CB  . MET   A 1 201 ? 11.441  -26.237 -37.040 1.00 28.65 ? 408 MET   A CB  1 
ATOM   1413 C CG  . MET   A 1 201 ? 11.924  -26.296 -35.635 1.00 31.20 ? 408 MET   A CG  1 
ATOM   1414 S SD  . MET   A 1 201 ? 12.639  -27.910 -35.219 1.00 41.12 ? 408 MET   A SD  1 
ATOM   1415 C CE  . MET   A 1 201 ? 11.208  -28.962 -35.485 1.00 38.61 ? 408 MET   A CE  1 
ATOM   1416 N N   . GLU   A 1 202 ? 9.560   -24.897 -39.453 1.00 21.71 ? 409 GLU   A N   1 
ATOM   1417 C CA  . GLU   A 1 202 ? 9.370   -24.683 -40.900 1.00 21.22 ? 409 GLU   A CA  1 
ATOM   1418 C C   . GLU   A 1 202 ? 9.461   -23.182 -41.239 1.00 22.07 ? 409 GLU   A C   1 
ATOM   1419 O O   . GLU   A 1 202 ? 9.660   -22.861 -42.430 1.00 23.97 ? 409 GLU   A O   1 
ATOM   1420 C CB  . GLU   A 1 202 ? 8.050   -25.242 -41.413 1.00 22.40 ? 409 GLU   A CB  1 
ATOM   1421 C CG  . GLU   A 1 202 ? 6.816   -24.418 -41.103 1.00 24.21 ? 409 GLU   A CG  1 
ATOM   1422 C CD  . GLU   A 1 202 ? 6.353   -24.401 -39.671 1.00 23.16 ? 409 GLU   A CD  1 
ATOM   1423 O OE1 . GLU   A 1 202 ? 6.860   -25.188 -38.808 1.00 22.72 ? 409 GLU   A OE1 1 
ATOM   1424 O OE2 . GLU   A 1 202 ? 5.417   -23.616 -39.422 1.00 22.28 ? 409 GLU   A OE2 1 
ATOM   1425 N N   . ASP   A 1 203 ? 9.206   -22.311 -40.256 1.00 21.04 ? 410 ASP   A N   1 
ATOM   1426 C CA  . ASP   A 1 203 ? 9.193   -20.847 -40.538 1.00 20.90 ? 410 ASP   A CA  1 
ATOM   1427 C C   . ASP   A 1 203 ? 9.986   -20.149 -39.446 1.00 18.87 ? 410 ASP   A C   1 
ATOM   1428 O O   . ASP   A 1 203 ? 9.440   -19.756 -38.409 1.00 18.07 ? 410 ASP   A O   1 
ATOM   1429 C CB  . ASP   A 1 203 ? 7.783   -20.260 -40.655 1.00 20.06 ? 410 ASP   A CB  1 
ATOM   1430 C CG  . ASP   A 1 203 ? 7.783   -18.746 -40.867 1.00 17.86 ? 410 ASP   A CG  1 
ATOM   1431 O OD1 . ASP   A 1 203 ? 8.897   -18.232 -41.052 1.00 18.71 ? 410 ASP   A OD1 1 
ATOM   1432 O OD2 . ASP   A 1 203 ? 6.689   -18.190 -40.899 1.00 21.45 ? 410 ASP   A OD2 1 
ATOM   1433 N N   . PRO   A 1 204 ? 11.314  -19.965 -39.587 1.00 20.38 ? 411 PRO   A N   1 
ATOM   1434 C CA  . PRO   A 1 204 ? 12.133  -19.379 -38.542 1.00 19.60 ? 411 PRO   A CA  1 
ATOM   1435 C C   . PRO   A 1 204 ? 11.814  -17.911 -38.245 1.00 19.59 ? 411 PRO   A C   1 
ATOM   1436 O O   . PRO   A 1 204 ? 12.280  -17.476 -37.213 1.00 24.66 ? 411 PRO   A O   1 
ATOM   1437 C CB  . PRO   A 1 204 ? 13.569  -19.389 -39.085 1.00 24.71 ? 411 PRO   A CB  1 
ATOM   1438 C CG  . PRO   A 1 204 ? 13.385  -19.607 -40.562 1.00 25.03 ? 411 PRO   A CG  1 
ATOM   1439 C CD  . PRO   A 1 204 ? 12.108  -20.398 -40.757 1.00 24.20 ? 411 PRO   A CD  1 
ATOM   1440 N N   . ARG   A 1 205 ? 10.951  -17.313 -39.048 1.00 19.79 ? 412 ARG   A N   1 
ATOM   1441 C CA  . ARG   A 1 205 ? 10.561  -15.880 -38.823 1.00 20.41 ? 412 ARG   A CA  1 
ATOM   1442 C C   . ARG   A 1 205 ? 9.096   -15.762 -38.372 1.00 19.95 ? 412 ARG   A C   1 
ATOM   1443 O O   . ARG   A 1 205 ? 8.538   -14.693 -38.383 1.00 18.16 ? 412 ARG   A O   1 
ATOM   1444 C CB  . ARG   A 1 205 ? 11.003  -15.121 -40.077 1.00 24.95 ? 412 ARG   A CB  1 
ATOM   1445 C CG  . ARG   A 1 205 ? 12.506  -14.872 -40.007 1.00 26.94 ? 412 ARG   A CG  1 
ATOM   1446 C CD  . ARG   A 1 205 ? 13.093  -13.905 -41.017 1.00 31.89 ? 412 ARG   A CD  1 
ATOM   1447 N NE  . ARG   A 1 205 ? 12.772  -14.396 -42.327 1.00 29.62 ? 412 ARG   A NE  1 
ATOM   1448 C CZ  . ARG   A 1 205 ? 13.440  -15.405 -42.937 1.00 30.88 ? 412 ARG   A CZ  1 
ATOM   1449 N NH1 . ARG   A 1 205 ? 14.489  -15.990 -42.378 1.00 30.82 ? 412 ARG   A NH1 1 
ATOM   1450 N NH2 . ARG   A 1 205 ? 13.029  -15.834 -44.097 1.00 27.51 ? 412 ARG   A NH2 1 
ATOM   1451 N N   . ARG   A 1 206 ? 8.457   -16.849 -37.956 1.00 17.83 ? 413 ARG   A N   1 
ATOM   1452 C CA  . ARG   A 1 206 ? 7.035   -16.779 -37.564 1.00 14.83 ? 413 ARG   A CA  1 
ATOM   1453 C C   . ARG   A 1 206 ? 6.836   -15.862 -36.343 1.00 14.09 ? 413 ARG   A C   1 
ATOM   1454 O O   . ARG   A 1 206 ? 5.800   -15.170 -36.312 1.00 13.87 ? 413 ARG   A O   1 
ATOM   1455 C CB  . ARG   A 1 206 ? 6.482   -18.200 -37.302 1.00 15.03 ? 413 ARG   A CB  1 
ATOM   1456 C CG  . ARG   A 1 206 ? 4.984   -18.222 -37.006 1.00 16.33 ? 413 ARG   A CG  1 
ATOM   1457 C CD  . ARG   A 1 206 ? 4.463   -19.675 -36.931 1.00 14.87 ? 413 ARG   A CD  1 
ATOM   1458 N NE  . ARG   A 1 206 ? 3.104   -19.790 -36.467 1.00 16.10 ? 413 ARG   A NE  1 
ATOM   1459 C CZ  . ARG   A 1 206 ? 2.045   -19.766 -37.220 1.00 16.63 ? 413 ARG   A CZ  1 
ATOM   1460 N NH1 . ARG   A 1 206 ? 2.091   -19.606 -38.538 1.00 18.37 ? 413 ARG   A NH1 1 
ATOM   1461 N NH2 . ARG   A 1 206 ? 0.856   -19.919 -36.655 1.00 18.51 ? 413 ARG   A NH2 1 
ATOM   1462 N N   . ALA   A 1 207 ? 7.723   -15.848 -35.363 1.00 14.41 ? 414 ALA   A N   1 
ATOM   1463 C CA  . ALA   A 1 207 ? 7.535   -14.943 -34.216 1.00 14.10 ? 414 ALA   A CA  1 
ATOM   1464 C C   . ALA   A 1 207 ? 7.441   -13.496 -34.712 1.00 14.07 ? 414 ALA   A C   1 
ATOM   1465 O O   . ALA   A 1 207 ? 6.547   -12.773 -34.281 1.00 14.18 ? 414 ALA   A O   1 
ATOM   1466 C CB  . ALA   A 1 207 ? 8.592   -15.080 -33.166 1.00 16.27 ? 414 ALA   A CB  1 
ATOM   1467 N N   . GLY   A 1 208 ? 8.361   -13.093 -35.587 1.00 14.54 ? 415 GLY   A N   1 
ATOM   1468 C CA  . GLY   A 1 208 ? 8.313   -11.723 -36.120 1.00 13.40 ? 415 GLY   A CA  1 
ATOM   1469 C C   . GLY   A 1 208 ? 7.070   -11.458 -36.943 1.00 14.29 ? 415 GLY   A C   1 
ATOM   1470 O O   . GLY   A 1 208 ? 6.502   -10.328 -36.843 1.00 14.43 ? 415 GLY   A O   1 
ATOM   1471 N N   . LYS   A 1 209 ? 6.576   -12.418 -37.703 1.00 14.40 ? 416 LYS   A N   1 
ATOM   1472 C CA  . LYS   A 1 209 ? 5.283   -12.275 -38.387 1.00 14.50 ? 416 LYS   A CA  1 
ATOM   1473 C C   . LYS   A 1 209 ? 4.183   -11.995 -37.355 1.00 14.45 ? 416 LYS   A C   1 
ATOM   1474 O O   . LYS   A 1 209 ? 3.278   -11.190 -37.622 1.00 15.29 ? 416 LYS   A O   1 
ATOM   1475 C CB  . LYS   A 1 209 ? 5.010   -13.502 -39.252 1.00 17.54 ? 416 LYS   A CB  1 
ATOM   1476 C CG  . LYS   A 1 209 ? 5.950   -13.649 -40.416 1.00 18.66 ? 416 LYS   A CG  1 
ATOM   1477 C CD  . LYS   A 1 209 ? 5.734   -14.893 -41.218 1.00 24.15 ? 416 LYS   A CD  1 
ATOM   1478 C CE  . LYS   A 1 209 ? 6.963   -15.116 -42.088 1.00 25.86 ? 416 LYS   A CE  1 
ATOM   1479 N NZ  . LYS   A 1 209 ? 6.856   -16.329 -42.900 1.00 29.58 ? 416 LYS   A NZ  1 
ATOM   1480 N N   . MET   A 1 210 ? 4.175   -12.735 -36.233 1.00 13.99 ? 417 MET   A N   1 
ATOM   1481 C CA  . MET   A 1 210 ? 3.170   -12.468 -35.238 1.00 14.76 ? 417 MET   A CA  1 
ATOM   1482 C C   . MET   A 1 210 ? 3.324   -11.065 -34.655 1.00 13.68 ? 417 MET   A C   1 
ATOM   1483 O O   . MET   A 1 210 ? 2.315   -10.371 -34.526 1.00 13.44 ? 417 MET   A O   1 
ATOM   1484 C CB  . MET   A 1 210 ? 3.234   -13.543 -34.141 1.00 16.13 ? 417 MET   A CB  1 
ATOM   1485 C CG  . MET   A 1 210 ? 2.901   -14.949 -34.644 1.00 15.88 ? 417 MET   A CG  1 
ATOM   1486 S SD  . MET   A 1 210 ? 1.149   -15.056 -35.000 1.00 18.74 ? 417 MET   A SD  1 
ATOM   1487 C CE  . MET   A 1 210 ? 1.122   -16.631 -35.850 1.00 18.71 ? 417 MET   A CE  1 
ATOM   1488 N N   . LEU   A 1 211 ? 4.544   -10.626 -34.383 1.00 12.99 ? 418 LEU   A N   1 
ATOM   1489 C CA  . LEU   A 1 211 ? 4.737   -9.242  -33.912 1.00 12.94 ? 418 LEU   A CA  1 
ATOM   1490 C C   . LEU   A 1 211 ? 4.235   -8.246  -34.953 1.00 13.43 ? 418 LEU   A C   1 
ATOM   1491 O O   . LEU   A 1 211 ? 3.726   -7.217  -34.585 1.00 13.64 ? 418 LEU   A O   1 
ATOM   1492 C CB  . LEU   A 1 211 ? 6.194   -9.006  -33.555 1.00 13.67 ? 418 LEU   A CB  1 
ATOM   1493 C CG  . LEU   A 1 211 ? 6.751   -9.868  -32.432 1.00 13.19 ? 418 LEU   A CG  1 
ATOM   1494 C CD1 . LEU   A 1 211 ? 8.228   -9.666  -32.315 1.00 14.09 ? 418 LEU   A CD1 1 
ATOM   1495 C CD2 . LEU   A 1 211 ? 6.035   -9.623  -31.107 1.00 13.80 ? 418 LEU   A CD2 1 
ATOM   1496 N N   . MET   A 1 212 ? 4.369   -8.556  -36.236 1.00 13.32 ? 419 MET   A N   1 
ATOM   1497 C CA  . MET   A 1 212 ? 3.957   -7.604  -37.299 1.00 14.38 ? 419 MET   A CA  1 
