data_8R00
# 
_entry.id   8R00 
# 
_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   8R00         pdb_00008r00 10.2210/pdb8r00/pdb 
WWPDB D_1292134367 ?            ?                   
# 
_pdbx_audit_revision_history.ordinal             1 
_pdbx_audit_revision_history.data_content_type   'Structure model' 
_pdbx_audit_revision_history.major_revision      1 
_pdbx_audit_revision_history.minor_revision      0 
_pdbx_audit_revision_history.revision_date       2025-04-16 
_pdbx_audit_revision_history.part_number         ? 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        8R00 
_pdbx_database_status.recvd_initial_deposition_date   2023-10-30 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    PDBE 
_pdbx_database_status.process_site                    PDBE 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              bourguet@cbs.cnrs.fr 
_pdbx_contact_author.name_first         William 
_pdbx_contact_author.name_last          Bourguet 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-0643-7719 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Bourguet, W.'  1 0000-0002-0643-7719 
'Carivenc, C.'  2 0000-0002-4413-9106 
'Sirounian, S.' 3 ?                   
# 
_citation.abstract                  ? 
_citation.abstract_id_CAS           ? 
_citation.book_id_ISBN              ? 
_citation.book_publisher            ? 
_citation.book_publisher_city       ? 
_citation.book_title                ? 
_citation.coordinate_linkage        ? 
_citation.country                   UK 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            'Nat Commun' 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2041-1723 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            16 
_citation.language                  ? 
_citation.page_first                1280 
_citation.page_last                 1280 
_citation.title                     
'An abundant ginger compound furanodienone alleviates gut inflammation via the xenobiotic nuclear receptor PXR in mice.' 
_citation.year                      2025 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.1038/s41467-025-56624-0 
_citation.pdbx_database_id_PubMed   39900639 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Wang, X.'        1  ?                   
primary 'Zhang, G.'       2  ?                   
primary 'Bian, Z.'        3  0009-0007-6507-0287 
primary 'Chow, V.'        4  ?                   
primary 'Grimaldi, M.'    5  ?                   
primary 'Carivenc, C.'    6  0000-0002-4413-9106 
primary 'Sirounian, S.'   7  0009-0009-6790-9730 
primary 'Li, H.'          8  ?                   
primary 'Sladekova, L.'   9  0000-0003-2054-5625 
primary 'Motta, S.'       10 0000-0002-0812-6834 
primary 'Luperi, Y.'      11 ?                   
primary 'Gong, Y.'        12 0000-0002-1396-527X 
primary 'Costello, C.'    13 ?                   
primary 'Li, L.'          14 0000-0003-3204-0915 
primary 'Jachimowicz, M.' 15 ?                   
primary 'Guo, M.'         16 ?                   
primary 'Hu, S.'          17 ?                   
primary 'Wilson, D.'      18 0000-0002-7012-6085 
primary 'Balaguer, P.'    19 0000-0002-3524-3622 
primary 'Bourguet, W.'    20 ?                   
primary 'Mani, S.'        21 0000-0003-4132-6157 
primary 'Bonati, L.'      22 0000-0003-3028-0368 
primary 'Peng, H.'        23 0000-0002-2000-1647 
primary 'March, J.'       24 ?                   
primary 'Wang, H.'        25 ?                   
primary 'Wang, S.'        26 0000-0003-3575-9212 
primary 'Krause, H.M.'    27 0000-0002-6182-7074 
primary 'Liu, J.'         28 0000-0002-5440-1841 
# 
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 'Nuclear receptor subfamily 1 group I member 2' 36747.465 1   ? ? ? ? 
2 non-polymer syn furanodienone                                   230.302   1   ? ? ? ? 
3 water       nat water                                           18.015    144 ? ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        
'Orphan nuclear receptor PAR1,Orphan nuclear receptor PXR,Pregnane X receptor,Steroid and xenobiotic receptor,SXR' 
# 
_entity_poly.entity_id                      1 
_entity_poly.type                           'polypeptide(L)' 
_entity_poly.nstd_linkage                   no 
_entity_poly.nstd_monomer                   no 
_entity_poly.pdbx_seq_one_letter_code       
;MKKGHHHHHHGSERTGTQPLGVQGLTEEQRMMIRELMDAQMKTFDTTFSHFKNFRLPGVLSSGCELPESLQAPSREEAAK
WSQVRKDLCSLKVSLQLRGEDGSVWNYKPPADSGGKEIFSLLPHMADMSTYMFKGIISFAKVISYFRDLPIEDQISLLKG
AAFELCQLRFNTVFNAETGTWECGRLSYCLEDTAGGFQQLLLEPMLKFHYMLKKLQLHEEEYVLMQAISLFSPDRPGVLQ
HRVVDQLQEQFAITLKSYIECNRPQPAHRFLFLKIMAMLTELRSINAQHTQRLLRIQDIHPFATPLMQELFGITGSLVPR
;
_entity_poly.pdbx_seq_one_letter_code_can   
;MKKGHHHHHHGSERTGTQPLGVQGLTEEQRMMIRELMDAQMKTFDTTFSHFKNFRLPGVLSSGCELPESLQAPSREEAAK
WSQVRKDLCSLKVSLQLRGEDGSVWNYKPPADSGGKEIFSLLPHMADMSTYMFKGIISFAKVISYFRDLPIEDQISLLKG
AAFELCQLRFNTVFNAETGTWECGRLSYCLEDTAGGFQQLLLEPMLKFHYMLKKLQLHEEEYVLMQAISLFSPDRPGVLQ
HRVVDQLQEQFAITLKSYIECNRPQPAHRFLFLKIMAMLTELRSINAQHTQRLLRIQDIHPFATPLMQELFGITGSLVPR
;
_entity_poly.pdbx_strand_id                 A 
_entity_poly.pdbx_target_identifier         ? 
# 
loop_
_pdbx_entity_nonpoly.entity_id 
_pdbx_entity_nonpoly.name 
_pdbx_entity_nonpoly.comp_id 
2 furanodienone XFQ 
3 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   LYS n 
1 3   LYS n 
1 4   GLY 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  GLY n 
1 12  SER n 
1 13  GLU n 
1 14  ARG n 
1 15  THR n 
1 16  GLY n 
1 17  THR n 
1 18  GLN n 
1 19  PRO n 
1 20  LEU n 
1 21  GLY n 
1 22  VAL n 
1 23  GLN n 
1 24  GLY n 
1 25  LEU n 
1 26  THR n 
1 27  GLU n 
1 28  GLU n 
1 29  GLN n 
1 30  ARG n 
1 31  MET n 
1 32  MET n 
1 33  ILE n 
1 34  ARG n 
1 35  GLU n 
1 36  LEU n 
1 37  MET n 
1 38  ASP n 
1 39  ALA n 
1 40  GLN n 
1 41  MET n 
1 42  LYS n 
1 43  THR n 
1 44  PHE n 
1 45  ASP n 
1 46  THR n 
1 47  THR n 
1 48  PHE n 
1 49  SER n 
1 50  HIS n 
1 51  PHE n 
1 52  LYS n 
1 53  ASN n 
1 54  PHE n 
1 55  ARG n 
1 56  LEU n 
1 57  PRO n 
1 58  GLY n 
1 59  VAL n 
1 60  LEU n 
1 61  SER n 
1 62  SER n 
1 63  GLY n 
1 64  CYS n 
1 65  GLU n 
1 66  LEU n 
1 67  PRO n 
1 68  GLU n 
1 69  SER n 
1 70  LEU n 
1 71  GLN n 
1 72  ALA n 
1 73  PRO n 
1 74  SER n 
1 75  ARG n 
1 76  GLU n 
1 77  GLU n 
1 78  ALA n 
1 79  ALA n 
1 80  LYS n 
1 81  TRP n 
1 82  SER n 
1 83  GLN n 
1 84  VAL n 
1 85  ARG n 
1 86  LYS n 
1 87  ASP n 
1 88  LEU n 
1 89  CYS n 
1 90  SER n 
1 91  LEU n 
1 92  LYS n 
1 93  VAL n 
1 94  SER n 
1 95  LEU n 
1 96  GLN n 
1 97  LEU n 
1 98  ARG n 
1 99  GLY n 
1 100 GLU n 
1 101 ASP n 
1 102 GLY n 
1 103 SER n 
1 104 VAL n 
1 105 TRP n 
1 106 ASN n 
1 107 TYR n 
1 108 LYS n 
1 109 PRO n 
1 110 PRO n 
1 111 ALA n 
1 112 ASP n 
1 113 SER n 
1 114 GLY n 
1 115 GLY n 
1 116 LYS n 
1 117 GLU n 
1 118 ILE n 
1 119 PHE n 
1 120 SER n 
1 121 LEU n 
1 122 LEU n 
1 123 PRO n 
1 124 HIS n 
1 125 MET n 
1 126 ALA n 
1 127 ASP n 
1 128 MET n 
1 129 SER n 
1 130 THR n 
1 131 TYR n 
1 132 MET n 
1 133 PHE n 
1 134 LYS n 
1 135 GLY n 
1 136 ILE n 
1 137 ILE n 
1 138 SER n 
1 139 PHE n 
1 140 ALA n 
1 141 LYS n 
1 142 VAL n 
1 143 ILE n 
1 144 SER n 
1 145 TYR n 
1 146 PHE n 
1 147 ARG n 
1 148 ASP n 
1 149 LEU n 
1 150 PRO n 
1 151 ILE n 
1 152 GLU n 
1 153 ASP n 
1 154 GLN n 
1 155 ILE n 
1 156 SER n 
1 157 LEU n 
1 158 LEU n 
1 159 LYS n 
1 160 GLY n 
1 161 ALA n 
1 162 ALA n 
1 163 PHE n 
1 164 GLU n 
1 165 LEU n 
1 166 CYS n 
1 167 GLN n 
1 168 LEU n 
1 169 ARG n 
1 170 PHE n 
1 171 ASN n 
1 172 THR n 
1 173 VAL n 
1 174 PHE n 
1 175 ASN n 
1 176 ALA n 
1 177 GLU n 
1 178 THR n 
1 179 GLY n 
1 180 THR n 
1 181 TRP n 
1 182 GLU n 
1 183 CYS n 
1 184 GLY n 
1 185 ARG n 
1 186 LEU n 
1 187 SER n 
1 188 TYR n 
1 189 CYS n 
1 190 LEU n 
1 191 GLU n 
1 192 ASP n 
1 193 THR n 
1 194 ALA n 
1 195 GLY n 
1 196 GLY n 
1 197 PHE n 
1 198 GLN n 
1 199 GLN n 
1 200 LEU n 
1 201 LEU n 
1 202 LEU n 
1 203 GLU n 
1 204 PRO n 
1 205 MET n 
1 206 LEU n 
1 207 LYS n 
1 208 PHE n 
1 209 HIS n 
1 210 TYR n 
1 211 MET n 
1 212 LEU n 
1 213 LYS n 
1 214 LYS n 
1 215 LEU n 
1 216 GLN n 
1 217 LEU n 
1 218 HIS n 
1 219 GLU n 
1 220 GLU n 
1 221 GLU n 
1 222 TYR n 
1 223 VAL n 
1 224 LEU n 
1 225 MET n 
1 226 GLN n 
1 227 ALA n 
1 228 ILE n 
1 229 SER n 
1 230 LEU n 
1 231 PHE n 
1 232 SER n 
1 233 PRO n 
1 234 ASP n 
1 235 ARG n 
1 236 PRO n 
1 237 GLY n 
1 238 VAL n 
1 239 LEU n 
1 240 GLN n 
1 241 HIS n 
1 242 ARG n 
1 243 VAL n 
1 244 VAL n 
1 245 ASP n 
1 246 GLN n 
1 247 LEU n 
1 248 GLN n 
1 249 GLU n 
1 250 GLN n 
1 251 PHE n 
1 252 ALA n 
1 253 ILE n 
1 254 THR n 
1 255 LEU n 
1 256 LYS n 
1 257 SER n 
1 258 TYR n 
1 259 ILE n 
1 260 GLU n 
1 261 CYS n 
1 262 ASN n 
1 263 ARG n 
1 264 PRO n 
1 265 GLN n 
1 266 PRO n 
1 267 ALA n 
1 268 HIS n 
1 269 ARG n 
1 270 PHE n 
1 271 LEU n 
1 272 PHE n 
1 273 LEU n 
1 274 LYS n 
1 275 ILE n 
1 276 MET n 
1 277 ALA n 
1 278 MET n 
1 279 LEU n 
1 280 THR n 
1 281 GLU n 
1 282 LEU n 
1 283 ARG n 
1 284 SER n 
1 285 ILE n 
1 286 ASN n 
1 287 ALA n 
1 288 GLN n 
1 289 HIS n 
1 290 THR n 
1 291 GLN n 
1 292 ARG n 
1 293 LEU n 
1 294 LEU n 
1 295 ARG n 
1 296 ILE n 
1 297 GLN n 
1 298 ASP n 
1 299 ILE n 
1 300 HIS n 
1 301 PRO n 
1 302 PHE n 
1 303 ALA n 
1 304 THR n 
1 305 PRO n 
1 306 LEU n 
1 307 MET n 
1 308 GLN n 
1 309 GLU n 
1 310 LEU n 
1 311 PHE n 
1 312 GLY n 
1 313 ILE n 
1 314 THR n 
1 315 GLY n 
1 316 SER n 
1 317 LEU n 
1 318 VAL n 
1 319 PRO n 
1 320 ARG n 
# 
_entity_src_gen.entity_id                          1 
_entity_src_gen.pdbx_src_id                        1 
_entity_src_gen.pdbx_alt_source_flag               sample 
_entity_src_gen.pdbx_seq_type                      'Biological sequence' 
_entity_src_gen.pdbx_beg_seq_num                   1 
_entity_src_gen.pdbx_end_seq_num                   320 
_entity_src_gen.gene_src_common_name               human 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 'NR1I2, PXR' 
_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      'Homo sapiens' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     9606 
_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      'Escherichia coli BL21(DE3)' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     469008 
_entity_src_gen.host_org_genus                     ? 
_entity_src_gen.pdbx_host_org_gene                 ? 
_entity_src_gen.pdbx_host_org_organ                ? 
_entity_src_gen.host_org_species                   ? 
_entity_src_gen.pdbx_host_org_tissue               ? 
_entity_src_gen.pdbx_host_org_tissue_fraction      ? 
_entity_src_gen.pdbx_host_org_strain               ? 
_entity_src_gen.pdbx_host_org_variant              ? 
_entity_src_gen.pdbx_host_org_cell_line            ? 
_entity_src_gen.pdbx_host_org_atcc                 ? 
_entity_src_gen.pdbx_host_org_culture_collection   ? 
_entity_src_gen.pdbx_host_org_cell                 ? 
_entity_src_gen.pdbx_host_org_organelle            ? 
_entity_src_gen.pdbx_host_org_cellular_location    ? 
_entity_src_gen.pdbx_host_org_vector_type          ? 
_entity_src_gen.pdbx_host_org_vector               ? 
_entity_src_gen.host_org_details                   ? 
_entity_src_gen.expression_system_id               ? 
_entity_src_gen.plasmid_name                       ? 
_entity_src_gen.plasmid_details                    ? 
_entity_src_gen.pdbx_description                   ? 
# 
loop_
_chem_comp.id 
_chem_comp.type 
_chem_comp.mon_nstd_flag 
_chem_comp.name 
_chem_comp.pdbx_synonyms 
_chem_comp.formula 
_chem_comp.formula_weight 
ALA 'L-peptide linking' y ALANINE         ?                                                             'C3 H7 N O2'     89.093  
ARG 'L-peptide linking' y ARGININE        ?                                                             'C6 H15 N4 O2 1' 175.209 
ASN 'L-peptide linking' y ASPARAGINE      ?                                                             'C4 H8 N2 O3'    132.118 
ASP 'L-peptide linking' y 'ASPARTIC ACID' ?                                                             'C4 H7 N O4'     133.103 
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 
XFQ non-polymer         . furanodienone   '3,6,10-trimethyl-8,11-dihydro-7~{H}-cyclodeca[b]furan-4-one' 'C15 H18 O2'     230.302 
# 
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   119 ?   ?   ?   A . n 
A 1 2   LYS 2   120 ?   ?   ?   A . n 
A 1 3   LYS 3   121 ?   ?   ?   A . n 
A 1 4   GLY 4   122 ?   ?   ?   A . n 
A 1 5   HIS 5   123 ?   ?   ?   A . n 
A 1 6   HIS 6   124 ?   ?   ?   A . n 
A 1 7   HIS 7   125 ?   ?   ?   A . n 
A 1 8   HIS 8   126 ?   ?   ?   A . n 
A 1 9   HIS 9   127 ?   ?   ?   A . n 
A 1 10  HIS 10  128 ?   ?   ?   A . n 
A 1 11  GLY 11  129 ?   ?   ?   A . n 
A 1 12  SER 12  130 ?   ?   ?   A . n 
A 1 13  GLU 13  131 ?   ?   ?   A . n 
A 1 14  ARG 14  132 ?   ?   ?   A . n 
A 1 15  THR 15  133 ?   ?   ?   A . n 
A 1 16  GLY 16  134 ?   ?   ?   A . n 
A 1 17  THR 17  135 ?   ?   ?   A . n 
A 1 18  GLN 18  136 ?   ?   ?   A . n 
A 1 19  PRO 19  137 ?   ?   ?   A . n 
A 1 20  LEU 20  138 ?   ?   ?   A . n 
A 1 21  GLY 21  139 ?   ?   ?   A . n 
A 1 22  VAL 22  140 ?   ?   ?   A . n 
A 1 23  GLN 23  141 ?   ?   ?   A . n 
A 1 24  GLY 24  142 142 GLY GLY A . n 
A 1 25  LEU 25  143 143 LEU LEU A . n 
A 1 26  THR 26  144 144 THR THR A . n 
A 1 27  GLU 27  145 145 GLU GLU A . n 
A 1 28  GLU 28  146 146 GLU GLU A . n 
A 1 29  GLN 29  147 147 GLN GLN A . n 
A 1 30  ARG 30  148 148 ARG ARG A . n 
A 1 31  MET 31  149 149 MET MET A . n 
A 1 32  MET 32  150 150 MET MET A . n 
A 1 33  ILE 33  151 151 ILE ILE A . n 
A 1 34  ARG 34  152 152 ARG ARG A . n 
A 1 35  GLU 35  153 153 GLU GLU A . n 
A 1 36  LEU 36  154 154 LEU LEU A . n 
A 1 37  MET 37  155 155 MET MET A . n 
A 1 38  ASP 38  156 156 ASP ASP A . n 
A 1 39  ALA 39  157 157 ALA ALA A . n 
A 1 40  GLN 40  158 158 GLN GLN A . n 
A 1 41  MET 41  159 159 MET MET A . n 
A 1 42  LYS 42  160 160 LYS LYS A . n 
A 1 43  THR 43  161 161 THR THR A . n 
A 1 44  PHE 44  162 162 PHE PHE A . n 
A 1 45  ASP 45  163 163 ASP ASP A . n 
A 1 46  THR 46  164 164 THR THR A . n 
A 1 47  THR 47  165 165 THR THR A . n 
A 1 48  PHE 48  166 166 PHE PHE A . n 
A 1 49  SER 49  167 167 SER SER A . n 
A 1 50  HIS 50  168 168 HIS HIS A . n 
A 1 51  PHE 51  169 169 PHE PHE A . n 
A 1 52  LYS 52  170 170 LYS LYS A . n 
A 1 53  ASN 53  171 171 ASN ASN A . n 
A 1 54  PHE 54  172 172 PHE PHE A . n 
A 1 55  ARG 55  173 173 ARG ARG A . n 
A 1 56  LEU 56  174 174 LEU LEU A . n 
A 1 57  PRO 57  175 175 PRO PRO A . n 
A 1 58  GLY 58  176 176 GLY GLY A . n 
A 1 59  VAL 59  177 177 VAL VAL A . n 
A 1 60  LEU 60  178 ?   ?   ?   A . n 
A 1 61  SER 61  179 ?   ?   ?   A . n 
A 1 62  SER 62  180 ?   ?   ?   A . n 
A 1 63  GLY 63  181 ?   ?   ?   A . n 
A 1 64  CYS 64  182 ?   ?   ?   A . n 
A 1 65  GLU 65  183 ?   ?   ?   A . n 
A 1 66  LEU 66  184 ?   ?   ?   A . n 
A 1 67  PRO 67  185 ?   ?   ?   A . n 
A 1 68  GLU 68  186 ?   ?   ?   A . n 
A 1 69  SER 69  187 ?   ?   ?   A . n 
A 1 70  LEU 70  188 ?   ?   ?   A . n 
A 1 71  GLN 71  189 ?   ?   ?   A . n 
A 1 72  ALA 72  190 ?   ?   ?   A . n 
A 1 73  PRO 73  191 ?   ?   ?   A . n 
A 1 74  SER 74  192 ?   ?   ?   A . n 
A 1 75  ARG 75  193 ?   ?   ?   A . n 
A 1 76  GLU 76  194 ?   ?   ?   A . n 
A 1 77  GLU 77  195 ?   ?   ?   A . n 
A 1 78  ALA 78  196 196 ALA ALA A . n 
A 1 79  ALA 79  197 197 ALA ALA A . n 
A 1 80  LYS 80  198 198 LYS LYS A . n 
A 1 81  TRP 81  199 199 TRP TRP A . n 
A 1 82  SER 82  200 200 SER SER A . n 
A 1 83  GLN 83  201 201 GLN GLN A . n 
A 1 84  VAL 84  202 202 VAL VAL A . n 
A 1 85  ARG 85  203 203 ARG ARG A . n 
A 1 86  LYS 86  204 204 LYS LYS A . n 
A 1 87  ASP 87  205 205 ASP ASP A . n 
A 1 88  LEU 88  206 206 LEU LEU A . n 
A 1 89  CYS 89  207 207 CYS CYS A . n 
A 1 90  SER 90  208 208 SER SER A . n 
A 1 91  LEU 91  209 209 LEU LEU A . n 
A 1 92  LYS 92  210 210 LYS LYS A . n 
A 1 93  VAL 93  211 211 VAL VAL A . n 
A 1 94  SER 94  212 212 SER SER A . n 
A 1 95  LEU 95  213 213 LEU LEU A . n 
A 1 96  GLN 96  214 214 GLN GLN A . n 
A 1 97  LEU 97  215 215 LEU LEU A . n 
A 1 98  ARG 98  216 216 ARG ARG A . n 
A 1 99  GLY 99  217 217 GLY GLY A . n 
A 1 100 GLU 100 218 218 GLU GLU A . n 
A 1 101 ASP 101 219 219 ASP ASP A . n 
A 1 102 GLY 102 220 220 GLY GLY A . n 
A 1 103 SER 103 221 221 SER SER A . n 
A 1 104 VAL 104 222 222 VAL VAL A . n 
A 1 105 TRP 105 223 223 TRP TRP A . n 
A 1 106 ASN 106 224 224 ASN ASN A . n 
A 1 107 TYR 107 225 225 TYR TYR A . n 
A 1 108 LYS 108 226 226 LYS LYS A . n 
A 1 109 PRO 109 227 227 PRO PRO A . n 
A 1 110 PRO 110 228 228 PRO PRO A . n 
A 1 111 ALA 111 229 229 ALA ALA A . n 
A 1 112 ASP 112 230 230 ASP ASP A . n 
A 1 113 SER 113 231 231 SER SER A . n 
A 1 114 GLY 114 232 232 GLY GLY A . n 
A 1 115 GLY 115 233 233 GLY GLY A . n 
A 1 116 LYS 116 234 234 LYS LYS A . n 
A 1 117 GLU 117 235 235 GLU GLU A . n 
A 1 118 ILE 118 236 236 ILE ILE A . n 
A 1 119 PHE 119 237 237 PHE PHE A . n 
A 1 120 SER 120 238 238 SER SER A . n 
A 1 121 LEU 121 239 239 LEU LEU A . n 
A 1 122 LEU 122 240 240 LEU LEU A . n 
A 1 123 PRO 123 241 241 PRO PRO A . n 
A 1 124 HIS 124 242 242 HIS HIS A . n 
A 1 125 MET 125 243 243 MET MET A . n 
A 1 126 ALA 126 244 244 ALA ALA A . n 
A 1 127 ASP 127 245 245 ASP ASP A . n 
A 1 128 MET 128 246 246 MET MET A . n 
A 1 129 SER 129 247 247 SER SER A . n 
A 1 130 THR 130 248 248 THR THR A . n 
A 1 131 TYR 131 249 249 TYR TYR A . n 
A 1 132 MET 132 250 250 MET MET A . n 
A 1 133 PHE 133 251 251 PHE PHE A . n 
A 1 134 LYS 134 252 252 LYS LYS A . n 
A 1 135 GLY 135 253 253 GLY GLY A . n 
A 1 136 ILE 136 254 254 ILE ILE A . n 
A 1 137 ILE 137 255 255 ILE ILE A . n 
A 1 138 SER 138 256 256 SER SER A . n 
A 1 139 PHE 139 257 257 PHE PHE A . n 
A 1 140 ALA 140 258 258 ALA ALA A . n 
A 1 141 LYS 141 259 259 LYS LYS A . n 
A 1 142 VAL 142 260 260 VAL VAL A . n 
A 1 143 ILE 143 261 261 ILE ILE A . n 
A 1 144 SER 144 262 262 SER SER A . n 
A 1 145 TYR 145 263 263 TYR TYR A . n 
A 1 146 PHE 146 264 264 PHE PHE A . n 
A 1 147 ARG 147 265 265 ARG ARG A . n 
A 1 148 ASP 148 266 266 ASP ASP A . n 
A 1 149 LEU 149 267 267 LEU LEU A . n 
A 1 150 PRO 150 268 268 PRO PRO A . n 
A 1 151 ILE 151 269 269 ILE ILE A . n 
A 1 152 GLU 152 270 270 GLU GLU A . n 
A 1 153 ASP 153 271 271 ASP ASP A . n 
A 1 154 GLN 154 272 272 GLN GLN A . n 
A 1 155 ILE 155 273 273 ILE ILE A . n 
A 1 156 SER 156 274 274 SER SER A . n 
A 1 157 LEU 157 275 275 LEU LEU A . n 
A 1 158 LEU 158 276 276 LEU LEU A . n 
A 1 159 LYS 159 277 277 LYS LYS A . n 
A 1 160 GLY 160 278 278 GLY GLY A . n 
A 1 161 ALA 161 279 279 ALA ALA A . n 
A 1 162 ALA 162 280 280 ALA ALA A . n 
A 1 163 PHE 163 281 281 PHE PHE A . n 
A 1 164 GLU 164 282 282 GLU GLU A . n 
A 1 165 LEU 165 283 283 LEU LEU A . n 
A 1 166 CYS 166 284 284 CYS CYS A . n 
A 1 167 GLN 167 285 285 GLN GLN A . n 
A 1 168 LEU 168 286 286 LEU LEU A . n 
A 1 169 ARG 169 287 287 ARG ARG A . n 
A 1 170 PHE 170 288 288 PHE PHE A . n 
A 1 171 ASN 171 289 289 ASN ASN A . n 
A 1 172 THR 172 290 290 THR THR A . n 
A 1 173 VAL 173 291 291 VAL VAL A . n 
A 1 174 PHE 174 292 292 PHE PHE A . n 
A 1 175 ASN 175 293 293 ASN ASN A . n 
A 1 176 ALA 176 294 294 ALA ALA A . n 
A 1 177 GLU 177 295 295 GLU GLU A . n 
A 1 178 THR 178 296 296 THR THR A . n 
A 1 179 GLY 179 297 297 GLY GLY A . n 
A 1 180 THR 180 298 298 THR THR A . n 
A 1 181 TRP 181 299 299 TRP TRP A . n 
A 1 182 GLU 182 300 300 GLU GLU A . n 
A 1 183 CYS 183 301 301 CYS CYS A . n 
A 1 184 GLY 184 302 302 GLY GLY A . n 
A 1 185 ARG 185 303 303 ARG ARG A . n 
A 1 186 LEU 186 304 304 LEU LEU A . n 
A 1 187 SER 187 305 305 SER SER A . n 
A 1 188 TYR 188 306 306 TYR TYR A . n 
A 1 189 CYS 189 307 307 CYS CYS A . n 
A 1 190 LEU 190 308 308 LEU LEU A . n 
A 1 191 GLU 191 309 309 GLU GLU A . n 
A 1 192 ASP 192 310 310 ASP ASP A . n 
A 1 193 THR 193 311 ?   ?   ?   A . n 
A 1 194 ALA 194 312 ?   ?   ?   A . n 
A 1 195 GLY 195 313 ?   ?   ?   A . n 
A 1 196 GLY 196 314 314 GLY GLY A . n 
A 1 197 PHE 197 315 315 PHE PHE A . n 
A 1 198 GLN 198 316 316 GLN GLN A . n 
A 1 199 GLN 199 317 317 GLN GLN A . n 
A 1 200 LEU 200 318 318 LEU LEU A . n 
A 1 201 LEU 201 319 319 LEU LEU A . n 
A 1 202 LEU 202 320 320 LEU LEU A . n 
A 1 203 GLU 203 321 321 GLU GLU A . n 
A 1 204 PRO 204 322 322 PRO PRO A . n 
A 1 205 MET 205 323 323 MET MET A . n 
A 1 206 LEU 206 324 324 LEU LEU A . n 
A 1 207 LYS 207 325 325 LYS LYS A . n 
A 1 208 PHE 208 326 326 PHE PHE A . n 
A 1 209 HIS 209 327 327 HIS HIS A . n 
A 1 210 TYR 210 328 328 TYR TYR A . n 
A 1 211 MET 211 329 329 MET MET A . n 
A 1 212 LEU 212 330 330 LEU LEU A . n 
A 1 213 LYS 213 331 331 LYS LYS A . n 
A 1 214 LYS 214 332 332 LYS LYS A . n 
A 1 215 LEU 215 333 333 LEU LEU A . n 
A 1 216 GLN 216 334 334 GLN GLN A . n 
A 1 217 LEU 217 335 335 LEU LEU A . n 
A 1 218 HIS 218 336 336 HIS HIS A . n 
A 1 219 GLU 219 337 337 GLU GLU A . n 
A 1 220 GLU 220 338 338 GLU GLU A . n 
A 1 221 GLU 221 339 339 GLU GLU A . n 
A 1 222 TYR 222 340 340 TYR TYR A . n 
A 1 223 VAL 223 341 341 VAL VAL A . n 
A 1 224 LEU 224 342 342 LEU LEU A . n 
A 1 225 MET 225 343 343 MET MET A . n 
A 1 226 GLN 226 344 344 GLN GLN A . n 
A 1 227 ALA 227 345 345 ALA ALA A . n 
A 1 228 ILE 228 346 346 ILE ILE A . n 
A 1 229 SER 229 347 347 SER SER A . n 
A 1 230 LEU 230 348 348 LEU LEU A . n 
A 1 231 PHE 231 349 349 PHE PHE A . n 
A 1 232 SER 232 350 350 SER SER A . n 
A 1 233 PRO 233 351 351 PRO PRO A . n 
A 1 234 ASP 234 352 352 ASP ASP A . n 
A 1 235 ARG 235 353 353 ARG ARG A . n 
A 1 236 PRO 236 354 354 PRO PRO A . n 
A 1 237 GLY 237 355 355 GLY GLY A . n 
A 1 238 VAL 238 356 356 VAL VAL A . n 
A 1 239 LEU 239 357 357 LEU LEU A . n 
A 1 240 GLN 240 358 358 GLN GLN A . n 
A 1 241 HIS 241 359 359 HIS HIS A . n 
A 1 242 ARG 242 360 360 ARG ARG A . n 
A 1 243 VAL 243 361 361 VAL VAL A . n 
A 1 244 VAL 244 362 362 VAL VAL A . n 
A 1 245 ASP 245 363 363 ASP ASP A . n 
A 1 246 GLN 246 364 364 GLN GLN A . n 
A 1 247 LEU 247 365 365 LEU LEU A . n 
A 1 248 GLN 248 366 366 GLN GLN A . n 
A 1 249 GLU 249 367 367 GLU GLU A . n 
A 1 250 GLN 250 368 368 GLN GLN A . n 
A 1 251 PHE 251 369 369 PHE PHE A . n 
A 1 252 ALA 252 370 370 ALA ALA A . n 
A 1 253 ILE 253 371 371 ILE ILE A . n 
A 1 254 THR 254 372 372 THR THR A . n 
A 1 255 LEU 255 373 373 LEU LEU A . n 
A 1 256 LYS 256 374 374 LYS LYS A . n 
A 1 257 SER 257 375 375 SER SER A . n 
A 1 258 TYR 258 376 376 TYR TYR A . n 
A 1 259 ILE 259 377 377 ILE ILE A . n 
A 1 260 GLU 260 378 378 GLU GLU A . n 
A 1 261 CYS 261 379 379 CYS CYS A . n 
A 1 262 ASN 262 380 380 ASN ASN A . n 
A 1 263 ARG 263 381 381 ARG ARG A . n 
A 1 264 PRO 264 382 382 PRO PRO A . n 
A 1 265 GLN 265 383 383 GLN GLN A . n 
A 1 266 PRO 266 384 384 PRO PRO A . n 
A 1 267 ALA 267 385 385 ALA ALA A . n 
A 1 268 HIS 268 386 386 HIS HIS A . n 
A 1 269 ARG 269 387 387 ARG ARG A . n 
A 1 270 PHE 270 388 388 PHE PHE A . n 
A 1 271 LEU 271 389 389 LEU LEU A . n 
A 1 272 PHE 272 390 390 PHE PHE A . n 
A 1 273 LEU 273 391 391 LEU LEU A . n 
A 1 274 LYS 274 392 392 LYS LYS A . n 
A 1 275 ILE 275 393 393 ILE ILE A . n 
A 1 276 MET 276 394 394 MET MET A . n 
A 1 277 ALA 277 395 395 ALA ALA A . n 
A 1 278 MET 278 396 396 MET MET A . n 
A 1 279 LEU 279 397 397 LEU LEU A . n 
A 1 280 THR 280 398 398 THR THR A . n 
A 1 281 GLU 281 399 399 GLU GLU A . n 
A 1 282 LEU 282 400 400 LEU LEU A . n 
A 1 283 ARG 283 401 401 ARG ARG A . n 
A 1 284 SER 284 402 402 SER SER A . n 
A 1 285 ILE 285 403 403 ILE ILE A . n 
A 1 286 ASN 286 404 404 ASN ASN A . n 
A 1 287 ALA 287 405 405 ALA ALA A . n 
A 1 288 GLN 288 406 406 GLN GLN A . n 
A 1 289 HIS 289 407 407 HIS HIS A . n 
A 1 290 THR 290 408 408 THR THR A . n 
A 1 291 GLN 291 409 409 GLN GLN A . n 
A 1 292 ARG 292 410 410 ARG ARG A . n 
A 1 293 LEU 293 411 411 LEU LEU A . n 
A 1 294 LEU 294 412 412 LEU LEU A . n 
A 1 295 ARG 295 413 413 ARG ARG A . n 
A 1 296 ILE 296 414 414 ILE ILE A . n 
A 1 297 GLN 297 415 415 GLN GLN A . n 
A 1 298 ASP 298 416 416 ASP ASP A . n 
A 1 299 ILE 299 417 417 ILE ILE A . n 
A 1 300 HIS 300 418 418 HIS HIS A . n 
A 1 301 PRO 301 419 419 PRO PRO A . n 
A 1 302 PHE 302 420 420 PHE PHE A . n 
A 1 303 ALA 303 421 421 ALA ALA A . n 
A 1 304 THR 304 422 422 THR THR A . n 
A 1 305 PRO 305 423 423 PRO PRO A . n 
A 1 306 LEU 306 424 424 LEU LEU A . n 
A 1 307 MET 307 425 425 MET MET A . n 
A 1 308 GLN 308 426 426 GLN GLN A . n 
A 1 309 GLU 309 427 427 GLU GLU A . n 
A 1 310 LEU 310 428 428 LEU LEU A . n 
A 1 311 PHE 311 429 429 PHE PHE A . n 
A 1 312 GLY 312 430 430 GLY GLY A . n 
A 1 313 ILE 313 431 431 ILE ILE A . n 
A 1 314 THR 314 432 432 THR THR A . n 
A 1 315 GLY 315 433 433 GLY GLY A . n 
A 1 316 SER 316 434 434 SER SER A . n 
A 1 317 LEU 317 435 435 LEU LEU A . n 
A 1 318 VAL 318 436 ?   ?   ?   A . n 
A 1 319 PRO 319 437 ?   ?   ?   A . n 
A 1 320 ARG 320 438 ?   ?   ?   A . n 
# 
_pdbx_entity_instance_feature.ordinal        1 
_pdbx_entity_instance_feature.comp_id        XFQ 
_pdbx_entity_instance_feature.asym_id        ? 