ATOM   1498 C C   . MET   A 1 212 ? 2.442   -7.515  -37.406 1.00 13.20 ? 419 MET   A C   1 
ATOM   1499 O O   . MET   A 1 212 ? 1.972   -6.641  -38.156 1.00 14.91 ? 419 MET   A O   1 
ATOM   1500 C CB  . MET   A 1 212 ? 4.576   -8.021  -38.630 1.00 15.15 ? 419 MET   A CB  1 
ATOM   1501 C CG  . MET   A 1 212 ? 6.086   -7.661  -38.636 1.00 15.53 ? 419 MET   A CG  1 
ATOM   1502 S SD  . MET   A 1 212 ? 6.980   -8.364  -40.062 1.00 20.16 ? 419 MET   A SD  1 
ATOM   1503 C CE  . MET   A 1 212 ? 6.247   -7.480  -41.421 1.00 21.53 ? 419 MET   A CE  1 
ATOM   1504 N N   . THR   A 1 213 ? 1.661   -8.302  -36.657 1.00 13.93 ? 420 THR   A N   1 
ATOM   1505 C CA  . THR   A 1 213 ? 0.186   -8.193  -36.610 1.00 14.50 ? 420 THR   A CA  1 
ATOM   1506 C C   . THR   A 1 213 ? -0.220  -7.097  -35.611 1.00 14.25 ? 420 THR   A C   1 
ATOM   1507 O O   . THR   A 1 213 ? -1.410  -6.676  -35.564 1.00 14.29 ? 420 THR   A O   1 
ATOM   1508 C CB  . THR   A 1 213 ? -0.522  -9.510  -36.280 1.00 15.19 ? 420 THR   A CB  1 
ATOM   1509 O OG1 . THR   A 1 213 ? -0.276  -9.877  -34.926 1.00 15.13 ? 420 THR   A OG1 1 
ATOM   1510 C CG2 . THR   A 1 213 ? -0.143  -10.637 -37.213 1.00 15.43 ? 420 THR   A CG2 1 
ATOM   1511 N N   . LEU   A 1 214 ? 0.680   -6.662  -34.744 1.00 13.40 ? 421 LEU   A N   1 
ATOM   1512 C CA  . LEU   A 1 214 ? 0.319   -5.739  -33.633 1.00 13.71 ? 421 LEU   A CA  1 
ATOM   1513 C C   . LEU   A 1 214 ? -0.032  -4.344  -34.131 1.00 14.07 ? 421 LEU   A C   1 
ATOM   1514 O O   . LEU   A 1 214 ? -0.922  -3.747  -33.528 1.00 13.83 ? 421 LEU   A O   1 
ATOM   1515 C CB  . LEU   A 1 214 ? 1.426   -5.730  -32.571 1.00 14.53 ? 421 LEU   A CB  1 
ATOM   1516 C CG  . LEU   A 1 214 ? 1.602   -7.043  -31.824 1.00 15.13 ? 421 LEU   A CG  1 
ATOM   1517 C CD1 . LEU   A 1 214 ? 2.841   -6.957  -30.951 1.00 17.17 ? 421 LEU   A CD1 1 
ATOM   1518 C CD2 . LEU   A 1 214 ? 0.368   -7.377  -31.018 1.00 17.39 ? 421 LEU   A CD2 1 
ATOM   1519 N N   . PRO   A 1 215 ? 0.542   -3.796  -35.224 1.00 13.18 ? 422 PRO   A N   1 
ATOM   1520 C CA  . PRO   A 1 215 ? 0.080   -2.466  -35.661 1.00 12.76 ? 422 PRO   A CA  1 
ATOM   1521 C C   . PRO   A 1 215 ? -1.425  -2.435  -35.995 1.00 13.17 ? 422 PRO   A C   1 
ATOM   1522 O O   . PRO   A 1 215 ? -2.058  -1.425  -35.672 1.00 13.77 ? 422 PRO   A O   1 
ATOM   1523 C CB  . PRO   A 1 215 ? 0.994   -2.150  -36.851 1.00 12.91 ? 422 PRO   A CB  1 
ATOM   1524 C CG  . PRO   A 1 215 ? 2.295   -2.861  -36.508 1.00 13.77 ? 422 PRO   A CG  1 
ATOM   1525 C CD  . PRO   A 1 215 ? 1.818   -4.154  -35.884 1.00 13.34 ? 422 PRO   A CD  1 
ATOM   1526 N N   . LEU   A 1 216 ? -1.923  -3.418  -36.718 1.00 13.05 ? 423 LEU   A N   1 
ATOM   1527 C CA  . LEU   A 1 216 ? -3.366  -3.399  -37.048 1.00 14.04 ? 423 LEU   A CA  1 
ATOM   1528 C C   . LEU   A 1 216 ? -4.206  -3.505  -35.802 1.00 15.90 ? 423 LEU   A C   1 
ATOM   1529 O O   . LEU   A 1 216 ? -5.286  -2.897  -35.742 1.00 16.13 ? 423 LEU   A O   1 
ATOM   1530 C CB  . LEU   A 1 216 ? -3.690  -4.500  -38.052 1.00 14.79 ? 423 LEU   A CB  1 
ATOM   1531 C CG  . LEU   A 1 216 ? -5.156  -4.537  -38.514 1.00 16.57 ? 423 LEU   A CG  1 
ATOM   1532 C CD1 . LEU   A 1 216 ? -5.625  -3.204  -39.121 1.00 16.72 ? 423 LEU   A CD1 1 
ATOM   1533 C CD2 . LEU   A 1 216 ? -5.318  -5.660  -39.511 1.00 17.72 ? 423 LEU   A CD2 1 
ATOM   1534 N N   . LEU   A 1 217 ? -3.753  -4.263  -34.818 1.00 14.59 ? 424 LEU   A N   1 
ATOM   1535 C CA  . LEU   A 1 217 ? -4.497  -4.328  -33.559 1.00 13.81 ? 424 LEU   A CA  1 
ATOM   1536 C C   . LEU   A 1 217 ? -4.531  -2.952  -32.902 1.00 15.48 ? 424 LEU   A C   1 
ATOM   1537 O O   . LEU   A 1 217 ? -5.608  -2.552  -32.376 1.00 16.61 ? 424 LEU   A O   1 
ATOM   1538 C CB  . LEU   A 1 217 ? -3.842  -5.384  -32.659 1.00 14.02 ? 424 LEU   A CB  1 
ATOM   1539 C CG  . LEU   A 1 217 ? -4.473  -5.579  -31.286 1.00 15.21 ? 424 LEU   A CG  1 
ATOM   1540 C CD1 . LEU   A 1 217 ? -5.909  -6.038  -31.373 1.00 16.21 ? 424 LEU   A CD1 1 
ATOM   1541 C CD2 . LEU   A 1 217 ? -3.659  -6.521  -30.453 1.00 14.47 ? 424 LEU   A CD2 1 
ATOM   1542 N N   . ARG   A 1 218 ? -3.406  -2.250  -32.825 1.00 14.62 ? 425 ARG   A N   1 
ATOM   1543 C CA  . ARG   A 1 218 ? -3.332  -0.877  -32.263 1.00 14.83 ? 425 ARG   A CA  1 
ATOM   1544 C C   . ARG   A 1 218 ? -4.293  0.036   -33.033 1.00 16.17 ? 425 ARG   A C   1 
ATOM   1545 O O   . ARG   A 1 218 ? -5.067  0.742   -32.375 1.00 17.25 ? 425 ARG   A O   1 
ATOM   1546 C CB  . ARG   A 1 218 ? -1.892  -0.392  -32.345 1.00 15.80 ? 425 ARG   A CB  1 
ATOM   1547 C CG  . ARG   A 1 218 ? -1.643  1.032   -31.867 1.00 17.69 ? 425 ARG   A CG  1 
ATOM   1548 C CD  . ARG   A 1 218 ? -1.747  1.266   -30.370 1.00 17.73 ? 425 ARG   A CD  1 
ATOM   1549 N NE  . ARG   A 1 218 ? -0.928  0.382   -29.575 1.00 15.86 ? 425 ARG   A NE  1 
ATOM   1550 C CZ  . ARG   A 1 218 ? 0.368   0.586   -29.249 1.00 14.47 ? 425 ARG   A CZ  1 
ATOM   1551 N NH1 . ARG   A 1 218 ? 0.961   1.723   -29.624 1.00 15.58 ? 425 ARG   A NH1 1 
ATOM   1552 N NH2 . ARG   A 1 218 ? 1.001   -0.352  -28.603 1.00 15.57 ? 425 ARG   A NH2 1 
ATOM   1553 N N   . GLN   A 1 219 ? -4.253  -0.015  -34.359 1.00 15.71 ? 426 GLN   A N   1 
ATOM   1554 C CA  . GLN   A 1 219 ? -5.109  0.845   -35.224 1.00 16.50 ? 426 GLN   A CA  1 
ATOM   1555 C C   . GLN   A 1 219 ? -6.565  0.545   -34.893 1.00 17.42 ? 426 GLN   A C   1 
ATOM   1556 O O   . GLN   A 1 219 ? -7.339  1.539   -34.763 1.00 19.37 ? 426 GLN   A O   1 
ATOM   1557 C CB  . GLN   A 1 219 ? -4.776  0.531   -36.665 1.00 16.46 ? 426 GLN   A CB  1 
ATOM   1558 C CG  . GLN   A 1 219 ? -5.612  1.312   -37.681 1.00 19.53 ? 426 GLN   A CG  1 
ATOM   1559 C CD  . GLN   A 1 219 ? -5.038  1.205   -39.072 1.00 25.74 ? 426 GLN   A CD  1 
ATOM   1560 O OE1 . GLN   A 1 219 ? -4.348  0.266   -39.491 1.00 21.21 ? 426 GLN   A OE1 1 
ATOM   1561 N NE2 . GLN   A 1 219 ? -5.313  2.248   -39.842 1.00 34.56 ? 426 GLN   A NE2 1 
ATOM   1562 N N   . THR   A 1 220 ? -6.919  -0.733  -34.831 1.00 16.92 ? 427 THR   A N   1 
ATOM   1563 C CA  . THR   A 1 220 ? -8.351  -1.085  -34.685 1.00 18.72 ? 427 THR   A CA  1 
ATOM   1564 C C   . THR   A 1 220 ? -8.789  -0.685  -33.283 1.00 19.53 ? 427 THR   A C   1 
ATOM   1565 O O   . THR   A 1 220 ? -9.963  -0.227  -33.088 1.00 19.93 ? 427 THR   A O   1 
ATOM   1566 C CB  . THR   A 1 220 ? -8.557  -2.566  -34.957 1.00 20.66 ? 427 THR   A CB  1 
ATOM   1567 O OG1 . THR   A 1 220 ? -8.043  -2.828  -36.268 1.00 22.09 ? 427 THR   A OG1 1 
ATOM   1568 C CG2 . THR   A 1 220 ? -10.012 -2.955  -34.813 1.00 20.92 ? 427 THR   A CG2 1 
ATOM   1569 N N   . SER   A 1 221 ? -7.962  -0.839  -32.278 1.00 18.63 ? 428 SER   A N   1 
ATOM   1570 C CA  A SER   A 1 221 ? -8.267  -0.437  -30.873 0.50 18.82 ? 428 SER   A CA  1 
ATOM   1571 C CA  B SER   A 1 221 ? -8.366  -0.461  -30.908 0.50 19.32 ? 428 SER   A CA  1 
ATOM   1572 C C   . SER   A 1 221 ? -8.508  1.068   -30.779 1.00 22.11 ? 428 SER   A C   1 
ATOM   1573 O O   . SER   A 1 221 ? -9.443  1.513   -30.103 1.00 22.28 ? 428 SER   A O   1 
ATOM   1574 C CB  A SER   A 1 221 ? -7.142  -0.795  -29.922 0.50 19.05 ? 428 SER   A CB  1 
ATOM   1575 C CB  B SER   A 1 221 ? -7.413  -1.116  -29.966 0.50 20.64 ? 428 SER   A CB  1 
ATOM   1576 O OG  A SER   A 1 221 ? -7.310  -0.136  -28.660 0.50 18.99 ? 428 SER   A OG  1 
ATOM   1577 O OG  B SER   A 1 221 ? -7.396  -2.505  -30.302 0.50 21.88 ? 428 SER   A OG  1 
ATOM   1578 N N   . THR   A 1 222 ? -7.670  1.853   -31.437 1.00 20.49 ? 429 THR   A N   1 
ATOM   1579 C CA  . THR   A 1 222 ? -7.806  3.323   -31.332 1.00 23.86 ? 429 THR   A CA  1 
ATOM   1580 C C   . THR   A 1 222 ? -9.156  3.689   -31.945 1.00 22.15 ? 429 THR   A C   1 
ATOM   1581 O O   . THR   A 1 222 ? -9.828  4.577   -31.343 1.00 23.92 ? 429 THR   A O   1 
ATOM   1582 C CB  . THR   A 1 222 ? -6.628  4.046   -31.988 1.00 25.55 ? 429 THR   A CB  1 
ATOM   1583 O OG1 . THR   A 1 222 ? -5.503  3.655   -31.206 1.00 30.95 ? 429 THR   A OG1 1 