_pdbx_entity_instance_feature.seq_num        ? 
_pdbx_entity_instance_feature.auth_comp_id   XFQ 
_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 
B 2 XFQ 1   501 1   XFQ FUR A . 
C 3 HOH 1   601 163 HOH HOH A . 
C 3 HOH 2   602 152 HOH HOH A . 
C 3 HOH 3   603 22  HOH HOH A . 
C 3 HOH 4   604 3   HOH HOH A . 
C 3 HOH 5   605 2   HOH HOH A . 
C 3 HOH 6   606 120 HOH HOH A . 
C 3 HOH 7   607 11  HOH HOH A . 
C 3 HOH 8   608 5   HOH HOH A . 
C 3 HOH 9   609 14  HOH HOH A . 
C 3 HOH 10  610 145 HOH HOH A . 
C 3 HOH 11  611 8   HOH HOH A . 
C 3 HOH 12  612 27  HOH HOH A . 
C 3 HOH 13  613 42  HOH HOH A . 
C 3 HOH 14  614 156 HOH HOH A . 
C 3 HOH 15  615 7   HOH HOH A . 
C 3 HOH 16  616 44  HOH HOH A . 
C 3 HOH 17  617 24  HOH HOH A . 
C 3 HOH 18  618 165 HOH HOH A . 
C 3 HOH 19  619 41  HOH HOH A . 
C 3 HOH 20  620 36  HOH HOH A . 
C 3 HOH 21  621 30  HOH HOH A . 
C 3 HOH 22  622 16  HOH HOH A . 
C 3 HOH 23  623 20  HOH HOH A . 
C 3 HOH 24  624 131 HOH HOH A . 
C 3 HOH 25  625 10  HOH HOH A . 
C 3 HOH 26  626 18  HOH HOH A . 
C 3 HOH 27  627 106 HOH HOH A . 
C 3 HOH 28  628 13  HOH HOH A . 
C 3 HOH 29  629 110 HOH HOH A . 
C 3 HOH 30  630 23  HOH HOH A . 
C 3 HOH 31  631 52  HOH HOH A . 
C 3 HOH 32  632 21  HOH HOH A . 
C 3 HOH 33  633 47  HOH HOH A . 
C 3 HOH 34  634 31  HOH HOH A . 
C 3 HOH 35  635 54  HOH HOH A . 
C 3 HOH 36  636 66  HOH HOH A . 
C 3 HOH 37  637 117 HOH HOH A . 
C 3 HOH 38  638 12  HOH HOH A . 
C 3 HOH 39  639 127 HOH HOH A . 
C 3 HOH 40  640 158 HOH HOH A . 
C 3 HOH 41  641 73  HOH HOH A . 
C 3 HOH 42  642 49  HOH HOH A . 
C 3 HOH 43  643 64  HOH HOH A . 
C 3 HOH 44  644 128 HOH HOH A . 
C 3 HOH 45  645 38  HOH HOH A . 
C 3 HOH 46  646 15  HOH HOH A . 
C 3 HOH 47  647 56  HOH HOH A . 
C 3 HOH 48  648 159 HOH HOH A . 
C 3 HOH 49  649 50  HOH HOH A . 
C 3 HOH 50  650 35  HOH HOH A . 
C 3 HOH 51  651 43  HOH HOH A . 
C 3 HOH 52  652 149 HOH HOH A . 
C 3 HOH 53  653 143 HOH HOH A . 
C 3 HOH 54  654 28  HOH HOH A . 
C 3 HOH 55  655 58  HOH HOH A . 
C 3 HOH 56  656 25  HOH HOH A . 
C 3 HOH 57  657 9   HOH HOH A . 
C 3 HOH 58  658 147 HOH HOH A . 
C 3 HOH 59  659 154 HOH HOH A . 
C 3 HOH 60  660 40  HOH HOH A . 
C 3 HOH 61  661 71  HOH HOH A . 
C 3 HOH 62  662 112 HOH HOH A . 
C 3 HOH 63  663 160 HOH HOH A . 
C 3 HOH 64  664 34  HOH HOH A . 
C 3 HOH 65  665 37  HOH HOH A . 
C 3 HOH 66  666 151 HOH HOH A . 
C 3 HOH 67  667 78  HOH HOH A . 
C 3 HOH 68  668 53  HOH HOH A . 
C 3 HOH 69  669 133 HOH HOH A . 
C 3 HOH 70  670 48  HOH HOH A . 
C 3 HOH 71  671 29  HOH HOH A . 
C 3 HOH 72  672 107 HOH HOH A . 
C 3 HOH 73  673 59  HOH HOH A . 
C 3 HOH 74  674 82  HOH HOH A . 
C 3 HOH 75  675 75  HOH HOH A . 
C 3 HOH 76  676 32  HOH HOH A . 
C 3 HOH 77  677 51  HOH HOH A . 
C 3 HOH 78  678 72  HOH HOH A . 
C 3 HOH 79  679 69  HOH HOH A . 
C 3 HOH 80  680 63  HOH HOH A . 
C 3 HOH 81  681 61  HOH HOH A . 
C 3 HOH 82  682 62  HOH HOH A . 
C 3 HOH 83  683 68  HOH HOH A . 
C 3 HOH 84  684 33  HOH HOH A . 
C 3 HOH 85  685 79  HOH HOH A . 
C 3 HOH 86  686 90  HOH HOH A . 
C 3 HOH 87  687 45  HOH HOH A . 
C 3 HOH 88  688 162 HOH HOH A . 
C 3 HOH 89  689 57  HOH HOH A . 
C 3 HOH 90  690 80  HOH HOH A . 
C 3 HOH 91  691 65  HOH HOH A . 
C 3 HOH 92  692 142 HOH HOH A . 
C 3 HOH 93  693 26  HOH HOH A . 
C 3 HOH 94  694 83  HOH HOH A . 
C 3 HOH 95  695 39  HOH HOH A . 
C 3 HOH 96  696 70  HOH HOH A . 
C 3 HOH 97  697 74  HOH HOH A . 
C 3 HOH 98  698 77  HOH HOH A . 
C 3 HOH 99  699 161 HOH HOH A . 
C 3 HOH 100 700 60  HOH HOH A . 
C 3 HOH 101 701 76  HOH HOH A . 
C 3 HOH 102 702 81  HOH HOH A . 
C 3 HOH 103 703 116 HOH HOH A . 
C 3 HOH 104 704 87  HOH HOH A . 
C 3 HOH 105 705 137 HOH HOH A . 
C 3 HOH 106 706 92  HOH HOH A . 
C 3 HOH 107 707 103 HOH HOH A . 
C 3 HOH 108 708 86  HOH HOH A . 
C 3 HOH 109 709 113 HOH HOH A . 
C 3 HOH 110 710 91  HOH HOH A . 
C 3 HOH 111 711 85  HOH HOH A . 
C 3 HOH 112 712 108 HOH HOH A . 
C 3 HOH 113 713 134 HOH HOH A . 
C 3 HOH 114 714 93  HOH HOH A . 
C 3 HOH 115 715 89  HOH HOH A . 
C 3 HOH 116 716 84  HOH HOH A . 
C 3 HOH 117 717 67  HOH HOH A . 
C 3 HOH 118 718 118 HOH HOH A . 
C 3 HOH 119 719 95  HOH HOH A . 
C 3 HOH 120 720 164 HOH HOH A . 
C 3 HOH 121 721 94  HOH HOH A . 
C 3 HOH 122 722 96  HOH HOH A . 
C 3 HOH 123 723 125 HOH HOH A . 
C 3 HOH 124 724 136 HOH HOH A . 
C 3 HOH 125 725 122 HOH HOH A . 
C 3 HOH 126 726 135 HOH HOH A . 
C 3 HOH 127 727 105 HOH HOH A . 
C 3 HOH 128 728 97  HOH HOH A . 
C 3 HOH 129 729 141 HOH HOH A . 
C 3 HOH 130 730 104 HOH HOH A . 
C 3 HOH 131 731 102 HOH HOH A . 
C 3 HOH 132 732 98  HOH HOH A . 
C 3 HOH 133 733 146 HOH HOH A . 
C 3 HOH 134 734 138 HOH HOH A . 
C 3 HOH 135 735 111 HOH HOH A . 
C 3 HOH 136 736 119 HOH HOH A . 
C 3 HOH 137 737 114 HOH HOH A . 
C 3 HOH 138 738 130 HOH HOH A . 
C 3 HOH 139 739 100 HOH HOH A . 
C 3 HOH 140 740 148 HOH HOH A . 
C 3 HOH 141 741 124 HOH HOH A . 
C 3 HOH 142 742 101 HOH HOH A . 
C 3 HOH 143 743 123 HOH HOH A . 
C 3 HOH 144 744 140 HOH HOH A . 
# 
loop_
_pdbx_unobs_or_zero_occ_atoms.id 
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 
_pdbx_unobs_or_zero_occ_atoms.polymer_flag 
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id 
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id 
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id 
_pdbx_unobs_or_zero_occ_atoms.label_alt_id 
_pdbx_unobs_or_zero_occ_atoms.label_asym_id 
_pdbx_unobs_or_zero_occ_atoms.label_comp_id 
_pdbx_unobs_or_zero_occ_atoms.label_seq_id 
_pdbx_unobs_or_zero_occ_atoms.label_atom_id 
1  1 Y 1 A GLU 146 ? CD  ? A GLU 28  CD  
2  1 Y 1 A GLU 146 ? OE1 ? A GLU 28  OE1 
3  1 Y 1 A GLU 146 ? OE2 ? A GLU 28  OE2 
4  1 Y 1 A LYS 170 ? CD  ? A LYS 52  CD  
5  1 Y 1 A LYS 170 ? CE  ? A LYS 52  CE  
6  1 Y 1 A LYS 170 ? NZ  ? A LYS 52  NZ  
7  1 Y 1 A VAL 177 ? CG1 ? A VAL 59  CG1 
8  1 Y 1 A VAL 177 ? CG2 ? A VAL 59  CG2 
9  1 Y 1 A SER 200 ? OG  ? A SER 82  OG  
10 1 Y 1 A ARG 203 ? CG  ? A ARG 85  CG  
11 1 Y 1 A ARG 203 ? CD  ? A ARG 85  CD  
12 1 Y 1 A ARG 203 ? NE  ? A ARG 85  NE  
13 1 Y 1 A ARG 203 ? CZ  ? A ARG 85  CZ  
14 1 Y 1 A ARG 203 ? NH1 ? A ARG 85  NH1 
15 1 Y 1 A ARG 203 ? NH2 ? A ARG 85  NH2 
16 1 Y 1 A LYS 204 ? CG  ? A LYS 86  CG  
17 1 Y 1 A LYS 204 ? CD  ? A LYS 86  CD  
18 1 Y 1 A LYS 204 ? CE  ? A LYS 86  CE  
19 1 Y 1 A LYS 204 ? NZ  ? A LYS 86  NZ  
20 1 Y 1 A CYS 207 ? SG  ? A CYS 89  SG  
21 1 Y 1 A SER 208 ? OG  ? A SER 90  OG  
22 1 Y 1 A LEU 209 ? CG  ? A LEU 91  CG  
23 1 Y 1 A LEU 209 ? CD1 ? A LEU 91  CD1 
24 1 Y 1 A LEU 209 ? CD2 ? A LEU 91  CD2 
25 1 Y 1 A LYS 210 ? CG  ? A LYS 92  CG  
26 1 Y 1 A LYS 210 ? CD  ? A LYS 92  CD  
27 1 Y 1 A LYS 210 ? CE  ? A LYS 92  CE  
28 1 Y 1 A LYS 210 ? NZ  ? A LYS 92  NZ  
29 1 Y 1 A GLU 218 ? CD  ? A GLU 100 CD  
30 1 Y 1 A GLU 218 ? OE1 ? A GLU 100 OE1 
31 1 Y 1 A GLU 218 ? OE2 ? A GLU 100 OE2 
32 1 Y 1 A LYS 226 ? CD  ? A LYS 108 CD  
33 1 Y 1 A LYS 226 ? CE  ? A LYS 108 CE  
34 1 Y 1 A LYS 226 ? NZ  ? A LYS 108 NZ  
35 1 Y 1 A SER 231 ? OG  ? A SER 113 OG  
36 1 Y 1 A LYS 234 ? CG  ? A LYS 116 CG  
37 1 Y 1 A LYS 234 ? CD  ? A LYS 116 CD  
38 1 Y 1 A LYS 234 ? CE  ? A LYS 116 CE  
39 1 Y 1 A LYS 234 ? NZ  ? A LYS 116 NZ  
40 1 Y 1 A ILE 236 ? CD1 ? A ILE 118 CD1 
41 1 Y 1 A ARG 303 ? CD  ? A ARG 185 CD  
42 1 Y 1 A ARG 303 ? NE  ? A ARG 185 NE  
43 1 Y 1 A ARG 303 ? CZ  ? A ARG 185 CZ  
44 1 Y 1 A ARG 303 ? NH1 ? A ARG 185 NH1 
45 1 Y 1 A ARG 303 ? NH2 ? A ARG 185 NH2 
46 1 Y 1 A ASP 310 ? CG  ? A ASP 192 CG  
47 1 Y 1 A ASP 310 ? OD1 ? A ASP 192 OD1 
48 1 Y 1 A ASP 310 ? OD2 ? A ASP 192 OD2 
49 1 Y 1 A PHE 315 ? CG  ? A PHE 197 CG  
50 1 Y 1 A PHE 315 ? CD1 ? A PHE 197 CD1 
51 1 Y 1 A PHE 315 ? CD2 ? A PHE 197 CD2 
52 1 Y 1 A PHE 315 ? CE1 ? A PHE 197 CE1 
53 1 Y 1 A PHE 315 ? CE2 ? A PHE 197 CE2 
54 1 Y 1 A PHE 315 ? CZ  ? A PHE 197 CZ  
55 1 Y 1 A GLN 316 ? CG  ? A GLN 198 CG  
56 1 Y 1 A GLN 316 ? CD  ? A GLN 198 CD  
57 1 Y 1 A GLN 316 ? OE1 ? A GLN 198 OE1 
58 1 Y 1 A GLN 316 ? NE2 ? A GLN 198 NE2 
59 1 Y 1 A GLN 317 ? CD  ? A GLN 199 CD  
60 1 Y 1 A GLN 317 ? OE1 ? A GLN 199 OE1 
61 1 Y 1 A GLN 317 ? NE2 ? A GLN 199 NE2 
62 1 Y 1 A LEU 318 ? CG  ? A LEU 200 CG  
63 1 Y 1 A LEU 318 ? CD1 ? A LEU 200 CD1 
64 1 Y 1 A LEU 318 ? CD2 ? A LEU 200 CD2 
65 1 Y 1 A LEU 324 ? CD1 ? A LEU 206 CD1 
66 1 Y 1 A LEU 324 ? CD2 ? A LEU 206 CD2 
67 1 Y 1 A LYS 325 ? CE  ? A LYS 207 CE  
68 1 Y 1 A LYS 325 ? NZ  ? A LYS 207 NZ  
69 1 Y 1 A LYS 332 ? CE  ? A LYS 214 CE  
70 1 Y 1 A LYS 332 ? NZ  ? A LYS 214 NZ  
71 1 Y 1 A ARG 360 ? CG  ? A ARG 242 CG  
72 1 Y 1 A ARG 360 ? CD  ? A ARG 242 CD  
73 1 Y 1 A ARG 360 ? NE  ? A ARG 242 NE  
74 1 Y 1 A ARG 360 ? CZ  ? A ARG 242 CZ  
75 1 Y 1 A ARG 360 ? NH1 ? A ARG 242 NH1 
76 1 Y 1 A ARG 360 ? NH2 ? A ARG 242 NH2 
77 1 Y 1 A GLN 364 ? CD  ? A GLN 246 CD  
78 1 Y 1 A GLN 364 ? OE1 ? A GLN 246 OE1 
79 1 Y 1 A GLN 364 ? NE2 ? A GLN 246 NE2 
80 1 Y 1 A LEU 411 ? CD1 ? A LEU 293 CD1 
81 1 Y 1 A LEU 411 ? CD2 ? A LEU 293 CD2 
82 1 Y 1 A LEU 435 ? CG  ? A LEU 317 CG  
83 1 Y 1 A LEU 435 ? CD1 ? A LEU 317 CD1 
84 1 Y 1 A LEU 435 ? CD2 ? A LEU 317 CD2 
# 
loop_
_software.citation_id 
_software.classification 
_software.compiler_name 
_software.compiler_version 
_software.contact_author 
_software.contact_author_email 
_software.date 
_software.description 
_software.dependencies 
_software.hardware 
_software.language 
_software.location 
_software.mods 
_software.name 
_software.os 
_software.os_version 
_software.type 
_software.version 
_software.pdbx_ordinal 
? refinement       ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? '(1.18.2_3874: ???)' 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? SCALA  ? ? ? .                    2 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS    ? ? ? .                    3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? .                    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                     8R00 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     91.826 
_cell.length_a_esd                 ? 
_cell.length_b                     91.826 
_cell.length_b_esd                 ? 
_cell.length_c                     85.731 
_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                         8R00 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                96 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'P 43 21 2' 
_symmetry.pdbx_full_space_group_name_H-M   ? 
# 
_exptl.absorpt_coefficient_mu     ? 
_exptl.absorpt_correction_T_max   ? 
_exptl.absorpt_correction_T_min   ? 
_exptl.absorpt_correction_type    ? 
_exptl.absorpt_process_details    ? 
_exptl.entry_id                   8R00 
_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             2.46 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          49.98 
_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, HANGING 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    '50-100 mM IMIDAZOLE, 8-14% ISOPROPANOL' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            291 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER X 4M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-02-09 
_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   0.8856 
_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                        'ESRF BEAMLINE ID30B' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        0.8856 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   ID30B 
_diffrn_source.pdbx_synchrotron_site       ESRF 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       8R00 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.95 
_reflns.d_resolution_low                               85.73 
_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                                     27166 
_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                           99.6 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                7.7 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          21.3 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               ? 
_reflns.pdbx_scaling_rejects                           ? 
_reflns.pdbx_d_res_high_opt                            ? 
_reflns.pdbx_d_res_low_opt                             ? 
_reflns.pdbx_d_res_opt_method                          ? 
_reflns.phase_calculation_details                      ? 
_reflns.pdbx_Rrim_I_all                                0.052 
_reflns.pdbx_Rpim_I_all                                0.018 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       207844 
_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                              0.049 
_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                                    1.95 
_reflns_shell.d_res_low                                     2.06 
_reflns_shell.meanI_over_sigI_all                           ? 
_reflns_shell.meanI_over_sigI_obs                           ? 
_reflns_shell.number_measured_all                           28977 
_reflns_shell.number_measured_obs                           ? 
_reflns_shell.number_possible                               ? 
_reflns_shell.number_unique_all                             ? 
_reflns_shell.number_unique_obs                             3897 
_reflns_shell.percent_possible_obs                          100.0 
_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                               7.4 
_reflns_shell.pdbx_chi_squared                              ? 
_reflns_shell.pdbx_netI_over_sigmaI_all                     ? 
_reflns_shell.pdbx_netI_over_sigmaI_obs                     3.4 
_reflns_shell.pdbx_Rrim_I_all                               0.627 
_reflns_shell.pdbx_Rpim_I_all                               0.219 
_reflns_shell.pdbx_rejects                                  ? 
_reflns_shell.pdbx_ordinal                                  1 
_reflns_shell.pdbx_diffrn_id                                1 
_reflns_shell.pdbx_CC_half                                  0.880 
_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                                  0.586 
_reflns_shell.pdbx_Rsym_value                               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal             ? 
_reflns_shell.pdbx_percent_possible_spherical               ? 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous   ? 
_reflns_shell.pdbx_percent_possible_spherical_anomalous     ? 
_reflns_shell.pdbx_redundancy_anomalous                     ? 
_reflns_shell.pdbx_CC_half_anomalous                        ? 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous             ? 
_reflns_shell.pdbx_percent_possible_anomalous               ? 
# 
_refine.aniso_B[1][1]                            ? 
_refine.aniso_B[1][2]                            ? 
_refine.aniso_B[1][3]                            ? 
_refine.aniso_B[2][2]                            ? 
_refine.aniso_B[2][3]                            ? 
_refine.aniso_B[3][3]                            ? 
_refine.B_iso_max                                ? 
_refine.B_iso_mean                               ? 
_refine.B_iso_min                                ? 
_refine.correlation_coeff_Fo_to_Fc               ? 
_refine.correlation_coeff_Fo_to_Fc_free          ? 
_refine.details                                  ? 
_refine.diff_density_max                         ? 
_refine.diff_density_max_esd                     ? 
_refine.diff_density_min                         ? 
_refine.diff_density_min_esd                     ? 
_refine.diff_density_rms                         ? 
_refine.diff_density_rms_esd                     ? 
_refine.entry_id                                 8R00 
_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                            1.95 
_refine.ls_d_res_low                             41.07 
_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                     27126 
_refine.ls_number_reflns_R_free                  1436 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    99.33 
_refine.ls_percent_reflns_R_free                 5.29 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1960 
_refine.ls_R_factor_R_free                       0.2149 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1948 
_refine.ls_R_Fsqd_factor_obs                     ? 
_refine.ls_R_I_factor_obs                        ? 
_refine.ls_redundancy_reflns_all                 ? 
_refine.ls_redundancy_reflns_obs                 ? 
_refine.ls_restrained_S_all                      ? 
_refine.ls_restrained_S_obs                      ? 
_refine.ls_shift_over_esd_max                    ? 
_refine.ls_shift_over_esd_mean                   ? 
_refine.ls_structure_factor_coef                 ? 
_refine.ls_weighting_details                     ? 
_refine.ls_weighting_scheme                      ? 
_refine.ls_wR_factor_all                         ? 
_refine.ls_wR_factor_obs                         ? 
_refine.ls_wR_factor_R_free                      ? 
_refine.ls_wR_factor_R_work                      ? 
_refine.occupancy_max                            ? 
_refine.occupancy_min                            ? 
_refine.solvent_model_details                    'FLAT BULK SOLVENT MODEL' 
_refine.solvent_model_param_bsol                 ? 
_refine.solvent_model_param_ksol                 ? 
_refine.pdbx_R_complete                          ? 
_refine.ls_R_factor_gt                           ? 
_refine.ls_goodness_of_fit_gt                    ? 
_refine.ls_goodness_of_fit_ref                   ? 
_refine.ls_shift_over_su_max                     ? 
_refine.ls_shift_over_su_max_lt                  ? 
_refine.ls_shift_over_su_mean                    ? 
_refine.ls_shift_over_su_mean_lt                 ? 
_refine.pdbx_ls_sigma_I                          ? 
_refine.pdbx_ls_sigma_F                          1.34 
_refine.pdbx_ls_sigma_Fsqd                       ? 
_refine.pdbx_data_cutoff_high_absF               ? 
_refine.pdbx_data_cutoff_high_rms_absF           ? 
_refine.pdbx_data_cutoff_low_absF                ? 
_refine.pdbx_isotropic_thermal_model             ? 
_refine.pdbx_ls_cross_valid_method               'FREE R-VALUE' 
_refine.pdbx_method_to_determine_struct          'MOLECULAR REPLACEMENT' 
_refine.pdbx_starting_model                      ? 
_refine.pdbx_stereochemistry_target_values       ML 
_refine.pdbx_R_Free_selection_details            ? 
_refine.pdbx_stereochem_target_val_spec_case     ? 
_refine.pdbx_overall_ESU_R                       ? 
_refine.pdbx_overall_ESU_R_Free                  ? 
_refine.pdbx_solvent_vdw_probe_radii             1.11 
_refine.pdbx_solvent_ion_probe_radii             ? 
_refine.pdbx_solvent_shrinkage_radii             0.90 
_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                 22.52 
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI   ? 
_refine.pdbx_overall_SU_R_free_Blow_DPI          ? 
_refine.pdbx_overall_SU_R_Blow_DPI               ? 
_refine.pdbx_TLS_residual_ADP_flag               ? 
_refine.pdbx_diffrn_id                           1 
_refine.overall_SU_B                             ? 
_refine.overall_SU_ML                            0.21 
_refine.overall_SU_R_Cruickshank_DPI             ? 
_refine.overall_SU_R_free                        ? 
_refine.overall_FOM_free_R_set                   ? 
_refine.overall_FOM_work_R_set                   ? 
_refine.pdbx_average_fsc_overall                 ? 
_refine.pdbx_average_fsc_work                    ? 
_refine.pdbx_average_fsc_free                    ? 
# 
_refine_hist.pdbx_refine_id                   'X-RAY DIFFRACTION' 
_refine_hist.cycle_id                         LAST 
_refine_hist.pdbx_number_atoms_protein        2136 
_refine_hist.pdbx_number_atoms_nucleic_acid   0 
_refine_hist.pdbx_number_atoms_ligand         17 
_refine_hist.number_atoms_solvent             144 
_refine_hist.number_atoms_total               2297 
_refine_hist.d_res_high                       1.95 
_refine_hist.d_res_low                        41.07 
# 
loop_
_refine_ls_restr.pdbx_refine_id 
_refine_ls_restr.criterion 
_refine_ls_restr.dev_ideal 
_refine_ls_restr.dev_ideal_target 
_refine_ls_restr.number 
_refine_ls_restr.rejects 
_refine_ls_restr.type 
_refine_ls_restr.weight 
_refine_ls_restr.pdbx_restraint_function 
'X-RAY DIFFRACTION' ? 0.009  ? 2282 ? f_bond_d           ? ? 
'X-RAY DIFFRACTION' ? 1.125  ? 3104 ? f_angle_d          ? ? 
'X-RAY DIFFRACTION' ? 20.433 ? 328  ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.054  ? 341  ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.006  ? 407  ? f_plane_restr      ? ? 
# 
loop_
_refine_ls_shell.pdbx_refine_id 
_refine_ls_shell.d_res_high 
_refine_ls_shell.d_res_low 
_refine_ls_shell.number_reflns_all 
_refine_ls_shell.number_reflns_obs 
_refine_ls_shell.number_reflns_R_free 
_refine_ls_shell.number_reflns_R_work 
_refine_ls_shell.percent_reflns_obs 
_refine_ls_shell.percent_reflns_R_free 
_refine_ls_shell.R_factor_all 
_refine_ls_shell.R_factor_obs 
_refine_ls_shell.R_factor_R_free_error 
_refine_ls_shell.R_factor_R_work 
_refine_ls_shell.redundancy_reflns_all 
_refine_ls_shell.redundancy_reflns_obs 
_refine_ls_shell.wR_factor_all 
_refine_ls_shell.wR_factor_obs 
_refine_ls_shell.wR_factor_R_free 
_refine_ls_shell.wR_factor_R_work 
_refine_ls_shell.pdbx_R_complete 
_refine_ls_shell.pdbx_total_number_of_bins_used 
_refine_ls_shell.pdbx_phase_error 
_refine_ls_shell.pdbx_fsc_work 
_refine_ls_shell.pdbx_fsc_free 
_refine_ls_shell.R_factor_R_free 
'X-RAY DIFFRACTION' 1.95 2.02  . . 148 2505 100.00 . . . . 0.2641 . . . . . . . . . . . 0.3345 
'X-RAY DIFFRACTION' 2.02 2.10  . . 135 2544 100.00 . . . . 0.2264 . . . . . . . . . . . 0.2636 
'X-RAY DIFFRACTION' 2.10 2.20  . . 124 2573 100.00 . . . . 0.2128 . . . . . . . . . . . 0.2723 
'X-RAY DIFFRACTION' 2.20 2.31  . . 117 2551 100.00 . . . . 0.2073 . . . . . . . . . . . 0.2597 
'X-RAY DIFFRACTION' 2.31 2.46  . . 151 2548 100.00 . . . . 0.2083 . . . . . . . . . . . 0.2258 
'X-RAY DIFFRACTION' 2.46 2.65  . . 143 2554 100.00 . . . . 0.2078 . . . . . . . . . . . 0.2429 
'X-RAY DIFFRACTION' 2.65 2.91  . . 151 2571 100.00 . . . . 0.2050 . . . . . . . . . . . 0.2173 
'X-RAY DIFFRACTION' 2.91 3.33  . . 132 2577 99.00  . . . . 0.2103 . . . . . . . . . . . 0.2394 
'X-RAY DIFFRACTION' 3.33 4.20  . . 164 2597 99.00  . . . . 0.1765 . . . . . . . . . . . 0.2065 
'X-RAY DIFFRACTION' 4.20 41.07 . . 171 2670 97.00  . . . . 0.1762 . . . . . . . . . . . 0.1757 
# 
_struct.entry_id                     8R00 
_struct.title                        'Crystal structure of the human PXR ligand-binding domain in complex with furanodienone' 
_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        8R00 
_struct_keywords.text            'Nuclear receptor, pregnane X receptor, 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 ? 
# 
_struct_ref.id                         1 
_struct_ref.db_name                    UNP 
_struct_ref.db_code                    NR1I2_HUMAN 
_struct_ref.pdbx_db_accession          O75469 
_struct_ref.pdbx_db_isoform            ? 
_struct_ref.entity_id                  1 
_struct_ref.pdbx_seq_one_letter_code   
;SERTGTQPLGVQGLTEEQRMMIRELMDAQMKTFDTTFSHFKNFRLPGVLSSGCELPESLQAPSREEAAKWSQVRKDLCSL
KVSLQLRGEDGSVWNYKPPADSGGKEIFSLLPHMADMSTYMFKGIISFAKVISYFRDLPIEDQISLLKGAAFELCQLRFN
TVFNAETGTWECGRLSYCLEDTAGGFQQLLLEPMLKFHYMLKKLQLHEEEYVLMQAISLFSPDRPGVLQHRVVDQLQEQF
AITLKSYIECNRPQPAHRFLFLKIMAMLTELRSINAQHTQRLLRIQDIHPFATPLMQELFGITGS
;
_struct_ref.pdbx_align_begin           130 
# 
_struct_ref_seq.align_id                      1 
_struct_ref_seq.ref_id                        1 
_struct_ref_seq.pdbx_PDB_id_code              8R00 
_struct_ref_seq.pdbx_strand_id                A 
_struct_ref_seq.seq_align_beg                 12 
_struct_ref_seq.pdbx_seq_align_beg_ins_code   ? 
_struct_ref_seq.seq_align_end                 316 
_struct_ref_seq.pdbx_seq_align_end_ins_code   ? 
_struct_ref_seq.pdbx_db_accession             O75469 
_struct_ref_seq.db_align_beg                  130 
_struct_ref_seq.pdbx_db_align_beg_ins_code    ? 
_struct_ref_seq.db_align_end                  434 
_struct_ref_seq.pdbx_db_align_end_ins_code    ? 
_struct_ref_seq.pdbx_auth_seq_align_beg       130 
_struct_ref_seq.pdbx_auth_seq_align_end       434 
# 
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 8R00 MET A 1   ? UNP O75469 ? ? 'initiating methionine' 119 1  
1 8R00 LYS A 2   ? UNP O75469 ? ? 'expression tag'        120 2  
1 8R00 LYS A 3   ? UNP O75469 ? ? 'expression tag'        121 3  
1 8R00 GLY A 4   ? UNP O75469 ? ? 'expression tag'        122 4  
1 8R00 HIS A 5   ? UNP O75469 ? ? 'expression tag'        123 5  
1 8R00 HIS A 6   ? UNP O75469 ? ? 'expression tag'        124 6  
1 8R00 HIS A 7   ? UNP O75469 ? ? 'expression tag'        125 7  
1 8R00 HIS A 8   ? UNP O75469 ? ? 'expression tag'        126 8  
1 8R00 HIS A 9   ? UNP O75469 ? ? 'expression tag'        127 9  
1 8R00 HIS A 10  ? UNP O75469 ? ? 'expression tag'        128 10 
1 8R00 GLY A 11  ? UNP O75469 ? ? 'expression tag'        129 11 
1 8R00 LEU A 317 ? UNP O75469 ? ? 'expression tag'        435 12 
1 8R00 VAL A 318 ? UNP O75469 ? ? 'expression tag'        436 13 
1 8R00 PRO A 319 ? UNP O75469 ? ? 'expression tag'        437 14 
1 8R00 ARG A 320 ? UNP O75469 ? ? 'expression tag'        438 15 
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_and_software_defined_assembly 
_pdbx_struct_assembly.method_details       PISA 
_pdbx_struct_assembly.oligomeric_details   monomeric 
_pdbx_struct_assembly.oligomeric_count     1 
# 
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)' 0     ? 