ATOM   1584 C CG2 . THR   A 1 222 ? -6.839  5.550   -31.935 1.00 29.24 ? 429 THR   A CG2 1 
ATOM   1585 N N   . LYS   A 1 223 ? -9.489  3.111   -33.089 1.00 20.36 ? 430 LYS   A N   1 
ATOM   1586 C CA  . LYS   A 1 223 ? -10.805 3.337   -33.781 1.00 25.34 ? 430 LYS   A CA  1 
ATOM   1587 C C   . LYS   A 1 223 ? -11.934 3.004   -32.807 1.00 25.75 ? 430 LYS   A C   1 
ATOM   1588 O O   . LYS   A 1 223 ? -12.941 3.746   -32.726 1.00 26.73 ? 430 LYS   A O   1 
ATOM   1589 C CB  . LYS   A 1 223 ? -10.935 2.489   -35.041 1.00 26.94 ? 430 LYS   A CB  1 
ATOM   1590 C CG  . LYS   A 1 223 ? -10.251 3.040   -36.277 1.00 37.63 ? 430 LYS   A CG  1 
ATOM   1591 C CD  . LYS   A 1 223 ? -10.274 2.079   -37.430 1.00 42.60 ? 430 LYS   A CD  1 
ATOM   1592 C CE  . LYS   A 1 223 ? -9.465  2.558   -38.612 1.00 47.48 ? 430 LYS   A CE  1 
ATOM   1593 N NZ  . LYS   A 1 223 ? -9.436  1.512   -39.652 1.00 48.51 ? 430 LYS   A NZ  1 
ATOM   1594 N N   . ALA   A 1 224 ? -11.806 1.915   -32.081 1.00 20.96 ? 431 ALA   A N   1 
ATOM   1595 C CA  . ALA   A 1 224 ? -12.912 1.414   -31.223 1.00 20.27 ? 431 ALA   A CA  1 
ATOM   1596 C C   . ALA   A 1 224 ? -13.083 2.380   -30.070 1.00 22.52 ? 431 ALA   A C   1 
ATOM   1597 O O   . ALA   A 1 224 ? -14.257 2.684   -29.682 1.00 23.03 ? 431 ALA   A O   1 
ATOM   1598 C CB  . ALA   A 1 224 ? -12.626 0.001   -30.761 1.00 21.51 ? 431 ALA   A CB  1 
ATOM   1599 N N   . VAL   A 1 225 ? -12.009 2.774   -29.437 1.00 21.98 ? 432 VAL   A N   1 
ATOM   1600 C CA  . VAL   A 1 225 ? -12.055 3.703   -28.281 1.00 21.33 ? 432 VAL   A CA  1 
ATOM   1601 C C   . VAL   A 1 225 ? -12.687 5.007   -28.749 1.00 25.09 ? 432 VAL   A C   1 
ATOM   1602 O O   . VAL   A 1 225 ? -13.589 5.494   -28.035 1.00 27.47 ? 432 VAL   A O   1 
ATOM   1603 C CB  . VAL   A 1 225 ? -10.642 3.924   -27.736 1.00 24.72 ? 432 VAL   A CB  1 
ATOM   1604 C CG1 . VAL   A 1 225 ? -10.645 5.081   -26.757 1.00 25.81 ? 432 VAL   A CG1 1 
ATOM   1605 C CG2 . VAL   A 1 225 ? -10.143 2.650   -27.099 1.00 23.68 ? 432 VAL   A CG2 1 
ATOM   1606 N N   . GLN   A 1 226 ? -12.284 5.506   -29.909 1.00 25.73 ? 433 GLN   A N   1 
ATOM   1607 C CA  . GLN   A 1 226 ? -12.838 6.806   -30.391 1.00 27.80 ? 433 GLN   A CA  1 
ATOM   1608 C C   . GLN   A 1 226 ? -14.340 6.622   -30.628 1.00 27.37 ? 433 GLN   A C   1 
ATOM   1609 O O   . GLN   A 1 226 ? -15.095 7.511   -30.194 1.00 29.91 ? 433 GLN   A O   1 
ATOM   1610 C CB  . GLN   A 1 226 ? -12.049 7.269   -31.613 1.00 30.97 ? 433 GLN   A CB  1 
ATOM   1611 C CG  . GLN   A 1 226 ? -12.529 8.565   -32.251 1.00 43.24 ? 433 GLN   A CG  1 
ATOM   1612 C CD  . GLN   A 1 226 ? -11.577 8.932   -33.375 1.00 50.87 ? 433 GLN   A CD  1 
ATOM   1613 O OE1 . GLN   A 1 226 ? -10.590 8.235   -33.638 1.00 57.29 ? 433 GLN   A OE1 1 
ATOM   1614 N NE2 . GLN   A 1 226 ? -11.835 10.058  -34.024 1.00 64.04 ? 433 GLN   A NE2 1 
ATOM   1615 N N   . HIS   A 1 227 ? -14.755 5.539   -31.285 1.00 25.32 ? 434 HIS   A N   1 
ATOM   1616 C CA  . HIS   A 1 227 ? -16.178 5.221   -31.615 1.00 28.98 ? 434 HIS   A CA  1 
ATOM   1617 C C   . HIS   A 1 227 ? -16.999 5.190   -30.315 1.00 32.16 ? 434 HIS   A C   1 
ATOM   1618 O O   . HIS   A 1 227 ? -18.033 5.922   -30.189 1.00 30.65 ? 434 HIS   A O   1 
ATOM   1619 C CB  . HIS   A 1 227 ? -16.287 3.917   -32.389 1.00 31.69 ? 434 HIS   A CB  1 
ATOM   1620 C CG  . HIS   A 1 227 ? -17.661 3.685   -32.914 1.00 33.74 ? 434 HIS   A CG  1 
ATOM   1621 N ND1 . HIS   A 1 227 ? -18.026 4.052   -34.186 1.00 38.10 ? 434 HIS   A ND1 1 
ATOM   1622 C CD2 . HIS   A 1 227 ? -18.754 3.162   -32.327 1.00 33.41 ? 434 HIS   A CD2 1 
ATOM   1623 C CE1 . HIS   A 1 227 ? -19.304 3.760   -34.366 1.00 38.77 ? 434 HIS   A CE1 1 
ATOM   1624 N NE2 . HIS   A 1 227 ? -19.767 3.211   -33.251 1.00 34.67 ? 434 HIS   A NE2 1 
ATOM   1625 N N   . PHE   A 1 228 ? -16.564 4.440   -29.306 1.00 29.00 ? 435 PHE   A N   1 
ATOM   1626 C CA  . PHE   A 1 228 ? -17.354 4.352   -28.054 1.00 24.55 ? 435 PHE   A CA  1 
ATOM   1627 C C   . PHE   A 1 228 ? -17.237 5.615   -27.212 1.00 29.46 ? 435 PHE   A C   1 
ATOM   1628 O O   . PHE   A 1 228 ? -18.156 5.818   -26.378 1.00 29.07 ? 435 PHE   A O   1 
ATOM   1629 C CB  . PHE   A 1 228 ? -16.995 3.063   -27.315 1.00 25.88 ? 435 PHE   A CB  1 
ATOM   1630 C CG  . PHE   A 1 228 ? -17.648 1.875   -27.964 1.00 26.19 ? 435 PHE   A CG  1 
ATOM   1631 C CD1 . PHE   A 1 228 ? -18.926 1.499   -27.579 1.00 29.51 ? 435 PHE   A CD1 1 
ATOM   1632 C CD2 . PHE   A 1 228 ? -17.038 1.164   -28.992 1.00 27.39 ? 435 PHE   A CD2 1 
ATOM   1633 C CE1 . PHE   A 1 228 ? -19.562 0.443   -28.198 1.00 30.00 ? 435 PHE   A CE1 1 
ATOM   1634 C CE2 . PHE   A 1 228 ? -17.671 0.104   -29.604 1.00 27.65 ? 435 PHE   A CE2 1 
ATOM   1635 C CZ  . PHE   A 1 228 ? -18.937 -0.262  -29.191 1.00 29.28 ? 435 PHE   A CZ  1 
ATOM   1636 N N   . TYR   A 1 229 ? -16.141 6.372   -27.294 1.00 27.60 ? 436 TYR   A N   1 
ATOM   1637 C CA  . TYR   A 1 229 ? -16.058 7.660   -26.558 1.00 31.66 ? 436 TYR   A CA  1 
ATOM   1638 C C   . TYR   A 1 229 ? -17.149 8.556   -27.148 1.00 30.80 ? 436 TYR   A C   1 
ATOM   1639 O O   . TYR   A 1 229 ? -17.790 9.275   -26.369 1.00 33.53 ? 436 TYR   A O   1 
ATOM   1640 C CB  . TYR   A 1 229 ? -14.700 8.355   -26.690 1.00 32.77 ? 436 TYR   A CB  1 
ATOM   1641 C CG  . TYR   A 1 229 ? -14.545 9.529   -25.750 1.00 35.24 ? 436 TYR   A CG  1 
ATOM   1642 C CD1 . TYR   A 1 229 ? -14.296 9.332   -24.405 1.00 39.02 ? 436 TYR   A CD1 1 
ATOM   1643 C CD2 . TYR   A 1 229 ? -14.691 10.835  -26.196 1.00 40.98 ? 436 TYR   A CD2 1 
ATOM   1644 C CE1 . TYR   A 1 229 ? -14.190 10.392  -23.520 1.00 47.31 ? 436 TYR   A CE1 1 
ATOM   1645 C CE2 . TYR   A 1 229 ? -14.581 11.909  -25.325 1.00 42.49 ? 436 TYR   A CE2 1 
ATOM   1646 C CZ  . TYR   A 1 229 ? -14.322 11.689  -23.986 1.00 43.96 ? 436 TYR   A CZ  1 
ATOM   1647 O OH  . TYR   A 1 229 ? -14.212 12.731  -23.112 1.00 51.95 ? 436 TYR   A OH  1 
ATOM   1648 N N   . ASN   A 1 230 ? -17.375 8.483   -28.458 1.00 30.41 ? 437 ASN   A N   1 
ATOM   1649 C CA  . ASN   A 1 230 ? -18.364 9.385   -29.117 1.00 32.29 ? 437 ASN   A CA  1 
ATOM   1650 C C   . ASN   A 1 230 ? -19.774 8.953   -28.701 1.00 35.67 ? 437 ASN   A C   1 
ATOM   1651 O O   . ASN   A 1 230 ? -20.590 9.831   -28.431 1.00 37.67 ? 437 ASN   A O   1 
ATOM   1652 C CB  . ASN   A 1 230 ? -18.199 9.446   -30.624 1.00 32.90 ? 437 ASN   A CB  1 
ATOM   1653 C CG  . ASN   A 1 230 ? -16.967 10.241  -30.999 1.00 35.75 ? 437 ASN   A CG  1 
ATOM   1654 O OD1 . ASN   A 1 230 ? -16.473 11.036  -30.197 1.00 38.38 ? 437 ASN   A OD1 1 
ATOM   1655 N ND2 . ASN   A 1 230 ? -16.459 10.007  -32.199 1.00 37.31 ? 437 ASN   A ND2 1 
ATOM   1656 N N   . ILE   A 1 231 ? -20.030 7.643   -28.628 1.00 31.49 ? 438 ILE   A N   1 
ATOM   1657 C CA  . ILE   A 1 231 ? -21.307 7.115   -28.076 1.00 29.50 ? 438 ILE   A CA  1 
ATOM   1658 C C   . ILE   A 1 231 ? -21.482 7.610   -26.632 1.00 32.94 ? 438 ILE   A C   1 
ATOM   1659 O O   . ILE   A 1 231 ? -22.631 8.011   -26.279 1.00 35.59 ? 438 ILE   A O   1 
ATOM   1660 C CB  . ILE   A 1 231 ? -21.337 5.583   -28.198 1.00 31.47 ? 438 ILE   A CB  1 
ATOM   1661 C CG1 . ILE   A 1 231 ? -21.511 5.162   -29.659 1.00 33.17 ? 438 ILE   A CG1 1 
ATOM   1662 C CG2 . ILE   A 1 231 ? -22.437 5.027   -27.299 1.00 30.89 ? 438 ILE   A CG2 1 
ATOM   1663 C CD1 . ILE   A 1 231 ? -21.061 3.770   -29.978 1.00 39.59 ? 438 ILE   A CD1 1 
ATOM   1664 N N   . LYS   A 1 232 ? -20.441 7.619   -25.794 1.00 31.79 ? 439 LYS   A N   1 
ATOM   1665 C CA  . LYS   A 1 232 ? -20.486 8.197   -24.428 1.00 33.54 ? 439 LYS   A CA  1 
ATOM   1666 C C   . LYS   A 1 232 ? -20.959 9.660   -24.499 1.00 40.30 ? 439 LYS   A C   1 
ATOM   1667 O O   . LYS   A 1 232 ? -21.939 9.997   -23.792 1.00 40.20 ? 439 LYS   A O   1 
ATOM   1668 C CB  . LYS   A 1 232 ? -19.121 8.084   -23.749 1.00 34.93 ? 439 LYS   A CB  1 
ATOM   1669 C CG  . LYS   A 1 232 ? -19.009 8.764   -22.393 1.00 41.79 ? 439 LYS   A CG  1 
ATOM   1670 C CD  . LYS   A 1 232 ? -17.714 9.530   -22.224 1.00 51.51 ? 439 LYS   A CD  1 
ATOM   1671 C CE  . LYS   A 1 232 ? -17.848 10.709  -21.286 1.00 55.42 ? 439 LYS   A CE  1 
ATOM   1672 N NZ  . LYS   A 1 232 ? -16.562 11.024  -20.623 1.00 63.25 ? 439 LYS   A NZ  1 
ATOM   1673 N N   . LEU   A 1 233 ? -20.324 10.490  -25.330 1.00 40.98 ? 440 LEU   A N   1 
ATOM   1674 C CA  . LEU   A 1 233 ? -20.619 11.950  -25.395 1.00 41.80 ? 440 LEU   A CA  1 
ATOM   1675 C C   . LEU   A 1 233 ? -22.080 12.165  -25.811 1.00 45.17 ? 440 LEU   A C   1 
ATOM   1676 O O   . LEU   A 1 233 ? -22.689 13.122  -25.311 1.00 45.74 ? 440 LEU   A O   1 
ATOM   1677 C CB  . LEU   A 1 233 ? -19.678 12.643  -26.385 1.00 43.94 ? 440 LEU   A CB  1 
ATOM   1678 C CG  . LEU   A 1 233 ? -18.216 12.748  -25.940 1.00 48.96 ? 440 LEU   A CG  1 
ATOM   1679 C CD1 . LEU   A 1 233 ? -17.391 13.474  -26.998 1.00 51.95 ? 440 LEU   A CD1 1 
ATOM   1680 C CD2 . LEU   A 1 233 ? -18.090 13.443  -24.586 1.00 47.50 ? 440 LEU   A CD2 1 
ATOM   1681 N N   . GLU   A 1 234 ? -22.603 11.320  -26.699 1.00 47.84 ? 441 GLU   A N   1 
ATOM   1682 C CA  . GLU   A 1 234 ? -23.980 11.434  -27.251 1.00 52.35 ? 441 GLU   A CA  1 
ATOM   1683 C C   . GLU   A 1 234 ? -25.024 11.097  -26.165 1.00 54.40 ? 441 GLU   A C   1 
ATOM   1684 O O   . GLU   A 1 234 ? -26.169 11.586  -26.286 1.00 53.71 ? 441 GLU   A O   1 
ATOM   1685 C CB  . GLU   A 1 234 ? -24.114 10.533  -28.474 1.00 55.87 ? 441 GLU   A CB  1 
ATOM   1686 C CG  . GLU   A 1 234 ? -24.937 11.144  -29.587 1.00 64.78 ? 441 GLU   A CG  1 
ATOM   1687 C CD  . GLU   A 1 234 ? -25.651 10.121  -30.451 1.00 72.67 ? 441 GLU   A CD  1 
ATOM   1688 O OE1 . GLU   A 1 234 ? -25.209 8.947   -30.472 1.00 76.49 ? 441 GLU   A OE1 1 
ATOM   1689 O OE2 . GLU   A 1 234 ? -26.664 10.494  -31.078 1.00 81.34 ? 441 GLU   A OE2 1 
ATOM   1690 N N   . GLY   A 1 235 ? -24.669 10.277  -25.167 1.00 47.46 ? 442 GLY   A N   1 
ATOM   1691 C CA  . GLY   A 1 235 ? -25.421 10.103  -23.908 1.00 43.56 ? 442 GLY   A CA  1 
ATOM   1692 C C   . GLY   A 1 235 ? -26.672 9.241   -24.042 1.00 43.94 ? 442 GLY   A C   1 
ATOM   1693 O O   . GLY   A 1 235 ? -27.513 9.312   -23.124 1.00 48.73 ? 442 GLY   A O   1 
ATOM   1694 N N   . LYS   A 1 236 ? -26.802 8.423   -25.091 1.00 41.97 ? 443 LYS   A N   1 
ATOM   1695 C CA  . LYS   A 1 236 ? -28.003 7.574   -25.338 1.00 44.04 ? 443 LYS   A CA  1 
ATOM   1696 C C   . LYS   A 1 236 ? -27.789 6.116   -24.896 1.00 44.75 ? 443 LYS   A C   1 
ATOM   1697 O O   . LYS   A 1 236 ? -28.766 5.333   -24.933 1.00 39.89 ? 443 LYS   A O   1 
ATOM   1698 C CB  . LYS   A 1 236 ? -28.364 7.614   -26.820 1.00 48.12 ? 443 LYS   A CB  1 
ATOM   1699 C CG  . LYS   A 1 236 ? -28.644 9.021   -27.320 1.00 53.02 ? 443 LYS   A CG  1 
ATOM   1700 C CD  . LYS   A 1 236 ? -29.356 9.062   -28.650 1.00 57.33 ? 443 LYS   A CD  1 
ATOM   1701 C CE  . LYS   A 1 236 ? -29.782 10.468  -29.018 1.00 62.86 ? 443 LYS   A CE  1 
ATOM   1702 N NZ  . LYS   A 1 236 ? -30.326 10.529  -30.395 1.00 66.63 ? 443 LYS   A NZ  1 
ATOM   1703 N N   . VAL   A 1 237 ? -26.573 5.740   -24.493 1.00 37.26 ? 444 VAL   A N   1 
ATOM   1704 C CA  . VAL   A 1 237 ? -26.253 4.339   -24.126 1.00 34.07 ? 444 VAL   A CA  1 
ATOM   1705 C C   . VAL   A 1 237 ? -25.708 4.336   -22.706 1.00 37.68 ? 444 VAL   A C   1 
ATOM   1706 O O   . VAL   A 1 237 ? -24.649 4.918   -22.439 1.00 35.41 ? 444 VAL   A O   1 
ATOM   1707 C CB  . VAL   A 1 237 ? -25.245 3.738   -25.120 1.00 31.68 ? 444 VAL   A CB  1 
ATOM   1708 C CG1 . VAL   A 1 237 ? -24.841 2.330   -24.729 1.00 31.23 ? 444 VAL   A CG1 1 
ATOM   1709 C CG2 . VAL   A 1 237 ? -25.755 3.778   -26.547 1.00 32.81 ? 444 VAL   A CG2 1 
ATOM   1710 N N   . PRO   A 1 238 ? -26.405 3.672   -21.754 1.00 37.06 ? 445 PRO   A N   1 
ATOM   1711 C CA  . PRO   A 1 238 ? -25.926 3.566   -20.385 1.00 37.71 ? 445 PRO   A CA  1 
ATOM   1712 C C   . PRO   A 1 238 ? -24.655 2.715   -20.395 1.00 36.46 ? 445 PRO   A C   1 
ATOM   1713 O O   . PRO   A 1 238 ? -24.584 1.727   -21.159 1.00 39.39 ? 445 PRO   A O   1 
ATOM   1714 C CB  . PRO   A 1 238 ? -27.053 2.883   -19.591 1.00 40.73 ? 445 PRO   A CB  1 
ATOM   1715 C CG  . PRO   A 1 238 ? -27.895 2.198   -20.658 1.00 39.77 ? 445 PRO   A CG  1 
ATOM   1716 C CD  . PRO   A 1 238 ? -27.671 2.953   -21.951 1.00 38.05 ? 445 PRO   A CD  1 
ATOM   1717 N N   . MET   A 1 239 ? -23.684 3.132   -19.591 1.00 34.59 ? 446 MET   A N   1 
ATOM   1718 C CA  . MET   A 1 239 ? -22.375 2.443   -19.459 1.00 35.74 ? 446 MET   A CA  1 
ATOM   1719 C C   . MET   A 1 239 ? -22.057 2.289   -17.969 1.00 35.11 ? 446 MET   A C   1 
ATOM   1720 O O   . MET   A 1 239 ? -22.339 3.229   -17.211 1.00 40.90 ? 446 MET   A O   1 
ATOM   1721 C CB  . MET   A 1 239 ? -21.284 3.254   -20.156 1.00 33.74 ? 446 MET   A CB  1 
ATOM   1722 C CG  . MET   A 1 239 ? -21.480 3.351   -21.641 1.00 33.41 ? 446 MET   A CG  1 
ATOM   1723 S SD  . MET   A 1 239 ? -20.307 4.461   -22.450 1.00 34.85 ? 446 MET   A SD  1 
ATOM   1724 C CE  . MET   A 1 239 ? -20.892 4.330   -24.128 1.00 33.33 ? 446 MET   A CE  1 
ATOM   1725 N N   . HIS   A 1 240 ? -21.520 1.137   -17.564 1.00 32.47 ? 447 HIS   A N   1 
ATOM   1726 C CA  . HIS   A 1 240 ? -21.146 0.848   -16.155 1.00 34.25 ? 447 HIS   A CA  1 
ATOM   1727 C C   . HIS   A 1 240 ? -19.805 1.517   -15.830 1.00 34.41 ? 447 HIS   A C   1 
ATOM   1728 O O   . HIS   A 1 240 ? -19.100 1.944   -16.788 1.00 33.85 ? 447 HIS   A O   1 
ATOM   1729 C CB  . HIS   A 1 240 ? -21.160 -0.658  -15.890 1.00 36.11 ? 447 HIS   A CB  1 
ATOM   1730 C CG  . HIS   A 1 240 ? -22.530 -1.241  -15.839 1.00 43.96 ? 447 HIS   A CG  1 
ATOM   1731 N ND1 . HIS   A 1 240 ? -23.424 -0.931  -14.831 1.00 46.93 ? 447 HIS   A ND1 1 
ATOM   1732 C CD2 . HIS   A 1 240 ? -23.159 -2.110  -16.665 1.00 47.47 ? 447 HIS   A CD2 1 
ATOM   1733 C CE1 . HIS   A 1 240 ? -24.552 -1.582  -15.042 1.00 49.54 ? 447 HIS   A CE1 1 
ATOM   1734 N NE2 . HIS   A 1 240 ? -24.411 -2.324  -16.153 1.00 50.03 ? 447 HIS   A NE2 1 
ATOM   1735 N N   . LYS   A 1 241 ? -19.484 1.623   -14.537 1.00 36.61 ? 448 LYS   A N   1 
ATOM   1736 C CA  . LYS   A 1 241 ? -18.412 2.488   -13.973 1.00 37.54 ? 448 LYS   A CA  1 
ATOM   1737 C C   . LYS   A 1 241 ? -17.038 2.118   -14.554 1.00 31.82 ? 448 LYS   A C   1 
ATOM   1738 O O   . LYS   A 1 241 ? -16.349 3.054   -14.997 1.00 32.81 ? 448 LYS   A O   1 
ATOM   1739 C CB  . LYS   A 1 241 ? -18.367 2.390   -12.446 1.00 42.24 ? 448 LYS   A CB  1 
ATOM   1740 C CG  . LYS   A 1 241 ? -19.481 3.142   -11.735 1.00 53.95 ? 448 LYS   A CG  1 
ATOM   1741 C CD  . LYS   A 1 241 ? -19.136 3.557   -10.321 1.00 60.10 ? 448 LYS   A CD  1 
ATOM   1742 C CE  . LYS   A 1 241 ? -20.109 4.585   -9.780  1.00 66.07 ? 448 LYS   A CE  1 
ATOM   1743 N NZ  . LYS   A 1 241 ? -20.120 4.608   -8.295  1.00 69.13 ? 448 LYS   A NZ  1 
ATOM   1744 N N   . LEU   A 1 242 ? -16.668 0.841   -14.517 1.00 28.36 ? 449 LEU   A N   1 
ATOM   1745 C CA  . LEU   A 1 242 ? -15.316 0.403   -14.995 1.00 29.39 ? 449 LEU   A CA  1 
ATOM   1746 C C   . LEU   A 1 242 ? -15.145 0.712   -16.488 1.00 30.12 ? 449 LEU   A C   1 
ATOM   1747 O O   . LEU   A 1 242 ? -14.105 1.264   -16.860 1.00 27.36 ? 449 LEU   A O   1 
ATOM   1748 C CB  . LEU   A 1 242 ? -15.079 -1.071  -14.694 1.00 29.36 ? 449 LEU   A CB  1 
ATOM   1749 C CG  . LEU   A 1 242 ? -13.657 -1.583  -14.934 1.00 29.73 ? 449 LEU   A CG  1 
ATOM   1750 C CD1 . LEU   A 1 242 ? -12.620 -0.752  -14.175 1.00 30.86 ? 449 LEU   A CD1 1 
ATOM   1751 C CD2 . LEU   A 1 242 ? -13.560 -3.040  -14.575 1.00 30.75 ? 449 LEU   A CD2 1 
ATOM   1752 N N   . PHE   A 1 243 ? -16.094 0.374   -17.350 1.00 30.18 ? 450 PHE   A N   1 
ATOM   1753 C CA  . PHE   A 1 243 ? -15.987 0.719   -18.798 1.00 27.72 ? 450 PHE   A CA  1 
ATOM   1754 C C   . PHE   A 1 243 ? -15.766 2.220   -18.995 1.00 30.89 ? 450 PHE   A C   1 