1 MORE         0     ? 
1 'SSA (A^2)'  13780 ? 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C 
# 
_pdbx_struct_assembly_auth_evidence.id                     1 
_pdbx_struct_assembly_auth_evidence.assembly_id            1 
_pdbx_struct_assembly_auth_evidence.experimental_support   'gel filtration' 
_pdbx_struct_assembly_auth_evidence.details                ? 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
loop_
_struct_conf.conf_type_id 
_struct_conf.id 
_struct_conf.pdbx_PDB_helix_id 
_struct_conf.beg_label_comp_id 
_struct_conf.beg_label_asym_id 
_struct_conf.beg_label_seq_id 
_struct_conf.pdbx_beg_PDB_ins_code 
_struct_conf.end_label_comp_id 
_struct_conf.end_label_asym_id 
_struct_conf.end_label_seq_id 
_struct_conf.pdbx_end_PDB_ins_code 
_struct_conf.beg_auth_comp_id 
_struct_conf.beg_auth_asym_id 
_struct_conf.beg_auth_seq_id 
_struct_conf.end_auth_comp_id 
_struct_conf.end_auth_asym_id 
_struct_conf.end_auth_seq_id 
_struct_conf.pdbx_PDB_helix_class 
_struct_conf.details 
_struct_conf.pdbx_PDB_helix_length 
HELX_P HELX_P1  AA1 THR A 26  ? PHE A 44  ? THR A 144 PHE A 162 1 ? 19 
HELX_P HELX_P2  AA2 ALA A 79  ? CYS A 89  ? ALA A 197 CYS A 207 1 ? 11 
HELX_P HELX_P3  AA3 GLY A 115 ? SER A 120 ? GLY A 233 SER A 238 5 ? 6  
HELX_P HELX_P4  AA4 LEU A 121 ? ILE A 143 ? LEU A 239 ILE A 261 1 ? 23 
HELX_P HELX_P5  AA5 ILE A 143 ? ASP A 148 ? ILE A 261 ASP A 266 1 ? 6  
HELX_P HELX_P6  AA6 PRO A 150 ? VAL A 173 ? PRO A 268 VAL A 291 1 ? 24 
HELX_P HELX_P7  AA7 PHE A 197 ? LEU A 201 ? PHE A 315 LEU A 319 1 ? 5  
HELX_P HELX_P8  AA8 GLU A 203 ? LEU A 215 ? GLU A 321 LEU A 333 1 ? 13 
HELX_P HELX_P9  AA9 HIS A 218 ? PHE A 231 ? HIS A 336 PHE A 349 1 ? 14 
HELX_P HELX_P10 AB1 GLN A 240 ? ARG A 263 ? GLN A 358 ARG A 381 1 ? 24 
HELX_P HELX_P11 AB2 GLN A 265 ? ARG A 269 ? GLN A 383 ARG A 387 5 ? 5  
HELX_P HELX_P12 AB3 PHE A 270 ? HIS A 300 ? PHE A 388 HIS A 418 1 ? 31 
HELX_P HELX_P13 AB4 THR A 304 ? PHE A 311 ? THR A 422 PHE A 429 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   5 
_struct_sheet.details          ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA1 4 5 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 VAL A 104 ? TYR A 107 ? VAL A 222 TYR A 225 
AA1 2 VAL A 93  ? ARG A 98  ? VAL A 211 ARG A 216 
AA1 3 LEU A 186 ? LEU A 190 ? LEU A 304 LEU A 308 
AA1 4 THR A 180 ? CYS A 183 ? THR A 298 CYS A 301 
AA1 5 PHE A 174 ? ASN A 175 ? PHE A 292 ASN A 293 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 O TRP A 105 ? O TRP A 223 N LEU A 97  ? N LEU A 215 
AA1 2 3 N SER A 94  ? N SER A 212 O CYS A 189 ? O CYS A 307 
AA1 3 4 O TYR A 188 ? O TYR A 306 N TRP A 181 ? N TRP A 299 
AA1 4 5 O THR A 180 ? O THR A 298 N ASN A 175 ? N ASN A 293 
# 
_pdbx_entry_details.entry_id                   8R00 
_pdbx_entry_details.has_ligand_of_interest     Y 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_protein_modification   N 
# 
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 163 ? ? O A HOH 601 ? ? 1.94 
2 1 OD1 A ASP 266 ? ? O A HOH 602 ? ? 2.05 
3 1 OE1 A GLU 300 ? ? O A HOH 603 ? ? 2.07 
4 1 O   A GLY 355 ? ? O A HOH 604 ? ? 2.17 
# 
loop_
_pdbx_validate_rmsd_angle.id 
_pdbx_validate_rmsd_angle.PDB_model_num 
_pdbx_validate_rmsd_angle.auth_atom_id_1 
_pdbx_validate_rmsd_angle.auth_asym_id_1 
_pdbx_validate_rmsd_angle.auth_comp_id_1 
_pdbx_validate_rmsd_angle.auth_seq_id_1 
_pdbx_validate_rmsd_angle.PDB_ins_code_1 
_pdbx_validate_rmsd_angle.label_alt_id_1 
_pdbx_validate_rmsd_angle.auth_atom_id_2 
_pdbx_validate_rmsd_angle.auth_asym_id_2 
_pdbx_validate_rmsd_angle.auth_comp_id_2 
_pdbx_validate_rmsd_angle.auth_seq_id_2 
_pdbx_validate_rmsd_angle.PDB_ins_code_2 
_pdbx_validate_rmsd_angle.label_alt_id_2 
_pdbx_validate_rmsd_angle.auth_atom_id_3 
_pdbx_validate_rmsd_angle.auth_asym_id_3 
_pdbx_validate_rmsd_angle.auth_comp_id_3 
_pdbx_validate_rmsd_angle.auth_seq_id_3 
_pdbx_validate_rmsd_angle.PDB_ins_code_3 
_pdbx_validate_rmsd_angle.label_alt_id_3 
_pdbx_validate_rmsd_angle.angle_value 
_pdbx_validate_rmsd_angle.angle_target_value 
_pdbx_validate_rmsd_angle.angle_deviation 
_pdbx_validate_rmsd_angle.angle_standard_deviation 
_pdbx_validate_rmsd_angle.linker_flag 
1 1 CB A LEU 213 ? ? CG A LEU 213 ? ? CD2 A LEU 213 ? ? 95.37  111.00 -15.63 1.70 N 
2 1 CB A LEU 215 ? ? CG A LEU 215 ? ? CD1 A LEU 215 ? ? 100.01 111.00 -10.99 1.70 N 
3 1 CB A ARG 265 ? ? CG A ARG 265 ? ? CD  A ARG 265 ? ? 127.31 111.60 15.71  2.60 N 
4 1 CD A ARG 265 ? ? NE A ARG 265 ? ? CZ  A ARG 265 ? ? 133.33 123.60 9.73   1.40 N 
# 
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 CYS A 301 ? ? -107.74 67.99  
2 1 PHE A 349 ? ? -92.16  50.61  
3 1 PHE A 420 ? ? -153.68 -16.54 
# 
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 119 ? A MET 1   
2  1 Y 1 A LYS 120 ? A LYS 2   
3  1 Y 1 A LYS 121 ? A LYS 3   
4  1 Y 1 A GLY 122 ? A GLY 4   
5  1 Y 1 A HIS 123 ? A HIS 5   
6  1 Y 1 A HIS 124 ? A HIS 6   
7  1 Y 1 A HIS 125 ? A HIS 7   
8  1 Y 1 A HIS 126 ? A HIS 8   
9  1 Y 1 A HIS 127 ? A HIS 9   
10 1 Y 1 A HIS 128 ? A HIS 10  
11 1 Y 1 A GLY 129 ? A GLY 11  
12 1 Y 1 A SER 130 ? A SER 12  
13 1 Y 1 A GLU 131 ? A GLU 13  
14 1 Y 1 A ARG 132 ? A ARG 14  
15 1 Y 1 A THR 133 ? A THR 15  
16 1 Y 1 A GLY 134 ? A GLY 16  
17 1 Y 1 A THR 135 ? A THR 17  
18 1 Y 1 A GLN 136 ? A GLN 18  
19 1 Y 1 A PRO 137 ? A PRO 19  
20 1 Y 1 A LEU 138 ? A LEU 20  
21 1 Y 1 A GLY 139 ? A GLY 21  
22 1 Y 1 A VAL 140 ? A VAL 22  
23 1 Y 1 A GLN 141 ? A GLN 23  
24 1 Y 1 A LEU 178 ? A LEU 60  
25 1 Y 1 A SER 179 ? A SER 61  
26 1 Y 1 A SER 180 ? A SER 62  
27 1 Y 1 A GLY 181 ? A GLY 63  
28 1 Y 1 A CYS 182 ? A CYS 64  
29 1 Y 1 A GLU 183 ? A GLU 65  
30 1 Y 1 A LEU 184 ? A LEU 66  
31 1 Y 1 A PRO 185 ? A PRO 67  
32 1 Y 1 A GLU 186 ? A GLU 68  
33 1 Y 1 A SER 187 ? A SER 69  
34 1 Y 1 A LEU 188 ? A LEU 70  
35 1 Y 1 A GLN 189 ? A GLN 71  
36 1 Y 1 A ALA 190 ? A ALA 72  
37 1 Y 1 A PRO 191 ? A PRO 73  
38 1 Y 1 A SER 192 ? A SER 74  
39 1 Y 1 A ARG 193 ? A ARG 75  
40 1 Y 1 A GLU 194 ? A GLU 76  
41 1 Y 1 A GLU 195 ? A GLU 77  
42 1 Y 1 A THR 311 ? A THR 193 
43 1 Y 1 A ALA 312 ? A ALA 194 
44 1 Y 1 A GLY 313 ? A GLY 195 
45 1 Y 1 A VAL 436 ? A VAL 318 
46 1 Y 1 A PRO 437 ? A PRO 319 
47 1 Y 1 A ARG 438 ? A ARG 320 
# 
loop_
_chem_comp_atom.comp_id 
_chem_comp_atom.atom_id 
_chem_comp_atom.type_symbol 
_chem_comp_atom.pdbx_aromatic_flag 
_chem_comp_atom.pdbx_stereo_config 
_chem_comp_atom.pdbx_ordinal 
ALA N    N N N 1   
ALA CA   C N S 2   
ALA C    C N N 3   
ALA O    O N N 4   
ALA CB   C N N 5   
ALA OXT  O N N 6   
ALA H    H N N 7   
ALA H2   H N N 8   
ALA HA   H N N 9   
ALA HB1  H N N 10  
ALA HB2  H N N 11  
ALA HB3  H N N 12  
ALA HXT  H N N 13  
ARG N    N N N 14  
ARG CA   C N S 15  
ARG C    C N N 16  
ARG O    O N N 17  
ARG CB   C N N 18  
ARG CG   C N N 19  
ARG CD   C N N 20  
ARG NE   N N N 21  
ARG CZ   C N N 22  
ARG NH1  N N N 23  
ARG NH2  N N N 24  
ARG OXT  O N N 25  
ARG H    H N N 26  
ARG H2   H N N 27  
ARG HA   H N N 28  
ARG HB2  H N N 29  
ARG HB3  H N N 30  
ARG HG2  H N N 31  
ARG HG3  H N N 32  
ARG HD2  H N N 33  
ARG HD3  H N N 34  
ARG HE   H N N 35  
ARG HH11 H N N 36  
ARG HH12 H N N 37  
ARG HH21 H N N 38  
ARG HH22 H N N 39  
ARG HXT  H N N 40  
ASN N    N N N 41  
ASN CA   C N S 42  
ASN C    C N N 43  
ASN O    O N N 44  
ASN CB   C N N 45  
ASN CG   C N N 46  
ASN OD1  O N N 47  
ASN ND2  N N N 48  
ASN OXT  O N N 49  
ASN H    H N N 50  
ASN H2   H N N 51  
ASN HA   H N N 52  
ASN HB2  H N N 53  
ASN HB3  H N N 54  
ASN HD21 H N N 55  
ASN HD22 H N N 56  
ASN HXT  H N N 57  
ASP N    N N N 58  
ASP CA   C N S 59  
ASP C    C N N 60  
ASP O    O N N 61  
ASP CB   C N N 62  
ASP CG   C N N 63  
ASP OD1  O N N 64  
ASP OD2  O N N 65  
ASP OXT  O N N 66  
ASP H    H N N 67  
ASP H2   H N N 68  
ASP HA   H N N 69  
ASP HB2  H N N 70  
ASP HB3  H N N 71  
ASP HD2  H N N 72  
ASP HXT  H N N 73  
CYS N    N N N 74  
CYS CA   C N R 75  
CYS C    C N N 76  
CYS O    O N N 77  
CYS CB   C N N 78  
CYS SG   S N N 79  
CYS OXT  O N N 80  
CYS H    H N N 81  
CYS H2   H N N 82  
CYS HA   H N N 83  
CYS HB2  H N N 84  
CYS HB3  H N N 85  
CYS HG   H N N 86  
CYS HXT  H N N 87  
GLN N    N N N 88  
GLN CA   C N S 89  
GLN C    C N N 90  
GLN O    O N N 91  
GLN CB   C N N 92  
GLN CG   C N N 93  
GLN CD   C N N 94  
GLN OE1  O N N 95  
GLN NE2  N N N 96  
GLN OXT  O N N 97  
GLN H    H N N 98  
GLN H2   H N N 99  
GLN HA   H N N 100 
GLN HB2  H N N 101 
GLN HB3  H N N 102 
GLN HG2  H N N 103 
GLN HG3  H N N 104 
GLN HE21 H N N 105 
GLN HE22 H N N 106 
GLN HXT  H N N 107 
GLU N    N N N 108 
GLU CA   C N S 109 
GLU C    C N N 110 
GLU O    O N N 111 
GLU CB   C N N 112 
GLU CG   C N N 113 
GLU CD   C N N 114 
GLU OE1  O N N 115 
GLU OE2  O N N 116 
GLU OXT  O N N 117 
GLU H    H N N 118 
GLU H2   H N N 119 
GLU HA   H N N 120 
GLU HB2  H N N 121 
GLU HB3  H N N 122 
GLU HG2  H N N 123 
GLU HG3  H N N 124 
GLU HE2  H N N 125 
GLU HXT  H N N 126 
GLY N    N N N 127 
GLY CA   C N N 128 
GLY C    C N N 129 
GLY O    O N N 130 
GLY OXT  O N N 131 
GLY H    H N N 132 
GLY H2   H N N 133 
GLY HA2  H N N 134 
GLY HA3  H N N 135 
GLY HXT  H N N 136 
HIS N    N N N 137 
HIS CA   C N S 138 
HIS C    C N N 139 
HIS O    O N N 140 
HIS CB   C N N 141 
HIS CG   C Y N 142 
HIS ND1  N Y N 143 
HIS CD2  C Y N 144 
HIS CE1  C Y N 145 
HIS NE2  N Y N 146 
HIS OXT  O N N 147 
HIS H    H N N 148 
HIS H2   H N N 149 
HIS HA   H N N 150 
HIS HB2  H N N 151 
HIS HB3  H N N 152 
HIS HD1  H N N 153 
HIS HD2  H N N 154 
HIS HE1  H N N 155 
HIS HE2  H N N 156 
HIS HXT  H N N 157 
HOH O    O N N 158 
HOH H1   H N N 159 
HOH H2   H N N 160 
ILE N    N N N 161 
ILE CA   C N S 162 
ILE C    C N N 163 
ILE O    O N N 164 
ILE CB   C N S 165 
ILE CG1  C N N 166 
ILE CG2  C N N 167 
ILE CD1  C N N 168 
ILE OXT  O N N 169 
ILE H    H N N 170 
ILE H2   H N N 171 
ILE HA   H N N 172 
ILE HB   H N N 173 
ILE HG12 H N N 174 
ILE HG13 H N N 175 
ILE HG21 H N N 176 
ILE HG22 H N N 177 
ILE HG23 H N N 178 
ILE HD11 H N N 179 
ILE HD12 H N N 180 
ILE HD13 H N N 181 
ILE HXT  H N N 182 
LEU N    N N N 183 
LEU CA   C N S 184 
LEU C    C N N 185 
LEU O    O N N 186 
LEU CB   C N N 187 
LEU CG   C N N 188 
LEU CD1  C N N 189 
LEU CD2  C N N 190 
LEU OXT  O N N 191 
LEU H    H N N 192 
LEU H2   H N N 193 
LEU HA   H N N 194 
LEU HB2  H N N 195 
LEU HB3  H N N 196 
LEU HG   H N N 197 
LEU HD11 H N N 198 
LEU HD12 H N N 199 
LEU HD13 H N N 200 
LEU HD21 H N N 201 
LEU HD22 H N N 202 
LEU HD23 H N N 203 
LEU HXT  H N N 204 
LYS N    N N N 205 
LYS CA   C N S 206 
LYS C    C N N 207 
LYS O    O N N 208 
LYS CB   C N N 209 
LYS CG   C N N 210 
LYS CD   C N N 211 
LYS CE   C N N 212 
LYS NZ   N N N 213 
LYS OXT  O N N 214 
LYS H    H N N 215 
LYS H2   H N N 216 
LYS HA   H N N 217 
LYS HB2  H N N 218 
LYS HB3  H N N 219 
LYS HG2  H N N 220 
LYS HG3  H N N 221 
LYS HD2  H N N 222 
LYS HD3  H N N 223 
LYS HE2  H N N 224 
LYS HE3  H N N 225 
LYS HZ1  H N N 226 
LYS HZ2  H N N 227 
LYS HZ3  H N N 228 
LYS HXT  H N N 229 
MET N    N N N 230 
MET CA   C N S 231 
MET C    C N N 232 
MET O    O N N 233 
MET CB   C N N 234 
MET CG   C N N 235 
MET SD   S N N 236 
MET CE   C N N 237 
MET OXT  O N N 238 
MET H    H N N 239 
MET H2   H N N 240 
MET HA   H N N 241 
MET HB2  H N N 242 
MET HB3  H N N 243 
MET HG2  H N N 244 
MET HG3  H N N 245 
MET HE1  H N N 246 
MET HE2  H N N 247 
MET HE3  H N N 248 
MET HXT  H N N 249 
PHE N    N N N 250 
PHE CA   C N S 251 
PHE C    C N N 252 
PHE O    O N N 253 
PHE CB   C N N 254 
PHE CG   C Y N 255 
PHE CD1  C Y N 256 
PHE CD2  C Y N 257 
PHE CE1  C Y N 258 
PHE CE2  C Y N 259 
PHE CZ   C Y N 260 
PHE OXT  O N N 261 
PHE H    H N N 262 
PHE H2   H N N 263 
PHE HA   H N N 264 
PHE HB2  H N N 265 
PHE HB3  H N N 266 
PHE HD1  H N N 267 
PHE HD2  H N N 268 
PHE HE1  H N N 269 
PHE HE2  H N N 270 
PHE HZ   H N N 271 
PHE HXT  H N N 272 
PRO N    N N N 273 
PRO CA   C N S 274 
PRO C    C N N 275 
PRO O    O N N 276 
PRO CB   C N N 277 
PRO CG   C N N 278 
PRO CD   C N N 279 
PRO OXT  O N N 280 
PRO H    H N N 281 
PRO HA   H N N 282 
PRO HB2  H N N 283 
PRO HB3  H N N 284 
PRO HG2  H N N 285 
PRO HG3  H N N 286 
PRO HD2  H N N 287 
PRO HD3  H N N 288 
PRO HXT  H N N 289 
SER N    N N N 290 
SER CA   C N S 291 
SER C    C N N 292 
SER O    O N N 293 
SER CB   C N N 294 
SER OG   O N N 295 
SER OXT  O N N 296 
SER H    H N N 297 
SER H2   H N N 298 
SER HA   H N N 299 
SER HB2  H N N 300 
SER HB3  H N N 301 
SER HG   H N N 302 
SER HXT  H N N 303 
THR N    N N N 304 
THR CA   C N S 305 
THR C    C N N 306 
THR O    O N N 307 
THR CB   C N R 308 
THR OG1  O N N 309 
THR CG2  C N N 310 
THR OXT  O N N 311 
THR H    H N N 312 
THR H2   H N N 313 
THR HA   H N N 314 
THR HB   H N N 315 
THR HG1  H N N 316 
THR HG21 H N N 317 
THR HG22 H N N 318 
THR HG23 H N N 319 
THR HXT  H N N 320 
TRP N    N N N 321 
TRP CA   C N S 322 
TRP C    C N N 323 
TRP O    O N N 324 
TRP CB   C N N 325 
TRP CG   C Y N 326 
TRP CD1  C Y N 327 
TRP CD2  C Y N 328 
TRP NE1  N Y N 329 
TRP CE2  C Y N 330 
TRP CE3  C Y N 331 
TRP CZ2  C Y N 332 
TRP CZ3  C Y N 333 
TRP CH2  C Y N 334 
TRP OXT  O N N 335 
TRP H    H N N 336 
TRP H2   H N N 337 
TRP HA   H N N 338 
TRP HB2  H N N 339 
TRP HB3  H N N 340 
TRP HD1  H N N 341 
TRP HE1  H N N 342 
TRP HE3  H N N 343 
TRP HZ2  H N N 344 
TRP HZ3  H N N 345 
TRP HH2  H N N 346 
TRP HXT  H N N 347 
TYR N    N N N 348 
TYR CA   C N S 349 
TYR C    C N N 350 
TYR O    O N N 351 
TYR CB   C N N 352 
TYR CG   C Y N 353 
TYR CD1  C Y N 354 
TYR CD2  C Y N 355 
TYR CE1  C Y N 356 
TYR CE2  C Y N 357 
TYR CZ   C Y N 358 
TYR OH   O N N 359 
TYR OXT  O N N 360 
TYR H    H N N 361 
TYR H2   H N N 362 
TYR HA   H N N 363 
TYR HB2  H N N 364 
TYR HB3  H N N 365 
TYR HD1  H N N 366 
TYR HD2  H N N 367 
TYR HE1  H N N 368 
TYR HE2  H N N 369 
TYR HH   H N N 370 
TYR HXT  H N N 371 
VAL N    N N N 372 
VAL CA   C N S 373 
VAL C    C N N 374 
VAL O    O N N 375 
VAL CB   C N N 376 
VAL CG1  C N N 377 
VAL CG2  C N N 378 
VAL OXT  O N N 379 
VAL H    H N N 380 
VAL H2   H N N 381 
VAL HA   H N N 382 
VAL HB   H N N 383 
VAL HG11 H N N 384 
VAL HG12 H N N 385 
VAL HG13 H N N 386 
VAL HG21 H N N 387 
VAL HG22 H N N 388 
VAL HG23 H N N 389 
VAL HXT  H N N 390 
XFQ C1   C N N 391 
XFQ C2   C N N 392 
XFQ C3   C N N 393 
XFQ C4   C N N 394 
XFQ C5   C Y N 395 
XFQ C8   C N N 396 
XFQ C6   C Y N 397 
XFQ C7   C N N 398 
XFQ C10  C N N 399 
XFQ C11  C N N 400 
XFQ C12  C N N 401 
XFQ C14  C Y N 402 
XFQ C15  C Y N 403 
XFQ C16  C N N 404 
XFQ C9   C N N 405 
XFQ O13  O Y N 406 
XFQ O17  O N N 407 
XFQ H1   H N N 408 
XFQ H2   H N N 409 
XFQ H3   H N N 410 
XFQ H5   H N N 411 
XFQ H8   H N N 412 
XFQ H9   H N N 413 
XFQ H10  H N N 414 
XFQ H12  H N N 415 
XFQ H13  H N N 416 
XFQ H14  H N N 417 
XFQ H15  H N N 418 
XFQ H16  H N N 419 
XFQ H17  H N N 420 
XFQ H18  H N N 421 
XFQ H19  H N N 422 
XFQ H20  H N N 423 
XFQ H21  H N N 424 
XFQ H22  H N N 425 
# 
loop_
_chem_comp_bond.comp_id 
_chem_comp_bond.atom_id_1 
_chem_comp_bond.atom_id_2 
_chem_comp_bond.value_order 
_chem_comp_bond.pdbx_aromatic_flag 
_chem_comp_bond.pdbx_stereo_config 
_chem_comp_bond.pdbx_ordinal 
ALA N   CA   sing N N 1   
ALA N   H    sing N N 2   
ALA N   H2   sing N N 3   
ALA CA  C    sing N N 4   
ALA CA  CB   sing N N 5   
ALA CA  HA   sing N N 6   
ALA C   O    doub N N 7   
ALA C   OXT  sing N N 8   
ALA CB  HB1  sing N N 9   
ALA CB  HB2  sing N N 10  
ALA CB  HB3  sing N N 11  
ALA OXT HXT  sing N N 12  
ARG N   CA   sing N N 13  
ARG N   H    sing N N 14  
ARG N   H2   sing N N 15  
ARG CA  C    sing N N 16  
ARG CA  CB   sing N N 17  
ARG CA  HA   sing N N 18  
ARG C   O    doub N N 19  
ARG C   OXT  sing N N 20  
ARG CB  CG   sing N N 21  
ARG CB  HB2  sing N N 22  
ARG CB  HB3  sing N N 23  
ARG CG  CD   sing N N 24  
ARG CG  HG2  sing N N 25  
ARG CG  HG3  sing N N 26  
ARG CD  NE   sing N N 27  
ARG CD  HD2  sing N N 28  
ARG CD  HD3  sing N N 29  
ARG NE  CZ   sing N N 30  
ARG NE  HE   sing N N 31  
ARG CZ  NH1  sing N N 32  
ARG CZ  NH2  doub N N 33  
ARG NH1 HH11 sing N N 34  
ARG NH1 HH12 sing N N 35  
ARG NH2 HH21 sing N N 36  
ARG NH2 HH22 sing N N 37  
ARG OXT HXT  sing N N 38  
ASN N   CA   sing N N 39  
ASN N   H    sing N N 40  
ASN N   H2   sing N N 41  
ASN CA  C    sing N N 42  
ASN CA  CB   sing N N 43  
ASN CA  HA   sing N N 44  
ASN C   O    doub N N 45  
ASN C   OXT  sing N N 46  
ASN CB  CG   sing N N 47  
ASN CB  HB2  sing N N 48  
ASN CB  HB3  sing N N 49  
ASN CG  OD1  doub N N 50  
ASN CG  ND2  sing N N 51  
ASN ND2 HD21 sing N N 52  
ASN ND2 HD22 sing N N 53  
ASN OXT HXT  sing N N 54  
ASP N   CA   sing N N 55  
ASP N   H    sing N N 56  
ASP N   H2   sing N N 57  
ASP CA  C    sing N N 58  
ASP CA  CB   sing N N 59  
ASP CA  HA   sing N N 60  
ASP C   O    doub N N 61  
ASP C   OXT  sing N N 62  
ASP CB  CG   sing N N 63  
ASP CB  HB2  sing N N 64  
ASP CB  HB3  sing N N 65  
ASP CG  OD1  doub N N 66  
ASP CG  OD2  sing N N 67  
ASP OD2 HD2  sing N N 68  
ASP OXT HXT  sing N N 69  
CYS N   CA   sing N N 70  
CYS N   H    sing N N 71  
CYS N   H2   sing N N 72  
CYS CA  C    sing N N 73  
CYS CA  CB   sing N N 74  
CYS CA  HA   sing N N 75  
CYS C   O    doub N N 76  
CYS C   OXT  sing N N 77  
CYS CB  SG   sing N N 78  
CYS CB  HB2  sing N N 79  
CYS CB  HB3  sing N N 80  
CYS SG  HG   sing N N 81  
CYS OXT HXT  sing N N 82  
GLN N   CA   sing N N 83  
GLN N   H    sing N N 84  
GLN N   H2   sing N N 85  
GLN CA  C    sing N N 86  
GLN CA  CB   sing N N 87  
GLN CA  HA   sing N N 88  
GLN C   O    doub N N 89  
GLN C   OXT  sing N N 90  
GLN CB  CG   sing N N 91  
GLN CB  HB2  sing N N 92  
GLN CB  HB3  sing N N 93  
GLN CG  CD   sing N N 94  
GLN CG  HG2  sing N N 95  
GLN CG  HG3  sing N N 96  
GLN CD  OE1  doub N N 97  
GLN CD  NE2  sing N N 98  
GLN NE2 HE21 sing N N 99  
GLN NE2 HE22 sing N N 100 
GLN OXT HXT  sing N N 101 
GLU N   CA   sing N N 102 
GLU N   H    sing N N 103 
GLU N   H2   sing N N 104 
GLU CA  C    sing N N 105 
GLU CA  CB   sing N N 106 
GLU CA  HA   sing N N 107 
GLU C   O    doub N N 108 
GLU C   OXT  sing N N 109 
GLU CB  CG   sing N N 110 
GLU CB  HB2  sing N N 111 
GLU CB  HB3  sing N N 112 
GLU CG  CD   sing N N 113 
GLU CG  HG2  sing N N 114 
GLU CG  HG3  sing N N 115 
GLU CD  OE1  doub N N 116 
GLU CD  OE2  sing N N 117 
GLU OE2 HE2  sing N N 118 
GLU OXT HXT  sing N N 119 
GLY N   CA   sing N N 120 
GLY N   H    sing N N 121 
GLY N   H2   sing N N 122 
GLY CA  C    sing N N 123 
GLY CA  HA2  sing N N 124 
GLY CA  HA3  sing N N 125 
GLY C   O    doub N N 126 
GLY C   OXT  sing N N 127 
GLY OXT HXT  sing N N 128 
HIS N   CA   sing N N 129 
HIS N   H    sing N N 130 
HIS N   H2   sing N N 131 
HIS CA  C    sing N N 132 
HIS CA  CB   sing N N 133 
HIS CA  HA   sing N N 134 
HIS C   O    doub N N 135 
HIS C   OXT  sing N N 136 
HIS CB  CG   sing N N 137 
HIS CB  HB2  sing N N 138 
HIS CB  HB3  sing N N 139 
HIS CG  ND1  sing Y N 140 
HIS CG  CD2  doub Y N 141 
HIS ND1 CE1  doub Y N 142 
HIS ND1 HD1  sing N N 143 
HIS CD2 NE2  sing Y N 144 
HIS CD2 HD2  sing N N 145 
HIS CE1 NE2  sing Y N 146 
HIS CE1 HE1  sing N N 147 
HIS NE2 HE2  sing N N 148 
HIS OXT HXT  sing N N 149 
HOH O   H1   sing N N 150 
HOH O   H2   sing N N 151 
ILE N   CA   sing N N 152 
ILE N   H    sing N N 153 
ILE N   H2   sing N N 154 
ILE CA  C    sing N N 155 
ILE CA  CB   sing N N 156 
ILE CA  HA   sing N N 157 
ILE C   O    doub N N 158 
ILE C   OXT  sing N N 159 
ILE CB  CG1  sing N N 160 
ILE CB  CG2  sing N N 161 
ILE CB  HB   sing N N 162 
ILE CG1 CD1  sing N N 163 
ILE CG1 HG12 sing N N 164 
ILE CG1 HG13 sing N N 165 
ILE CG2 HG21 sing N N 166 
ILE CG2 HG22 sing N N 167 
ILE CG2 HG23 sing N N 168 
ILE CD1 HD11 sing N N 169 
ILE CD1 HD12 sing N N 170 
ILE CD1 HD13 sing N N 171 
ILE OXT HXT  sing N N 172 
LEU N   CA   sing N N 173 
LEU N   H    sing N N 174 
LEU N   H2   sing N N 175 
LEU CA  C    sing N N 176 
LEU CA  CB   sing N N 177 
LEU CA  HA   sing N N 178 
LEU C   O    doub N N 179 
LEU C   OXT  sing N N 180 
LEU CB  CG   sing N N 181 
LEU CB  HB2  sing N N 182 
LEU CB  HB3  sing N N 183 
LEU CG  CD1  sing N N 184 
LEU CG  CD2  sing N N 185 
LEU CG  HG   sing N N 186 
LEU CD1 HD11 sing N N 187 
LEU CD1 HD12 sing N N 188 
LEU CD1 HD13 sing N N 189 
LEU CD2 HD21 sing N N 190 
LEU CD2 HD22 sing N N 191 
LEU CD2 HD23 sing N N 192 
LEU OXT HXT  sing N N 193 
LYS N   CA   sing N N 194 
LYS N   H    sing N N 195 
LYS N   H2   sing N N 196 
LYS CA  C    sing N N 197 
LYS CA  CB   sing N N 198 
LYS CA  HA   sing N N 199 
LYS C   O    doub N N 200 
LYS C   OXT  sing N N 201 
LYS CB  CG   sing N N 202 
LYS CB  HB2  sing N N 203 
LYS CB  HB3  sing N N 204 
LYS CG  CD   sing N N 205 
LYS CG  HG2  sing N N 206 
LYS CG  HG3  sing N N 207 
LYS CD  CE   sing N N 208 
LYS CD  HD2  sing N N 209 
LYS CD  HD3  sing N N 210 
LYS CE  NZ   sing N N 211 
LYS CE  HE2  sing N N 212 
LYS CE  HE3  sing N N 213 
LYS NZ  HZ1  sing N N 214 
LYS NZ  HZ2  sing N N 215 
LYS NZ  HZ3  sing N N 216 
LYS OXT HXT  sing N N 217 
MET N   CA   sing N N 218 
MET N   H    sing N N 219 
MET N   H2   sing N N 220 
MET CA  C    sing N N 221 
MET CA  CB   sing N N 222 
MET CA  HA   sing N N 223 
MET C   O    doub N N 224 
MET C   OXT  sing N N 225 
MET CB  CG   sing N N 226 
MET CB  HB2  sing N N 227 
MET CB  HB3  sing N N 228 
MET CG  SD   sing N N 229 
MET CG  HG2  sing N N 230 
MET CG  HG3  sing N N 231 
MET SD  CE   sing N N 232 
MET CE  HE1  sing N N 233 
MET CE  HE2  sing N N 234 
MET CE  HE3  sing N N 235 
MET OXT HXT  sing N N 236 
PHE N   CA   sing N N 237 
PHE N   H    sing N N 238 
PHE N   H2   sing N N 239 
PHE CA  C    sing N N 240 
PHE CA  CB   sing N N 241 
PHE CA  HA   sing N N 242 
PHE C   O    doub N N 243 
PHE C   OXT  sing N N 244 
PHE CB  CG   sing N N 245 
PHE CB  HB2  sing N N 246 
PHE CB  HB3  sing N N 247 
PHE CG  CD1  doub Y N 248 
PHE CG  CD2  sing Y N 249 
PHE CD1 CE1  sing Y N 250 
PHE CD1 HD1  sing N N 251 
PHE CD2 CE2  doub Y N 252 
PHE CD2 HD2  sing N N 253 
PHE CE1 CZ   doub Y N 254 
PHE CE1 HE1  sing N N 255 
PHE CE2 CZ   sing Y N 256 
PHE CE2 HE2  sing N N 257 
PHE CZ  HZ   sing N N 258 
PHE OXT HXT  sing N N 259 
PRO N   CA   sing N N 260 
PRO N   CD   sing N N 261 
PRO N   H    sing N N 262 
PRO CA  C    sing N N 263 
PRO CA  CB   sing N N 264 
PRO CA  HA   sing N N 265 
PRO C   O    doub N N 266 
PRO C   OXT  sing N N 267 
PRO CB  CG   sing N N 268 
PRO CB  HB2  sing N N 269 
PRO CB  HB3  sing N N 270 
PRO CG  CD   sing N N 271 
PRO CG  HG2  sing N N 272 
PRO CG  HG3  sing N N 273 
PRO CD  HD2  sing N N 274 
PRO CD  HD3  sing N N 275 
PRO OXT HXT  sing N N 276 
SER N   CA   sing N N 277 
SER N   H    sing N N 278 
SER N   H2   sing N N 279 
SER CA  C    sing N N 280 
SER CA  CB   sing N N 281 
SER CA  HA   sing N N 282 
SER C   O    doub N N 283 
SER C   OXT  sing N N 284 
SER CB  OG   sing N N 285 
SER CB  HB2  sing N N 286 
SER CB  HB3  sing N N 287 
SER OG  HG   sing N N 288 
SER OXT HXT  sing N N 289 
THR N   CA   sing N N 290 
THR N   H    sing N N 291 
THR N   H2   sing N N 292 
THR CA  C    sing N N 293 
THR CA  CB   sing N N 294 
THR CA  HA   sing N N 295 
THR C   O    doub N N 296 
THR C   OXT  sing N N 297 
THR CB  OG1  sing N N 298 
THR CB  CG2  sing N N 299 
THR CB  HB   sing N N 300 
THR OG1 HG1  sing N N 301 
THR CG2 HG21 sing N N 302 
THR CG2 HG22 sing N N 303 
THR CG2 HG23 sing N N 304 
THR OXT HXT  sing N N 305 
TRP N   CA   sing N N 306 
TRP N   H    sing N N 307 
TRP N   H2   sing N N 308 
TRP CA  C    sing N N 309 
TRP CA  CB   sing N N 310 
TRP CA  HA   sing N N 311 
TRP C   O    doub N N 312 
TRP C   OXT  sing N N 313 
TRP CB  CG   sing N N 314 
TRP CB  HB2  sing N N 315 
TRP CB  HB3  sing N N 316 
TRP CG  CD1  doub Y N 317 
TRP CG  CD2  sing Y N 318 
TRP CD1 NE1  sing Y N 319 
TRP CD1 HD1  sing N N 320 
TRP CD2 CE2  doub Y N 321 
TRP CD2 CE3  sing Y N 322 
TRP NE1 CE2  sing Y N 323 
TRP NE1 HE1  sing N N 324 
TRP CE2 CZ2  sing Y N 325 
TRP CE3 CZ3  doub Y N 326 
TRP CE3 HE3  sing N N 327 
TRP CZ2 CH2  doub Y N 328 
TRP CZ2 HZ2  sing N N 329 
TRP CZ3 CH2  sing Y N 330 
TRP CZ3 HZ3  sing N N 331 
TRP CH2 HH2  sing N N 332 
TRP OXT HXT  sing N N 333 
TYR N   CA   sing N N 334 
TYR N   H    sing N N 335 
TYR N   H2   sing N N 336 
TYR CA  C    sing N N 337 
TYR CA  CB   sing N N 338 
TYR CA  HA   sing N N 339 
TYR C   O    doub N N 340 
TYR C   OXT  sing N N 341 
TYR CB  CG   sing N N 342 
TYR CB  HB2  sing N N 343 
TYR CB  HB3  sing N N 344 
TYR CG  CD1  doub Y N 345 
TYR CG  CD2  sing Y N 346 
TYR CD1 CE1  sing Y N 347 
TYR CD1 HD1  sing N N 348 
TYR CD2 CE2  doub Y N 349 
TYR CD2 HD2  sing N N 350 
TYR CE1 CZ   doub Y N 351 
TYR CE1 HE1  sing N N 352 
TYR CE2 CZ   sing Y N 353 
TYR CE2 HE2  sing N N 354 
TYR CZ  OH   sing N N 355 
TYR OH  HH   sing N N 356 
TYR OXT HXT  sing N N 357 
VAL N   CA   sing N N 358 
VAL N   H    sing N N 359 
VAL N   H2   sing N N 360 
VAL CA  C    sing N N 361 
VAL CA  CB   sing N N 362 
VAL CA  HA   sing N N 363 
VAL C   O    doub N N 364 
VAL C   OXT  sing N N 365 
VAL CB  CG1  sing N N 366 
VAL CB  CG2  sing N N 367 
VAL CB  HB   sing N N 368 
VAL CG1 HG11 sing N N 369 
VAL CG1 HG12 sing N N 370 
VAL CG1 HG13 sing N N 371 
VAL CG2 HG21 sing N N 372 
VAL CG2 HG22 sing N N 373 
VAL CG2 HG23 sing N N 374 
VAL OXT HXT  sing N N 375 
XFQ C9  C8   sing N N 376 
XFQ C7  C8   sing N N 377 
XFQ C7  C6   sing N N 378 
XFQ C8  C10  doub N Z 379 
XFQ O13 C6   sing Y N 380 
XFQ O13 C14  sing Y N 381 
XFQ C6  C5   doub Y N 382 
XFQ C10 C11  sing N N 383 
XFQ C14 C15  doub Y N 384 
XFQ C11 C12  sing N N 385 
XFQ C12 C2   sing N N 386 
XFQ C5  C15  sing Y N 387 
XFQ C5  C4   sing N N 388 
XFQ C15 C16  sing N N 389 
XFQ C2  C3   doub N E 390 
XFQ C2  C1   sing N N 391 
XFQ C3  C4   sing N N 392 
XFQ C4  O17  doub N N 393 
XFQ C1  H1   sing N N 394 
XFQ C1  H2   sing N N 395 
XFQ C1  H3   sing N N 396 
XFQ C3  H5   sing N N 397 
XFQ C7  H8   sing N N 398 
XFQ C7  H9   sing N N 399 
XFQ C10 H10  sing N N 400 
XFQ C11 H12  sing N N 401 
XFQ C11 H13  sing N N 402 
XFQ C12 H14  sing N N 403 
XFQ C12 H15  sing N N 404 
XFQ C14 H16  sing N N 405 
XFQ C16 H17  sing N N 406 
XFQ C16 H18  sing N N 407 
XFQ C16 H19  sing N N 408 
XFQ C9  H20  sing N N 409 
XFQ C9  H21  sing N N 410 
XFQ C9  H22  sing N N 411 
# 
_pdbx_audit_support.funding_organization   'Agence Nationale de la Recherche (ANR)' 
_pdbx_audit_support.country                France 
_pdbx_audit_support.grant_number           ANR-18-CE34-0009-01 
_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   7AXE 
_pdbx_initial_refinement_model.details          ? 
# 
_atom_sites.entry_id                    8R00 
_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]   0.010890 
_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]   0.010890 
_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]   0.011664 
_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   . GLY A 1 24  ? -5.816  43.984  10.433  1.00 66.52  ? 142 GLY A N   1 
ATOM   2    C CA  . GLY A 1 24  ? -5.804  43.942  11.885  1.00 61.97  ? 142 GLY A CA  1 
ATOM   3    C C   . GLY A 1 24  ? -6.229  45.268  12.478  1.00 60.60  ? 142 GLY A C   1 
ATOM   4    O O   . GLY A 1 24  ? -6.090  45.523  13.674  1.00 57.27  ? 142 GLY A O   1 
ATOM   5    N N   . LEU A 1 25  ? -6.761  46.119  11.613  1.00 51.83  ? 143 LEU A N   1 
ATOM   6    C CA  . LEU A 1 25  ? -7.258  47.424  12.005  1.00 46.25  ? 143 LEU A CA  1 
ATOM   7    C C   . LEU A 1 25  ? -8.703  47.301  12.469  1.00 42.96  ? 143 LEU A C   1 
ATOM   8    O O   . LEU A 1 25  ? -9.442  46.432  12.006  1.00 50.85  ? 143 LEU A O   1 
ATOM   9    C CB  . LEU A 1 25  ? -7.176  48.381  10.814  1.00 42.62  ? 143 LEU A CB  1 
ATOM   10   C CG  . LEU A 1 25  ? -5.770  48.784  10.356  1.00 43.31  ? 143 LEU A CG  1 
ATOM   11   C CD1 . LEU A 1 25  ? -5.847  49.421  8.986   1.00 50.82  ? 143 LEU A CD1 1 
ATOM   12   C CD2 . LEU A 1 25  ? -5.188  49.755  11.315  1.00 39.36  ? 143 LEU A CD2 1 
ATOM   13   N N   . THR A 1 26  ? -9.114  48.188  13.371  1.00 42.57  ? 144 THR A N   1 
ATOM   14   C CA  . THR A 1 26  ? -10.533 48.264  13.675  1.00 49.01  ? 144 THR A CA  1 
ATOM   15   C C   . THR A 1 26  ? -11.295 48.846  12.491  1.00 56.19  ? 144 THR A C   1 
ATOM   16   O O   . THR A 1 26  ? -10.721 49.443  11.574  1.00 45.77  ? 144 THR A O   1 
ATOM   17   C CB  . THR A 1 26  ? -10.806 49.129  14.903  1.00 47.33  ? 144 THR A CB  1 
ATOM   18   O OG1 . THR A 1 26  ? -10.523 50.498  14.596  1.00 45.61  ? 144 THR A OG1 1 
ATOM   19   C CG2 . THR A 1 26  ? -9.928  48.706  16.041  1.00 46.15  ? 144 THR A CG2 1 
ATOM   20   N N   . GLU A 1 27  ? -12.617 48.674  12.528  1.00 54.85  ? 145 GLU A N   1 
ATOM   21   C CA  . GLU A 1 27  ? -13.458 49.255  11.489  1.00 61.32  ? 145 GLU A CA  1 
ATOM   22   C C   . GLU A 1 27  ? -13.340 50.771  11.492  1.00 51.68  ? 145 GLU A C   1 
ATOM   23   O O   . GLU A 1 27  ? -13.366 51.410  10.433  1.00 53.87  ? 145 GLU A O   1 
ATOM   24   C CB  . GLU A 1 27  ? -14.913 48.810  11.685  1.00 65.56  ? 145 GLU A CB  1 
ATOM   25   C CG  . GLU A 1 27  ? -15.933 49.508  10.790  1.00 67.52  ? 145 GLU A CG  1 
ATOM   26   C CD  . GLU A 1 27  ? -15.774 49.149  9.319   1.00 74.30  ? 145 GLU A CD  1 
ATOM   27   O OE1 . GLU A 1 27  ? -15.152 48.103  9.021   1.00 70.23  ? 145 GLU A OE1 1 
ATOM   28   O OE2 . GLU A 1 27  ? -16.283 49.912  8.464   1.00 76.31  ? 145 GLU A OE2 1 
ATOM   29   N N   . GLU A 1 28  ? -13.187 51.361  12.676  1.00 41.14  ? 146 GLU A N   1 
ATOM   30   C CA  . GLU A 1 28  ? -12.997 52.801  12.770  1.00 46.13  ? 146 GLU A CA  1 
ATOM   31   C C   . GLU A 1 28  ? -11.685 53.219  12.119  1.00 45.65  ? 146 GLU A C   1 
ATOM   32   O O   . GLU A 1 28  ? -11.623 54.229  11.408  1.00 42.40  ? 146 GLU A O   1 
ATOM   33   C CB  . GLU A 1 28  ? -13.023 53.231  14.235  1.00 49.03  ? 146 GLU A CB  1 
ATOM   34   C CG  . GLU A 1 28  ? -13.402 54.673  14.462  1.00 56.08  ? 146 GLU A CG  1 
ATOM   35   N N   . GLN A 1 29  ? -10.616 52.463  12.375  1.00 39.67  ? 147 GLN A N   1 
ATOM   36   C CA  . GLN A 1 29  ? -9.331  52.778  11.765  1.00 40.56  ? 147 GLN A CA  1 
ATOM   37   C C   . GLN A 1 29  ? -9.388  52.595  10.256  1.00 40.84  ? 147 GLN A C   1 
ATOM   38   O O   . GLN A 1 29  ? -8.834  53.411  9.511   1.00 33.79  ? 147 GLN A O   1 
ATOM   39   C CB  . GLN A 1 29  ? -8.231  51.919  12.393  1.00 35.07  ? 147 GLN A CB  1 
ATOM   40   C CG  . GLN A 1 29  ? -7.985  52.250  13.856  1.00 39.38  ? 147 GLN A CG  1 
ATOM   41   C CD  . GLN A 1 29  ? -7.048  51.262  14.531  1.00 39.88  ? 147 GLN A CD  1 
ATOM   42   O OE1 . GLN A 1 29  ? -7.011  50.076  14.184  1.00 40.02  ? 147 GLN A OE1 1 
ATOM   43   N NE2 . GLN A 1 29  ? -6.282  51.749  15.499  1.00 42.78  ? 147 GLN A NE2 1 
ATOM   44   N N   . ARG A 1 30  ? -10.078 51.548  9.782   1.00 38.79  ? 148 ARG A N   1 
ATOM   45   C CA  . ARG A 1 30  ? -10.192 51.344  8.339   1.00 39.19  ? 148 ARG A CA  1 
ATOM   46   C C   . ARG A 1 30  ? -10.954 52.485  7.683   1.00 40.76  ? 148 ARG A C   1 
ATOM   47   O O   . ARG A 1 30  ? -10.599 52.930  6.580   1.00 38.00  ? 148 ARG A O   1 
ATOM   48   C CB  . ARG A 1 30  ? -10.902 50.024  8.009   1.00 44.91  ? 148 ARG A CB  1 
ATOM   49   C CG  . ARG A 1 30  ? -10.028 48.771  8.038   1.00 50.21  ? 148 ARG A CG  1 
ATOM   50   C CD  . ARG A 1 30  ? -10.867 47.514  7.740   1.00 51.35  ? 148 ARG A CD  1 
ATOM   51   N NE  . ARG A 1 30  ? -12.058 47.402  8.582   1.00 69.16  ? 148 ARG A NE  1 
ATOM   52   C CZ  . ARG A 1 30  ? -12.313 46.398  9.418   1.00 73.30  ? 148 ARG A CZ  1 
ATOM   53   N NH1 . ARG A 1 30  ? -11.457 45.391  9.545   1.00 74.07  ? 148 ARG A NH1 1 
ATOM   54   N NH2 . ARG A 1 30  ? -13.437 46.398  10.122  1.00 67.63  ? 148 ARG A NH2 1 
ATOM   55   N N   . MET A 1 31  ? -12.031 52.950  8.320   1.00 39.62  ? 149 MET A N   1 
ATOM   56   C CA  . MET A 1 31  ? -12.785 54.062  7.752   1.00 42.69  ? 149 MET A CA  1 
ATOM   57   C C   . MET A 1 31  ? -11.971 55.343  7.783   1.00 37.13  ? 149 MET A C   1 
ATOM   58   O O   . MET A 1 31  ? -12.070 56.172  6.875   1.00 33.40  ? 149 MET A O   1 
ATOM   59   C CB  . MET A 1 31  ? -14.108 54.256  8.498   1.00 46.46  ? 149 MET A CB  1 
ATOM   60   C CG  . MET A 1 31  ? -15.112 53.127  8.248   1.00 68.41  ? 149 MET A CG  1 
ATOM   61   S SD  . MET A 1 31  ? -15.759 53.088  6.552   1.00 116.54 ? 149 MET A SD  1 
ATOM   62   C CE  . MET A 1 31  ? -14.807 51.749  5.810   1.00 59.39  ? 149 MET A CE  1 
ATOM   63   N N   . MET A 1 32  ? -11.168 55.524  8.826   1.00 33.51  ? 150 MET A N   1 
ATOM   64   C CA  . MET A 1 32  ? -10.319 56.702  8.917   1.00 36.12  ? 150 MET A CA  1 
ATOM   65   C C   . MET A 1 32  ? -9.338  56.759  7.740   1.00 30.73  ? 150 MET A C   1 
ATOM   66   O O   . MET A 1 32  ? -9.180  57.799  7.088   1.00 31.29  ? 150 MET A O   1 
ATOM   67   C CB  . MET A 1 32  ? -9.589  56.653  10.257  1.00 40.45  ? 150 MET A CB  1 
ATOM   68   C CG  . MET A 1 32  ? -8.548  57.703  10.484  1.00 39.72  ? 150 MET A CG  1 
ATOM   69   S SD  . MET A 1 32  ? -8.111  57.743  12.258  1.00 50.61  ? 150 MET A SD  1 
ATOM   70   C CE  . MET A 1 32  ? -9.623  58.316  13.007  1.00 43.56  ? 150 MET A CE  1 
ATOM   71   N N   . ILE A 1 33  ? -8.656  55.648  7.466   1.00 29.01  ? 151 ILE A N   1 
ATOM   72   C CA  . ILE A 1 33  ? -7.707  55.627  6.361   1.00 30.31  ? 151 ILE A CA  1 
ATOM   73   C C   . ILE A 1 33  ? -8.444  55.837  5.057   1.00 33.62  ? 151 ILE A C   1 
ATOM   74   O O   . ILE A 1 33  ? -7.973  56.548  4.160   1.00 25.49  ? 151 ILE A O   1 
ATOM   75   C CB  . ILE A 1 33  ? -6.932  54.303  6.345   1.00 28.84  ? 151 ILE A CB  1 
ATOM   76   C CG1 . ILE A 1 33  ? -6.023  54.199  7.570   1.00 28.31  ? 151 ILE A CG1 1 
ATOM   77   C CG2 . ILE A 1 33  ? -6.112  54.180  5.026   1.00 29.37  ? 151 ILE A CG2 1 
ATOM   78   C CD1 . ILE A 1 33  ? -5.325  52.839  7.625   1.00 31.97  ? 151 ILE A CD1 1 
ATOM   79   N N   A ARG A 1 34  ? -9.629  55.232  4.936   0.61 33.89  ? 152 ARG A N   1 
ATOM   80   N N   B ARG A 1 34  ? -9.631  55.240  4.936   0.39 33.94  ? 152 ARG A N   1 
ATOM   81   C CA  A ARG A 1 34  ? -10.422 55.396  3.728   0.61 36.21  ? 152 ARG A CA  1 
ATOM   82   C CA  B ARG A 1 34  ? -10.409 55.406  3.718   0.39 36.20  ? 152 ARG A CA  1 
ATOM   83   C C   A ARG A 1 34  ? -10.790 56.854  3.500   0.61 32.37  ? 152 ARG A C   1 
ATOM   84   C C   B ARG A 1 34  ? -10.778 56.865  3.496   0.39 32.46  ? 152 ARG A C   1 
ATOM   85   O O   A ARG A 1 34  ? -10.711 57.350  2.372   0.61 28.74  ? 152 ARG A O   1 
ATOM   86   O O   B ARG A 1 34  ? -10.686 57.369  2.372   0.39 28.86  ? 152 ARG A O   1 
ATOM   87   C CB  A ARG A 1 34  ? -11.671 54.510  3.803   0.61 38.31  ? 152 ARG A CB  1 
ATOM   88   C CB  B ARG A 1 34  ? -11.658 54.528  3.771   0.39 38.42  ? 152 ARG A CB  1 
ATOM   89   C CG  A ARG A 1 34  ? -12.732 54.865  2.786   0.61 47.01  ? 152 ARG A CG  1 
ATOM   90   C CG  B ARG A 1 34  ? -12.091 54.061  2.408   0.39 48.96  ? 152 ARG A CG  1 
ATOM   91   C CD  A ARG A 1 34  ? -12.628 53.989  1.531   0.61 57.79  ? 152 ARG A CD  1 
ATOM   92   C CD  B ARG A 1 34  ? -11.195 52.929  1.922   0.39 53.78  ? 152 ARG A CD  1 
ATOM   93   N NE  A ARG A 1 34  ? -11.256 53.568  1.255   0.61 59.76  ? 152 ARG A NE  1 
ATOM   94   N NE  B ARG A 1 34  ? -10.192 53.381  0.955   0.39 58.77  ? 152 ARG A NE  1 
ATOM   95   C CZ  A ARG A 1 34  ? -10.388 54.273  0.533   0.61 54.51  ? 152 ARG A CZ  1 
ATOM   96   C CZ  B ARG A 1 34  ? -8.876  53.301  1.141   0.39 53.97  ? 152 ARG A CZ  1 
ATOM   97   N NH1 A ARG A 1 34  ? -9.155  53.809  0.347   0.61 45.73  ? 152 ARG A NH1 1 
ATOM   98   N NH1 B ARG A 1 34  ? -8.047  53.731  0.199   0.39 47.44  ? 152 ARG A NH1 1 
ATOM   99   N NH2 A ARG A 1 34  ? -10.747 55.444  0.013   0.61 65.27  ? 152 ARG A NH2 1 
ATOM   100  N NH2 B ARG A 1 34  ? -8.385  52.790  2.263   0.39 65.27  ? 152 ARG A NH2 1 
ATOM   101  N N   . GLU A 1 35  ? -11.181 57.570  4.555   1.00 28.74  ? 153 GLU A N   1 
ATOM   102  C CA  . GLU A 1 35  ? -11.566 58.964  4.362   1.00 30.79  ? 153 GLU A CA  1 
ATOM   103  C C   . GLU A 1 35  ? -10.355 59.820  3.986   1.00 30.05  ? 153 GLU A C   1 
ATOM   104  O O   . GLU A 1 35  ? -10.464 60.733  3.156   1.00 27.84  ? 153 GLU A O   1 
ATOM   105  C CB  . GLU A 1 35  ? -12.250 59.535  5.601   1.00 32.07  ? 153 GLU A CB  1 
ATOM   106  C CG  . GLU A 1 35  ? -12.724 60.926  5.273   1.00 43.01  ? 153 GLU A CG  1 
ATOM   107  C CD  . GLU A 1 35  ? -13.437 61.628  6.386   1.00 51.51  ? 153 GLU A CD  1 
ATOM   108  O OE1 . GLU A 1 35  ? -13.426 61.119  7.533   1.00 48.86  ? 153 GLU A OE1 1 
ATOM   109  O OE2 . GLU A 1 35  ? -14.029 62.690  6.084   1.00 49.77  ? 153 GLU A OE2 1 
ATOM   110  N N   . LEU A 1 36  ? -9.187  59.528  4.569   1.00 28.27  ? 154 LEU A N   1 
ATOM   111  C CA  . LEU A 1 36  ? -7.971  60.256  4.203   1.00 27.32  ? 154 LEU A CA  1 
ATOM   112  C C   . LEU A 1 36  ? -7.556  59.978  2.756   1.00 24.61  ? 154 LEU A C   1 
ATOM   113  O O   . LEU A 1 36  ? -7.225  60.905  2.016   1.00 28.38  ? 154 LEU A O   1 
ATOM   114  C CB  . LEU A 1 36  ? -6.833  59.886  5.165   1.00 25.46  ? 154 LEU A CB  1 
ATOM   115  C CG  . LEU A 1 36  ? -7.068  60.292  6.623   1.00 27.76  ? 154 LEU A CG  1 
ATOM   116  C CD1 . LEU A 1 36  ? -5.868  59.885  7.499   1.00 26.47  ? 154 LEU A CD1 1 
ATOM   117  C CD2 . LEU A 1 36  ? -7.309  61.795  6.714   1.00 21.61  ? 154 LEU A CD2 1 
ATOM   118  N N   . MET A 1 37  ? -7.483  58.696  2.361   1.00 25.39  ? 155 MET A N   1 
ATOM   119  C CA  . MET A 1 37  ? -7.161  58.345  0.971   1.00 25.14  ? 155 MET A CA  1 
ATOM   120  C C   . MET A 1 37  ? -8.138  58.977  -0.009  1.00 28.78  ? 155 MET A C   1 
ATOM   121  O O   . MET A 1 37  ? -7.745  59.424  -1.097  1.00 26.40  ? 155 MET A O   1 
ATOM   122  C CB  . MET A 1 37  ? -7.156  56.823  0.825   1.00 25.34  ? 155 MET A CB  1 
ATOM   123  C CG  . MET A 1 37  ? -5.931  56.070  1.377   1.00 29.70  ? 155 MET A CG  1 
ATOM   124  S SD  . MET A 1 37  ? -4.335  56.770  0.851   1.00 31.08  ? 155 MET A SD  1 
ATOM   125  C CE  . MET A 1 37  ? -4.363  56.244  -0.879  1.00 37.16  ? 155 MET A CE  1 
ATOM   126  N N   . ASP A 1 38  ? -9.414  59.030  0.364   1.00 29.11  ? 156 ASP A N   1 
ATOM   127  C CA  . ASP A 1 38  ? -10.412 59.668  -0.484  1.00 29.67  ? 156 ASP A CA  1 
ATOM   128  C C   . ASP A 1 38  ? -10.112 61.151  -0.648  1.00 30.71  ? 156 ASP A C   1 
ATOM   129  O O   . ASP A 1 38  ? -10.105 61.675  -1.770  1.00 24.97  ? 156 ASP A O   1 
ATOM   130  C CB  . ASP A 1 38  ? -11.804 59.464  0.112   1.00 27.72  ? 156 ASP A CB  1 
ATOM   131  C CG  . ASP A 1 38  ? -12.907 59.911  -0.837  1.00 41.32  ? 156 ASP A CG  1 
ATOM   132  O OD1 . ASP A 1 38  ? -12.920 59.416  -1.984  1.00 50.62  ? 156 ASP A OD1 1 
ATOM   133  O OD2 . ASP A 1 38  ? -13.735 60.757  -0.443  1.00 38.54  ? 156 ASP A OD2 1 
ATOM   134  N N   . ALA A 1 39  ? -9.847  61.844  0.469   1.00 26.45  ? 157 ALA A N   1 
ATOM   135  C CA  . ALA A 1 39  ? -9.496  63.256  0.414   1.00 26.97  ? 157 ALA A CA  1 
ATOM   136  C C   . ALA A 1 39  ? -8.226  63.468  -0.403  1.00 27.33  ? 157 ALA A C   1 
ATOM   137  O O   . ALA A 1 39  ? -8.147  64.407  -1.204  1.00 26.60  ? 157 ALA A O   1 
ATOM   138  C CB  . ALA A 1 39  ? -9.315  63.814  1.827   1.00 26.45  ? 157 ALA A CB  1 
ATOM   139  N N   . GLN A 1 40  ? -7.226  62.596  -0.218  1.00 24.18  ? 158 GLN A N   1 
ATOM   140  C CA  . GLN A 1 40  ? -5.982  62.696  -0.994  1.00 22.74  ? 158 GLN A CA  1 
ATOM   141  C C   . GLN A 1 40  ? -6.239  62.530  -2.495  1.00 28.39  ? 158 GLN A C   1 
ATOM   142  O O   . GLN A 1 40  ? -5.793  63.345  -3.316  1.00 27.42  ? 158 GLN A O   1 
ATOM   143  C CB  . GLN A 1 40  ? -4.986  61.632  -0.494  1.00 25.97  ? 158 GLN A CB  1 
ATOM   144  C CG  . GLN A 1 40  ? -3.554  61.758  -1.101  1.00 24.72  ? 158 GLN A CG  1 
ATOM   145  C CD  . GLN A 1 40  ? -2.680  62.760  -0.371  1.00 26.77  ? 158 GLN A CD  1 
ATOM   146  O OE1 . GLN A 1 40  ? -3.105  63.883  -0.105  1.00 27.28  ? 158 GLN A OE1 1 
ATOM   147  N NE2 . GLN A 1 40  ? -1.422  62.378  -0.073  1.00 26.38  ? 158 GLN A NE2 1 
ATOM   148  N N   . MET A 1 41  ? -6.941  61.460  -2.870  1.00 26.30  ? 159 MET A N   1 
ATOM   149  C CA  . MET A 1 41  ? -7.312  61.210  -4.275  1.00 25.21  ? 159 MET A CA  1 
ATOM   150  C C   . MET A 1 41  ? -8.035  62.393  -4.910  1.00 28.04  ? 159 MET A C   1 
ATOM   151  O O   . MET A 1 41  ? -7.858  62.676  -6.107  1.00 28.02  ? 159 MET A O   1 
ATOM   152  C CB  . MET A 1 41  ? -8.188  59.950  -4.328  1.00 28.34  ? 159 MET A CB  1 
ATOM   153  C CG  . MET A 1 41  ? -8.680  59.441  -5.700  1.00 33.65  ? 159 MET A CG  1 
ATOM   154  S SD  . MET A 1 41  ? -10.224 60.271  -6.153  1.00 36.59  ? 159 MET A SD  1 
ATOM   155  C CE  . MET A 1 41  ? -11.497 59.447  -5.184  1.00 30.50  ? 159 MET A CE  1 
ATOM   156  N N   . LYS A 1 42  ? -8.870  63.089  -4.139  1.00 27.19  ? 160 LYS A N   1 
ATOM   157  C CA  . LYS A 1 42  ? -9.707  64.126  -4.731  1.00 27.09  ? 160 LYS A CA  1 
ATOM   158  C C   . LYS A 1 42  ? -8.974  65.437  -4.885  1.00 31.46  ? 160 LYS A C   1 
ATOM   159  O O   . LYS A 1 42  ? -9.378  66.258  -5.718  1.00 26.24  ? 160 LYS A O   1 
ATOM   160  C CB  . LYS A 1 42  ? -10.976 64.353  -3.881  1.00 25.76  ? 160 LYS A CB  1 
ATOM   161  C CG  . LYS A 1 42  ? -11.985 63.226  -3.945  1.00 31.30  ? 160 LYS A CG  1 
ATOM   162  C CD  . LYS A 1 42  ? -13.113 63.407  -2.922  1.00 41.22  ? 160 LYS A CD  1 
ATOM   163  C CE  . LYS A 1 42  ? -14.172 62.320  -3.085  1.00 48.81  ? 160 LYS A CE  1 
ATOM   164  N NZ  . LYS A 1 42  ? -15.129 62.336  -1.937  1.00 57.37  ? 160 LYS A NZ  1 
ATOM   165  N N   . THR A 1 43  ? -7.908  65.654  -4.103  1.00 25.17  ? 161 THR A N   1 
ATOM   166  C CA  . THR A 1 43  ? -7.322  66.979  -3.957  1.00 23.74  ? 161 THR A CA  1 
ATOM   167  C C   . THR A 1 43  ? -5.833  67.038  -4.283  1.00 28.31  ? 161 THR A C   1 
ATOM   168  O O   . THR A 1 43  ? -5.255  68.119  -4.226  1.00 26.02  ? 161 THR A O   1 
ATOM   169  C CB  . THR A 1 43  ? -7.543  67.503  -2.532  1.00 25.92  ? 161 THR A CB  1 
ATOM   170  O OG1 . THR A 1 43  ? -6.854  66.656  -1.596  1.00 23.17  ? 161 THR A OG1 1 
ATOM   171  C CG2 . THR A 1 43  ? -9.062  67.534  -2.202  1.00 26.17  ? 161 THR A CG2 1 
ATOM   172  N N   . PHE A 1 44  ? -5.199  65.924  -4.596  1.00 25.14  ? 162 PHE A N   1 
ATOM   173  C CA  . PHE A 1 44  ? -3.784  65.896  -4.965  1.00 29.41  ? 162 PHE A CA  1 
ATOM   174  C C   . PHE A 1 44  ? -3.721  65.571  -6.455  1.00 32.00  ? 162 PHE A C   1 
ATOM   175  O O   . PHE A 1 44  ? -3.883  64.422  -6.876  1.00 27.93  ? 162 PHE A O   1 
ATOM   176  C CB  . PHE A 1 44  ? -3.007  64.913  -4.077  1.00 24.05  ? 162 PHE A CB  1 
ATOM   177  C CG  . PHE A 1 44  ? -1.505  64.944  -4.281  1.00 25.16  ? 162 PHE A CG  1 
ATOM   178  C CD1 . PHE A 1 44  ? -0.902  65.949  -5.034  1.00 26.02  ? 162 PHE A CD1 1 
ATOM   179  C CD2 . PHE A 1 44  ? -0.692  64.029  -3.619  1.00 27.30  ? 162 PHE A CD2 1 
ATOM   180  C CE1 . PHE A 1 44  ? 0.501   65.967  -5.224  1.00 29.10  ? 162 PHE A CE1 1 
ATOM   181  C CE2 . PHE A 1 44  ? 0.691   64.053  -3.789  1.00 24.72  ? 162 PHE A CE2 1 
ATOM   182  C CZ  . PHE A 1 44  ? 1.283   65.018  -4.590  1.00 28.05  ? 162 PHE A CZ  1 
ATOM   183  N N   . ASP A 1 45  ? -3.522  66.618  -7.240  1.00 30.51  ? 163 ASP A N   1 
ATOM   184  C CA  . ASP A 1 45  ? -3.334  66.568  -8.685  1.00 37.79  ? 163 ASP A CA  1 
ATOM   185  C C   . ASP A 1 45  ? -1.897  66.097  -8.914  1.00 29.12  ? 163 ASP A C   1 
ATOM   186  O O   . ASP A 1 45  ? -0.970  66.907  -8.988  1.00 32.08  ? 163 ASP A O   1 
ATOM   187  C CB  . ASP A 1 45  ? -3.602  67.971  -9.236  1.00 37.57  ? 163 ASP A CB  1 
ATOM   188  C CG  . ASP A 1 45  ? -3.467  68.090  -10.757 1.00 56.19  ? 163 ASP A CG  1 
ATOM   189  O OD1 . ASP A 1 45  ? -3.461  67.064  -11.463 1.00 41.69  ? 163 ASP A OD1 1 
ATOM   190  O OD2 . ASP A 1 45  ? -3.355  69.257  -11.235 1.00 48.21  ? 163 ASP A OD2 1 
ATOM   191  N N   . THR A 1 46  ? -1.683  64.777  -8.969  1.00 27.76  ? 164 THR A N   1 
ATOM   192  C CA  . THR A 1 46  ? -0.298  64.289  -8.977  1.00 31.11  ? 164 THR A CA  1 
ATOM   193  C C   . THR A 1 46  ? 0.405   64.558  -10.309 1.00 35.07  ? 164 THR A C   1 
ATOM   194  O O   . THR A 1 46  ? 1.638   64.498  -10.372 1.00 33.73  ? 164 THR A O   1 
ATOM   195  C CB  . THR A 1 46  ? -0.215  62.789  -8.674  1.00 35.85  ? 164 THR A CB  1 
ATOM   196  O OG1 . THR A 1 46  ? -0.863  62.058  -9.712  1.00 36.75  ? 164 THR A OG1 1 
ATOM   197  C CG2 . THR A 1 46  ? -0.858  62.440  -7.310  1.00 31.54  ? 164 THR A CG2 1 
ATOM   198  N N   . THR A 1 47  ? -0.340  64.851  -11.365 1.00 32.68  ? 165 THR A N   1 
ATOM   199  C CA  . THR A 1 47  ? 0.264   65.242  -12.630 1.00 32.60  ? 165 THR A CA  1 
ATOM   200  C C   . THR A 1 47  ? 0.432   66.747  -12.750 1.00 33.66  ? 165 THR A C   1 
ATOM   201  O O   . THR A 1 47  ? 0.961   67.211  -13.762 1.00 30.54  ? 165 THR A O   1 
ATOM   202  C CB  . THR A 1 47  ? -0.588  64.776  -13.812 1.00 33.90  ? 165 THR A CB  1 
ATOM   203  O OG1 . THR A 1 47  ? -1.837  65.479  -13.805 1.00 34.85  ? 165 THR A OG1 1 
ATOM   204  C CG2 . THR A 1 47  ? -0.831  63.282  -13.742 1.00 39.14  ? 165 THR A CG2 1 
ATOM   205  N N   . PHE A 1 48  ? -0.058  67.520  -11.779 1.00 28.14  ? 166 PHE A N   1 
ATOM   206  C CA  . PHE A 1 48  ? 0.052   68.980  -11.815 1.00 31.47  ? 166 PHE A CA  1 
ATOM   207  C C   . PHE A 1 48  ? -0.594  69.562  -13.077 1.00 40.33  ? 166 PHE A C   1 
ATOM   208  O O   . PHE A 1 48  ? -0.194  70.637  -13.549 1.00 33.09  ? 166 PHE A O   1 
ATOM   209  C CB  . PHE A 1 48  ? 1.520   69.431  -11.713 1.00 30.95  ? 166 PHE A CB  1 
ATOM   210  C CG  . PHE A 1 48  ? 2.163   69.098  -10.376 1.00 30.63  ? 166 PHE A CG  1 
ATOM   211  C CD1 . PHE A 1 48  ? 2.507   67.802  -10.063 1.00 29.51  ? 166 PHE A CD1 1 
ATOM   212  C CD2 . PHE A 1 48  ? 2.336   70.070  -9.415  1.00 30.57  ? 166 PHE A CD2 1 
ATOM   213  C CE1 . PHE A 1 48  ? 3.087   67.477  -8.844  1.00 28.50  ? 166 PHE A CE1 1 
ATOM   214  C CE2 . PHE A 1 48  ? 2.895   69.739  -8.196  1.00 31.67  ? 166 PHE A CE2 1 
ATOM   215  C CZ  . PHE A 1 48  ? 3.279   68.449  -7.916  1.00 28.47  ? 166 PHE A CZ  1 
ATOM   216  N N   A SER A 1 49  ? -1.596  68.868  -13.633 0.35 35.84  ? 167 SER A N   1 
ATOM   217  N N   B SER A 1 49  ? -1.612  68.872  -13.616 0.65 35.77  ? 167 SER A N   1 
ATOM   218  C CA  A SER A 1 49  ? -2.180  69.283  -14.906 0.35 37.27  ? 167 SER A CA  1 
ATOM   219  C CA  B SER A 1 49  ? -2.204  69.281  -14.890 0.65 37.24  ? 167 SER A CA  1 
ATOM   220  C C   A SER A 1 49  ? -2.890  70.626  -14.816 0.35 41.21  ? 167 SER A C   1 
ATOM   221  C C   B SER A 1 49  ? -2.827  70.663  -14.799 0.65 41.24  ? 167 SER A C   1 
ATOM   222  O O   A SER A 1 49  ? -3.053  71.294  -15.842 0.35 41.52  ? 167 SER A O   1 
ATOM   223  O O   B SER A 1 49  ? -2.866  71.398  -15.792 0.65 41.50  ? 167 SER A O   1 
ATOM   224  C CB  A SER A 1 49  ? -3.164  68.224  -15.414 0.35 37.80  ? 167 SER A CB  1 
ATOM   225  C CB  B SER A 1 49  ? -3.267  68.270  -15.336 0.65 37.67  ? 167 SER A CB  1 
ATOM   226  O OG  A SER A 1 49  ? -4.264  68.104  -14.530 0.35 42.00  ? 167 SER A OG  1 
ATOM   227  O OG  B SER A 1 49  ? -2.677  67.043  -15.709 0.65 38.37  ? 167 SER A OG  1 
ATOM   228  N N   . HIS A 1 50  ? -3.321  71.037  -13.626 1.00 35.04  ? 168 HIS A N   1 
ATOM   229  C CA  . HIS A 1 50  ? -4.012  72.303  -13.463 1.00 39.35  ? 168 HIS A CA  1 
ATOM   230  C C   . HIS A 1 50  ? -3.126  73.366  -12.842 1.00 40.62  ? 168 HIS A C   1 
ATOM   231  O O   . HIS A 1 50  ? -3.625  74.413  -12.436 1.00 38.93  ? 168 HIS A O   1 
ATOM   232  C CB  . HIS A 1 50  ? -5.276  72.094  -12.635 1.00 46.16  ? 168 HIS A CB  1 
ATOM   233  C CG  . HIS A 1 50  ? -6.240  71.149  -13.278 1.00 52.46  ? 168 HIS A CG  1 
ATOM   234  N ND1 . HIS A 1 50  ? -6.679  71.301  -14.577 1.00 56.27  ? 168 HIS A ND1 1 
ATOM   235  C CD2 . HIS A 1 50  ? -6.813  70.014  -12.817 1.00 58.05  ? 168 HIS A CD2 1 
ATOM   236  C CE1 . HIS A 1 50  ? -7.499  70.310  -14.879 1.00 58.42  ? 168 HIS A CE1 1 
ATOM   237  N NE2 . HIS A 1 50  ? -7.601  69.518  -13.826 1.00 67.35  ? 168 HIS A NE2 1 
ATOM   238  N N   . PHE A 1 51  ? -1.823  73.122  -12.752 1.00 33.91  ? 169 PHE A N   1 
ATOM   239  C CA  . PHE A 1 51  ? -0.878  74.173  -12.394 1.00 31.32  ? 169 PHE A CA  1 
ATOM   240  C C   . PHE A 1 51  ? -0.542  74.940  -13.662 1.00 35.44  ? 169 PHE A C   1 
ATOM   241  O O   . PHE A 1 51  ? 0.152   74.413  -14.530 1.00 31.99  ? 169 PHE A O   1 
ATOM   242  C CB  . PHE A 1 51  ? 0.394   73.586  -11.787 1.00 26.08  ? 169 PHE A CB  1 
ATOM   243  C CG  . PHE A 1 51  ? 1.391   74.628  -11.367 1.00 30.31  ? 169 PHE A CG  1 
ATOM   244  C CD1 . PHE A 1 51  ? 0.963   75.792  -10.751 1.00 31.05  ? 169 PHE A CD1 1 
ATOM   245  C CD2 . PHE A 1 51  ? 2.748   74.444  -11.579 1.00 29.12  ? 169 PHE A CD2 1 
ATOM   246  C CE1 . PHE A 1 51  ? 1.872   76.752  -10.349 1.00 33.96  ? 169 PHE A CE1 1 
ATOM   247  C CE2 . PHE A 1 51  ? 3.670   75.409  -11.171 1.00 30.73  ? 169 PHE A CE2 1 