ATOM   1755 O O   . PHE   A 1 243 ? -14.897 2.695   -19.793 1.00 30.88 ? 450 PHE   A O   1 
ATOM   1756 C CB  . PHE   A 1 243 ? -17.225 0.216   -19.513 1.00 29.36 ? 450 PHE   A CB  1 
ATOM   1757 C CG  . PHE   A 1 243 ? -17.193 0.396   -20.999 1.00 26.64 ? 450 PHE   A CG  1 
ATOM   1758 C CD1 . PHE   A 1 243 ? -16.411 -0.431  -21.789 1.00 27.19 ? 450 PHE   A CD1 1 
ATOM   1759 C CD2 . PHE   A 1 243 ? -17.981 1.342   -21.624 1.00 28.88 ? 450 PHE   A CD2 1 
ATOM   1760 C CE1 . PHE   A 1 243 ? -16.362 -0.276  -23.158 1.00 27.68 ? 450 PHE   A CE1 1 
ATOM   1761 C CE2 . PHE   A 1 243 ? -17.968 1.467   -23.000 1.00 29.91 ? 450 PHE   A CE2 1 
ATOM   1762 C CZ  . PHE   A 1 243 ? -17.157 0.661   -23.768 1.00 26.89 ? 450 PHE   A CZ  1 
ATOM   1763 N N   . LEU   A 1 244 ? -16.553 3.015   -18.275 1.00 33.67 ? 451 LEU   A N   1 
ATOM   1764 C CA  . LEU   A 1 244 ? -16.462 4.492   -18.326 1.00 33.72 ? 451 LEU   A CA  1 
ATOM   1765 C C   . LEU   A 1 244 ? -15.086 4.995   -17.892 1.00 30.12 ? 451 LEU   A C   1 
ATOM   1766 O O   . LEU   A 1 244 ? -14.567 5.876   -18.576 1.00 33.83 ? 451 LEU   A O   1 
ATOM   1767 C CB  . LEU   A 1 244 ? -17.549 5.082   -17.422 1.00 35.82 ? 451 LEU   A CB  1 
ATOM   1768 C CG  . LEU   A 1 244 ? -18.884 5.254   -18.130 1.00 37.64 ? 451 LEU   A CG  1 
ATOM   1769 C CD1 . LEU   A 1 244 ? -19.957 5.741   -17.162 1.00 37.29 ? 451 LEU   A CD1 1 
ATOM   1770 C CD2 . LEU   A 1 244 ? -18.735 6.218   -19.293 1.00 36.61 ? 451 LEU   A CD2 1 
ATOM   1771 N N   . GLU   A 1 245 ? -14.557 4.430   -16.811 1.00 30.26 ? 452 GLU   A N   1 
ATOM   1772 C CA  . GLU   A 1 245 ? -13.237 4.780   -16.242 1.00 33.33 ? 452 GLU   A CA  1 
ATOM   1773 C C   . GLU   A 1 245 ? -12.200 4.550   -17.349 1.00 32.69 ? 452 GLU   A C   1 
ATOM   1774 O O   . GLU   A 1 245 ? -11.333 5.428   -17.595 1.00 32.51 ? 452 GLU   A O   1 
ATOM   1775 C CB  . GLU   A 1 245 ? -12.958 3.916   -15.015 1.00 39.57 ? 452 GLU   A CB  1 
ATOM   1776 C CG  . GLU   A 1 245 ? -11.834 4.405   -14.135 1.00 47.30 ? 452 GLU   A CG  1 
ATOM   1777 C CD  . GLU   A 1 245 ? -11.847 3.689   -12.801 1.00 53.36 ? 452 GLU   A CD  1 
ATOM   1778 O OE1 . GLU   A 1 245 ? -12.843 3.853   -12.048 1.00 57.71 ? 452 GLU   A OE1 1 
ATOM   1779 O OE2 . GLU   A 1 245 ? -10.891 2.948   -12.532 1.00 57.07 ? 452 GLU   A OE2 1 
ATOM   1780 N N   . MET   A 1 246 ? -12.301 3.424   -18.063 1.00 28.30 ? 453 MET   A N   1 
ATOM   1781 C CA  . MET   A 1 246 ? -11.269 3.110   -19.105 1.00 28.31 ? 453 MET   A CA  1 
ATOM   1782 C C   . MET   A 1 246 ? -11.452 3.992   -20.347 1.00 30.59 ? 453 MET   A C   1 
ATOM   1783 O O   . MET   A 1 246 ? -10.429 4.391   -20.963 1.00 30.15 ? 453 MET   A O   1 
ATOM   1784 C CB  . MET   A 1 246 ? -11.298 1.636   -19.503 1.00 25.08 ? 453 MET   A CB  1 
ATOM   1785 C CG  . MET   A 1 246 ? -11.204 0.695   -18.342 1.00 26.62 ? 453 MET   A CG  1 
ATOM   1786 S SD  . MET   A 1 246 ? -9.813  0.938   -17.227 1.00 30.93 ? 453 MET   A SD  1 
ATOM   1787 C CE  . MET   A 1 246 ? -8.566  0.350   -18.359 1.00 25.08 ? 453 MET   A CE  1 
ATOM   1788 N N   . LEU   A 1 247 ? -12.682 4.307   -20.744 1.00 31.36 ? 454 LEU   A N   1 
ATOM   1789 C CA  . LEU   A 1 247 ? -12.936 5.220   -21.884 1.00 30.04 ? 454 LEU   A CA  1 
ATOM   1790 C C   . LEU   A 1 247 ? -12.417 6.613   -21.563 1.00 34.74 ? 454 LEU   A C   1 
ATOM   1791 O O   . LEU   A 1 247 ? -11.980 7.307   -22.491 1.00 41.50 ? 454 LEU   A O   1 
ATOM   1792 C CB  . LEU   A 1 247 ? -14.446 5.332   -22.123 1.00 34.48 ? 454 LEU   A CB  1 
ATOM   1793 C CG  . LEU   A 1 247 ? -15.064 4.491   -23.224 1.00 37.87 ? 454 LEU   A CG  1 
ATOM   1794 C CD1 . LEU   A 1 247 ? -16.534 4.886   -23.362 1.00 35.38 ? 454 LEU   A CD1 1 
ATOM   1795 C CD2 . LEU   A 1 247 ? -14.348 4.640   -24.564 1.00 38.10 ? 454 LEU   A CD2 1 
ATOM   1796 N N   . GLU   A 1 248 ? -12.570 7.030   -20.310 1.00 36.65 ? 455 GLU   A N   1 
ATOM   1797 C CA  . GLU   A 1 248 ? -12.257 8.422   -19.881 1.00 44.32 ? 455 GLU   A CA  1 
ATOM   1798 C C   . GLU   A 1 248 ? -10.735 8.589   -19.843 1.00 46.69 ? 455 GLU   A C   1 
ATOM   1799 O O   . GLU   A 1 248 ? -10.271 9.683   -20.217 1.00 49.97 ? 455 GLU   A O   1 
ATOM   1800 C CB  . GLU   A 1 248 ? -12.966 8.782   -18.564 1.00 49.30 ? 455 GLU   A CB  1 
ATOM   1801 C CG  . GLU   A 1 248 ? -14.202 9.659   -18.766 1.00 56.64 ? 455 GLU   A CG  1 
ATOM   1802 C CD  . GLU   A 1 248 ? -15.442 9.383   -17.916 1.00 57.88 ? 455 GLU   A CD  1 
ATOM   1803 O OE1 . GLU   A 1 248 ? -15.298 8.982   -16.742 1.00 61.47 ? 455 GLU   A OE1 1 
ATOM   1804 O OE2 . GLU   A 1 248 ? -16.562 9.582   -18.433 1.00 58.37 ? 455 GLU   A OE2 1 
ATOM   1805 N N   . ALA   A 1 249 ? -9.986  7.529   -19.510 1.00 47.76 ? 456 ALA   A N   1 
ATOM   1806 C CA  . ALA   A 1 249 ? -8.523  7.567   -19.257 1.00 52.58 ? 456 ALA   A CA  1 
ATOM   1807 C C   . ALA   A 1 249 ? -7.817  8.349   -20.376 1.00 56.57 ? 456 ALA   A C   1 
ATOM   1808 O O   . ALA   A 1 249 ? -6.866  9.111   -20.073 1.00 61.20 ? 456 ALA   A O   1 
ATOM   1809 C CB  . ALA   A 1 249 ? -7.989  6.158   -19.135 1.00 51.52 ? 456 ALA   A CB  1 
ATOM   1810 N N   . LYS   A 1 250 ? -8.277  8.154   -21.615 1.00 65.30 ? 457 LYS   A N   1 
ATOM   1811 C CA  . LYS   A 1 250 ? -7.880  8.917   -22.830 1.00 76.96 ? 457 LYS   A CA  1 
ATOM   1812 C C   . LYS   A 1 250 ? -8.984  9.938   -23.151 1.00 78.61 ? 457 LYS   A C   1 
ATOM   1813 O O   . LYS   A 1 250 ? -8.816  11.158  -23.216 1.00 82.99 ? 457 LYS   A O   1 
ATOM   1814 C CB  . LYS   A 1 250 ? -7.655  7.933   -23.987 1.00 79.15 ? 457 LYS   A CB  1 
ATOM   1815 C CG  . LYS   A 1 250 ? -8.928  7.442   -24.671 1.00 76.45 ? 457 LYS   A CG  1 
ATOM   1816 C CD  . LYS   A 1 250 ? -9.367  8.328   -25.824 1.00 75.51 ? 457 LYS   A CD  1 
ATOM   1817 C CE  . LYS   A 1 250 ? -10.844 8.667   -25.814 1.00 69.32 ? 457 LYS   A CE  1 
ATOM   1818 N NZ  . LYS   A 1 250 ? -11.234 9.333   -27.076 1.00 66.81 ? 457 LYS   A NZ  1 
ATOM   1819 N N   . SER   B 2 3   ? -10.998 5.348   -7.730  1.00 47.47 ? 378 SER   C N   1 
ATOM   1820 C CA  . SER   B 2 3   ? -10.663 4.535   -8.969  1.00 45.21 ? 378 SER   C CA  1 
ATOM   1821 C C   . SER   B 2 3   ? -11.140 3.088   -8.773  1.00 40.36 ? 378 SER   C C   1 
ATOM   1822 O O   . SER   B 2 3   ? -10.614 2.401   -7.875  1.00 43.75 ? 378 SER   C O   1 
ATOM   1823 C CB  . SER   B 2 3   ? -9.173  4.617   -9.257  1.00 48.56 ? 378 SER   C CB  1 
ATOM   1824 O OG  . SER   B 2 3   ? -8.781  3.833   -10.381 1.00 42.24 ? 378 SER   C OG  1 
ATOM   1825 N N   . LEU   B 2 4   ? -12.087 2.600   -9.581  1.00 38.36 ? 379 LEU   C N   1 
ATOM   1826 C CA  . LEU   B 2 4   ? -12.472 1.158   -9.509  1.00 37.54 ? 379 LEU   C CA  1 
ATOM   1827 C C   . LEU   B 2 4   ? -11.288 0.312   -10.028 1.00 32.10 ? 379 LEU   C C   1 
ATOM   1828 O O   . LEU   B 2 4   ? -11.033 -0.798  -9.476  1.00 32.93 ? 379 LEU   C O   1 
ATOM   1829 C CB  . LEU   B 2 4   ? -13.755 0.918   -10.321 1.00 42.41 ? 379 LEU   C CB  1 
ATOM   1830 C CG  . LEU   B 2 4   ? -14.378 -0.482  -10.255 1.00 46.42 ? 379 LEU   C CG  1 
ATOM   1831 C CD1 . LEU   B 2 4   ? -14.366 -1.077  -8.854  1.00 50.14 ? 379 LEU   C CD1 1 
ATOM   1832 C CD2 . LEU   B 2 4   ? -15.810 -0.454  -10.786 1.00 45.91 ? 379 LEU   C CD2 1 
ATOM   1833 N N   . LEU   B 2 5   ? -10.613 0.785   -11.071 1.00 35.43 ? 380 LEU   C N   1 
ATOM   1834 C CA  . LEU   B 2 5   ? -9.407  0.099   -11.606 1.00 32.51 ? 380 LEU   C CA  1 
ATOM   1835 C C   . LEU   B 2 5   ? -8.386  -0.131  -10.490 1.00 28.05 ? 380 LEU   C C   1 
ATOM   1836 O O   . LEU   B 2 5   ? -7.981  -1.266  -10.323 1.00 29.22 ? 380 LEU   C O   1 
ATOM   1837 C CB  . LEU   B 2 5   ? -8.793  0.897   -12.757 1.00 30.34 ? 380 LEU   C CB  1 
ATOM   1838 C CG  . LEU   B 2 5   ? -7.522  0.293   -13.355 1.00 29.94 ? 380 LEU   C CG  1 
ATOM   1839 C CD1 . LEU   B 2 5   ? -7.733  -1.159  -13.751 1.00 27.47 ? 380 LEU   C CD1 1 
ATOM   1840 C CD2 . LEU   B 2 5   ? -7.072  1.092   -14.565 1.00 29.90 ? 380 LEU   C CD2 1 