ATOM   248  C CZ  . PHE A 1 51  ? 3.222   76.564  -10.562 1.00 28.57  ? 169 PHE A CZ  1 
ATOM   249  N N   . LYS A 1 52  ? -1.023  76.171  -13.778 1.00 38.28  ? 170 LYS A N   1 
ATOM   250  C CA  . LYS A 1 52  ? -0.954  76.895  -15.043 1.00 38.96  ? 170 LYS A CA  1 
ATOM   251  C C   . LYS A 1 52  ? -0.814  78.377  -14.752 1.00 39.98  ? 170 LYS A C   1 
ATOM   252  O O   . LYS A 1 52  ? -0.984  78.826  -13.616 1.00 43.38  ? 170 LYS A O   1 
ATOM   253  C CB  . LYS A 1 52  ? -2.208  76.658  -15.904 1.00 42.75  ? 170 LYS A CB  1 
ATOM   254  C CG  . LYS A 1 52  ? -2.345  75.247  -16.437 1.00 47.49  ? 170 LYS A CG  1 
ATOM   255  N N   . ASN A 1 53  ? -0.515  79.143  -15.800 1.00 41.23  ? 171 ASN A N   1 
ATOM   256  C CA  . ASN A 1 53  ? -0.418  80.599  -15.704 1.00 48.15  ? 171 ASN A CA  1 
ATOM   257  C C   . ASN A 1 53  ? 0.587   81.041  -14.651 1.00 45.01  ? 171 ASN A C   1 
ATOM   258  O O   . ASN A 1 53  ? 0.419   82.090  -14.035 1.00 42.87  ? 171 ASN A O   1 
ATOM   259  C CB  . ASN A 1 53  ? -1.787  81.229  -15.418 1.00 44.73  ? 171 ASN A CB  1 
ATOM   260  C CG  . ASN A 1 53  ? -2.857  80.744  -16.374 1.00 53.79  ? 171 ASN A CG  1 
ATOM   261  O OD1 . ASN A 1 53  ? -2.588  80.521  -17.554 1.00 56.37  ? 171 ASN A OD1 1 
ATOM   262  N ND2 . ASN A 1 53  ? -4.067  80.547  -15.864 1.00 58.80  ? 171 ASN A ND2 1 
ATOM   263  N N   . PHE A 1 54  ? 1.634   80.251  -14.417 1.00 40.56  ? 172 PHE A N   1 
ATOM   264  C CA  . PHE A 1 54  ? 2.628   80.633  -13.425 1.00 40.07  ? 172 PHE A CA  1 
ATOM   265  C C   . PHE A 1 54  ? 3.699   81.521  -14.049 1.00 32.95  ? 172 PHE A C   1 
ATOM   266  O O   . PHE A 1 54  ? 3.977   81.463  -15.246 1.00 34.13  ? 172 PHE A O   1 
ATOM   267  C CB  . PHE A 1 54  ? 3.292   79.405  -12.797 1.00 31.59  ? 172 PHE A CB  1 
ATOM   268  C CG  . PHE A 1 54  ? 3.704   78.378  -13.803 1.00 35.88  ? 172 PHE A CG  1 
ATOM   269  C CD1 . PHE A 1 54  ? 4.874   78.536  -14.537 1.00 33.70  ? 172 PHE A CD1 1 
ATOM   270  C CD2 . PHE A 1 54  ? 2.927   77.255  -14.021 1.00 33.25  ? 172 PHE A CD2 1 
ATOM   271  C CE1 . PHE A 1 54  ? 5.242   77.607  -15.481 1.00 33.60  ? 172 PHE A CE1 1 
ATOM   272  C CE2 . PHE A 1 54  ? 3.301   76.297  -14.958 1.00 34.23  ? 172 PHE A CE2 1 
ATOM   273  C CZ  . PHE A 1 54  ? 4.460   76.479  -15.694 1.00 38.54  ? 172 PHE A CZ  1 
ATOM   274  N N   . ARG A 1 55  ? 4.326   82.316  -13.195 1.00 33.45  ? 173 ARG A N   1 
ATOM   275  C CA  . ARG A 1 55  ? 5.409   83.183  -13.608 1.00 35.09  ? 173 ARG A CA  1 
ATOM   276  C C   . ARG A 1 55  ? 6.691   82.369  -13.761 1.00 37.63  ? 173 ARG A C   1 
ATOM   277  O O   . ARG A 1 55  ? 6.851   81.302  -13.163 1.00 33.28  ? 173 ARG A O   1 
ATOM   278  C CB  . ARG A 1 55  ? 5.572   84.308  -12.587 1.00 32.75  ? 173 ARG A CB  1 
ATOM   279  C CG  . ARG A 1 55  ? 4.346   85.247  -12.543 1.00 38.83  ? 173 ARG A CG  1 
ATOM   280  C CD  . ARG A 1 55  ? 4.383   86.160  -11.329 1.00 38.42  ? 173 ARG A CD  1 
ATOM   281  N NE  . ARG A 1 55  ? 4.072   85.451  -10.100 1.00 37.48  ? 173 ARG A NE  1 
ATOM   282  C CZ  . ARG A 1 55  ? 4.060   86.031  -8.910  1.00 36.83  ? 173 ARG A CZ  1 
ATOM   283  N NH1 . ARG A 1 55  ? 4.348   87.317  -8.806  1.00 32.53  ? 173 ARG A NH1 1 
ATOM   284  N NH2 . ARG A 1 55  ? 3.768   85.331  -7.828  1.00 31.04  ? 173 ARG A NH2 1 
ATOM   285  N N   . LEU A 1 56  ? 7.590   82.857  -14.608 1.00 30.27  ? 174 LEU A N   1 
ATOM   286  C CA  . LEU A 1 56  ? 8.855   82.203  -14.888 1.00 34.46  ? 174 LEU A CA  1 
ATOM   287  C C   . LEU A 1 56  ? 9.969   83.235  -14.816 1.00 44.32  ? 174 LEU A C   1 
ATOM   288  O O   . LEU A 1 56  ? 9.725   84.423  -15.045 1.00 42.56  ? 174 LEU A O   1 
ATOM   289  C CB  . LEU A 1 56  ? 8.841   81.543  -16.271 1.00 32.05  ? 174 LEU A CB  1 
ATOM   290  C CG  . LEU A 1 56  ? 7.977   80.284  -16.347 1.00 35.80  ? 174 LEU A CG  1 
ATOM   291  C CD1 . LEU A 1 56  ? 7.679   79.871  -17.786 1.00 37.65  ? 174 LEU A CD1 1 
ATOM   292  C CD2 . LEU A 1 56  ? 8.674   79.152  -15.604 1.00 37.69  ? 174 LEU A CD2 1 
ATOM   293  N N   . PRO A 1 57  ? 11.187  82.821  -14.468 1.00 34.59  ? 175 PRO A N   1 
ATOM   294  C CA  . PRO A 1 57  ? 12.293  83.782  -14.387 1.00 41.13  ? 175 PRO A CA  1 
ATOM   295  C C   . PRO A 1 57  ? 12.455  84.522  -15.707 1.00 53.20  ? 175 PRO A C   1 
ATOM   296  O O   . PRO A 1 57  ? 12.355  83.930  -16.785 1.00 56.00  ? 175 PRO A O   1 
ATOM   297  C CB  . PRO A 1 57  ? 13.515  82.906  -14.088 1.00 41.42  ? 175 PRO A CB  1 
ATOM   298  C CG  . PRO A 1 57  ? 12.975  81.640  -13.553 1.00 47.34  ? 175 PRO A CG  1 
ATOM   299  C CD  . PRO A 1 57  ? 11.617  81.443  -14.171 1.00 35.56  ? 175 PRO A CD  1 
ATOM   300  N N   . GLY A 1 58  ? 12.688  85.833  -15.607 1.00 64.08  ? 176 GLY A N   1 
ATOM   301  C CA  . GLY A 1 58  ? 12.792  86.708  -16.757 1.00 53.75  ? 176 GLY A CA  1 
ATOM   302  C C   . GLY A 1 58  ? 13.698  86.182  -17.849 1.00 57.26  ? 176 GLY A C   1 
ATOM   303  O O   . GLY A 1 58  ? 14.690  85.496  -17.574 1.00 52.35  ? 176 GLY A O   1 
ATOM   304  N N   . VAL A 1 59  ? 13.356  86.485  -19.096 1.00 65.06  ? 177 VAL A N   1 
ATOM   305  C CA  . VAL A 1 59  ? 14.163  86.059  -20.229 1.00 69.63  ? 177 VAL A CA  1 
ATOM   306  C C   . VAL A 1 59  ? 15.270  87.082  -20.496 1.00 76.56  ? 177 VAL A C   1 
ATOM   307  O O   . VAL A 1 59  ? 16.461  86.779  -20.375 1.00 75.21  ? 177 VAL A O   1 
ATOM   308  C CB  . VAL A 1 59  ? 13.289  85.846  -21.480 1.00 61.86  ? 177 VAL A CB  1 
ATOM   309  N N   . ALA A 1 78  ? 21.707  96.168  6.051   1.00 81.86  ? 196 ALA A N   1 
ATOM   310  C CA  . ALA A 1 78  ? 22.711  95.630  5.132   1.00 95.61  ? 196 ALA A CA  1 
ATOM   311  C C   . ALA A 1 78  ? 23.090  94.201  5.514   1.00 88.06  ? 196 ALA A C   1 
ATOM   312  O O   . ALA A 1 78  ? 23.396  93.375  4.648   1.00 86.76  ? 196 ALA A O   1 
ATOM   313  C CB  . ALA A 1 78  ? 23.950  96.526  5.107   1.00 97.74  ? 196 ALA A CB  1 
ATOM   314  N N   . ALA A 1 79  ? 23.087  93.920  6.822   1.00 92.54  ? 197 ALA A N   1 
ATOM   315  C CA  . ALA A 1 79  ? 23.255  92.549  7.291   1.00 92.85  ? 197 ALA A CA  1 
ATOM   316  C C   . ALA A 1 79  ? 22.013  91.710  7.027   1.00 90.64  ? 197 ALA A C   1 
ATOM   317  O O   . ALA A 1 79  ? 22.099  90.476  7.021   1.00 86.85  ? 197 ALA A O   1 
ATOM   318  C CB  . ALA A 1 79  ? 23.597  92.530  8.782   1.00 88.57  ? 197 ALA A CB  1 
ATOM   319  N N   . LYS A 1 80  ? 20.862  92.360  6.824   1.00 92.31  ? 198 LYS A N   1 
ATOM   320  C CA  . LYS A 1 80  ? 19.684  91.668  6.312   1.00 89.12  ? 198 LYS A CA  1 
ATOM   321  C C   . LYS A 1 80  ? 19.998  90.971  4.994   1.00 91.73  ? 198 LYS A C   1 
ATOM   322  O O   . LYS A 1 80  ? 19.762  89.766  4.842   1.00 87.68  ? 198 LYS A O   1 
ATOM   323  C CB  . LYS A 1 80  ? 18.537  92.661  6.119   1.00 80.51  ? 198 LYS A CB  1 
ATOM   324  C CG  . LYS A 1 80  ? 17.779  93.050  7.376   1.00 76.27  ? 198 LYS A CG  1 
ATOM   325  C CD  . LYS A 1 80  ? 16.612  93.962  7.001   1.00 80.40  ? 198 LYS A CD  1 
ATOM   326  C CE  . LYS A 1 80  ? 15.745  94.317  8.194   1.00 70.76  ? 198 LYS A CE  1 
ATOM   327  N NZ  . LYS A 1 80  ? 14.748  95.362  7.830   1.00 72.98  ? 198 LYS A NZ  1 
ATOM   328  N N   . TRP A 1 81  ? 20.537  91.726  4.028   1.00 88.60  ? 199 TRP A N   1 
ATOM   329  C CA  . TRP A 1 81  ? 20.842  91.172  2.712   1.00 86.27  ? 199 TRP A CA  1 
ATOM   330  C C   . TRP A 1 81  ? 21.829  90.012  2.805   1.00 87.34  ? 199 TRP A C   1 
ATOM   331  O O   . TRP A 1 81  ? 21.702  89.023  2.072   1.00 85.38  ? 199 TRP A O   1 
ATOM   332  C CB  . TRP A 1 81  ? 21.398  92.268  1.803   1.00 89.06  ? 199 TRP A CB  1 
ATOM   333  C CG  . TRP A 1 81  ? 20.345  93.072  1.110   1.00 88.14  ? 199 TRP A CG  1 
ATOM   334  C CD1 . TRP A 1 81  ? 19.642  94.124  1.628   1.00 90.16  ? 199 TRP A CD1 1 
ATOM   335  C CD2 . TRP A 1 81  ? 19.876  92.900  -0.236  1.00 93.68  ? 199 TRP A CD2 1 
ATOM   336  N NE1 . TRP A 1 81  ? 18.761  94.615  0.689   1.00 90.63  ? 199 TRP A NE1 1 
ATOM   337  C CE2 . TRP A 1 81  ? 18.884  93.881  -0.463  1.00 89.16  ? 199 TRP A CE2 1 
ATOM   338  C CE3 . TRP A 1 81  ? 20.196  92.009  -1.269  1.00 89.92  ? 199 TRP A CE3 1 
ATOM   339  C CZ2 . TRP A 1 81  ? 18.210  93.996  -1.680  1.00 80.46  ? 199 TRP A CZ2 1 
ATOM   340  C CZ3 . TRP A 1 81  ? 19.525  92.126  -2.479  1.00 85.81  ? 199 TRP A CZ3 1 
ATOM   341  C CH2 . TRP A 1 81  ? 18.544  93.113  -2.674  1.00 85.71  ? 199 TRP A CH2 1 
ATOM   342  N N   . SER A 1 82  ? 22.828  90.121  3.687   1.00 86.39  ? 200 SER A N   1 
ATOM   343  C CA  . SER A 1 82  ? 23.803  89.042  3.829   1.00 87.08  ? 200 SER A CA  1 
ATOM   344  C C   . SER A 1 82  ? 23.122  87.747  4.247   1.00 84.46  ? 200 SER A C   1 
ATOM   345  O O   . SER A 1 82  ? 23.487  86.661  3.781   1.00 82.72  ? 200 SER A O   1 
ATOM   346  C CB  . SER A 1 82  ? 24.881  89.432  4.842   1.00 81.49  ? 200 SER A CB  1 
ATOM   347  N N   . GLN A 1 83  ? 22.119  87.850  5.120   1.00 82.21  ? 201 GLN A N   1 
ATOM   348  C CA  . GLN A 1 83  ? 21.376  86.683  5.578   1.00 82.55  ? 201 GLN A CA  1 
ATOM   349  C C   . GLN A 1 83  ? 20.326  86.238  4.558   1.00 81.22  ? 201 GLN A C   1 
ATOM   350  O O   . GLN A 1 83  ? 20.128  85.032  4.360   1.00 73.53  ? 201 GLN A O   1 
ATOM   351  C CB  . GLN A 1 83  ? 20.763  86.986  6.948   1.00 69.53  ? 201 GLN A CB  1 
ATOM   352  C CG  . GLN A 1 83  ? 19.729  85.994  7.430   1.00 73.24  ? 201 GLN A CG  1 
ATOM   353  C CD  . GLN A 1 83  ? 20.335  84.772  8.099   1.00 79.20  ? 201 GLN A CD  1 
ATOM   354  O OE1 . GLN A 1 83  ? 20.215  83.655  7.587   1.00 72.52  ? 201 GLN A OE1 1 
ATOM   355  N NE2 . GLN A 1 83  ? 21.034  84.982  9.210   1.00 84.16  ? 201 GLN A NE2 1 
ATOM   356  N N   . VAL A 1 84  ? 19.657  87.184  3.890   1.00 75.82  ? 202 VAL A N   1 
ATOM   357  C CA  . VAL A 1 84  ? 18.812  86.815  2.756   1.00 76.40  ? 202 VAL A CA  1 
ATOM   358  C C   . VAL A 1 84  ? 19.640  86.151  1.664   1.00 85.25  ? 202 VAL A C   1 
ATOM   359  O O   . VAL A 1 84  ? 19.155  85.247  0.968   1.00 84.50  ? 202 VAL A O   1 
ATOM   360  C CB  . VAL A 1 84  ? 18.046  88.044  2.226   1.00 75.27  ? 202 VAL A CB  1 
ATOM   361  C CG1 . VAL A 1 84  ? 17.262  87.688  0.961   1.00 70.66  ? 202 VAL A CG1 1 
ATOM   362  C CG2 . VAL A 1 84  ? 17.097  88.564  3.302   1.00 67.43  ? 202 VAL A CG2 1 
ATOM   363  N N   . ARG A 1 85  ? 20.899  86.574  1.501   1.00 84.91  ? 203 ARG A N   1 
ATOM   364  C CA  . ARG A 1 85  ? 21.800  85.903  0.567   1.00 81.84  ? 203 ARG A CA  1 
ATOM   365  C C   . ARG A 1 85  ? 21.995  84.443  0.958   1.00 84.45  ? 203 ARG A C   1 
ATOM   366  O O   . ARG A 1 85  ? 21.879  83.538  0.120   1.00 85.37  ? 203 ARG A O   1 
ATOM   367  C CB  . ARG A 1 85  ? 23.142  86.638  0.513   1.00 71.96  ? 203 ARG A CB  1 
ATOM   368  N N   . LYS A 1 86  ? 22.282  84.194  2.238   1.00 86.29  ? 204 LYS A N   1 
ATOM   369  C CA  . LYS A 1 86  ? 22.422  82.820  2.712   1.00 92.84  ? 204 LYS A CA  1 
ATOM   370  C C   . LYS A 1 86  ? 21.094  82.069  2.666   1.00 90.55  ? 204 LYS A C   1 
ATOM   371  O O   . LYS A 1 86  ? 21.074  80.865  2.379   1.00 90.80  ? 204 LYS A O   1 
ATOM   372  C CB  . LYS A 1 86  ? 22.994  82.812  4.134   1.00 81.59  ? 204 LYS A CB  1 
ATOM   373  N N   . ASP A 1 87  ? 19.981  82.763  2.934   1.00 86.30  ? 205 ASP A N   1 
ATOM   374  C CA  . ASP A 1 87  ? 18.671  82.115  2.957   1.00 85.69  ? 205 ASP A CA  1 
ATOM   375  C C   . ASP A 1 87  ? 18.295  81.544  1.592   1.00 86.22  ? 205 ASP A C   1 
ATOM   376  O O   . ASP A 1 87  ? 17.739  80.442  1.503   1.00 87.96  ? 205 ASP A O   1 
ATOM   377  C CB  . ASP A 1 87  ? 17.606  83.108  3.435   1.00 80.28  ? 205 ASP A CB  1 
ATOM   378  C CG  . ASP A 1 87  ? 17.664  83.369  4.945   1.00 77.08  ? 205 ASP A CG  1 
ATOM   379  O OD1 . ASP A 1 87  ? 18.337  82.595  5.665   1.00 75.66  ? 205 ASP A OD1 1 
ATOM   380  O OD2 . ASP A 1 87  ? 17.038  84.356  5.411   1.00 61.49  ? 205 ASP A OD2 1 
ATOM   381  N N   . LEU A 1 88  ? 18.594  82.274  0.516   1.00 81.28  ? 206 LEU A N   1 
ATOM   382  C CA  . LEU A 1 88  ? 18.142  81.868  -0.809  1.00 80.14  ? 206 LEU A CA  1 
ATOM   383  C C   . LEU A 1 88  ? 19.001  80.758  -1.408  1.00 92.39  ? 206 LEU A C   1 
ATOM   384  O O   . LEU A 1 88  ? 18.481  79.909  -2.143  1.00 97.05  ? 206 LEU A O   1 
ATOM   385  C CB  . LEU A 1 88  ? 18.134  83.075  -1.742  1.00 75.46  ? 206 LEU A CB  1 
ATOM   386  C CG  . LEU A 1 88  ? 16.887  83.950  -1.669  1.00 72.01  ? 206 LEU A CG  1 
ATOM   387  C CD1 . LEU A 1 88  ? 17.225  85.353  -2.129  1.00 74.46  ? 206 LEU A CD1 1 
ATOM   388  C CD2 . LEU A 1 88  ? 15.770  83.362  -2.506  1.00 71.88  ? 206 LEU A CD2 1 
ATOM   389  N N   . CYS A 1 89  ? 20.312  80.743  -1.116  1.00 96.36  ? 207 CYS A N   1 
ATOM   390  C CA  . CYS A 1 89  ? 21.228  79.759  -1.714  1.00 103.13 ? 207 CYS A CA  1 
ATOM   391  C C   . CYS A 1 89  ? 21.067  78.354  -1.135  1.00 95.16  ? 207 CYS A C   1 
ATOM   392  O O   . CYS A 1 89  ? 21.861  77.462  -1.473  1.00 94.56  ? 207 CYS A O   1 
ATOM   393  C CB  . CYS A 1 89  ? 22.681  80.219  -1.555  1.00 90.80  ? 207 CYS A CB  1 
ATOM   394  N N   . SER A 1 90  ? 20.068  78.124  -0.287  1.00 89.70  ? 208 SER A N   1 
ATOM   395  C CA  . SER A 1 90  ? 19.901  76.826  0.347   1.00 89.13  ? 208 SER A CA  1 
ATOM   396  C C   . SER A 1 90  ? 19.105  75.848  -0.505  1.00 92.70  ? 208 SER A C   1 
ATOM   397  O O   . SER A 1 90  ? 19.293  74.633  -0.371  1.00 94.49  ? 208 SER A O   1 
ATOM   398  C CB  . SER A 1 90  ? 19.219  76.996  1.701   1.00 87.48  ? 208 SER A CB  1 
ATOM   399  N N   . LEU A 1 91  ? 18.222  76.342  -1.369  1.00 94.11  ? 209 LEU A N   1 
ATOM   400  C CA  . LEU A 1 91  ? 17.450  75.513  -2.295  1.00 96.94  ? 209 LEU A CA  1 
ATOM   401  C C   . LEU A 1 91  ? 17.752  75.996  -3.718  1.00 93.12  ? 209 LEU A C   1 
ATOM   402  O O   . LEU A 1 91  ? 17.105  76.921  -4.219  1.00 94.72  ? 209 LEU A O   1 
ATOM   403  C CB  . LEU A 1 91  ? 15.945  75.576  -1.967  1.00 82.64  ? 209 LEU A CB  1 
ATOM   404  N N   . LYS A 1 92  ? 18.739  75.365  -4.367  1.00 81.49  ? 210 LYS A N   1 
ATOM   405  C CA  . LYS A 1 92  ? 19.209  75.761  -5.695  1.00 69.98  ? 210 LYS A CA  1 
ATOM   406  C C   . LYS A 1 92  ? 18.811  74.700  -6.718  1.00 69.66  ? 210 LYS A C   1 
ATOM   407  O O   . LYS A 1 92  ? 19.395  73.608  -6.756  1.00 59.23  ? 210 LYS A O   1 
ATOM   408  C CB  . LYS A 1 92  ? 20.721  75.974  -5.696  1.00 71.50  ? 210 LYS A CB  1 
ATOM   409  N N   . VAL A 1 93  ? 17.839  75.033  -7.567  1.00 59.52  ? 211 VAL A N   1 
ATOM   410  C CA  . VAL A 1 93  ? 17.303  74.082  -8.531  1.00 51.40  ? 211 VAL A CA  1 
ATOM   411  C C   . VAL A 1 93  ? 17.291  74.683  -9.927  1.00 39.65  ? 211 VAL A C   1 
ATOM   412  O O   . VAL A 1 93  ? 17.104  75.887  -10.117 1.00 43.75  ? 211 VAL A O   1 
ATOM   413  C CB  . VAL A 1 93  ? 15.880  73.619  -8.144  1.00 50.09  ? 211 VAL A CB  1 
ATOM   414  C CG1 . VAL A 1 93  ? 15.912  72.898  -6.809  1.00 55.74  ? 211 VAL A CG1 1 
ATOM   415  C CG2 . VAL A 1 93  ? 14.935  74.820  -8.080  1.00 47.73  ? 211 VAL A CG2 1 
ATOM   416  N N   . SER A 1 94  ? 17.503  73.826  -10.906 1.00 43.95  ? 212 SER A N   1 
ATOM   417  C CA  . SER A 1 94  ? 17.144  74.151  -12.268 1.00 46.88  ? 212 SER A CA  1 
ATOM   418  C C   . SER A 1 94  ? 15.721  73.684  -12.523 1.00 51.44  ? 212 SER A C   1 
ATOM   419  O O   . SER A 1 94  ? 15.161  72.863  -11.793 1.00 36.14  ? 212 SER A O   1 
ATOM   420  C CB  . SER A 1 94  ? 18.087  73.492  -13.267 1.00 45.88  ? 212 SER A CB  1 
ATOM   421  O OG  . SER A 1 94  ? 17.886  72.097  -13.299 1.00 48.19  ? 212 SER A OG  1 
ATOM   422  N N   . LEU A 1 95  ? 15.153  74.199  -13.596 1.00 37.87  ? 213 LEU A N   1 
ATOM   423  C CA  . LEU A 1 95  ? 13.763  73.981  -13.943 1.00 34.80  ? 213 LEU A CA  1 
ATOM   424  C C   . LEU A 1 95  ? 13.656  73.486  -15.373 1.00 42.93  ? 213 LEU A C   1 
ATOM   425  O O   . LEU A 1 95  ? 14.261  74.066  -16.278 1.00 43.03  ? 213 LEU A O   1 
ATOM   426  C CB  . LEU A 1 95  ? 12.988  75.291  -13.696 1.00 31.69  ? 213 LEU A CB  1 
ATOM   427  C CG  . LEU A 1 95  ? 11.505  75.383  -14.000 1.00 50.72  ? 213 LEU A CG  1 
ATOM   428  C CD1 . LEU A 1 95  ? 10.782  76.458  -13.264 1.00 45.57  ? 213 LEU A CD1 1 
ATOM   429  C CD2 . LEU A 1 95  ? 11.673  75.948  -15.326 1.00 51.57  ? 213 LEU A CD2 1 
ATOM   430  N N   . GLN A 1 96  ? 12.877  72.430  -15.577 1.00 35.82  ? 214 GLN A N   1 
ATOM   431  C CA  . GLN A 1 96  ? 12.585  71.915  -16.908 1.00 33.45  ? 214 GLN A CA  1 
ATOM   432  C C   . GLN A 1 96  ? 11.085  71.982  -17.158 1.00 40.53  ? 214 GLN A C   1 
ATOM   433  O O   . GLN A 1 96  ? 10.300  71.596  -16.288 1.00 39.84  ? 214 GLN A O   1 
ATOM   434  C CB  . GLN A 1 96  ? 13.092  70.480  -17.069 1.00 36.03  ? 214 GLN A CB  1 
ATOM   435  C CG  . GLN A 1 96  ? 12.934  69.967  -18.480 1.00 40.76  ? 214 GLN A CG  1 
ATOM   436  C CD  . GLN A 1 96  ? 13.567  68.597  -18.742 1.00 65.49  ? 214 GLN A CD  1 
ATOM   437  O OE1 . GLN A 1 96  ? 14.752  68.511  -19.066 1.00 60.32  ? 214 GLN A OE1 1 
ATOM   438  N NE2 . GLN A 1 96  ? 12.763  67.537  -18.680 1.00 63.19  ? 214 GLN A NE2 1 
ATOM   439  N N   . LEU A 1 97  ? 10.680  72.463  -18.337 1.00 36.42  ? 215 LEU A N   1 
ATOM   440  C CA  . LEU A 1 97  ? 9.267   72.469  -18.721 1.00 34.79  ? 215 LEU A CA  1 
ATOM   441  C C   . LEU A 1 97  ? 9.120   71.715  -20.022 1.00 40.25  ? 215 LEU A C   1 
ATOM   442  O O   . LEU A 1 97  ? 9.617   72.171  -21.060 1.00 34.59  ? 215 LEU A O   1 
ATOM   443  C CB  . LEU A 1 97  ? 8.682   73.857  -18.951 1.00 39.68  ? 215 LEU A CB  1 
ATOM   444  C CG  . LEU A 1 97  ? 8.569   74.866  -17.847 1.00 53.03  ? 215 LEU A CG  1 
ATOM   445  C CD1 . LEU A 1 97  ? 9.942   75.361  -17.814 1.00 53.45  ? 215 LEU A CD1 1 
ATOM   446  C CD2 . LEU A 1 97  ? 7.589   75.976  -18.165 1.00 57.94  ? 215 LEU A CD2 1 
ATOM   447  N N   . ARG A 1 98  ? 8.411   70.602  -19.978 1.00 35.87  ? 216 ARG A N   1 
ATOM   448  C CA  . ARG A 1 98  ? 8.185   69.772  -21.153 1.00 40.11  ? 216 ARG A CA  1 
ATOM   449  C C   . ARG A 1 98  ? 6.823   70.125  -21.734 1.00 54.09  ? 216 ARG A C   1 
ATOM   450  O O   . ARG A 1 98  ? 5.798   69.971  -21.061 1.00 58.30  ? 216 ARG A O   1 
ATOM   451  C CB  . ARG A 1 98  ? 8.270   68.283  -20.802 1.00 37.49  ? 216 ARG A CB  1 
ATOM   452  C CG  . ARG A 1 98  ? 9.660   67.822  -20.363 1.00 43.56  ? 216 ARG A CG  1 
ATOM   453  C CD  . ARG A 1 98  ? 9.665   66.424  -19.714 1.00 53.60  ? 216 ARG A CD  1 
ATOM   454  N NE  . ARG A 1 98  ? 8.875   66.348  -18.477 1.00 51.45  ? 216 ARG A NE  1 
ATOM   455  C CZ  . ARG A 1 98  ? 9.223   66.903  -17.315 1.00 53.25  ? 216 ARG A CZ  1 
ATOM   456  N NH1 . ARG A 1 98  ? 10.356  67.591  -17.192 1.00 46.15  ? 216 ARG A NH1 1 
ATOM   457  N NH2 . ARG A 1 98  ? 8.431   66.769  -16.264 1.00 50.71  ? 216 ARG A NH2 1 
ATOM   458  N N   . GLY A 1 99  ? 6.811   70.606  -22.971 1.00 46.49  ? 217 GLY A N   1 
ATOM   459  C CA  . GLY A 1 99  ? 5.553   70.902  -23.615 1.00 50.31  ? 217 GLY A CA  1 
ATOM   460  C C   . GLY A 1 99  ? 4.892   69.658  -24.165 1.00 50.39  ? 217 GLY A C   1 
ATOM   461  O O   . GLY A 1 99  ? 5.554   68.660  -24.454 1.00 53.88  ? 217 GLY A O   1 
ATOM   462  N N   . GLU A 1 100 ? 3.561   69.741  -24.306 1.00 58.98  ? 218 GLU A N   1 
ATOM   463  C CA  . GLU A 1 100 ? 2.788   68.645  -24.891 1.00 64.93  ? 218 GLU A CA  1 
ATOM   464  C C   . GLU A 1 100 ? 3.301   68.262  -26.272 1.00 67.55  ? 218 GLU A C   1 
ATOM   465  O O   . GLU A 1 100 ? 3.257   67.085  -26.651 1.00 71.16  ? 218 GLU A O   1 
ATOM   466  C CB  . GLU A 1 100 ? 1.311   69.033  -24.979 1.00 67.74  ? 218 GLU A CB  1 
ATOM   467  C CG  . GLU A 1 100 ? 0.884   70.090  -23.976 1.00 63.33  ? 218 GLU A CG  1 
ATOM   468  N N   . ASP A 1 101 ? 3.790   69.241  -27.035 1.00 60.95  ? 219 ASP A N   1 
ATOM   469  C CA  . ASP A 1 101 ? 4.330   68.993  -28.361 1.00 53.17  ? 219 ASP A CA  1 
ATOM   470  C C   . ASP A 1 101 ? 5.647   68.233  -28.357 1.00 57.63  ? 219 ASP A C   1 
ATOM   471  O O   . ASP A 1 101 ? 6.088   67.797  -29.423 1.00 68.82  ? 219 ASP A O   1 
ATOM   472  C CB  . ASP A 1 101 ? 4.469   70.328  -29.095 1.00 59.25  ? 219 ASP A CB  1 
ATOM   473  C CG  . ASP A 1 101 ? 5.614   71.191  -28.561 1.00 68.99  ? 219 ASP A CG  1 
ATOM   474  O OD1 . ASP A 1 101 ? 6.356   70.758  -27.650 1.00 69.50  ? 219 ASP A OD1 1 
ATOM   475  O OD2 . ASP A 1 101 ? 5.765   72.327  -29.056 1.00 64.55  ? 219 ASP A OD2 1 
ATOM   476  N N   . GLY A 1 102 ? 6.289   68.066  -27.211 1.00 51.32  ? 220 GLY A N   1 
ATOM   477  C CA  . GLY A 1 102 ? 7.591   67.444  -27.167 1.00 48.00  ? 220 GLY A CA  1 
ATOM   478  C C   . GLY A 1 102 ? 8.734   68.413  -26.973 1.00 44.29  ? 220 GLY A C   1 
ATOM   479  O O   . GLY A 1 102 ? 9.862   67.973  -26.723 1.00 50.67  ? 220 GLY A O   1 
ATOM   480  N N   . SER A 1 103 ? 8.477   69.715  -27.059 1.00 51.51  ? 221 SER A N   1 
ATOM   481  C CA  . SER A 1 103 ? 9.519   70.698  -26.802 1.00 47.84  ? 221 SER A CA  1 
ATOM   482  C C   . SER A 1 103 ? 9.894   70.711  -25.327 1.00 43.82  ? 221 SER A C   1 
ATOM   483  O O   . SER A 1 103 ? 9.089   70.370  -24.451 1.00 36.64  ? 221 SER A O   1 
ATOM   484  C CB  . SER A 1 103 ? 9.050   72.086  -27.224 1.00 45.67  ? 221 SER A CB  1 
ATOM   485  O OG  . SER A 1 103 ? 7.797   72.386  -26.636 1.00 53.17  ? 221 SER A OG  1 
ATOM   486  N N   . VAL A 1 104 ? 11.129  71.115  -25.051 1.00 36.69  ? 222 VAL A N   1 
ATOM   487  C CA  . VAL A 1 104 ? 11.625  71.238  -23.682 1.00 39.19  ? 222 VAL A CA  1 
ATOM   488  C C   . VAL A 1 104 ? 12.265  72.607  -23.491 1.00 44.98  ? 222 VAL A C   1 
ATOM   489  O O   . VAL A 1 104 ? 13.189  72.967  -24.223 1.00 46.35  ? 222 VAL A O   1 
ATOM   490  C CB  . VAL A 1 104 ? 12.640  70.139  -23.343 1.00 39.98  ? 222 VAL A CB  1 
ATOM   491  C CG1 . VAL A 1 104 ? 12.928  70.173  -21.879 1.00 44.52  ? 222 VAL A CG1 1 
ATOM   492  C CG2 . VAL A 1 104 ? 12.120  68.778  -23.772 1.00 47.15  ? 222 VAL A CG2 1 
ATOM   493  N N   . TRP A 1 105 ? 11.798  73.354  -22.495 1.00 35.78  ? 223 TRP A N   1 
ATOM   494  C CA  . TRP A 1 105 ? 12.495  74.539  -22.008 1.00 33.16  ? 223 TRP A CA  1 
ATOM   495  C C   . TRP A 1 105 ? 13.239  74.163  -20.733 1.00 43.64  ? 223 TRP A C   1 
ATOM   496  O O   . TRP A 1 105 ? 12.670  73.499  -19.857 1.00 40.84  ? 223 TRP A O   1 
ATOM   497  C CB  . TRP A 1 105 ? 11.508  75.669  -21.708 1.00 32.14  ? 223 TRP A CB  1 