ATOM   1841 N N   . LEU   B 2 6   ? -8.037  0.901   -9.713  1.00 35.05 ? 381 LEU   C N   1 
ATOM   1842 C CA  . LEU   B 2 6   ? -7.101  0.786   -8.554  1.00 37.56 ? 381 LEU   C CA  1 
ATOM   1843 C C   . LEU   B 2 6   ? -7.663  -0.181  -7.513  1.00 36.42 ? 381 LEU   C C   1 
ATOM   1844 O O   . LEU   B 2 6   ? -6.898  -1.028  -7.004  1.00 35.08 ? 381 LEU   C O   1 
ATOM   1845 C CB  . LEU   B 2 6   ? -6.879  2.173   -7.939  1.00 42.24 ? 381 LEU   C CB  1 
ATOM   1846 C CG  . LEU   B 2 6   ? -5.850  2.251   -6.806  1.00 45.40 ? 381 LEU   C CG  1 
ATOM   1847 C CD1 . LEU   B 2 6   ? -4.487  1.715   -7.237  1.00 46.41 ? 381 LEU   C CD1 1 
ATOM   1848 C CD2 . LEU   B 2 6   ? -5.718  3.686   -6.325  1.00 47.67 ? 381 LEU   C CD2 1 
ATOM   1849 N N   . HIS   B 2 7   ? -8.959  -0.075  -7.188  1.00 38.83 ? 382 HIS   C N   1 
ATOM   1850 C CA  . HIS   B 2 7   ? -9.597  -0.974  -6.195  1.00 38.57 ? 382 HIS   C CA  1 
ATOM   1851 C C   . HIS   B 2 7   ? -9.419  -2.430  -6.625  1.00 35.22 ? 382 HIS   C C   1 
ATOM   1852 O O   . HIS   B 2 7   ? -8.990  -3.261  -5.793  1.00 34.81 ? 382 HIS   C O   1 
ATOM   1853 C CB  . HIS   B 2 7   ? -11.077 -0.620  -5.968  1.00 43.47 ? 382 HIS   C CB  1 
ATOM   1854 C CG  . HIS   B 2 7   ? -11.761 -1.631  -5.105  1.00 47.92 ? 382 HIS   C CG  1 
ATOM   1855 N ND1 . HIS   B 2 7   ? -11.526 -1.717  -3.747  1.00 51.39 ? 382 HIS   C ND1 1 
ATOM   1856 C CD2 . HIS   B 2 7   ? -12.600 -2.649  -5.404  1.00 55.90 ? 382 HIS   C CD2 1 
ATOM   1857 C CE1 . HIS   B 2 7   ? -12.207 -2.729  -3.241  1.00 54.46 ? 382 HIS   C CE1 1 
ATOM   1858 N NE2 . HIS   B 2 7   ? -12.876 -3.322  -4.236  1.00 55.27 ? 382 HIS   C NE2 1 
ATOM   1859 N N   . LEU   B 2 8   ? -9.687  -2.740  -7.900  1.00 31.66 ? 383 LEU   C N   1 
ATOM   1860 C CA  . LEU   B 2 8   ? -9.606  -4.137  -8.385  1.00 32.75 ? 383 LEU   C CA  1 
ATOM   1861 C C   . LEU   B 2 8   ? -8.150  -4.603  -8.420  1.00 32.24 ? 383 LEU   C C   1 
ATOM   1862 O O   . LEU   B 2 8   ? -7.896  -5.814  -8.189  1.00 34.32 ? 383 LEU   C O   1 
ATOM   1863 C CB  . LEU   B 2 8   ? -10.296 -4.235  -9.743  1.00 33.12 ? 383 LEU   C CB  1 
ATOM   1864 C CG  . LEU   B 2 8   ? -11.812 -4.052  -9.675  1.00 35.69 ? 383 LEU   C CG  1 
ATOM   1865 C CD1 . LEU   B 2 8   ? -12.372 -3.627  -11.032 1.00 38.06 ? 383 LEU   C CD1 1 
ATOM   1866 C CD2 . LEU   B 2 8   ? -12.476 -5.331  -9.165  1.00 38.52 ? 383 LEU   C CD2 1 
ATOM   1867 N N   . LEU   B 2 9   ? -7.224  -3.716  -8.747  1.00 31.56 ? 384 LEU   C N   1 
ATOM   1868 C CA  . LEU   B 2 9   ? -5.789  -4.101  -8.774  1.00 34.53 ? 384 LEU   C CA  1 
ATOM   1869 C C   . LEU   B 2 9   ? -5.309  -4.419  -7.339  1.00 34.89 ? 384 LEU   C C   1 
ATOM   1870 O O   . LEU   B 2 9   ? -4.445  -5.286  -7.193  1.00 34.05 ? 384 LEU   C O   1 
ATOM   1871 C CB  . LEU   B 2 9   ? -4.980  -2.976  -9.434  1.00 30.63 ? 384 LEU   C CB  1 
ATOM   1872 C CG  . LEU   B 2 9   ? -5.001  -2.941  -10.966 1.00 29.99 ? 384 LEU   C CG  1 
ATOM   1873 C CD1 . LEU   B 2 9   ? -4.323  -1.686  -11.474 1.00 31.35 ? 384 LEU   C CD1 1 
ATOM   1874 C CD2 . LEU   B 2 9   ? -4.334  -4.199  -11.518 1.00 27.02 ? 384 LEU   C CD2 1 
ATOM   1875 N N   . LYS   B 2 10  ? -5.914  -3.806  -6.319  1.00 42.48 ? 385 LYS   C N   1 
ATOM   1876 C CA  . LYS   B 2 10  ? -5.498  -3.972  -4.895  1.00 48.95 ? 385 LYS   C CA  1 
ATOM   1877 C C   . LYS   B 2 10  ? -6.141  -5.210  -4.267  1.00 51.37 ? 385 LYS   C C   1 
ATOM   1878 O O   . LYS   B 2 10  ? -5.489  -5.790  -3.402  1.00 53.31 ? 385 LYS   C O   1 
ATOM   1879 C CB  . LYS   B 2 10  ? -5.838  -2.725  -4.078  1.00 52.17 ? 385 LYS   C CB  1 
ATOM   1880 C CG  . LYS   B 2 10  ? -5.024  -1.496  -4.451  1.00 52.19 ? 385 LYS   C CG  1 
ATOM   1881 C CD  . LYS   B 2 10  ? -5.222  -0.320  -3.522  1.00 58.24 ? 385 LYS   C CD  1 
ATOM   1882 C CE  . LYS   B 2 10  ? -4.373  -0.424  -2.272  1.00 63.30 ? 385 LYS   C CE  1 
ATOM   1883 N NZ  . LYS   B 2 10  ? -3.900  0.907   -1.827  1.00 63.88 ? 385 LYS   C NZ  1 
ATOM   1884 N N   . SER   B 2 11  ? -7.326  -5.627  -4.723  1.00 55.84 ? 386 SER   C N   1 
ATOM   1885 C CA  . SER   B 2 11  ? -8.204  -6.608  -4.027  1.00 58.75 ? 386 SER   C CA  1 
ATOM   1886 C C   . SER   B 2 11  ? -7.588  -8.013  -4.042  1.00 58.95 ? 386 SER   C C   1 
ATOM   1887 O O   . SER   B 2 11  ? -7.016  -8.420  -5.045  1.00 61.47 ? 386 SER   C O   1 
ATOM   1888 C CB  . SER   B 2 11  ? -9.582  -6.606  -4.636  1.00 60.61 ? 386 SER   C CB  1 
ATOM   1889 O OG  . SER   B 2 11  ? -9.530  -6.978  -6.003  1.00 62.08 ? 386 SER   C OG  1 
HETATM 1890 C C1  . A1EGD C 3 .   ? -14.688 -3.602  -29.968 1.00 40.39 ? 501 A1EGD A C1  1 
HETATM 1891 C C2  . A1EGD C 3 .   ? -15.252 -4.193  -28.832 1.00 36.99 ? 501 A1EGD A C2  1 
HETATM 1892 C C3  . A1EGD C 3 .   ? -16.250 -3.581  -28.133 1.00 38.31 ? 501 A1EGD A C3  1 
HETATM 1893 C C4  . A1EGD C 3 .   ? -16.762 -4.246  -27.031 1.00 41.11 ? 501 A1EGD A C4  1 
HETATM 1894 N N1  . A1EGD C 3 .   ? -17.733 -3.672  -26.346 1.00 47.96 ? 501 A1EGD A N1  1 
HETATM 1895 C C5  . A1EGD C 3 .   ? -16.330 -5.434  -26.602 1.00 40.15 ? 501 A1EGD A C5  1 
HETATM 1896 N N2  . A1EGD C 3 .   ? -16.739 -6.191  -25.528 1.00 36.93 ? 501 A1EGD A N2  1 
HETATM 1897 C C6  . A1EGD C 3 .   ? -16.093 -7.354  -25.356 1.00 41.69 ? 501 A1EGD A C6  1 
HETATM 1898 N N3  . A1EGD C 3 .   ? -16.232 -8.247  -24.376 1.00 43.97 ? 501 A1EGD A N3  1 
HETATM 1899 S S1  . A1EGD C 3 .   ? -14.900 -7.525  -26.519 1.00 38.93 ? 501 A1EGD A S1  1 
HETATM 1900 C C7  . A1EGD C 3 .   ? -15.307 -6.010  -27.296 1.00 35.88 ? 501 A1EGD A C7  1 
HETATM 1901 C C8  . A1EGD C 3 .   ? -14.783 -5.410  -28.382 1.00 38.50 ? 501 A1EGD A C8  1 
HETATM 1902 O O   . HOH   D 4 .   ? 13.458  -10.642 -25.344 1.00 34.05 ? 601 HOH   A O   1 
HETATM 1903 O O   . HOH   D 4 .   ? 15.857  -9.657  -24.588 1.00 29.87 ? 602 HOH   A O   1 
HETATM 1904 O O   . HOH   D 4 .   ? 13.657  -17.090 -27.122 1.00 35.16 ? 603 HOH   A O   1 
HETATM 1905 O O   . HOH   D 4 .   ? -15.996 -10.807 -23.137 1.00 79.25 ? 604 HOH   A O   1 
HETATM 1906 O O   . HOH   D 4 .   ? 12.858  -19.362 -22.061 1.00 45.41 ? 605 HOH   A O   1 
HETATM 1907 O O   . HOH   D 4 .   ? 1.827   0.855   -21.816 1.00 28.83 ? 606 HOH   A O   1 
HETATM 1908 O O   . HOH   D 4 .   ? -14.536 -15.078 -17.312 1.00 30.57 ? 607 HOH   A O   1 
HETATM 1909 O O   . HOH   D 4 .   ? 13.919  -12.067 -21.466 1.00 39.37 ? 608 HOH   A O   1 
HETATM 1910 O O   . HOH   D 4 .   ? 11.758  5.117   -15.748 1.00 50.67 ? 609 HOH   A O   1 
HETATM 1911 O O   . HOH   D 4 .   ? 12.879  -8.457  -26.744 1.00 32.30 ? 610 HOH   A O   1 
HETATM 1912 O O   . HOH   D 4 .   ? -1.766  -5.901  -8.601  1.00 42.27 ? 611 HOH   A O   1 
HETATM 1913 O O   . HOH   D 4 .   ? 8.238   -6.286  -12.909 1.00 41.20 ? 612 HOH   A O   1 
HETATM 1914 O O   . HOH   D 4 .   ? -3.050  -13.756 -22.642 1.00 30.80 ? 613 HOH   A O   1 
HETATM 1915 O O   . HOH   D 4 .   ? 15.703  -4.916  -24.142 1.00 32.89 ? 614 HOH   A O   1 
HETATM 1916 O O   . HOH   D 4 .   ? -21.657 -4.989  -16.749 1.00 44.92 ? 615 HOH   A O   1 
HETATM 1917 O O   . HOH   D 4 .   ? -35.568 -4.878  -19.222 1.00 36.31 ? 616 HOH   A O   1 
HETATM 1918 O O   . HOH   D 4 .   ? -13.526 -19.676 -33.846 1.00 25.89 ? 617 HOH   A O   1 
HETATM 1919 O O   . HOH   D 4 .   ? -23.792 -0.738  -21.135 1.00 41.66 ? 618 HOH   A O   1 
HETATM 1920 O O   . HOH   D 4 .   ? -13.123 -10.236 -25.769 1.00 22.33 ? 619 HOH   A O   1 
HETATM 1921 O O   . HOH   D 4 .   ? -30.698 -13.243 -24.221 1.00 28.73 ? 620 HOH   A O   1 
HETATM 1922 O O   . HOH   D 4 .   ? -3.820  0.833   -27.586 1.00 27.81 ? 621 HOH   A O   1 
HETATM 1923 O O   . HOH   D 4 .   ? 4.338   -19.238 -40.413 1.00 20.17 ? 622 HOH   A O   1 
HETATM 1924 O O   . HOH   D 4 .   ? -13.163 -0.536  -41.781 1.00 31.70 ? 623 HOH   A O   1 
HETATM 1925 O O   . HOH   D 4 .   ? -28.884 -6.542  -29.303 1.00 25.77 ? 624 HOH   A O   1 
HETATM 1926 O O   . HOH   D 4 .   ? 5.686   3.739   -23.087 1.00 30.85 ? 625 HOH   A O   1 
HETATM 1927 O O   . HOH   D 4 .   ? -4.050  -15.970 -21.118 1.00 20.41 ? 626 HOH   A O   1 
HETATM 1928 O O   . HOH   D 4 .   ? -9.822  -10.684 -24.273 1.00 28.00 ? 627 HOH   A O   1 
HETATM 1929 O O   . HOH   D 4 .   ? 15.261  -17.864 -25.195 1.00 34.45 ? 628 HOH   A O   1 
HETATM 1930 O O   . HOH   D 4 .   ? 13.523  2.895   -15.470 1.00 45.44 ? 629 HOH   A O   1 
HETATM 1931 O O   . HOH   D 4 .   ? -24.941 1.723   -40.359 1.00 48.55 ? 630 HOH   A O   1 
HETATM 1932 O O   . HOH   D 4 .   ? 13.954  -23.721 -34.519 1.00 50.39 ? 631 HOH   A O   1 
HETATM 1933 O O   . HOH   D 4 .   ? -22.514 2.780   -33.281 1.00 31.17 ? 632 HOH   A O   1 
HETATM 1934 O O   . HOH   D 4 .   ? -23.930 -7.664  -22.009 1.00 36.58 ? 633 HOH   A O   1 
HETATM 1935 O O   . HOH   D 4 .   ? -41.100 -6.459  -23.858 1.00 31.80 ? 634 HOH   A O   1 
HETATM 1936 O O   . HOH   D 4 .   ? 12.399  -12.221 -32.053 1.00 29.28 ? 635 HOH   A O   1 
HETATM 1937 O O   . HOH   D 4 .   ? -6.904  3.981   -35.762 1.00 29.72 ? 636 HOH   A O   1 
HETATM 1938 O O   . HOH   D 4 .   ? -34.331 -0.785  -28.009 1.00 27.02 ? 637 HOH   A O   1 
HETATM 1939 O O   . HOH   D 4 .   ? -25.124 7.494   -27.115 1.00 35.81 ? 638 HOH   A O   1 
HETATM 1940 O O   . HOH   D 4 .   ? 14.986  -3.356  -18.911 1.00 32.77 ? 639 HOH   A O   1 
HETATM 1941 O O   . HOH   D 4 .   ? 15.117  -14.219 -19.614 1.00 38.77 ? 640 HOH   A O   1 
HETATM 1942 O O   . HOH   D 4 .   ? 2.415   4.935   -14.417 1.00 29.32 ? 641 HOH   A O   1 
HETATM 1943 O O   . HOH   D 4 .   ? -15.081 -14.451 -38.662 1.00 23.84 ? 642 HOH   A O   1 
HETATM 1944 O O   . HOH   D 4 .   ? -6.993  -20.840 -40.278 1.00 46.34 ? 643 HOH   A O   1 
HETATM 1945 O O   . HOH   D 4 .   ? -1.038  -23.309 -36.700 1.00 22.93 ? 644 HOH   A O   1 
HETATM 1946 O O   . HOH   D 4 .   ? -12.470 -18.208 -22.484 1.00 40.34 ? 645 HOH   A O   1 
HETATM 1947 O O   . HOH   D 4 .   ? -28.474 -14.926 -24.190 1.00 37.65 ? 646 HOH   A O   1 
HETATM 1948 O O   . HOH   D 4 .   ? -6.451  -21.650 -22.332 1.00 41.21 ? 647 HOH   A O   1 
HETATM 1949 O O   . HOH   D 4 .   ? -1.700  4.972   -20.160 1.00 32.74 ? 648 HOH   A O   1 
HETATM 1950 O O   . HOH   D 4 .   ? 8.829   -1.431  -11.201 1.00 30.87 ? 649 HOH   A O   1 
HETATM 1951 O O   . HOH   D 4 .   ? 10.403  -18.241 -22.058 1.00 30.11 ? 650 HOH   A O   1 
HETATM 1952 O O   . HOH   D 4 .   ? -11.230 -19.971 -32.295 1.00 30.24 ? 651 HOH   A O   1 
HETATM 1953 O O   . HOH   D 4 .   ? 6.112   -0.105  -25.678 1.00 23.40 ? 652 HOH   A O   1 
HETATM 1954 O O   . HOH   D 4 .   ? 2.210   -10.735 -11.871 1.00 27.13 ? 653 HOH   A O   1 
HETATM 1955 O O   . HOH   D 4 .   ? -4.648  9.085   -21.668 1.00 51.89 ? 654 HOH   A O   1 
HETATM 1956 O O   . HOH   D 4 .   ? 11.082  -7.152  -26.259 1.00 24.16 ? 655 HOH   A O   1 
HETATM 1957 O O   . HOH   D 4 .   ? -0.213  -2.746  -27.404 1.00 19.73 ? 656 HOH   A O   1 
HETATM 1958 O O   . HOH   D 4 .   ? 7.305   -27.560 -37.515 1.00 34.25 ? 657 HOH   A O   1 
HETATM 1959 O O   . HOH   D 4 .   ? 10.381  -4.310  -26.715 1.00 21.26 ? 658 HOH   A O   1 
HETATM 1960 O O   . HOH   D 4 .   ? -21.746 -11.222 -42.379 1.00 34.29 ? 659 HOH   A O   1 
HETATM 1961 O O   . HOH   D 4 .   ? 8.221   -1.106  -28.156 1.00 18.77 ? 660 HOH   A O   1 
HETATM 1962 O O   . HOH   D 4 .   ? -6.597  -21.577 -32.996 1.00 28.08 ? 661 HOH   A O   1 
HETATM 1963 O O   . HOH   D 4 .   ? 4.756   -4.907  -33.495 1.00 28.97 ? 662 HOH   A O   1 
HETATM 1964 O O   . HOH   D 4 .   ? -32.376 -10.334 -27.080 1.00 27.93 ? 663 HOH   A O   1 
HETATM 1965 O O   . HOH   D 4 .   ? 5.920   6.299   -20.518 1.00 36.59 ? 664 HOH   A O   1 
HETATM 1966 O O   . HOH   D 4 .   ? -29.334 -5.940  -23.795 1.00 25.24 ? 665 HOH   A O   1 
HETATM 1967 O O   . HOH   D 4 .   ? 2.390   -10.608 -40.170 1.00 18.41 ? 666 HOH   A O   1 
HETATM 1968 O O   . HOH   D 4 .   ? -12.737 -6.640  -43.543 1.00 28.74 ? 667 HOH   A O   1 
HETATM 1969 O O   . HOH   D 4 .   ? 4.108   -21.877 -41.124 1.00 22.55 ? 668 HOH   A O   1 
HETATM 1970 O O   . HOH   D 4 .   ? 1.548   -22.354 -14.296 1.00 25.65 ? 669 HOH   A O   1 
HETATM 1971 O O   . HOH   D 4 .   ? -16.306 -18.934 -28.094 1.00 41.49 ? 670 HOH   A O   1 
HETATM 1972 O O   . HOH   D 4 .   ? 5.177   0.434   -30.460 1.00 16.40 ? 671 HOH   A O   1 
HETATM 1973 O O   . HOH   D 4 .   ? -21.830 4.885   -36.625 1.00 44.27 ? 672 HOH   A O   1 
HETATM 1974 O O   . HOH   D 4 .   ? 9.998   -20.276 -35.744 1.00 20.32 ? 673 HOH   A O   1 
HETATM 1975 O O   . HOH   D 4 .   ? -26.640 -13.684 -34.941 1.00 51.22 ? 674 HOH   A O   1 
HETATM 1976 O O   . HOH   D 4 .   ? -2.773  -7.775  -37.880 1.00 22.29 ? 675 HOH   A O   1 
HETATM 1977 O O   . HOH   D 4 .   ? -1.715  5.130   -24.746 1.00 34.14 ? 676 HOH   A O   1 
HETATM 1978 O O   . HOH   D 4 .   ? -9.633  -13.281 -24.478 1.00 27.56 ? 677 HOH   A O   1 
HETATM 1979 O O   . HOH   D 4 .   ? -37.215 -3.511  -33.052 1.00 32.13 ? 678 HOH   A O   1 
HETATM 1980 O O   . HOH   D 4 .   ? -15.110 -20.897 -20.628 1.00 46.87 ? 679 HOH   A O   1 
HETATM 1981 O O   . HOH   D 4 .   ? -24.103 7.185   -23.962 1.00 34.29 ? 680 HOH   A O   1 
HETATM 1982 O O   . HOH   D 4 .   ? -19.508 -9.287  -38.936 1.00 39.67 ? 681 HOH   A O   1 
HETATM 1983 O O   . HOH   D 4 .   ? 6.206   4.212   -25.646 1.00 29.47 ? 682 HOH   A O   1 
HETATM 1984 O O   . HOH   D 4 .   ? 8.626   -10.500 -16.086 1.00 40.01 ? 683 HOH   A O   1 
HETATM 1985 O O   . HOH   D 4 .   ? 6.795   0.163   -11.590 1.00 29.04 ? 684 HOH   A O   1 
HETATM 1986 O O   . HOH   D 4 .   ? -1.262  -24.941 -19.669 1.00 32.45 ? 685 HOH   A O   1 
HETATM 1987 O O   . HOH   D 4 .   ? -7.205  -15.325 -14.651 1.00 32.07 ? 686 HOH   A O   1 
HETATM 1988 O O   . HOH   D 4 .   ? 12.457  -23.486 -28.385 1.00 37.81 ? 687 HOH   A O   1 
HETATM 1989 O O   . HOH   D 4 .   ? -16.950 -9.918  -14.607 1.00 25.30 ? 688 HOH   A O   1 
HETATM 1990 O O   . HOH   D 4 .   ? -25.112 -13.870 -37.036 1.00 40.87 ? 689 HOH   A O   1 
HETATM 1991 O O   . HOH   D 4 .   ? -13.601 5.460   -34.842 1.00 41.62 ? 690 HOH   A O   1 
HETATM 1992 O O   . HOH   D 4 .   ? -0.521  -3.398  -30.686 1.00 17.59 ? 691 HOH   A O   1 
HETATM 1993 O O   . HOH   D 4 .   ? -15.814 -19.264 -30.719 1.00 29.11 ? 692 HOH   A O   1 
HETATM 1994 O O   . HOH   D 4 .   ? 0.108   -16.644 -11.308 1.00 32.74 ? 693 HOH   A O   1 
HETATM 1995 O O   . HOH   D 4 .   ? -7.725  -15.489 -44.474 1.00 31.46 ? 694 HOH   A O   1 
HETATM 1996 O O   . HOH   D 4 .   ? -22.343 -20.051 -30.373 1.00 45.61 ? 695 HOH   A O   1 
HETATM 1997 O O   . HOH   D 4 .   ? -6.204  -21.005 -36.538 1.00 32.02 ? 696 HOH   A O   1 
HETATM 1998 O O   . HOH   D 4 .   ? -17.545 -13.145 -24.511 1.00 25.41 ? 697 HOH   A O   1 
HETATM 1999 O O   . HOH   D 4 .   ? -30.125 0.738   -22.902 1.00 29.34 ? 698 HOH   A O   1 
HETATM 2000 O O   . HOH   D 4 .   ? 11.033  -15.572 -21.041 1.00 23.82 ? 699 HOH   A O   1 
HETATM 2001 O O   . HOH   D 4 .   ? -7.489  -11.744 -21.260 1.00 33.04 ? 700 HOH   A O   1 
HETATM 2002 O O   . HOH   D 4 .   ? -8.152  -0.594  -38.282 1.00 34.64 ? 701 HOH   A O   1 
HETATM 2003 O O   . HOH   D 4 .   ? -28.635 -14.554 -28.015 1.00 42.88 ? 702 HOH   A O   1 
HETATM 2004 O O   . HOH   D 4 .   ? -27.172 -5.052  -34.224 1.00 32.22 ? 703 HOH   A O   1 
HETATM 2005 O O   . HOH   D 4 .   ? -6.404  -0.466  -25.910 1.00 24.36 ? 704 HOH   A O   1 
HETATM 2006 O O   . HOH   D 4 .   ? -36.533 -10.959 -28.038 1.00 33.71 ? 705 HOH   A O   1 
HETATM 2007 O O   . HOH   D 4 .   ? 8.771   -27.382 -35.509 1.00 31.12 ? 706 HOH   A O   1 
HETATM 2008 O O   . HOH   D 4 .   ? -25.307 -9.802  -42.841 1.00 41.93 ? 707 HOH   A O   1 
HETATM 2009 O O   . HOH   D 4 .   ? -12.446 -12.051 -41.924 1.00 29.26 ? 708 HOH   A O   1 
HETATM 2010 O O   . HOH   D 4 .   ? -4.192  -12.667 -45.056 1.00 35.68 ? 709 HOH   A O   1 
HETATM 2011 O O   . HOH   D 4 .   ? -4.287  -10.124 -37.556 1.00 25.61 ? 710 HOH   A O   1 