ATOM   498  C CG  . TRP A 1 105 ? 11.085  76.565  -22.855 1.00 37.62  ? 223 TRP A CG  1 
ATOM   499  C CD1 . TRP A 1 105 ? 9.864   76.594  -23.473 1.00 41.24  ? 223 TRP A CD1 1 
ATOM   500  C CD2 . TRP A 1 105 ? 11.863  77.603  -23.465 1.00 39.87  ? 223 TRP A CD2 1 
ATOM   501  N NE1 . TRP A 1 105 ? 9.840   77.575  -24.442 1.00 39.02  ? 223 TRP A NE1 1 
ATOM   502  C CE2 . TRP A 1 105 ? 11.056  78.206  -24.455 1.00 39.96  ? 223 TRP A CE2 1 
ATOM   503  C CE3 . TRP A 1 105 ? 13.164  78.075  -23.276 1.00 39.37  ? 223 TRP A CE3 1 
ATOM   504  C CZ2 . TRP A 1 105 ? 11.514  79.248  -25.256 1.00 40.30  ? 223 TRP A CZ2 1 
ATOM   505  C CZ3 . TRP A 1 105 ? 13.615  79.119  -24.070 1.00 40.07  ? 223 TRP A CZ3 1 
ATOM   506  C CH2 . TRP A 1 105 ? 12.792  79.690  -25.048 1.00 31.62  ? 223 TRP A CH2 1 
ATOM   507  N N   . ASN A 1 106 ? 14.497  74.583  -20.620 1.00 33.47  ? 224 ASN A N   1 
ATOM   508  C CA  A ASN A 1 106 ? 15.324  74.332  -19.441 0.46 35.35  ? 224 ASN A CA  1 
ATOM   509  C CA  B ASN A 1 106 ? 15.296  74.343  -19.422 0.54 35.30  ? 224 ASN A CA  1 
ATOM   510  C C   . ASN A 1 106 ? 15.887  75.655  -18.946 1.00 44.01  ? 224 ASN A C   1 
ATOM   511  O O   . ASN A 1 106 ? 16.436  76.419  -19.742 1.00 39.66  ? 224 ASN A O   1 
ATOM   512  C CB  A ASN A 1 106 ? 16.487  73.378  -19.754 0.46 42.64  ? 224 ASN A CB  1 
ATOM   513  C CB  B ASN A 1 106 ? 16.421  73.327  -19.660 0.54 42.59  ? 224 ASN A CB  1 
ATOM   514  C CG  A ASN A 1 106 ? 16.053  71.932  -19.876 0.46 42.71  ? 224 ASN A CG  1 
ATOM   515  C CG  B ASN A 1 106 ? 17.091  72.876  -18.362 0.54 46.79  ? 224 ASN A CG  1 
ATOM   516  O OD1 A ASN A 1 106 ? 15.862  71.246  -18.875 0.46 44.33  ? 224 ASN A OD1 1 
ATOM   517  O OD1 B ASN A 1 106 ? 18.046  73.510  -17.899 0.54 44.63  ? 224 ASN A OD1 1 
ATOM   518  N ND2 A ASN A 1 106 ? 15.937  71.448  -21.108 0.46 46.15  ? 224 ASN A ND2 1 
ATOM   519  N ND2 B ASN A 1 106 ? 16.609  71.780  -17.780 0.54 39.34  ? 224 ASN A ND2 1 
ATOM   520  N N   . TYR A 1 107 ? 15.767  75.910  -17.641 1.00 34.36  ? 225 TYR A N   1 
ATOM   521  C CA  . TYR A 1 107 ? 16.292  77.112  -17.000 1.00 32.72  ? 225 TYR A CA  1 
ATOM   522  C C   . TYR A 1 107 ? 17.367  76.719  -16.004 1.00 50.81  ? 225 TYR A C   1 
ATOM   523  O O   . TYR A 1 107 ? 17.107  75.920  -15.094 1.00 46.11  ? 225 TYR A O   1 
ATOM   524  C CB  . TYR A 1 107 ? 15.198  77.889  -16.276 1.00 34.48  ? 225 TYR A CB  1 
ATOM   525  C CG  . TYR A 1 107 ? 15.714  79.109  -15.514 1.00 38.96  ? 225 TYR A CG  1 
ATOM   526  C CD1 . TYR A 1 107 ? 16.029  80.287  -16.177 1.00 43.54  ? 225 TYR A CD1 1 
ATOM   527  C CD2 . TYR A 1 107 ? 15.904  79.070  -14.134 1.00 48.08  ? 225 TYR A CD2 1 
ATOM   528  C CE1 . TYR A 1 107 ? 16.497  81.407  -15.484 1.00 50.64  ? 225 TYR A CE1 1 
ATOM   529  C CE2 . TYR A 1 107 ? 16.375  80.185  -13.432 1.00 47.40  ? 225 TYR A CE2 1 
ATOM   530  C CZ  . TYR A 1 107 ? 16.669  81.349  -14.106 1.00 52.76  ? 225 TYR A CZ  1 
ATOM   531  O OH  . TYR A 1 107 ? 17.141  82.458  -13.410 1.00 54.53  ? 225 TYR A OH  1 
ATOM   532  N N   . LYS A 1 108 ? 18.564  77.296  -16.165 1.00 42.11  ? 226 LYS A N   1 
ATOM   533  C CA  . LYS A 1 108 ? 19.646  77.175  -15.194 1.00 48.74  ? 226 LYS A CA  1 
ATOM   534  C C   . LYS A 1 108 ? 19.816  78.495  -14.472 1.00 56.49  ? 226 LYS A C   1 
ATOM   535  O O   . LYS A 1 108 ? 19.968  79.536  -15.128 1.00 49.59  ? 226 LYS A O   1 
ATOM   536  C CB  . LYS A 1 108 ? 20.956  76.780  -15.874 1.00 51.33  ? 226 LYS A CB  1 
ATOM   537  C CG  . LYS A 1 108 ? 20.928  75.371  -16.429 1.00 49.13  ? 226 LYS A CG  1 
ATOM   538  N N   . PRO A 1 109 ? 19.788  78.498  -13.141 1.00 51.60  ? 227 PRO A N   1 
ATOM   539  C CA  . PRO A 1 109 ? 19.759  79.755  -12.393 1.00 46.10  ? 227 PRO A CA  1 
ATOM   540  C C   . PRO A 1 109 ? 21.115  80.434  -12.411 1.00 57.64  ? 227 PRO A C   1 
ATOM   541  O O   . PRO A 1 109 ? 22.132  79.815  -12.767 1.00 52.64  ? 227 PRO A O   1 
ATOM   542  C CB  . PRO A 1 109 ? 19.385  79.305  -10.972 1.00 44.55  ? 227 PRO A CB  1 
ATOM   543  C CG  . PRO A 1 109 ? 19.964  77.924  -10.894 1.00 55.23  ? 227 PRO A CG  1 
ATOM   544  C CD  . PRO A 1 109 ? 19.731  77.324  -12.251 1.00 54.66  ? 227 PRO A CD  1 
ATOM   545  N N   . PRO A 1 110 ? 21.174  81.709  -12.041 1.00 56.05  ? 228 PRO A N   1 
ATOM   546  C CA  . PRO A 1 110 ? 22.469  82.397  -11.994 1.00 59.83  ? 228 PRO A CA  1 
ATOM   547  C C   . PRO A 1 110 ? 23.299  81.966  -10.798 1.00 72.42  ? 228 PRO A C   1 
ATOM   548  O O   . PRO A 1 110 ? 22.853  81.162  -9.973  1.00 81.71  ? 228 PRO A O   1 
ATOM   549  C CB  . PRO A 1 110 ? 22.075  83.876  -11.894 1.00 62.60  ? 228 PRO A CB  1 
ATOM   550  C CG  . PRO A 1 110 ? 20.724  83.871  -11.251 1.00 67.96  ? 228 PRO A CG  1 
ATOM   551  C CD  . PRO A 1 110 ? 20.047  82.608  -11.714 1.00 60.80  ? 228 PRO A CD  1 
ATOM   552  N N   . ALA A 1 111 ? 24.517  82.480  -10.707 1.00 80.67  ? 229 ALA A N   1 
ATOM   553  C CA  . ALA A 1 111 ? 25.291  82.390  -9.480  1.00 79.90  ? 229 ALA A CA  1 
ATOM   554  C C   . ALA A 1 111 ? 25.050  83.648  -8.657  1.00 86.62  ? 229 ALA A C   1 
ATOM   555  O O   . ALA A 1 111 ? 24.694  84.704  -9.193  1.00 79.85  ? 229 ALA A O   1 
ATOM   556  C CB  . ALA A 1 111 ? 26.781  82.225  -9.781  1.00 61.25  ? 229 ALA A CB  1 
ATOM   557  N N   . ASP A 1 112 ? 25.219  83.530  -7.342  1.00 88.15  ? 230 ASP A N   1 
ATOM   558  C CA  . ASP A 1 112 ? 25.083  84.707  -6.495  1.00 91.72  ? 230 ASP A CA  1 
ATOM   559  C C   . ASP A 1 112 ? 26.279  85.622  -6.743  1.00 94.32  ? 230 ASP A C   1 
ATOM   560  O O   . ASP A 1 112 ? 27.432  85.212  -6.560  1.00 88.01  ? 230 ASP A O   1 
ATOM   561  C CB  . ASP A 1 112 ? 24.984  84.313  -5.022  1.00 80.97  ? 230 ASP A CB  1 
ATOM   562  C CG  . ASP A 1 112 ? 24.757  85.515  -4.104  1.00 90.21  ? 230 ASP A CG  1 
ATOM   563  O OD1 . ASP A 1 112 ? 24.501  86.633  -4.608  1.00 86.08  ? 230 ASP A OD1 1 
ATOM   564  O OD2 . ASP A 1 112 ? 24.843  85.343  -2.870  1.00 94.40  ? 230 ASP A OD2 1 
ATOM   565  N N   . SER A 1 113 ? 26.004  86.853  -7.194  1.00 94.96  ? 231 SER A N   1 
ATOM   566  C CA  . SER A 1 113 ? 27.053  87.815  -7.513  1.00 91.82  ? 231 SER A CA  1 
ATOM   567  C C   . SER A 1 113 ? 26.742  89.199  -6.943  1.00 100.59 ? 231 SER A C   1 
ATOM   568  O O   . SER A 1 113 ? 27.152  90.216  -7.517  1.00 98.29  ? 231 SER A O   1 
ATOM   569  C CB  . SER A 1 113 ? 27.277  87.905  -9.026  1.00 80.55  ? 231 SER A CB  1 
ATOM   570  N N   . GLY A 1 114 ? 26.012  89.256  -5.828  1.00 96.87  ? 232 GLY A N   1 
ATOM   571  C CA  . GLY A 1 114 ? 25.807  90.495  -5.102  1.00 86.66  ? 232 GLY A CA  1 
ATOM   572  C C   . GLY A 1 114 ? 24.653  91.362  -5.555  1.00 93.73  ? 232 GLY A C   1 
ATOM   573  O O   . GLY A 1 114 ? 24.603  92.539  -5.179  1.00 96.07  ? 232 GLY A O   1 
ATOM   574  N N   . GLY A 1 115 ? 23.720  90.829  -6.341  1.00 94.21  ? 233 GLY A N   1 
ATOM   575  C CA  . GLY A 1 115 ? 22.620  91.638  -6.832  1.00 86.07  ? 233 GLY A CA  1 
ATOM   576  C C   . GLY A 1 115 ? 21.262  90.990  -6.669  1.00 91.23  ? 233 GLY A C   1 
ATOM   577  O O   . GLY A 1 115 ? 21.122  90.002  -5.940  1.00 90.60  ? 233 GLY A O   1 
ATOM   578  N N   . LYS A 1 116 ? 20.253  91.533  -7.357  1.00 88.65  ? 234 LYS A N   1 
ATOM   579  C CA  . LYS A 1 116 ? 18.887  91.030  -7.247  1.00 90.33  ? 234 LYS A CA  1 
ATOM   580  C C   . LYS A 1 116 ? 18.666  89.711  -7.986  1.00 87.03  ? 234 LYS A C   1 
ATOM   581  O O   . LYS A 1 116 ? 17.573  89.142  -7.879  1.00 81.56  ? 234 LYS A O   1 
ATOM   582  C CB  . LYS A 1 116 ? 17.899  92.086  -7.761  1.00 77.50  ? 234 LYS A CB  1 
ATOM   583  N N   . GLU A 1 117 ? 19.671  89.203  -8.711  1.00 84.79  ? 235 GLU A N   1 
ATOM   584  C CA  . GLU A 1 117 ? 19.504  87.970  -9.480  1.00 77.99  ? 235 GLU A CA  1 
ATOM   585  C C   . GLU A 1 117 ? 19.202  86.758  -8.603  1.00 74.15  ? 235 GLU A C   1 
ATOM   586  O O   . GLU A 1 117 ? 18.766  85.722  -9.121  1.00 70.34  ? 235 GLU A O   1 
ATOM   587  C CB  . GLU A 1 117 ? 20.756  87.689  -10.315 1.00 82.91  ? 235 GLU A CB  1 
ATOM   588  C CG  . GLU A 1 117 ? 22.027  87.412  -9.502  1.00 88.53  ? 235 GLU A CG  1 
ATOM   589  C CD  . GLU A 1 117 ? 22.676  88.677  -8.956  1.00 87.45  ? 235 GLU A CD  1 
ATOM   590  O OE1 . GLU A 1 117 ? 22.234  89.784  -9.334  1.00 80.07  ? 235 GLU A OE1 1 
ATOM   591  O OE2 . GLU A 1 117 ? 23.626  88.559  -8.151  1.00 85.73  ? 235 GLU A OE2 1 
ATOM   592  N N   . ILE A 1 118 ? 19.428  86.853  -7.292  1.00 72.36  ? 236 ILE A N   1 
ATOM   593  C CA  . ILE A 1 118 ? 19.064  85.762  -6.398  1.00 79.53  ? 236 ILE A CA  1 
ATOM   594  C C   . ILE A 1 118 ? 17.555  85.612  -6.235  1.00 66.65  ? 236 ILE A C   1 
ATOM   595  O O   . ILE A 1 118 ? 17.106  84.596  -5.697  1.00 54.87  ? 236 ILE A O   1 
ATOM   596  C CB  . ILE A 1 118 ? 19.743  85.956  -5.026  1.00 78.49  ? 236 ILE A CB  1 
ATOM   597  C CG1 . ILE A 1 118 ? 19.307  87.280  -4.385  1.00 73.21  ? 236 ILE A CG1 1 
ATOM   598  C CG2 . ILE A 1 118 ? 21.261  85.902  -5.175  1.00 76.90  ? 236 ILE A CG2 1 
ATOM   599  N N   . PHE A 1 119 ? 16.768  86.584  -6.712  1.00 65.93  ? 237 PHE A N   1 
ATOM   600  C CA  . PHE A 1 119 ? 15.316  86.618  -6.561  1.00 58.50  ? 237 PHE A CA  1 
ATOM   601  C C   . PHE A 1 119 ? 14.570  86.138  -7.800  1.00 59.74  ? 237 PHE A C   1 
ATOM   602  O O   . PHE A 1 119 ? 13.336  86.208  -7.827  1.00 46.27  ? 237 PHE A O   1 
ATOM   603  C CB  . PHE A 1 119 ? 14.846  88.040  -6.240  1.00 62.11  ? 237 PHE A CB  1 
ATOM   604  C CG  . PHE A 1 119 ? 15.416  88.597  -4.973  1.00 63.90  ? 237 PHE A CG  1 
ATOM   605  C CD1 . PHE A 1 119 ? 15.316  87.892  -3.793  1.00 59.11  ? 237 PHE A CD1 1 
ATOM   606  C CD2 . PHE A 1 119 ? 16.041  89.829  -4.964  1.00 65.50  ? 237 PHE A CD2 1 
ATOM   607  C CE1 . PHE A 1 119 ? 15.842  88.396  -2.626  1.00 67.65  ? 237 PHE A CE1 1 
ATOM   608  C CE2 . PHE A 1 119 ? 16.573  90.339  -3.798  1.00 67.66  ? 237 PHE A CE2 1 
ATOM   609  C CZ  . PHE A 1 119 ? 16.472  89.620  -2.629  1.00 70.02  ? 237 PHE A CZ  1 
ATOM   610  N N   . SER A 1 120 ? 15.286  85.680  -8.832  1.00 47.82  ? 238 SER A N   1 
ATOM   611  C CA  . SER A 1 120 ? 14.656  85.425  -10.126 1.00 52.03  ? 238 SER A CA  1 
ATOM   612  C C   . SER A 1 120 ? 13.605  84.323  -10.048 1.00 37.29  ? 238 SER A C   1 
ATOM   613  O O   . SER A 1 120 ? 12.626  84.354  -10.796 1.00 34.73  ? 238 SER A O   1 
ATOM   614  C CB  . SER A 1 120 ? 15.720  85.062  -11.172 1.00 40.53  ? 238 SER A CB  1 
ATOM   615  O OG  . SER A 1 120 ? 16.478  83.935  -10.747 1.00 51.15  ? 238 SER A OG  1 
ATOM   616  N N   . LEU A 1 121 ? 13.783  83.350  -9.169  1.00 33.84  ? 239 LEU A N   1 
ATOM   617  C CA  . LEU A 1 121 ? 12.851  82.233  -9.092  1.00 39.57  ? 239 LEU A CA  1 
ATOM   618  C C   . LEU A 1 121 ? 11.742  82.420  -8.060  1.00 43.86  ? 239 LEU A C   1 
ATOM   619  O O   . LEU A 1 121 ? 10.867  81.548  -7.945  1.00 32.44  ? 239 LEU A O   1 
ATOM   620  C CB  . LEU A 1 121 ? 13.614  80.946  -8.791  1.00 42.28  ? 239 LEU A CB  1 
ATOM   621  C CG  . LEU A 1 121 ? 14.055  80.167  -10.034 1.00 52.24  ? 239 LEU A CG  1 
ATOM   622  C CD1 . LEU A 1 121 ? 15.158  79.203  -9.688  1.00 50.53  ? 239 LEU A CD1 1 
ATOM   623  C CD2 . LEU A 1 121 ? 12.889  79.423  -10.655 1.00 47.25  ? 239 LEU A CD2 1 
ATOM   624  N N   . LEU A 1 122 ? 11.748  83.518  -7.309  1.00 34.47  ? 240 LEU A N   1 
ATOM   625  C CA  . LEU A 1 122 ? 10.774  83.659  -6.228  1.00 39.84  ? 240 LEU A CA  1 
ATOM   626  C C   . LEU A 1 122 ? 9.348   83.759  -6.741  1.00 34.16  ? 240 LEU A C   1 
ATOM   627  O O   . LEU A 1 122 ? 8.463   83.127  -6.135  1.00 34.81  ? 240 LEU A O   1 
ATOM   628  C CB  . LEU A 1 122 ? 11.114  84.873  -5.346  1.00 36.20  ? 240 LEU A CB  1 
ATOM   629  C CG  . LEU A 1 122 ? 12.229  84.681  -4.316  1.00 41.40  ? 240 LEU A CG  1 
ATOM   630  C CD1 . LEU A 1 122 ? 12.404  85.947  -3.488  1.00 46.40  ? 240 LEU A CD1 1 
ATOM   631  C CD2 . LEU A 1 122 ? 11.906  83.501  -3.400  1.00 43.40  ? 240 LEU A CD2 1 
ATOM   632  N N   . PRO A 1 123 ? 9.040   84.524  -7.788  1.00 30.16  ? 241 PRO A N   1 
ATOM   633  C CA  . PRO A 1 123 ? 7.649   84.549  -8.240  1.00 27.55  ? 241 PRO A CA  1 
ATOM   634  C C   . PRO A 1 123 ? 7.185   83.177  -8.670  1.00 33.55  ? 241 PRO A C   1 
ATOM   635  O O   . PRO A 1 123 ? 6.065   82.775  -8.336  1.00 30.68  ? 241 PRO A O   1 
ATOM   636  C CB  . PRO A 1 123 ? 7.675   85.534  -9.418  1.00 31.71  ? 241 PRO A CB  1 
ATOM   637  C CG  . PRO A 1 123 ? 8.821   86.419  -9.137  1.00 32.64  ? 241 PRO A CG  1 
ATOM   638  C CD  . PRO A 1 123 ? 9.852   85.541  -8.490  1.00 36.40  ? 241 PRO A CD  1 
ATOM   639  N N   . HIS A 1 124 ? 8.020   82.438  -9.404  1.00 31.45  ? 242 HIS A N   1 
ATOM   640  C CA  . HIS A 1 124 ? 7.611   81.097  -9.816  1.00 29.96  ? 242 HIS A CA  1 
ATOM   641  C C   . HIS A 1 124 ? 7.352   80.198  -8.613  1.00 29.47  ? 242 HIS A C   1 
ATOM   642  O O   . HIS A 1 124 ? 6.335   79.491  -8.559  1.00 27.25  ? 242 HIS A O   1 
ATOM   643  C CB  . HIS A 1 124 ? 8.641   80.433  -10.721 1.00 28.40  ? 242 HIS A CB  1 
ATOM   644  C CG  . HIS A 1 124 ? 8.259   79.026  -11.061 1.00 27.86  ? 242 HIS A CG  1 
ATOM   645  N ND1 . HIS A 1 124 ? 7.329   78.736  -12.034 1.00 30.52  ? 242 HIS A ND1 1 
ATOM   646  C CD2 . HIS A 1 124 ? 8.598   77.841  -10.498 1.00 33.38  ? 242 HIS A CD2 1 
ATOM   647  C CE1 . HIS A 1 124 ? 7.145   77.427  -12.092 1.00 35.53  ? 242 HIS A CE1 1 
ATOM   648  N NE2 . HIS A 1 124 ? 7.905   76.861  -11.169 1.00 29.88  ? 242 HIS A NE2 1 
ATOM   649  N N   . MET A 1 125 ? 8.265   80.183  -7.644  1.00 27.70  ? 243 MET A N   1 
ATOM   650  C CA  A MET A 1 125 ? 8.034   79.326  -6.487  0.54 32.71  ? 243 MET A CA  1 
ATOM   651  C CA  B MET A 1 125 ? 8.040   79.335  -6.480  0.46 32.71  ? 243 MET A CA  1 
ATOM   652  C C   . MET A 1 125 ? 6.842   79.792  -5.664  1.00 30.86  ? 243 MET A C   1 
ATOM   653  O O   . MET A 1 125 ? 6.172   78.964  -5.043  1.00 28.37  ? 243 MET A O   1 
ATOM   654  C CB  A MET A 1 125 ? 9.295   79.210  -5.626  0.54 34.31  ? 243 MET A CB  1 
ATOM   655  C CB  B MET A 1 125 ? 9.298   79.264  -5.617  0.46 34.28  ? 243 MET A CB  1 
ATOM   656  C CG  A MET A 1 125 ? 10.366  78.332  -6.291  0.54 43.89  ? 243 MET A CG  1 
ATOM   657  C CG  B MET A 1 125 ? 10.548  78.777  -6.369  0.46 42.53  ? 243 MET A CG  1 
ATOM   658  S SD  A MET A 1 125 ? 11.831  77.979  -5.287  0.54 57.78  ? 243 MET A SD  1 
ATOM   659  S SD  B MET A 1 125 ? 10.743  76.990  -6.725  0.46 55.79  ? 243 MET A SD  1 
ATOM   660  C CE  A MET A 1 125 ? 13.146  78.375  -6.432  0.54 54.25  ? 243 MET A CE  1 
ATOM   661  C CE  B MET A 1 125 ? 9.236   76.458  -7.533  0.46 50.30  ? 243 MET A CE  1 
ATOM   662  N N   . ALA A 1 126 ? 6.551   81.089  -5.655  1.00 27.38  ? 244 ALA A N   1 
ATOM   663  C CA  . ALA A 1 126 ? 5.350   81.550  -4.961  1.00 34.97  ? 244 ALA A CA  1 
ATOM   664  C C   . ALA A 1 126 ? 4.090   81.002  -5.632  1.00 27.73  ? 244 ALA A C   1 
ATOM   665  O O   . ALA A 1 126 ? 3.135   80.611  -4.946  1.00 27.99  ? 244 ALA A O   1 
ATOM   666  C CB  . ALA A 1 126 ? 5.322   83.077  -4.904  1.00 33.20  ? 244 ALA A CB  1 
ATOM   667  N N   . ASP A 1 127 ? 4.070   80.962  -6.975  1.00 24.66  ? 245 ASP A N   1 
ATOM   668  C CA  . ASP A 1 127 ? 2.922   80.407  -7.697  1.00 27.97  ? 245 ASP A CA  1 
ATOM   669  C C   . ASP A 1 127 ? 2.786   78.912  -7.451  1.00 30.85  ? 245 ASP A C   1 
ATOM   670  O O   . ASP A 1 127 ? 1.679   78.387  -7.274  1.00 24.68  ? 245 ASP A O   1 
ATOM   671  C CB  . ASP A 1 127 ? 3.061   80.686  -9.189  1.00 29.57  ? 245 ASP A CB  1 
ATOM   672  C CG  . ASP A 1 127 ? 2.872   82.147  -9.513  1.00 36.13  ? 245 ASP A CG  1 
ATOM   673  O OD1 . ASP A 1 127 ? 2.234   82.846  -8.688  1.00 29.93  ? 245 ASP A OD1 1 
ATOM   674  O OD2 . ASP A 1 127 ? 3.359   82.599  -10.565 1.00 32.71  ? 245 ASP A OD2 1 
ATOM   675  N N   . MET A 1 128 ? 3.899   78.196  -7.484  1.00 26.32  ? 246 MET A N   1 
ATOM   676  C CA  . MET A 1 128 ? 3.863   76.792  -7.039  1.00 24.38  ? 246 MET A CA  1 
ATOM   677  C C   . MET A 1 128 ? 3.390   76.568  -5.627  1.00 25.29  ? 246 MET A C   1 
ATOM   678  O O   . MET A 1 128 ? 2.611   75.627  -5.375  1.00 26.77  ? 246 MET A O   1 
ATOM   679  C CB  . MET A 1 128 ? 5.193   76.077  -7.319  1.00 26.03  ? 246 MET A CB  1 
ATOM   680  C CG  . MET A 1 128 ? 5.165   74.609  -6.931  1.00 27.55  ? 246 MET A CG  1 
ATOM   681  S SD  . MET A 1 128 ? 4.071   73.537  -7.753  1.00 31.43  ? 246 MET A SD  1 
ATOM   682  C CE  . MET A 1 128 ? 3.834   72.248  -6.725  1.00 59.91  ? 246 MET A CE  1 
ATOM   683  N N   . SER A 1 129 ? 3.930   77.323  -4.684  1.00 25.69  ? 247 SER A N   1 
ATOM   684  C CA  . SER A 1 129 ? 3.521   77.164  -3.303  1.00 27.16  ? 247 SER A CA  1 
ATOM   685  C C   . SER A 1 129 ? 2.036   77.381  -3.200  1.00 26.04  ? 247 SER A C   1 
ATOM   686  O O   . SER A 1 129 ? 1.331   76.668  -2.481  1.00 26.70  ? 247 SER A O   1 
ATOM   687  C CB  . SER A 1 129 ? 4.242   78.215  -2.472  1.00 31.69  ? 247 SER A CB  1 
ATOM   688  O OG  . SER A 1 129 ? 5.569   77.830  -2.214  1.00 42.69  ? 247 SER A OG  1 
ATOM   689  N N   . THR A 1 130 ? 1.559   78.431  -3.863  1.00 24.05  ? 248 THR A N   1 
ATOM   690  C CA  . THR A 1 130 ? 0.150   78.785  -3.786  1.00 26.85  ? 248 THR A CA  1 
ATOM   691  C C   . THR A 1 130 ? -0.712  77.673  -4.349  1.00 24.33  ? 248 THR A C   1 
ATOM   692  O O   . THR A 1 130 ? -1.738  77.306  -3.760  1.00 28.37  ? 248 THR A O   1 
ATOM   693  C CB  . THR A 1 130 ? -0.063  80.081  -4.555  1.00 30.50  ? 248 THR A CB  1 
ATOM   694  O OG1 . THR A 1 130 ? 0.689   81.119  -3.905  1.00 30.00  ? 248 THR A OG1 1 
ATOM   695  C CG2 . THR A 1 130 ? -1.545  80.457  -4.546  1.00 28.72  ? 248 THR A CG2 1 
ATOM   696  N N   . TYR A 1 131 ? -0.313  77.135  -5.505  1.00 26.00  ? 249 TYR A N   1 
ATOM   697  C CA  . TYR A 1 131 ? -1.040  76.016  -6.086  1.00 27.69  ? 249 TYR A CA  1 
ATOM   698  C C   . TYR A 1 131 ? -1.070  74.845  -5.117  1.00 29.03  ? 249 TYR A C   1 
ATOM   699  O O   . TYR A 1 131 ? -2.121  74.215  -4.910  1.00 28.91  ? 249 TYR A O   1 
ATOM   700  C CB  . TYR A 1 131 ? -0.399  75.613  -7.423  1.00 27.54  ? 249 TYR A CB  1 
ATOM   701  C CG  . TYR A 1 131 ? -1.016  74.367  -8.017  1.00 31.84  ? 249 TYR A CG  1 
ATOM   702  C CD1 . TYR A 1 131 ? -2.249  74.423  -8.665  1.00 33.82  ? 249 TYR A CD1 1 
ATOM   703  C CD2 . TYR A 1 131 ? -0.378  73.131  -7.914  1.00 32.34  ? 249 TYR A CD2 1 
ATOM   704  C CE1 . TYR A 1 131 ? -2.833  73.292  -9.192  1.00 37.91  ? 249 TYR A CE1 1 
ATOM   705  C CE2 . TYR A 1 131 ? -0.963  71.986  -8.452  1.00 38.96  ? 249 TYR A CE2 1 
ATOM   706  C CZ  . TYR A 1 131 ? -2.189  72.085  -9.090  1.00 41.48  ? 249 TYR A CZ  1 
ATOM   707  O OH  . TYR A 1 131 ? -2.800  70.971  -9.637  1.00 61.95  ? 249 TYR A OH  1 
ATOM   708  N N   . MET A 1 132 ? 0.067   74.551  -4.486  1.00 24.22  ? 250 MET A N   1 
ATOM   709  C CA  . MET A 1 132 ? 0.099   73.407  -3.579  1.00 25.69  ? 250 MET A CA  1 
ATOM   710  C C   . MET A 1 132 ? -0.754  73.668  -2.339  1.00 32.27  ? 250 MET A C   1 
ATOM   711  O O   . MET A 1 132 ? -1.438  72.764  -1.830  1.00 28.76  ? 250 MET A O   1 
ATOM   712  C CB  . MET A 1 132 ? 1.531   73.089  -3.164  1.00 26.86  ? 250 MET A CB  1 
ATOM   713  C CG  . MET A 1 132 ? 2.232   72.581  -4.338  1.00 26.03  ? 250 MET A CG  1 
ATOM   714  S SD  . MET A 1 132 ? 1.778   70.911  -4.826  1.00 30.77  ? 250 MET A SD  1 
ATOM   715  C CE  . MET A 1 132 ? 2.284   69.899  -3.429  1.00 28.85  ? 250 MET A CE  1 
ATOM   716  N N   . PHE A 1 133 ? -0.715  74.903  -1.838  1.00 25.77  ? 251 PHE A N   1 
ATOM   717  C CA  . PHE A 1 133 ? -1.490  75.258  -0.651  1.00 29.96  ? 251 PHE A CA  1 
ATOM   718  C C   . PHE A 1 133 ? -2.984  75.123  -0.911  1.00 28.30  ? 251 PHE A C   1 
ATOM   719  O O   . PHE A 1 133 ? -3.745  74.693  -0.031  1.00 26.40  ? 251 PHE A O   1 
ATOM   720  C CB  . PHE A 1 133 ? -1.178  76.694  -0.234  1.00 25.89  ? 251 PHE A CB  1 
ATOM   721  C CG  . PHE A 1 133 ? 0.178   76.879  0.405   1.00 28.97  ? 251 PHE A CG  1 
ATOM   722  C CD1 . PHE A 1 133 ? 0.713   75.899  1.216   1.00 37.01  ? 251 PHE A CD1 1 
ATOM   723  C CD2 . PHE A 1 133 ? 0.883   78.066  0.254   1.00 32.79  ? 251 PHE A CD2 1 
ATOM   724  C CE1 . PHE A 1 133 ? 1.965   76.074  1.822   1.00 45.30  ? 251 PHE A CE1 1 
ATOM   725  C CE2 . PHE A 1 133 ? 2.122   78.254  0.878   1.00 32.79  ? 251 PHE A CE2 1 
ATOM   726  C CZ  . PHE A 1 133 ? 2.663   77.259  1.650   1.00 42.39  ? 251 PHE A CZ  1 
ATOM   727  N N   . LYS A 1 134 ? -3.431  75.522  -2.102  1.00 23.19  ? 252 LYS A N   1 
ATOM   728  C CA  . LYS A 1 134 ? -4.846  75.358  -2.436  1.00 29.70  ? 252 LYS A CA  1 
ATOM   729  C C   . LYS A 1 134 ? -5.261  73.903  -2.336  1.00 31.53  ? 252 LYS A C   1 
ATOM   730  O O   . LYS A 1 134 ? -6.358  73.586  -1.843  1.00 27.39  ? 252 LYS A O   1 
ATOM   731  C CB  . LYS A 1 134 ? -5.108  75.875  -3.847  1.00 26.22  ? 252 LYS A CB  1 
ATOM   732  C CG  . LYS A 1 134 ? -5.275  77.382  -3.883  1.00 38.13  ? 252 LYS A CG  1 
ATOM   733  C CD  . LYS A 1 134 ? -5.269  77.919  -5.310  1.00 42.84  ? 252 LYS A CD  1 
ATOM   734  C CE  . LYS A 1 134 ? -5.718  79.378  -5.318  1.00 52.32  ? 252 LYS A CE  1 
ATOM   735  N NZ  . LYS A 1 134 ? -5.201  80.180  -6.485  1.00 52.93  ? 252 LYS A NZ  1 
ATOM   736  N N   . GLY A 1 135 ? -4.413  73.005  -2.847  1.00 27.82  ? 253 GLY A N   1 
ATOM   737  C CA  . GLY A 1 135 ? -4.704  71.584  -2.762  1.00 26.87  ? 253 GLY A CA  1 
ATOM   738  C C   . GLY A 1 135 ? -4.747  71.094  -1.329  1.00 26.69  ? 253 GLY A C   1 
ATOM   739  O O   . GLY A 1 135 ? -5.606  70.283  -0.967  1.00 28.11  ? 253 GLY A O   1 
ATOM   740  N N   . ILE A 1 136 ? -3.828  71.589  -0.489  1.00 21.42  ? 254 ILE A N   1 
ATOM   741  C CA  . ILE A 1 136 ? -3.807  71.212  0.921   1.00 23.82  ? 254 ILE A CA  1 
ATOM   742  C C   . ILE A 1 136 ? -5.041  71.712  1.641   1.00 23.33  ? 254 ILE A C   1 
ATOM   743  O O   . ILE A 1 136 ? -5.613  71.003  2.481   1.00 25.30  ? 254 ILE A O   1 
ATOM   744  C CB  . ILE A 1 136 ? -2.509  71.724  1.587   1.00 25.60  ? 254 ILE A CB  1 
ATOM   745  C CG1 . ILE A 1 136 ? -1.308  71.048  0.924   1.00 25.22  ? 254 ILE A CG1 1 
ATOM   746  C CG2 . ILE A 1 136 ? -2.548  71.543  3.092   1.00 32.94  ? 254 ILE A CG2 1 
ATOM   747  C CD1 . ILE A 1 136 ? -1.405  69.604  1.112   1.00 32.07  ? 254 ILE A CD1 1 
ATOM   748  N N   . ILE A 1 137 ? -5.437  72.956  1.377   1.00 23.93  ? 255 ILE A N   1 
ATOM   749  C CA  . ILE A 1 137 ? -6.651  73.470  2.008   1.00 26.22  ? 255 ILE A CA  1 
ATOM   750  C C   . ILE A 1 137 ? -7.860  72.632  1.598   1.00 26.94  ? 255 ILE A C   1 
ATOM   751  O O   . ILE A 1 137 ? -8.693  72.262  2.440   1.00 29.59  ? 255 ILE A O   1 
ATOM   752  C CB  . ILE A 1 137 ? -6.813  74.965  1.671   1.00 26.26  ? 255 ILE A CB  1 
ATOM   753  C CG1 . ILE A 1 137 ? -5.713  75.774  2.377   1.00 27.14  ? 255 ILE A CG1 1 
ATOM   754  C CG2 . ILE A 1 137 ? -8.208  75.489  2.062   1.00 28.77  ? 255 ILE A CG2 1 
ATOM   755  C CD1 . ILE A 1 137 ? -5.446  77.131  1.726   1.00 31.17  ? 255 ILE A CD1 1 
ATOM   756  N N   . SER A 1 138 ? -7.947  72.279  0.309   1.00 23.85  ? 256 SER A N   1 
ATOM   757  C CA  . SER A 1 138 ? -9.025  71.417  -0.184  1.00 30.34  ? 256 SER A CA  1 
ATOM   758  C C   . SER A 1 138 ? -9.018  70.056  0.499   1.00 31.97  ? 256 SER A C   1 
ATOM   759  O O   . SER A 1 138 ? -10.079 69.505  0.823   1.00 28.41  ? 256 SER A O   1 
ATOM   760  C CB  . SER A 1 138 ? -8.889  71.240  -1.702  1.00 29.42  ? 256 SER A CB  1 
ATOM   761  O OG  . SER A 1 138 ? -9.026  72.483  -2.359  1.00 41.23  ? 256 SER A OG  1 
ATOM   762  N N   . PHE A 1 139 ? -7.828  69.475  0.662   1.00 27.79  ? 257 PHE A N   1 
ATOM   763  C CA  . PHE A 1 139 ? -7.652  68.208  1.364   1.00 20.56  ? 257 PHE A CA  1 
ATOM   764  C C   . PHE A 1 139 ? -8.262  68.267  2.751   1.00 25.35  ? 257 PHE A C   1 
ATOM   765  O O   . PHE A 1 139 ? -9.085  67.428  3.125   1.00 28.73  ? 257 PHE A O   1 
ATOM   766  C CB  . PHE A 1 139 ? -6.140  67.914  1.467   1.00 22.54  ? 257 PHE A CB  1 
ATOM   767  C CG  . PHE A 1 139 ? -5.783  66.719  2.327   1.00 24.65  ? 257 PHE A CG  1 
ATOM   768  C CD1 . PHE A 1 139 ? -5.989  65.425  1.887   1.00 27.21  ? 257 PHE A CD1 1 
ATOM   769  C CD2 . PHE A 1 139 ? -5.260  66.917  3.606   1.00 21.96  ? 257 PHE A CD2 1 
ATOM   770  C CE1 . PHE A 1 139 ? -5.649  64.337  2.706   1.00 24.82  ? 257 PHE A CE1 1 
ATOM   771  C CE2 . PHE A 1 139 ? -4.923  65.879  4.414   1.00 21.95  ? 257 PHE A CE2 1 
ATOM   772  C CZ  . PHE A 1 139 ? -5.112  64.574  3.988   1.00 27.68  ? 257 PHE A CZ  1 
ATOM   773  N N   . ALA A 1 140 ? -7.860  69.272  3.528   1.00 23.58  ? 258 ALA A N   1 
ATOM   774  C CA  . ALA A 1 140 ? -8.358  69.417  4.886   1.00 26.50  ? 258 ALA A CA  1 
ATOM   775  C C   . ALA A 1 140 ? -9.875  69.592  4.906   1.00 30.75  ? 258 ALA A C   1 
ATOM   776  O O   . ALA A 1 140 ? -10.561 69.005  5.749   1.00 31.30  ? 258 ALA A O   1 
ATOM   777  C CB  . ALA A 1 140 ? -7.663  70.609  5.552   1.00 24.87  ? 258 ALA A CB  1 
ATOM   778  N N   . LYS A 1 141 ? -10.425 70.375  3.976   1.00 32.49  ? 259 LYS A N   1 
ATOM   779  C CA  . LYS A 1 141 ? -11.871 70.652  4.026   1.00 36.85  ? 259 LYS A CA  1 
ATOM   780  C C   . LYS A 1 141 ? -12.749 69.430  3.724   1.00 42.86  ? 259 LYS A C   1 
ATOM   781  O O   . LYS A 1 141 ? -13.897 69.370  4.192   1.00 44.74  ? 259 LYS A O   1 
ATOM   782  C CB  . LYS A 1 141 ? -12.211 71.805  3.085   1.00 41.17  ? 259 LYS A CB  1 
ATOM   783  C CG  . LYS A 1 141 ? -11.584 73.126  3.503   1.00 44.42  ? 259 LYS A CG  1 
ATOM   784  C CD  . LYS A 1 141 ? -12.031 74.230  2.536   1.00 56.28  ? 259 LYS A CD  1 
ATOM   785  C CE  . LYS A 1 141 ? -11.604 75.612  2.997   1.00 65.13  ? 259 LYS A CE  1 
ATOM   786  N NZ  . LYS A 1 141 ? -11.442 76.551  1.837   1.00 64.50  ? 259 LYS A NZ  1 
ATOM   787  N N   . VAL A 1 142 ? -12.255 68.470  2.938   1.00 32.99  ? 260 VAL A N   1 
ATOM   788  C CA  . VAL A 1 142 ? -12.915 67.173  2.745   1.00 37.82  ? 260 VAL A CA  1 
ATOM   789  C C   . VAL A 1 142 ? -13.008 66.345  4.009   1.00 43.71  ? 260 VAL A C   1 
ATOM   790  O O   . VAL A 1 142 ? -13.922 65.521  4.148   1.00 44.62  ? 260 VAL A O   1 
ATOM   791  C CB  . VAL A 1 142 ? -12.206 66.348  1.645   1.00 48.12  ? 260 VAL A CB  1 
ATOM   792  C CG1 . VAL A 1 142 ? -12.811 64.937  1.537   1.00 58.21  ? 260 VAL A CG1 1 
ATOM   793  C CG2 . VAL A 1 142 ? -12.481 66.980  0.322   1.00 55.64  ? 260 VAL A CG2 1 
ATOM   794  N N   . ILE A 1 143 ? -12.048 66.466  4.910   1.00 30.19  ? 261 ILE A N   1 
ATOM   795  C CA  . ILE A 1 143 ? -11.951 65.484  5.977   1.00 28.88  ? 261 ILE A CA  1 
ATOM   796  C C   . ILE A 1 143 ? -12.977 65.823  7.053   1.00 37.23  ? 261 ILE A C   1 
ATOM   797  O O   . ILE A 1 143 ? -13.025 66.955  7.543   1.00 30.80  ? 261 ILE A O   1 
ATOM   798  C CB  . ILE A 1 143 ? -10.532 65.439  6.548   1.00 33.12  ? 261 ILE A CB  1 
ATOM   799  C CG1 . ILE A 1 143 ? -9.513  65.037  5.473   1.00 29.72  ? 261 ILE A CG1 1 
ATOM   800  C CG2 . ILE A 1 143 ? -10.487 64.472  7.736   1.00 33.81  ? 261 ILE A CG2 1 
ATOM   801  C CD1 . ILE A 1 143 ? -8.074  65.208  5.966   1.00 32.45  ? 261 ILE A CD1 1 
ATOM   802  N N   . SER A 1 144 ? -13.787 64.828  7.429   1.00 38.72  ? 262 SER A N   1 
ATOM   803  C CA  . SER A 1 144 ? -14.862 65.047  8.399   1.00 39.10  ? 262 SER A CA  1 
ATOM   804  C C   . SER A 1 144 ? -14.317 65.550  9.728   1.00 37.08  ? 262 SER A C   1 
ATOM   805  O O   . SER A 1 144 ? -14.823 66.532  10.288  1.00 38.35  ? 262 SER A O   1 
ATOM   806  C CB  . SER A 1 144 ? -15.638 63.748  8.611   1.00 33.61  ? 262 SER A CB  1 
ATOM   807  O OG  . SER A 1 144 ? -14.763 62.728  9.068   1.00 35.95  ? 262 SER A OG  1 
ATOM   808  N N   . TYR A 1 145 ? -13.280 64.881  10.249  1.00 37.53  ? 263 TYR A N   1 
ATOM   809  C CA  . TYR A 1 145 ? -12.674 65.295  11.509  1.00 38.90  ? 263 TYR A CA  1 
ATOM   810  C C   . TYR A 1 145 ? -12.230 66.742  11.440  1.00 41.50  ? 263 TYR A C   1 
ATOM   811  O O   . TYR A 1 145 ? -12.227 67.443  12.463  1.00 43.19  ? 263 TYR A O   1 
ATOM   812  C CB  . TYR A 1 145 ? -11.474 64.400  11.843  1.00 38.88  ? 263 TYR A CB  1 
ATOM   813  C CG  . TYR A 1 145 ? -11.745 62.934  11.612  1.00 40.94  ? 263 TYR A CG  1 
ATOM   814  C CD1 . TYR A 1 145 ? -12.273 62.125  12.611  1.00 48.39  ? 263 TYR A CD1 1 
ATOM   815  C CD2 . TYR A 1 145 ? -11.442 62.353  10.389  1.00 41.45  ? 263 TYR A CD2 1 
ATOM   816  C CE1 . TYR A 1 145 ? -12.517 60.771  12.380  1.00 45.26  ? 263 TYR A CE1 1 
ATOM   817  C CE2 . TYR A 1 145 ? -11.678 61.016  10.147  1.00 48.93  ? 263 TYR A CE2 1 
ATOM   818  C CZ  . TYR A 1 145 ? -12.215 60.223  11.146  1.00 54.17  ? 263 TYR A CZ  1 
ATOM   819  O OH  . TYR A 1 145 ? -12.449 58.885  10.886  1.00 53.64  ? 263 TYR A OH  1 
ATOM   820  N N   . PHE A 1 146 ? -11.865 67.218  10.242  1.00 29.69  ? 264 PHE A N   1 
ATOM   821  C CA  . PHE A 1 146 ? -11.436 68.608  10.136  1.00 37.36  ? 264 PHE A CA  1 
ATOM   822  C C   . PHE A 1 146 ? -12.611 69.558  9.991   1.00 40.65  ? 264 PHE A C   1 
ATOM   823  O O   . PHE A 1 146 ? -12.678 70.556  10.708  1.00 38.26  ? 264 PHE A O   1 
ATOM   824  C CB  . PHE A 1 146 ? -10.466 68.780  8.955   1.00 31.39  ? 264 PHE A CB  1 
ATOM   825  C CG  . PHE A 1 146 ? -9.873  70.161  8.838   1.00 32.38  ? 264 PHE A CG  1 
ATOM   826  C CD1 . PHE A 1 146 ? -8.754  70.525  9.586   1.00 33.04  ? 264 PHE A CD1 1 
ATOM   827  C CD2 . PHE A 1 146 ? -10.417 71.088  7.975   1.00 35.13  ? 264 PHE A CD2 1 
ATOM   828  C CE1 . PHE A 1 146 ? -8.223  71.824  9.464   1.00 35.84  ? 264 PHE A CE1 1 
ATOM   829  C CE2 . PHE A 1 146 ? -9.896  72.369  7.853   1.00 33.89  ? 264 PHE A CE2 1 
ATOM   830  C CZ  . PHE A 1 146 ? -8.792  72.731  8.590   1.00 28.99  ? 264 PHE A CZ  1 
ATOM   831  N N   . ARG A 1 147 ? -13.532 69.307  9.062   1.00 35.88  ? 265 ARG A N   1 
ATOM   832  C CA  . ARG A 1 147 ? -14.629 70.259  8.935   1.00 41.29  ? 265 ARG A CA  1 
ATOM   833  C C   . ARG A 1 147 ? -15.510 70.341  10.165  1.00 41.10  ? 265 ARG A C   1 
ATOM   834  O O   . ARG A 1 147 ? -16.209 71.341  10.290  1.00 42.83  ? 265 ARG A O   1 
ATOM   835  C CB  . ARG A 1 147 ? -15.552 69.956  7.790   1.00 50.55  ? 265 ARG A CB  1 
ATOM   836  C CG  . ARG A 1 147 ? -16.213 68.684  8.137   1.00 60.11  ? 265 ARG A CG  1 
ATOM   837  C CD  . ARG A 1 147 ? -17.234 67.874  7.264   1.00 64.07  ? 265 ARG A CD  1 
ATOM   838  N NE  . ARG A 1 147 ? -16.729 67.250  6.072   1.00 70.31  ? 265 ARG A NE  1 
ATOM   839  C CZ  . ARG A 1 147 ? -17.294 66.607  5.094   1.00 70.48  ? 265 ARG A CZ  1 
ATOM   840  N NH1 . ARG A 1 147 ? -18.509 66.076  5.205   1.00 77.25  ? 265 ARG A NH1 1 
ATOM   841  N NH2 . ARG A 1 147 ? -16.592 66.317  4.062   1.00 68.84  ? 265 ARG A NH2 1 
ATOM   842  N N   . ASP A 1 148 ? -15.490 69.343  11.066  1.00 39.49  ? 266 ASP A N   1 
ATOM   843  C CA  . ASP A 1 148 ? -16.235 69.423  12.325  1.00 46.56  ? 266 ASP A CA  1 
ATOM   844  C C   . ASP A 1 148 ? -15.585 70.302  13.363  1.00 52.59  ? 266 ASP A C   1 
ATOM   845  O O   . ASP A 1 148 ? -16.197 70.509  14.406  1.00 50.12  ? 266 ASP A O   1 
ATOM   846  C CB  . ASP A 1 148 ? -16.450 68.034  12.939  1.00 45.83  ? 266 ASP A CB  1 
ATOM   847  C CG  . ASP A 1 148 ? -17.408 67.177  12.142  1.00 45.35  ? 266 ASP A CG  1 
ATOM   848  O OD1 . ASP A 1 148 ? -18.133 67.764  11.328  1.00 47.64  ? 266 ASP A OD1 1 
ATOM   849  O OD2 . ASP A 1 148 ? -17.459 65.937  12.353  1.00 46.85  ? 266 ASP A OD2 1 
ATOM   850  N N   . LEU A 1 149 ? -14.380 70.807  13.120  1.00 42.82  ? 267 LEU A N   1 
ATOM   851  C CA  . LEU A 1 149 ? -13.768 71.716  14.068  1.00 40.46  ? 267 LEU A CA  1 
ATOM   852  C C   . LEU A 1 149 ? -14.340 73.107  13.859  1.00 40.56  ? 267 LEU A C   1 
ATOM   853  O O   . LEU A 1 149 ? -14.830 73.424  12.775  1.00 40.70  ? 267 LEU A O   1 
ATOM   854  C CB  . LEU A 1 149 ? -12.257 71.740  13.870  1.00 40.73  ? 267 LEU A CB  1 
ATOM   855  C CG  . LEU A 1 149 ? -11.502 70.468  14.258  1.00 46.36  ? 267 LEU A CG  1 
ATOM   856  C CD1 . LEU A 1 149 ? -10.090 70.510  13.692  1.00 38.31  ? 267 LEU A CD1 1 
ATOM   857  C CD2 . LEU A 1 149 ? -11.471 70.302  15.764  1.00 46.02  ? 267 LEU A CD2 1 
ATOM   858  N N   . PRO A 1 150 ? -14.278 73.964  14.879  1.00 39.65  ? 268 PRO A N   1 
ATOM   859  C CA  . PRO A 1 150 ? -14.657 75.371  14.684  1.00 44.79  ? 268 PRO A CA  1 
ATOM   860  C C   . PRO A 1 150 ? -13.792 76.033  13.620  1.00 44.77  ? 268 PRO A C   1 
ATOM   861  O O   . PRO A 1 150 ? -12.593 75.769  13.516  1.00 42.50  ? 268 PRO A O   1 
ATOM   862  C CB  . PRO A 1 150 ? -14.404 76.002  16.058  1.00 41.18  ? 268 PRO A CB  1 
ATOM   863  C CG  . PRO A 1 150 ? -14.402 74.867  17.025  1.00 47.77  ? 268 PRO A CG  1 
ATOM   864  C CD  . PRO A 1 150 ? -13.871 73.678  16.267  1.00 45.17  ? 268 PRO A CD  1 
ATOM   865  N N   . ILE A 1 151 ? -14.407 76.937  12.852  1.00 36.89  ? 269 ILE A N   1 
ATOM   866  C CA  . ILE A 1 151 ? -13.712 77.584  11.745  1.00 46.37  ? 269 ILE A CA  1 
ATOM   867  C C   . ILE A 1 151 ? -12.417 78.257  12.192  1.00 53.50  ? 269 ILE A C   1 
ATOM   868  O O   . ILE A 1 151 ? -11.436 78.287  11.436  1.00 49.61  ? 269 ILE A O   1 
ATOM   869  C CB  . ILE A 1 151 ? -14.655 78.577  11.040  1.00 47.28  ? 269 ILE A CB  1 
ATOM   870  C CG1 . ILE A 1 151 ? -14.047 79.013  9.707   1.00 50.13  ? 269 ILE A CG1 1 
ATOM   871  C CG2 . ILE A 1 151 ? -14.964 79.763  11.933  1.00 58.19  ? 269 ILE A CG2 1 
ATOM   872  C CD1 . ILE A 1 151 ? -13.880 77.861  8.729   1.00 49.03  ? 269 ILE A CD1 1 
ATOM   873  N N   . GLU A 1 152 ? -12.375 78.793  13.414  1.00 43.83  ? 270 GLU A N   1 
ATOM   874  C CA  . GLU A 1 152 ? -11.160 79.455  13.869  1.00 50.89  ? 270 GLU A CA  1 
ATOM   875  C C   . GLU A 1 152 ? -10.028 78.451  14.027  1.00 47.05  ? 270 GLU A C   1 
ATOM   876  O O   . GLU A 1 152 ? -8.876  78.745  13.691  1.00 41.13  ? 270 GLU A O   1 
ATOM   877  C CB  . GLU A 1 152 ? -11.400 80.184  15.194  1.00 53.27  ? 270 GLU A CB  1 
ATOM   878  C CG  . GLU A 1 152 ? -12.341 81.385  15.112  1.00 57.42  ? 270 GLU A CG  1 
ATOM   879  C CD  . GLU A 1 152 ? -13.809 80.989  14.957  1.00 70.36  ? 270 GLU A CD  1 
ATOM   880  O OE1 . GLU A 1 152 ? -14.615 81.863  14.562  1.00 70.79  ? 270 GLU A OE1 1 
ATOM   881  O OE2 . GLU A 1 152 ? -14.161 79.815  15.247  1.00 58.09  ? 270 GLU A OE2 1 
ATOM   882  N N   . ASP A 1 153 ? -10.337 77.259  14.540  1.00 44.07  ? 271 ASP A N   1 
ATOM   883  C CA  . ASP A 1 153 ? -9.306  76.235  14.678  1.00 46.23  ? 271 ASP A CA  1 
ATOM   884  C C   . ASP A 1 153 ? -8.893  75.663  13.323  1.00 43.42  ? 271 ASP A C   1 
ATOM   885  O O   . ASP A 1 153 ? -7.712  75.368  13.109  1.00 37.23  ? 271 ASP A O   1 
ATOM   886  C CB  . ASP A 1 153 ? -9.784  75.141  15.625  1.00 43.33  ? 271 ASP A CB  1 
ATOM   887  C CG  . ASP A 1 153 ? -9.727  75.576  17.080  1.00 51.49  ? 271 ASP A CG  1 
ATOM   888  O OD1 . ASP A 1 153 ? -9.228  76.688  17.368  1.00 53.05  ? 271 ASP A OD1 1 
ATOM   889  O OD2 . ASP A 1 153 ? -10.181 74.805  17.938  1.00 60.19  ? 271 ASP A OD2 1 
ATOM   890  N N   . GLN A 1 154 ? -9.843  75.502  12.403  1.00 39.98  ? 272 GLN A N   1 
ATOM   891  C CA  . GLN A 1 154 ? -9.499  75.099  11.042  1.00 41.57  ? 272 GLN A CA  1 
ATOM   892  C C   . GLN A 1 154 ? -8.455  76.022  10.433  1.00 41.90  ? 272 GLN A C   1 
ATOM   893  O O   . GLN A 1 154 ? -7.479  75.564  9.822   1.00 36.96  ? 272 GLN A O   1 
ATOM   894  C CB  . GLN A 1 154 ? -10.747 75.082  10.172  1.00 38.29  ? 272 GLN A CB  1 
ATOM   895  C CG  . GLN A 1 154 ? -11.739 74.022  10.551  1.00 37.39  ? 272 GLN A CG  1 
ATOM   896  C CD  . GLN A 1 154 ? -12.890 74.020  9.607   1.00 40.24  ? 272 GLN A CD  1 
ATOM   897  O OE1 . GLN A 1 154 ? -12.717 74.283  8.423   1.00 40.44  ? 272 GLN A OE1 1 
ATOM   898  N NE2 . GLN A 1 154 ? -14.079 73.705  10.110  1.00 44.71  ? 272 GLN A NE2 1 
ATOM   899  N N   . ILE A 1 155 ? -8.658  77.331  10.570  1.00 39.77  ? 273 ILE A N   1 
ATOM   900  C CA  . ILE A 1 155 ? -7.709  78.296  10.020  1.00 39.05  ? 273 ILE A CA  1 
ATOM   901  C C   . ILE A 1 155 ? -6.372  78.212  10.745  1.00 36.36  ? 273 ILE A C   1 
ATOM   902  O O   . ILE A 1 155 ? -5.311  78.218  10.113  1.00 33.94  ? 273 ILE A O   1 
ATOM   903  C CB  . ILE A 1 155 ? -8.312  79.711  10.085  1.00 42.97  ? 273 ILE A CB  1 
ATOM   904  C CG1 . ILE A 1 155 ? -9.554  79.777  9.192   1.00 42.71  ? 273 ILE A CG1 1 
ATOM   905  C CG2 . ILE A 1 155 ? -7.276  80.763  9.700   1.00 35.13  ? 273 ILE A CG2 1 
ATOM   906  C CD1 . ILE A 1 155 ? -10.356 81.025  9.364   1.00 55.50  ? 273 ILE A CD1 1 
ATOM   907  N N   . SER A 1 156 ? -6.393  78.120  12.077  1.00 33.41  ? 274 SER A N   1 
ATOM   908  C CA  . SER A 1 156 ? -5.141  78.043  12.820  1.00 32.79  ? 274 SER A CA  1 
ATOM   909  C C   . SER A 1 156 ? -4.350  76.791  12.460  1.00 38.07  ? 274 SER A C   1 
ATOM   910  O O   . SER A 1 156 ? -3.111  76.827  12.384  1.00 32.88  ? 274 SER A O   1 
ATOM   911  C CB  . SER A 1 156 ? -5.416  78.093  14.324  1.00 40.44  ? 274 SER A CB  1 
ATOM   912  O OG  . SER A 1 156 ? -5.815  79.400  14.709  1.00 42.92  ? 274 SER A OG  1 
ATOM   913  N N   . LEU A 1 157 ? -5.045  75.672  12.239  1.00 30.18  ? 275 LEU A N   1 
ATOM   914  C CA  . LEU A 1 157 ? -4.358  74.429  11.902  1.00 30.47  ? 275 LEU A CA  1 
ATOM   915  C C   . LEU A 1 157 ? -3.744  74.501  10.505  1.00 35.75  ? 275 LEU A C   1 
ATOM   916  O O   . LEU A 1 157 ? -2.618  74.026  10.292  1.00 30.98  ? 275 LEU A O   1 
ATOM   917  C CB  . LEU A 1 157 ? -5.334  73.258  12.002  1.00 32.68  ? 275 LEU A CB  1 
ATOM   918  C CG  . LEU A 1 157 ? -5.758  72.851  13.422  1.00 33.35  ? 275 LEU A CG  1 
ATOM   919  C CD1 . LEU A 1 157 ? -6.731  71.684  13.354  1.00 34.55  ? 275 LEU A CD1 1 
ATOM   920  C CD2 . LEU A 1 157 ? -4.576  72.518  14.326  1.00 33.64  ? 275 LEU A CD2 1 
ATOM   921  N N   . LEU A 1 158 ? -4.469  75.091  9.547   1.00 29.07  ? 276 LEU A N   1 
ATOM   922  C CA  . LEU A 1 158 ? -3.950  75.214  8.186   1.00 36.38  ? 276 LEU A CA  1 
ATOM   923  C C   . LEU A 1 158 ? -2.772  76.178  8.143   1.00 35.60  ? 276 LEU A C   1 
ATOM   924  O O   . LEU A 1 158 ? -1.755  75.902  7.497   1.00 33.57  ? 276 LEU A O   1 
ATOM   925  C CB  . LEU A 1 158 ? -5.072  75.668  7.244   1.00 34.33  ? 276 LEU A CB  1 
ATOM   926  C CG  . LEU A 1 158 ? -6.013  74.532  6.821   1.00 38.09  ? 276 LEU A CG  1 
ATOM   927  C CD1 . LEU A 1 158 ? -7.279  75.091  6.165   1.00 29.84  ? 276 LEU A CD1 1 
ATOM   928  C CD2 . LEU A 1 158 ? -5.298  73.496  5.886   1.00 29.71  ? 276 LEU A CD2 1 
ATOM   929  N N   . LYS A 1 159 ? -2.876  77.306  8.856   1.00 34.93  ? 277 LYS A N   1 
ATOM   930  C CA  . LYS A 1 159 ? -1.735  78.213  8.972   1.00 34.32  ? 277 LYS A CA  1 
ATOM   931  C C   . LYS A 1 159 ? -0.522  77.485  9.530   1.00 34.83  ? 277 LYS A C   1 
ATOM   932  O O   . LYS A 1 159 ? 0.614   77.708  9.085   1.00 34.46  ? 277 LYS A O   1 
ATOM   933  C CB  . LYS A 1 159 ? -2.100  79.403  9.875   1.00 35.17  ? 277 LYS A CB  1 
ATOM   934  C CG  . LYS A 1 159 ? -2.933  80.490  9.179   1.00 30.27  ? 277 LYS A CG  1 
ATOM   935  C CD  . LYS A 1 159 ? -3.404  81.549  10.183  1.00 36.63  ? 277 LYS A CD  1 
ATOM   936  C CE  . LYS A 1 159 ? -3.968  82.758  9.466   1.00 48.36  ? 277 LYS A CE  1 
ATOM   937  N NZ  . LYS A 1 159 ? -4.570  83.762  10.407  1.00 58.01  ? 277 LYS A NZ  1 
ATOM   938  N N   . GLY A 1 160 ? -0.743  76.597  10.505  1.00 35.71  ? 278 GLY A N   1 
ATOM   939  C CA  . GLY A 1 160 ? 0.374   75.938  11.159  1.00 38.50  ? 278 GLY A CA  1 
ATOM   940  C C   . GLY A 1 160 ? 1.025   74.861  10.316  1.00 39.11  ? 278 GLY A C   1 
ATOM   941  O O   . GLY A 1 160 ? 2.244   74.670  10.392  1.00 41.38  ? 278 GLY A O   1 
ATOM   942  N N   . ALA A 1 161 ? 0.240   74.168  9.481   1.00 34.87  ? 279 ALA A N   1 
ATOM   943  C CA  . ALA A 1 161 ? 0.668   72.910  8.866   1.00 34.78  ? 279 ALA A CA  1 
ATOM   944  C C   . ALA A 1 161 ? 0.713   72.927  7.347   1.00 31.89  ? 279 ALA A C   1 
ATOM   945  O O   . ALA A 1 161 ? 1.190   71.949  6.757   1.00 34.66  ? 279 ALA A O   1 
ATOM   946  C CB  . ALA A 1 161 ? -0.269  71.762  9.296   1.00 32.51  ? 279 ALA A CB  1 
ATOM   947  N N   . ALA A 1 162 ? 0.196   73.972  6.693   1.00 28.85  ? 280 ALA A N   1 
ATOM   948  C CA  . ALA A 1 162 ? 0.133   73.975  5.231   1.00 32.53  ? 280 ALA A CA  1 
ATOM   949  C C   . ALA A 1 162 ? 1.491   73.652  4.624   1.00 32.45  ? 280 ALA A C   1 
ATOM   950  O O   . ALA A 1 162 ? 1.607   72.817  3.718   1.00 30.98  ? 280 ALA A O   1 
ATOM   951  C CB  . ALA A 1 162 ? -0.340  75.335  4.725   1.00 34.17  ? 280 ALA A CB  1 
ATOM   952  N N   . PHE A 1 163 ? 2.528   74.331  5.096   1.00 29.45  ? 281 PHE A N   1 
ATOM   953  C CA  . PHE A 1 163 ? 3.860   74.070  4.568   1.00 31.11  ? 281 PHE A CA  1 
ATOM   954  C C   . PHE A 1 163 ? 4.262   72.614  4.776   1.00 32.41  ? 281 PHE A C   1 
ATOM   955  O O   . PHE A 1 163 ? 4.878   72.007  3.895   1.00 25.21  ? 281 PHE A O   1 
ATOM   956  C CB  . PHE A 1 163 ? 4.880   75.000  5.219   1.00 33.24  ? 281 PHE A CB  1 
ATOM   957  C CG  . PHE A 1 163 ? 6.310   74.644  4.894   1.00 35.69  ? 281 PHE A CG  1 
ATOM   958  C CD1 . PHE A 1 163 ? 6.914   75.159  3.755   1.00 45.48  ? 281 PHE A CD1 1 
ATOM   959  C CD2 . PHE A 1 163 ? 7.050   73.821  5.729   1.00 41.21  ? 281 PHE A CD2 1 
ATOM   960  C CE1 . PHE A 1 163 ? 8.228   74.851  3.451   1.00 41.90  ? 281 PHE A CE1 1 
ATOM   961  C CE2 . PHE A 1 163 ? 8.369   73.503  5.422   1.00 44.58  ? 281 PHE A CE2 1 
ATOM   962  C CZ  . PHE A 1 163 ? 8.950   74.020  4.284   1.00 40.74  ? 281 PHE A CZ  1 
ATOM   963  N N   . GLU A 1 164 ? 3.961   72.039  5.948   1.00 26.74  ? 282 GLU A N   1 
ATOM   964  C CA  . GLU A 1 164 ? 4.385   70.658  6.180   1.00 26.11  ? 282 GLU A CA  1 
ATOM   965  C C   . GLU A 1 164 ? 3.674   69.699  5.252   1.00 25.70  ? 282 GLU A C   1 
ATOM   966  O O   . GLU A 1 164 ? 4.285   68.752  4.737   1.00 23.37  ? 282 GLU A O   1 
ATOM   967  C CB  . GLU A 1 164 ? 4.151   70.261  7.636   1.00 24.95  ? 282 GLU A CB  1 
ATOM   968  C CG  . GLU A 1 164 ? 4.865   71.215  8.568   1.00 28.73  ? 282 GLU A CG  1 
ATOM   969  C CD  . GLU A 1 164 ? 4.641   70.913  10.030  1.00 39.04  ? 282 GLU A CD  1 
ATOM   970  O OE1 . GLU A 1 164 ? 4.095   69.830  10.361  1.00 31.07  ? 282 GLU A OE1 1 
ATOM   971  O OE2 . GLU A 1 164 ? 4.981   71.801  10.844  1.00 34.46  ? 282 GLU A OE2 1 
ATOM   972  N N   . LEU A 1 165 ? 2.373   69.902  5.041   1.00 26.33  ? 283 LEU A N   1 
ATOM   973  C CA  . LEU A 1 165 ? 1.673   68.985  4.158   1.00 24.03  ? 283 LEU A CA  1 
ATOM   974  C C   . LEU A 1 165 ? 2.135   69.175  2.722   1.00 24.20  ? 283 LEU A C   1 
ATOM   975  O O   . LEU A 1 165 ? 2.183   68.209  1.958   1.00 23.42  ? 283 LEU A O   1 
ATOM   976  C CB  . LEU A 1 165 ? 0.160   69.182  4.262   1.00 24.21  ? 283 LEU A CB  1 
ATOM   977  C CG  . LEU A 1 165 ? -0.489  68.311  5.348   1.00 25.17  ? 283 LEU A CG  1 
ATOM   978  C CD1 . LEU A 1 165 ? -0.123  68.835  6.724   1.00 26.35  ? 283 LEU A CD1 1 
ATOM   979  C CD2 . LEU A 1 165 ? -2.015  68.275  5.189   1.00 25.34  ? 283 LEU A CD2 1 
ATOM   980  N N   . CYS A 1 166 ? 2.494   70.400  2.338   1.00 21.77  ? 284 CYS A N   1 
ATOM   981  C CA  A CYS A 1 166 ? 3.050   70.590  1.005   0.48 23.60  ? 284 CYS A CA  1 
ATOM   982  C CA  B CYS A 1 166 ? 3.075   70.620  1.012   0.52 23.61  ? 284 CYS A CA  1 
ATOM   983  C C   . CYS A 1 166 ? 4.316   69.759  0.817   1.00 23.46  ? 284 CYS A C   1 
ATOM   984  O O   . CYS A 1 166 ? 4.478   69.090  -0.210  1.00 25.87  ? 284 CYS A O   1 
ATOM   985  C CB  A CYS A 1 166 ? 3.316   72.070  0.776   0.48 23.95  ? 284 CYS A CB  1 
ATOM   986  C CB  B CYS A 1 166 ? 3.430   72.101  0.834   0.52 23.95  ? 284 CYS A CB  1 
ATOM   987  S SG  A CYS A 1 166 ? 1.764   72.914  0.541   0.48 31.74  ? 284 CYS A SG  1 
ATOM   988  S SG  B CYS A 1 166 ? 4.094   72.550  -0.802  0.52 27.87  ? 284 CYS A SG  1 
ATOM   989  N N   . GLN A 1 167 ? 5.223   69.777  1.809   1.00 23.78  ? 285 GLN A N   1 
ATOM   990  C CA  . GLN A 1 167 ? 6.475   69.023  1.695   1.00 21.59  ? 285 GLN A CA  1 
ATOM   991  C C   . GLN A 1 167 ? 6.227   67.520  1.667   1.00 24.36  ? 285 GLN A C   1 
ATOM   992  O O   . GLN A 1 167 ? 6.940   66.776  0.980   1.00 23.82  ? 285 GLN A O   1 
ATOM   993  C CB  . GLN A 1 167 ? 7.391   69.381  2.872   1.00 24.03  ? 285 GLN A CB  1 
ATOM   994  C CG  . GLN A 1 167 ? 7.935   70.804  2.793   1.00 27.83  ? 285 GLN A CG  1 
ATOM   995  C CD  . GLN A 1 167 ? 8.595   71.097  1.457   1.00 36.31  ? 285 GLN A CD  1 
ATOM   996  O OE1 . GLN A 1 167 ? 9.362   70.290  0.943   1.00 35.63  ? 285 GLN A OE1 1 
ATOM   997  N NE2 . GLN A 1 167 ? 8.275   72.241  0.874   1.00 38.50  ? 285 GLN A NE2 1 