HETATM 2012 O O   . HOH   D 4 .   ? -10.322 -12.079 -20.835 1.00 32.16 ? 711 HOH   A O   1 
HETATM 2013 O O   . HOH   D 4 .   ? -9.338  -13.385 -14.356 1.00 35.07 ? 712 HOH   A O   1 
HETATM 2014 O O   . HOH   D 4 .   ? -0.635  7.250   -22.491 1.00 34.51 ? 713 HOH   A O   1 
HETATM 2015 O O   . HOH   D 4 .   ? -21.308 -0.788  -19.662 1.00 39.44 ? 714 HOH   A O   1 
HETATM 2016 O O   . HOH   D 4 .   ? 10.192  -17.486 -35.162 1.00 20.16 ? 715 HOH   A O   1 
HETATM 2017 O O   . HOH   D 4 .   ? 9.604   -0.447  -25.678 1.00 23.58 ? 716 HOH   A O   1 
HETATM 2018 O O   . HOH   D 4 .   ? -14.137 -14.061 -41.229 1.00 25.06 ? 717 HOH   A O   1 
HETATM 2019 O O   . HOH   D 4 .   ? 9.287   -6.575  -15.074 1.00 40.73 ? 718 HOH   A O   1 
HETATM 2020 O O   . HOH   D 4 .   ? -11.618 -15.534 -25.797 1.00 40.22 ? 719 HOH   A O   1 
HETATM 2021 O O   . HOH   D 4 .   ? -4.946  -23.671 -31.007 1.00 31.92 ? 720 HOH   A O   1 
HETATM 2022 O O   . HOH   D 4 .   ? -19.449 -16.644 -24.656 1.00 29.37 ? 721 HOH   A O   1 
HETATM 2023 O O   . HOH   D 4 .   ? -7.253  -23.192 -16.668 1.00 40.96 ? 722 HOH   A O   1 
HETATM 2024 O O   . HOH   D 4 .   ? -5.780  -8.507  -43.156 1.00 29.98 ? 723 HOH   A O   1 
HETATM 2025 O O   . HOH   D 4 .   ? -13.009 -16.527 -15.539 1.00 35.39 ? 724 HOH   A O   1 
HETATM 2026 O O   . HOH   D 4 .   ? -21.543 0.593   -12.751 1.00 41.81 ? 725 HOH   A O   1 
HETATM 2027 O O   . HOH   D 4 .   ? -31.867 -3.994  -20.813 1.00 43.08 ? 726 HOH   A O   1 
HETATM 2028 O O   . HOH   D 4 .   ? 10.090  -22.585 -20.733 1.00 30.74 ? 727 HOH   A O   1 
HETATM 2029 O O   . HOH   D 4 .   ? -19.780 -18.230 -40.037 1.00 33.47 ? 728 HOH   A O   1 
HETATM 2030 O O   . HOH   D 4 .   ? -30.223 -5.000  -31.092 1.00 29.89 ? 729 HOH   A O   1 
HETATM 2031 O O   . HOH   D 4 .   ? -28.675 -3.756  -41.662 1.00 49.12 ? 730 HOH   A O   1 
HETATM 2032 O O   . HOH   D 4 .   ? 15.934  -15.825 -39.828 1.00 43.77 ? 731 HOH   A O   1 
HETATM 2033 O O   . HOH   D 4 .   ? 4.598   0.017   -23.103 1.00 32.15 ? 732 HOH   A O   1 
HETATM 2034 O O   . HOH   D 4 .   ? 12.178  0.996   -22.890 1.00 40.33 ? 733 HOH   A O   1 
HETATM 2035 O O   . HOH   D 4 .   ? 14.218  -18.640 -29.043 1.00 39.65 ? 734 HOH   A O   1 
HETATM 2036 O O   . HOH   D 4 .   ? -25.874 6.070   -30.296 1.00 49.39 ? 735 HOH   A O   1 
HETATM 2037 O O   . HOH   D 4 .   ? -20.930 -12.595 -16.537 1.00 32.33 ? 736 HOH   A O   1 
HETATM 2038 O O   . HOH   D 4 .   ? 1.829   -3.847  -29.123 1.00 17.14 ? 737 HOH   A O   1 
HETATM 2039 O O   . HOH   D 4 .   ? -25.970 -14.441 -31.997 1.00 31.76 ? 738 HOH   A O   1 
HETATM 2040 O O   . HOH   D 4 .   ? 7.637   2.563   -10.128 1.00 37.12 ? 739 HOH   A O   1 
HETATM 2041 O O   . HOH   D 4 .   ? 10.988  -14.484 -35.707 1.00 23.64 ? 740 HOH   A O   1 
HETATM 2042 O O   . HOH   D 4 .   ? -38.207 -4.061  -21.999 1.00 52.00 ? 741 HOH   A O   1 
HETATM 2043 O O   . HOH   D 4 .   ? 3.184   -3.522  -6.415  1.00 46.39 ? 742 HOH   A O   1 
HETATM 2044 O O   . HOH   D 4 .   ? -18.301 -1.386  -13.359 1.00 36.74 ? 743 HOH   A O   1 
HETATM 2045 O O   . HOH   D 4 .   ? 2.447   0.553   -5.834  1.00 38.18 ? 744 HOH   A O   1 
HETATM 2046 O O   . HOH   D 4 .   ? -13.873 -14.037 -21.284 1.00 33.99 ? 745 HOH   A O   1 
HETATM 2047 O O   . HOH   D 4 .   ? 1.780   3.390   -7.503  1.00 31.73 ? 746 HOH   A O   1 
HETATM 2048 O O   . HOH   D 4 .   ? -11.635 -14.152 -43.357 1.00 42.73 ? 747 HOH   A O   1 
HETATM 2049 O O   . HOH   D 4 .   ? -21.558 -14.627 -18.162 1.00 31.97 ? 748 HOH   A O   1 
HETATM 2050 O O   . HOH   D 4 .   ? -7.529  3.933   -23.961 1.00 42.61 ? 749 HOH   A O   1 
HETATM 2051 O O   . HOH   D 4 .   ? -18.097 1.805   -37.108 1.00 35.04 ? 750 HOH   A O   1 
HETATM 2052 O O   . HOH   D 4 .   ? -22.508 1.149   -39.610 1.00 32.89 ? 751 HOH   A O   1 
HETATM 2053 O O   . HOH   D 4 .   ? -32.145 1.077   -34.411 1.00 36.60 ? 752 HOH   A O   1 
HETATM 2054 O O   . HOH   D 4 .   ? -30.369 -8.814  -29.351 1.00 34.97 ? 753 HOH   A O   1 
HETATM 2055 O O   . HOH   D 4 .   ? -10.901 -14.728 -21.756 1.00 32.11 ? 754 HOH   A O   1 
HETATM 2056 O O   . HOH   D 4 .   ? -25.646 -16.819 -31.208 1.00 41.46 ? 755 HOH   A O   1 
HETATM 2057 O O   . HOH   D 4 .   ? 1.622   -24.070 -16.286 1.00 35.05 ? 756 HOH   A O   1 
HETATM 2058 O O   . HOH   D 4 .   ? -16.347 -15.507 -24.033 1.00 30.98 ? 757 HOH   A O   1 
HETATM 2059 O O   . HOH   D 4 .   ? 0.458   -19.933 -41.946 1.00 34.67 ? 758 HOH   A O   1 
HETATM 2060 O O   . HOH   D 4 .   ? 9.058   -24.035 -26.473 1.00 37.35 ? 759 HOH   A O   1 
HETATM 2061 O O   . HOH   D 4 .   ? 9.343   -19.983 -19.991 1.00 26.38 ? 760 HOH   A O   1 
HETATM 2062 O O   . HOH   D 4 .   ? -38.434 -2.714  -23.668 1.00 46.81 ? 761 HOH   A O   1 
HETATM 2063 O O   . HOH   D 4 .   ? -15.614 -12.766 -23.475 1.00 32.71 ? 762 HOH   A O   1 
HETATM 2064 O O   . HOH   D 4 .   ? 9.184   -4.219  -11.284 1.00 39.16 ? 763 HOH   A O   1 
HETATM 2065 O O   . HOH   D 4 .   ? -15.137 -8.124  -44.098 1.00 37.06 ? 764 HOH   A O   1 
HETATM 2066 O O   . HOH   D 4 .   ? 2.169   -17.577 -41.473 1.00 29.84 ? 765 HOH   A O   1 
HETATM 2067 O O   . HOH   D 4 .   ? 11.243  -11.243 -34.477 0.50 32.05 ? 766 HOH   A O   1 
HETATM 2068 O O   . HOH   D 4 .   ? -10.941 -8.546  -44.158 1.00 36.74 ? 767 HOH   A O   1 
HETATM 2069 O O   . HOH   D 4 .   ? 1.348   -22.285 -40.870 1.00 25.62 ? 768 HOH   A O   1 
HETATM 2070 O O   . HOH   D 4 .   ? -13.560 -16.112 -23.709 1.00 32.77 ? 769 HOH   A O   1 
HETATM 2071 O O   . HOH   D 4 .   ? -31.299 -1.108  -24.360 1.00 30.00 ? 770 HOH   A O   1 
HETATM 2072 O O   . HOH   D 4 .   ? 15.483  -2.604  -25.957 1.00 39.92 ? 771 HOH   A O   1 
HETATM 2073 O O   . HOH   D 4 .   ? -6.245  3.738   -26.196 1.00 46.92 ? 772 HOH   A O   1 
HETATM 2074 O O   . HOH   D 4 .   ? -9.382  -21.443 -33.631 1.00 40.04 ? 773 HOH   A O   1 
HETATM 2075 O O   . HOH   D 4 .   ? -13.283 -20.937 -22.464 1.00 50.36 ? 774 HOH   A O   1 
HETATM 2076 O O   . HOH   D 4 .   ? 17.410  -14.074 -20.589 1.00 38.65 ? 775 HOH   A O   1 
HETATM 2077 O O   . HOH   D 4 .   ? -33.295 0.090   -25.750 1.00 35.67 ? 776 HOH   A O   1 
HETATM 2078 O O   . HOH   D 4 .   ? -5.337  -23.513 -36.781 1.00 47.49 ? 777 HOH   A O   1 
HETATM 2079 O O   . HOH   D 4 .   ? -3.079  -24.941 -36.513 1.00 43.48 ? 778 HOH   A O   1 
HETATM 2080 O O   . HOH   D 4 .   ? 0.628   -23.896 -38.820 1.00 24.31 ? 779 HOH   A O   1 
HETATM 2081 O O   . HOH   D 4 .   ? -4.650  6.413   -23.015 1.00 47.91 ? 780 HOH   A O   1 
HETATM 2082 O O   . HOH   D 4 .   ? 9.347   1.622   -23.998 1.00 39.89 ? 781 HOH   A O   1 
HETATM 2083 O O   . HOH   D 4 .   ? -4.449  -10.205 -44.727 1.00 37.29 ? 782 HOH   A O   1 
HETATM 2084 O O   . HOH   D 4 .   ? 11.432  -15.903 -18.262 1.00 32.87 ? 783 HOH   A O   1 
HETATM 2085 O O   . HOH   D 4 .   ? -42.627 -5.028  -25.304 1.00 41.23 ? 784 HOH   A O   1 
HETATM 2086 O O   . HOH   D 4 .   ? -3.980  -25.361 -20.478 1.00 46.40 ? 785 HOH   A O   1 
HETATM 2087 O O   . HOH   D 4 .   ? -18.276 -8.059  -13.168 1.00 32.80 ? 786 HOH   A O   1 
HETATM 2088 O O   . HOH   D 4 .   ? -9.470  -7.289  -45.535 1.00 56.61 ? 787 HOH   A O   1 
HETATM 2089 O O   . HOH   D 4 .   ? -11.116 -17.509 -26.504 1.00 38.27 ? 788 HOH   A O   1 
HETATM 2090 O O   . HOH   D 4 .   ? 15.476  -17.845 -18.756 1.00 33.54 ? 789 HOH   A O   1 
HETATM 2091 O O   . HOH   D 4 .   ? -30.962 -3.744  -23.429 1.00 28.61 ? 790 HOH   A O   1 
HETATM 2092 O O   . HOH   D 4 .   ? -30.175 -0.084  -20.330 1.00 38.57 ? 791 HOH   A O   1 
HETATM 2093 O O   . HOH   D 4 .   ? 0.365   -23.676 -43.267 1.00 35.99 ? 792 HOH   A O   1 
HETATM 2094 O O   . HOH   D 4 .   ? -18.413 -12.330 -15.601 1.00 35.13 ? 793 HOH   A O   1 
HETATM 2095 O O   . HOH   D 4 .   ? 16.371  -20.668 -21.936 1.00 31.69 ? 794 HOH   A O   1 
HETATM 2096 O O   . HOH   D 4 .   ? -33.825 2.715   -26.142 1.00 42.47 ? 795 HOH   A O   1 
HETATM 2097 O O   . HOH   D 4 .   ? -0.591  -26.218 -39.809 1.00 46.32 ? 796 HOH   A O   1 
# 