ATOM   998  N N   . LEU A 1 168 ? 5.260   67.042  2.453   1.00 26.71  ? 286 LEU A N   1 
ATOM   999  C CA  . LEU A 1 168 ? 4.919   65.622  2.407   1.00 22.26  ? 286 LEU A CA  1 
ATOM   1000 C C   . LEU A 1 168 ? 4.425   65.226  1.023   1.00 23.28  ? 286 LEU A C   1 
ATOM   1001 O O   . LEU A 1 168 ? 4.796   64.166  0.504   1.00 23.27  ? 286 LEU A O   1 
ATOM   1002 C CB  . LEU A 1 168 ? 3.864   65.300  3.470   1.00 22.37  ? 286 LEU A CB  1 
ATOM   1003 C CG  . LEU A 1 168 ? 4.406   65.448  4.888   1.00 24.85  ? 286 LEU A CG  1 
ATOM   1004 C CD1 . LEU A 1 168 ? 3.273   65.366  5.949   1.00 23.72  ? 286 LEU A CD1 1 
ATOM   1005 C CD2 . LEU A 1 168 ? 5.474   64.354  5.148   1.00 23.88  ? 286 LEU A CD2 1 
ATOM   1006 N N   . ARG A 1 169 ? 3.568   66.060  0.409   1.00 20.72  ? 287 ARG A N   1 
ATOM   1007 C CA  . ARG A 1 169 ? 3.139   65.764  -0.956  1.00 18.45  ? 287 ARG A CA  1 
ATOM   1008 C C   . ARG A 1 169 ? 4.309   65.842  -1.935  1.00 19.57  ? 287 ARG A C   1 
ATOM   1009 O O   . ARG A 1 169 ? 4.430   64.990  -2.830  1.00 22.42  ? 287 ARG A O   1 
ATOM   1010 C CB  . ARG A 1 169 ? 2.020   66.735  -1.389  1.00 20.45  ? 287 ARG A CB  1 
ATOM   1011 C CG  . ARG A 1 169 ? 0.691   66.376  -0.716  1.00 23.73  ? 287 ARG A CG  1 
ATOM   1012 C CD  . ARG A 1 169 ? -0.485  67.222  -1.265  1.00 23.46  ? 287 ARG A CD  1 
ATOM   1013 N NE  . ARG A 1 169 ? -1.777  66.617  -0.881  1.00 24.80  ? 287 ARG A NE  1 
ATOM   1014 C CZ  . ARG A 1 169 ? -2.953  67.050  -1.336  1.00 25.82  ? 287 ARG A CZ  1 
ATOM   1015 N NH1 . ARG A 1 169 ? -2.983  68.075  -2.174  1.00 24.23  ? 287 ARG A NH1 1 
ATOM   1016 N NH2 . ARG A 1 169 ? -4.088  66.424  -0.999  1.00 24.80  ? 287 ARG A NH2 1 
ATOM   1017 N N   . PHE A 1 170 ? 5.168   66.859  -1.806  1.00 21.13  ? 288 PHE A N   1 
ATOM   1018 C CA  . PHE A 1 170 ? 6.321   66.925  -2.709  1.00 21.29  ? 288 PHE A CA  1 
ATOM   1019 C C   . PHE A 1 170 ? 7.219   65.715  -2.563  1.00 22.04  ? 288 PHE A C   1 
ATOM   1020 O O   . PHE A 1 170 ? 7.864   65.279  -3.537  1.00 24.47  ? 288 PHE A O   1 
ATOM   1021 C CB  . PHE A 1 170 ? 7.170   68.175  -2.448  1.00 26.13  ? 288 PHE A CB  1 
ATOM   1022 C CG  . PHE A 1 170 ? 6.726   69.346  -3.234  1.00 29.76  ? 288 PHE A CG  1 
ATOM   1023 C CD1 . PHE A 1 170 ? 6.447   69.218  -4.581  1.00 33.34  ? 288 PHE A CD1 1 
ATOM   1024 C CD2 . PHE A 1 170 ? 6.578   70.586  -2.616  1.00 34.32  ? 288 PHE A CD2 1 
ATOM   1025 C CE1 . PHE A 1 170 ? 6.035   70.303  -5.279  1.00 34.91  ? 288 PHE A CE1 1 
ATOM   1026 C CE2 . PHE A 1 170 ? 6.163   71.682  -3.329  1.00 43.65  ? 288 PHE A CE2 1 
ATOM   1027 C CZ  . PHE A 1 170 ? 5.908   71.539  -4.639  1.00 35.26  ? 288 PHE A CZ  1 
ATOM   1028 N N   . ASN A 1 171 ? 7.319   65.165  -1.357  1.00 22.46  ? 289 ASN A N   1 
ATOM   1029 C CA  . ASN A 1 171 ? 8.194   64.000  -1.218  1.00 21.75  ? 289 ASN A CA  1 
ATOM   1030 C C   . ASN A 1 171 ? 7.726   62.844  -2.076  1.00 20.85  ? 289 ASN A C   1 
ATOM   1031 O O   . ASN A 1 171 ? 8.547   62.063  -2.585  1.00 24.25  ? 289 ASN A O   1 
ATOM   1032 C CB  . ASN A 1 171 ? 8.290   63.542  0.239   1.00 25.44  ? 289 ASN A CB  1 
ATOM   1033 C CG  . ASN A 1 171 ? 9.471   62.601  0.443   1.00 27.97  ? 289 ASN A CG  1 
ATOM   1034 O OD1 . ASN A 1 171 ? 10.640  63.021  0.319   1.00 28.36  ? 289 ASN A OD1 1 
ATOM   1035 N ND2 . ASN A 1 171 ? 9.186   61.327  0.707   1.00 21.82  ? 289 ASN A ND2 1 
ATOM   1036 N N   . THR A 1 172 ? 6.415   62.723  -2.288  1.00 24.32  ? 290 THR A N   1 
ATOM   1037 C CA  . THR A 1 172 ? 5.954   61.609  -3.087  1.00 24.68  ? 290 THR A CA  1 
ATOM   1038 C C   . THR A 1 172 ? 6.306   61.759  -4.556  1.00 26.43  ? 290 THR A C   1 
ATOM   1039 O O   . THR A 1 172 ? 6.245   60.768  -5.284  1.00 26.44  ? 290 THR A O   1 
ATOM   1040 C CB  . THR A 1 172 ? 4.438   61.410  -2.927  1.00 25.36  ? 290 THR A CB  1 
ATOM   1041 O OG1 . THR A 1 172 ? 3.746   62.501  -3.550  1.00 22.91  ? 290 THR A OG1 1 
ATOM   1042 C CG2 . THR A 1 172 ? 4.050   61.355  -1.439  1.00 26.47  ? 290 THR A CG2 1 
ATOM   1043 N N   . VAL A 1 173 ? 6.670   62.951  -5.026  1.00 24.76  ? 291 VAL A N   1 
ATOM   1044 C CA  . VAL A 1 173 ? 7.121   63.090  -6.406  1.00 21.97  ? 291 VAL A CA  1 
ATOM   1045 C C   . VAL A 1 173 ? 8.624   63.301  -6.474  1.00 29.58  ? 291 VAL A C   1 
ATOM   1046 O O   . VAL A 1 173 ? 9.163   63.576  -7.555  1.00 28.85  ? 291 VAL A O   1 
ATOM   1047 C CB  . VAL A 1 173 ? 6.377   64.208  -7.153  1.00 23.33  ? 291 VAL A CB  1 
ATOM   1048 C CG1 . VAL A 1 173 ? 4.870   63.932  -7.154  1.00 27.23  ? 291 VAL A CG1 1 
ATOM   1049 C CG2 . VAL A 1 173 ? 6.704   65.565  -6.552  1.00 24.27  ? 291 VAL A CG2 1 
ATOM   1050 N N   . PHE A 1 174 ? 9.314   63.188  -5.341  1.00 25.61  ? 292 PHE A N   1 
ATOM   1051 C CA  . PHE A 1 174 ? 10.770  63.313  -5.305  1.00 23.08  ? 292 PHE A CA  1 
ATOM   1052 C C   . PHE A 1 174 ? 11.414  62.052  -5.841  1.00 31.63  ? 292 PHE A C   1 
ATOM   1053 O O   . PHE A 1 174 ? 11.013  60.946  -5.486  1.00 32.33  ? 292 PHE A O   1 
ATOM   1054 C CB  . PHE A 1 174 ? 11.249  63.577  -3.876  1.00 23.71  ? 292 PHE A CB  1 
ATOM   1055 C CG  . PHE A 1 174 ? 12.728  63.822  -3.767  1.00 33.02  ? 292 PHE A CG  1 
ATOM   1056 C CD1 . PHE A 1 174 ? 13.317  64.895  -4.438  1.00 34.31  ? 292 PHE A CD1 1 
ATOM   1057 C CD2 . PHE A 1 174 ? 13.529  63.007  -2.974  1.00 31.04  ? 292 PHE A CD2 1 
ATOM   1058 C CE1 . PHE A 1 174 ? 14.683  65.143  -4.328  1.00 34.59  ? 292 PHE A CE1 1 
ATOM   1059 C CE2 . PHE A 1 174 ? 14.909  63.250  -2.863  1.00 33.03  ? 292 PHE A CE2 1 
ATOM   1060 C CZ  . PHE A 1 174 ? 15.476  64.313  -3.547  1.00 31.90  ? 292 PHE A CZ  1 
ATOM   1061 N N   . ASN A 1 175 ? 12.393  62.221  -6.718  1.00 28.54  ? 293 ASN A N   1 
ATOM   1062 C CA  . ASN A 1 175 ? 13.185  61.115  -7.258  1.00 39.85  ? 293 ASN A CA  1 
ATOM   1063 C C   . ASN A 1 175 ? 14.552  61.207  -6.601  1.00 36.61  ? 293 ASN A C   1 
ATOM   1064 O O   . ASN A 1 175 ? 15.337  62.112  -6.903  1.00 37.43  ? 293 ASN A O   1 
ATOM   1065 C CB  . ASN A 1 175 ? 13.263  61.187  -8.791  1.00 38.94  ? 293 ASN A CB  1 
ATOM   1066 C CG  . ASN A 1 175 ? 14.010  60.007  -9.406  1.00 47.30  ? 293 ASN A CG  1 
ATOM   1067 O OD1 . ASN A 1 175 ? 14.984  59.500  -8.837  1.00 41.88  ? 293 ASN A OD1 1 
ATOM   1068 N ND2 . ASN A 1 175 ? 13.536  59.547  -10.558 1.00 45.76  ? 293 ASN A ND2 1 
ATOM   1069 N N   . ALA A 1 176 ? 14.824  60.303  -5.666  1.00 34.19  ? 294 ALA A N   1 
ATOM   1070 C CA  . ALA A 1 176 ? 16.073  60.433  -4.931  1.00 40.14  ? 294 ALA A CA  1 
ATOM   1071 C C   . ALA A 1 176 ? 17.273  59.987  -5.765  1.00 44.62  ? 294 ALA A C   1 
ATOM   1072 O O   . ALA A 1 176 ? 18.403  60.345  -5.435  1.00 43.71  ? 294 ALA A O   1 
ATOM   1073 C CB  . ALA A 1 176 ? 15.996  59.649  -3.618  1.00 39.14  ? 294 ALA A CB  1 
ATOM   1074 N N   . GLU A 1 177 ? 17.051  59.241  -6.848  1.00 42.02  ? 295 GLU A N   1 
ATOM   1075 C CA  . GLU A 1 177 ? 18.168  58.838  -7.700  1.00 49.29  ? 295 GLU A CA  1 
ATOM   1076 C C   . GLU A 1 177 ? 18.678  59.985  -8.560  1.00 52.66  ? 295 GLU A C   1 
ATOM   1077 O O   . GLU A 1 177 ? 19.884  60.079  -8.811  1.00 51.09  ? 295 GLU A O   1 
ATOM   1078 C CB  . GLU A 1 177 ? 17.753  57.659  -8.574  1.00 50.16  ? 295 GLU A CB  1 
ATOM   1079 C CG  . GLU A 1 177 ? 17.649  56.346  -7.802  1.00 55.19  ? 295 GLU A CG  1 
ATOM   1080 C CD  . GLU A 1 177 ? 16.380  56.258  -6.958  1.00 73.66  ? 295 GLU A CD  1 
ATOM   1081 O OE1 . GLU A 1 177 ? 16.484  55.979  -5.738  1.00 69.90  ? 295 GLU A OE1 1 
ATOM   1082 O OE2 . GLU A 1 177 ? 15.277  56.490  -7.509  1.00 70.61  ? 295 GLU A OE2 1 
ATOM   1083 N N   . THR A 1 178 ? 17.797  60.882  -8.990  1.00 46.14  ? 296 THR A N   1 
ATOM   1084 C CA  . THR A 1 178 ? 18.190  62.031  -9.792  1.00 43.32  ? 296 THR A CA  1 
ATOM   1085 C C   . THR A 1 178 ? 18.126  63.357  -9.048  1.00 49.55  ? 296 THR A C   1 
ATOM   1086 O O   . THR A 1 178 ? 18.450  64.392  -9.640  1.00 52.48  ? 296 THR A O   1 
ATOM   1087 C CB  . THR A 1 178 ? 17.322  62.088  -11.048 1.00 52.16  ? 296 THR A CB  1 
ATOM   1088 O OG1 . THR A 1 178 ? 16.014  62.578  -10.707 1.00 44.84  ? 296 THR A OG1 1 
ATOM   1089 C CG2 . THR A 1 178 ? 17.207  60.694  -11.646 1.00 52.79  ? 296 THR A CG2 1 
ATOM   1090 N N   . GLY A 1 179 ? 17.737  63.366  -7.772  1.00 36.07  ? 297 GLY A N   1 
ATOM   1091 C CA  . GLY A 1 179 ? 17.628  64.619  -7.047  1.00 34.23  ? 297 GLY A CA  1 
ATOM   1092 C C   . GLY A 1 179 ? 16.638  65.575  -7.702  1.00 37.47  ? 297 GLY A C   1 
ATOM   1093 O O   . GLY A 1 179 ? 16.905  66.774  -7.799  1.00 36.70  ? 297 GLY A O   1 
ATOM   1094 N N   . THR A 1 180 ? 15.483  65.060  -8.126  1.00 35.83  ? 298 THR A N   1 
ATOM   1095 C CA  . THR A 1 180 ? 14.523  65.831  -8.915  1.00 35.10  ? 298 THR A CA  1 
ATOM   1096 C C   . THR A 1 180 ? 13.101  65.650  -8.382  1.00 32.24  ? 298 THR A C   1 
ATOM   1097 O O   . THR A 1 180 ? 12.676  64.518  -8.137  1.00 32.75  ? 298 THR A O   1 
ATOM   1098 C CB  . THR A 1 180 ? 14.609  65.387  -10.381 1.00 43.53  ? 298 THR A CB  1 
ATOM   1099 O OG1 . THR A 1 180 ? 15.914  65.721  -10.872 1.00 42.82  ? 298 THR A OG1 1 
ATOM   1100 C CG2 . THR A 1 180 ? 13.563  66.070  -11.245 1.00 37.38  ? 298 THR A CG2 1 
ATOM   1101 N N   . TRP A 1 181 ? 12.373  66.758  -8.191  1.00 28.20  ? 299 TRP A N   1 
ATOM   1102 C CA  . TRP A 1 181 ? 10.932  66.693  -7.924  1.00 26.06  ? 299 TRP A CA  1 
ATOM   1103 C C   . TRP A 1 181 ? 10.205  66.743  -9.259  1.00 31.42  ? 299 TRP A C   1 
ATOM   1104 O O   . TRP A 1 181 ? 10.282  67.747  -9.977  1.00 30.37  ? 299 TRP A O   1 
ATOM   1105 C CB  . TRP A 1 181 ? 10.499  67.840  -7.029  1.00 23.75  ? 299 TRP A CB  1 
ATOM   1106 C CG  . TRP A 1 181 ? 10.981  67.724  -5.651  1.00 32.86  ? 299 TRP A CG  1 
ATOM   1107 C CD1 . TRP A 1 181 ? 10.352  67.092  -4.594  1.00 27.87  ? 299 TRP A CD1 1 
ATOM   1108 C CD2 . TRP A 1 181 ? 12.222  68.219  -5.148  1.00 29.37  ? 299 TRP A CD2 1 
ATOM   1109 N NE1 . TRP A 1 181 ? 11.127  67.209  -3.454  1.00 28.09  ? 299 TRP A NE1 1 
ATOM   1110 C CE2 . TRP A 1 181 ? 12.282  67.884  -3.773  1.00 34.94  ? 299 TRP A CE2 1 
ATOM   1111 C CE3 . TRP A 1 181 ? 13.291  68.927  -5.726  1.00 34.55  ? 299 TRP A CE3 1 
ATOM   1112 C CZ2 . TRP A 1 181 ? 13.368  68.238  -2.968  1.00 34.35  ? 299 TRP A CZ2 1 
ATOM   1113 C CZ3 . TRP A 1 181 ? 14.370  69.275  -4.924  1.00 35.74  ? 299 TRP A CZ3 1 
ATOM   1114 C CH2 . TRP A 1 181 ? 14.401  68.923  -3.565  1.00 35.90  ? 299 TRP A CH2 1 
ATOM   1115 N N   . GLU A 1 182 ? 9.498   65.666  -9.589  1.00 29.46  ? 300 GLU A N   1 
ATOM   1116 C CA  . GLU A 1 182 ? 8.853   65.513  -10.890 1.00 33.52  ? 300 GLU A CA  1 
ATOM   1117 C C   . GLU A 1 182 ? 7.389   65.876  -10.806 1.00 36.85  ? 300 GLU A C   1 
ATOM   1118 O O   . GLU A 1 182 ? 6.544   65.090  -10.379 1.00 32.04  ? 300 GLU A O   1 
ATOM   1119 C CB  . GLU A 1 182 ? 9.130   64.123  -11.426 1.00 36.67  ? 300 GLU A CB  1 
ATOM   1120 C CG  . GLU A 1 182 ? 10.617  64.097  -11.415 1.00 49.44  ? 300 GLU A CG  1 
ATOM   1121 C CD  . GLU A 1 182 ? 11.286  62.860  -11.872 1.00 72.64  ? 300 GLU A CD  1 
ATOM   1122 O OE1 . GLU A 1 182 ? 12.530  62.886  -11.820 1.00 94.79  ? 300 GLU A OE1 1 
ATOM   1123 O OE2 . GLU A 1 182 ? 10.620  61.848  -12.149 1.00 75.09  ? 300 GLU A OE2 1 
ATOM   1124 N N   . CYS A 1 183 ? 7.102   67.086  -11.249 1.00 29.02  ? 301 CYS A N   1 
ATOM   1125 C CA  . CYS A 1 183 ? 5.777   67.637  -11.069 1.00 31.89  ? 301 CYS A CA  1 
ATOM   1126 C C   . CYS A 1 183 ? 5.079   67.656  -12.414 1.00 36.46  ? 301 CYS A C   1 
ATOM   1127 O O   . CYS A 1 183 ? 4.833   68.725  -12.975 1.00 31.96  ? 301 CYS A O   1 
ATOM   1128 C CB  . CYS A 1 183 ? 5.878   69.023  -10.448 1.00 26.60  ? 301 CYS A CB  1 
ATOM   1129 S SG  . CYS A 1 183 ? 6.746   69.048  -8.845  1.00 29.36  ? 301 CYS A SG  1 
ATOM   1130 N N   . GLY A 1 184 ? 4.774   66.470  -12.938 1.00 33.14  ? 302 GLY A N   1 
ATOM   1131 C CA  . GLY A 1 184 ? 4.134   66.360  -14.227 1.00 40.19  ? 302 GLY A CA  1 
ATOM   1132 C C   . GLY A 1 184 ? 5.070   66.864  -15.305 1.00 41.74  ? 302 GLY A C   1 
ATOM   1133 O O   . GLY A 1 184 ? 6.156   66.317  -15.491 1.00 40.02  ? 302 GLY A O   1 
ATOM   1134 N N   . ARG A 1 185 ? 4.682   67.932  -15.988 1.00 41.39  ? 303 ARG A N   1 
ATOM   1135 C CA  . ARG A 1 185 ? 5.497   68.477  -17.063 1.00 42.13  ? 303 ARG A CA  1 
ATOM   1136 C C   . ARG A 1 185 ? 6.570   69.439  -16.576 1.00 43.83  ? 303 ARG A C   1 
ATOM   1137 O O   . ARG A 1 185 ? 7.397   69.881  -17.384 1.00 38.95  ? 303 ARG A O   1 
ATOM   1138 C CB  . ARG A 1 185 ? 4.594   69.158  -18.090 1.00 42.91  ? 303 ARG A CB  1 
ATOM   1139 C CG  . ARG A 1 185 ? 4.103   70.528  -17.693 1.00 52.61  ? 303 ARG A CG  1 
ATOM   1140 N N   . LEU A 1 186 ? 6.580   69.772  -15.289 1.00 36.32  ? 304 LEU A N   1 
ATOM   1141 C CA  . LEU A 1 186 ? 7.628   70.578  -14.685 1.00 31.80  ? 304 LEU A CA  1 
ATOM   1142 C C   . LEU A 1 186 ? 8.527   69.650  -13.886 1.00 43.92  ? 304 LEU A C   1 
ATOM   1143 O O   . LEU A 1 186 ? 8.040   68.734  -13.213 1.00 36.56  ? 304 LEU A O   1 
ATOM   1144 C CB  . LEU A 1 186 ? 7.068   71.644  -13.742 1.00 29.09  ? 304 LEU A CB  1 
ATOM   1145 C CG  . LEU A 1 186 ? 6.270   72.794  -14.353 1.00 44.81  ? 304 LEU A CG  1 
ATOM   1146 C CD1 . LEU A 1 186 ? 4.878   72.310  -14.731 1.00 55.31  ? 304 LEU A CD1 1 
ATOM   1147 C CD2 . LEU A 1 186 ? 6.152   73.926  -13.381 1.00 41.21  ? 304 LEU A CD2 1 
ATOM   1148 N N   . SER A 1 187 ? 9.829   69.894  -13.947 1.00 34.79  ? 305 SER A N   1 
ATOM   1149 C CA  . SER A 1 187 ? 10.803  69.172  -13.136 1.00 35.08  ? 305 SER A CA  1 
ATOM   1150 C C   . SER A 1 187 ? 11.709  70.177  -12.440 1.00 42.15  ? 305 SER A C   1 
ATOM   1151 O O   . SER A 1 187 ? 12.134  71.168  -13.044 1.00 37.42  ? 305 SER A O   1 
ATOM   1152 C CB  . SER A 1 187 ? 11.664  68.238  -13.985 1.00 39.38  ? 305 SER A CB  1 
ATOM   1153 O OG  . SER A 1 187 ? 10.910  67.172  -14.507 1.00 42.21  ? 305 SER A OG  1 
ATOM   1154 N N   . TYR A 1 188 ? 12.027  69.922  -11.180 1.00 28.09  ? 306 TYR A N   1 
ATOM   1155 C CA  . TYR A 1 188 ? 12.928  70.783  -10.416 1.00 30.05  ? 306 TYR A CA  1 
ATOM   1156 C C   . TYR A 1 188 ? 14.106  69.925  -9.989  1.00 41.95  ? 306 TYR A C   1 
ATOM   1157 O O   . TYR A 1 188 ? 13.930  68.979  -9.218  1.00 32.71  ? 306 TYR A O   1 
ATOM   1158 C CB  . TYR A 1 188 ? 12.216  71.371  -9.211  1.00 35.57  ? 306 TYR A CB  1 
ATOM   1159 C CG  . TYR A 1 188 ? 10.980  72.176  -9.544  1.00 36.43  ? 306 TYR A CG  1 
ATOM   1160 C CD1 . TYR A 1 188 ? 11.062  73.527  -9.838  1.00 34.51  ? 306 TYR A CD1 1 
ATOM   1161 C CD2 . TYR A 1 188 ? 9.738   71.551  -9.665  1.00 40.33  ? 306 TYR A CD2 1 
ATOM   1162 C CE1 . TYR A 1 188 ? 9.908   74.262  -10.146 1.00 41.67  ? 306 TYR A CE1 1 
ATOM   1163 C CE2 . TYR A 1 188 ? 8.598   72.269  -9.964  1.00 39.52  ? 306 TYR A CE2 1 
ATOM   1164 C CZ  . TYR A 1 188 ? 8.685   73.613  -10.216 1.00 36.58  ? 306 TYR A CZ  1 
ATOM   1165 O OH  . TYR A 1 188 ? 7.528   74.295  -10.524 1.00 31.67  ? 306 TYR A OH  1 
ATOM   1166 N N   . CYS A 1 189 ? 15.296  70.228  -10.496 1.00 40.97  ? 307 CYS A N   1 
ATOM   1167 C CA  . CYS A 1 189 ? 16.445  69.347  -10.322 1.00 40.56  ? 307 CYS A CA  1 
ATOM   1168 C C   . CYS A 1 189 ? 17.498  70.061  -9.488  1.00 45.11  ? 307 CYS A C   1 
ATOM   1169 O O   . CYS A 1 189 ? 17.829  71.219  -9.754  1.00 40.11  ? 307 CYS A O   1 
ATOM   1170 C CB  . CYS A 1 189 ? 17.012  68.921  -11.678 1.00 49.49  ? 307 CYS A CB  1 
ATOM   1171 S SG  . CYS A 1 189 ? 18.417  67.774  -11.585 1.00 54.52  ? 307 CYS A SG  1 
ATOM   1172 N N   . LEU A 1 190 ? 18.001  69.381  -8.463  1.00 44.64  ? 308 LEU A N   1 
ATOM   1173 C CA  . LEU A 1 190 ? 19.018  69.978  -7.609  1.00 49.01  ? 308 LEU A CA  1 
ATOM   1174 C C   . LEU A 1 190 ? 20.309  70.167  -8.393  1.00 55.50  ? 308 LEU A C   1 
ATOM   1175 O O   . LEU A 1 190 ? 20.773  69.243  -9.070  1.00 47.01  ? 308 LEU A O   1 
ATOM   1176 C CB  . LEU A 1 190 ? 19.265  69.099  -6.385  1.00 50.71  ? 308 LEU A CB  1 
ATOM   1177 C CG  . LEU A 1 190 ? 18.145  69.102  -5.352  1.00 47.16  ? 308 LEU A CG  1 
ATOM   1178 C CD1 . LEU A 1 190 ? 18.346  67.987  -4.333  1.00 51.16  ? 308 LEU A CD1 1 
ATOM   1179 C CD2 . LEU A 1 190 ? 18.108  70.458  -4.671  1.00 46.48  ? 308 LEU A CD2 1 
ATOM   1180 N N   . GLU A 1 191 ? 20.862  71.376  -8.334  1.00 57.14  ? 309 GLU A N   1 
ATOM   1181 C CA  . GLU A 1 191 ? 22.174  71.626  -8.913  1.00 75.51  ? 309 GLU A CA  1 
ATOM   1182 C C   . GLU A 1 191 ? 23.230  70.822  -8.162  1.00 78.86  ? 309 GLU A C   1 
ATOM   1183 O O   . GLU A 1 191 ? 23.155  70.667  -6.941  1.00 81.65  ? 309 GLU A O   1 
ATOM   1184 C CB  . GLU A 1 191 ? 22.514  73.118  -8.844  1.00 74.73  ? 309 GLU A CB  1 
ATOM   1185 C CG  . GLU A 1 191 ? 21.641  74.062  -9.682  1.00 73.11  ? 309 GLU A CG  1 
ATOM   1186 C CD  . GLU A 1 191 ? 21.802  73.873  -11.194 1.00 80.49  ? 309 GLU A CD  1 
ATOM   1187 O OE1 . GLU A 1 191 ? 22.824  73.313  -11.641 1.00 93.16  ? 309 GLU A OE1 1 
ATOM   1188 O OE2 . GLU A 1 191 ? 20.916  74.329  -11.946 1.00 80.19  ? 309 GLU A OE2 1 
ATOM   1189 N N   . ASP A 1 192 ? 24.218  70.308  -8.888  1.00 88.87  ? 310 ASP A N   1 
ATOM   1190 C CA  . ASP A 1 192 ? 25.300  69.557  -8.244  1.00 87.21  ? 310 ASP A CA  1 
ATOM   1191 C C   . ASP A 1 192 ? 26.495  70.460  -7.926  1.00 83.27  ? 310 ASP A C   1 
ATOM   1192 O O   . ASP A 1 192 ? 26.360  71.473  -7.231  1.00 79.08  ? 310 ASP A O   1 
ATOM   1193 C CB  . ASP A 1 192 ? 25.741  68.385  -9.124  1.00 79.10  ? 310 ASP A CB  1 
ATOM   1194 N N   . GLY A 1 196 ? 29.611  67.032  -2.587  1.00 89.95  ? 314 GLY A N   1 
ATOM   1195 C CA  . GLY A 1 196 ? 28.572  66.673  -3.536  1.00 81.96  ? 314 GLY A CA  1 
ATOM   1196 C C   . GLY A 1 196 ? 27.252  66.367  -2.860  1.00 83.25  ? 314 GLY A C   1 
ATOM   1197 O O   . GLY A 1 196 ? 26.657  67.247  -2.233  1.00 78.31  ? 314 GLY A O   1 
ATOM   1198 N N   . PHE A 1 197 ? 26.798  65.114  -2.992  1.00 87.80  ? 315 PHE A N   1 
ATOM   1199 C CA  . PHE A 1 197 ? 25.562  64.689  -2.337  1.00 85.94  ? 315 PHE A CA  1 
ATOM   1200 C C   . PHE A 1 197 ? 25.661  64.834  -0.824  1.00 90.48  ? 315 PHE A C   1 
ATOM   1201 O O   . PHE A 1 197 ? 24.694  65.239  -0.168  1.00 85.23  ? 315 PHE A O   1 
ATOM   1202 C CB  . PHE A 1 197 ? 25.230  63.242  -2.713  1.00 77.66  ? 315 PHE A CB  1 
ATOM   1203 N N   . GLN A 1 198 ? 26.825  64.507  -0.249  1.00 96.65  ? 316 GLN A N   1 
ATOM   1204 C CA  . GLN A 1 198 ? 27.006  64.661  1.192   1.00 88.09  ? 316 GLN A CA  1 
ATOM   1205 C C   . GLN A 1 198 ? 26.930  66.124  1.614   1.00 78.49  ? 316 GLN A C   1 
ATOM   1206 O O   . GLN A 1 198 ? 26.544  66.420  2.751   1.00 81.12  ? 316 GLN A O   1 
ATOM   1207 C CB  . GLN A 1 198 ? 28.338  64.048  1.631   1.00 75.97  ? 316 GLN A CB  1 
ATOM   1208 N N   . GLN A 1 199 ? 27.285  67.052  0.720   1.00 79.14  ? 317 GLN A N   1 
ATOM   1209 C CA  . GLN A 1 199 ? 27.159  68.476  1.020   1.00 81.71  ? 317 GLN A CA  1 
ATOM   1210 C C   . GLN A 1 199 ? 25.730  68.988  0.869   1.00 82.70  ? 317 GLN A C   1 
ATOM   1211 O O   . GLN A 1 199 ? 25.401  70.037  1.438   1.00 71.90  ? 317 GLN A O   1 
ATOM   1212 C CB  . GLN A 1 199 ? 28.092  69.299  0.124   1.00 90.60  ? 317 GLN A CB  1 
ATOM   1213 C CG  . GLN A 1 199 ? 28.675  70.537  0.798   1.00 70.14  ? 317 GLN A CG  1 
ATOM   1214 N N   . LEU A 1 200 ? 24.883  68.277  0.111   1.00 85.35  ? 318 LEU A N   1 
ATOM   1215 C CA  . LEU A 1 200 ? 23.478  68.652  -0.016  1.00 75.21  ? 318 LEU A CA  1 
ATOM   1216 C C   . LEU A 1 200 ? 22.674  68.233  1.209   1.00 66.71  ? 318 LEU A C   1 
ATOM   1217 O O   . LEU A 1 200 ? 21.785  68.972  1.648   1.00 66.85  ? 318 LEU A O   1 
ATOM   1218 C CB  . LEU A 1 200 ? 22.879  68.035  -1.283  1.00 76.94  ? 318 LEU A CB  1 
ATOM   1219 N N   . LEU A 1 201 ? 22.975  67.058  1.777   1.00 62.45  ? 319 LEU A N   1 
ATOM   1220 C CA  . LEU A 1 201 ? 22.288  66.597  2.981   1.00 61.59  ? 319 LEU A CA  1 
ATOM   1221 C C   . LEU A 1 201 ? 22.526  67.509  4.177   1.00 62.06  ? 319 LEU A C   1 
ATOM   1222 O O   . LEU A 1 201 ? 21.874  67.325  5.214   1.00 63.10  ? 319 LEU A O   1 
ATOM   1223 C CB  . LEU A 1 201 ? 22.731  65.177  3.343   1.00 73.75  ? 319 LEU A CB  1 
ATOM   1224 C CG  . LEU A 1 201 ? 22.546  64.068  2.307   1.00 80.16  ? 319 LEU A CG  1 
ATOM   1225 C CD1 . LEU A 1 201 ? 23.081  62.737  2.851   1.00 72.58  ? 319 LEU A CD1 1 
ATOM   1226 C CD2 . LEU A 1 201 ? 21.089  63.959  1.875   1.00 57.03  ? 319 LEU A CD2 1 
ATOM   1227 N N   . LEU A 1 202 ? 23.450  68.469  4.072   1.00 56.41  ? 320 LEU A N   1 
ATOM   1228 C CA  . LEU A 1 202 ? 23.623  69.433  5.151   1.00 52.31  ? 320 LEU A CA  1 
ATOM   1229 C C   . LEU A 1 202 ? 22.437  70.383  5.242   1.00 53.04  ? 320 LEU A C   1 
ATOM   1230 O O   . LEU A 1 202 ? 22.119  70.862  6.335   1.00 48.43  ? 320 LEU A O   1 
ATOM   1231 C CB  . LEU A 1 202 ? 24.926  70.210  4.963   1.00 56.12  ? 320 LEU A CB  1 
ATOM   1232 C CG  . LEU A 1 202 ? 26.218  69.410  5.198   1.00 58.77  ? 320 LEU A CG  1 
ATOM   1233 C CD1 . LEU A 1 202 ? 27.421  70.334  5.252   1.00 54.29  ? 320 LEU A CD1 1 
ATOM   1234 C CD2 . LEU A 1 202 ? 26.143  68.550  6.463   1.00 57.49  ? 320 LEU A CD2 1 
ATOM   1235 N N   A GLU A 1 203 ? 21.779  70.658  4.122   0.45 51.82  ? 321 GLU A N   1 
ATOM   1236 N N   B GLU A 1 203 ? 21.775  70.672  4.122   0.55 51.81  ? 321 GLU A N   1 
ATOM   1237 C CA  A GLU A 1 203 ? 20.584  71.497  4.123   0.45 54.46  ? 321 GLU A CA  1 
ATOM   1238 C CA  B GLU A 1 203 ? 20.596  71.537  4.153   0.55 54.47  ? 321 GLU A CA  1 
ATOM   1239 C C   A GLU A 1 203 ? 19.422  70.712  4.714   0.45 47.10  ? 321 GLU A C   1 
ATOM   1240 C C   B GLU A 1 203 ? 19.414  70.746  4.699   0.55 47.10  ? 321 GLU A C   1 
ATOM   1241 O O   A GLU A 1 203 ? 19.052  69.672  4.155   0.45 45.12  ? 321 GLU A O   1 
ATOM   1242 O O   B GLU A 1 203 ? 19.027  69.742  4.094   0.55 45.09  ? 321 GLU A O   1 
ATOM   1243 C CB  A GLU A 1 203 ? 20.257  71.951  2.705   0.45 53.26  ? 321 GLU A CB  1 
ATOM   1244 C CB  B GLU A 1 203 ? 20.282  72.081  2.764   0.55 53.26  ? 321 GLU A CB  1 
ATOM   1245 C CG  A GLU A 1 203 ? 19.144  72.974  2.634   0.45 58.27  ? 321 GLU A CG  1 
ATOM   1246 C CG  B GLU A 1 203 ? 18.888  72.698  2.611   0.55 57.35  ? 321 GLU A CG  1 
ATOM   1247 C CD  A GLU A 1 203 ? 19.424  74.181  3.507   0.45 65.98  ? 321 GLU A CD  1 
ATOM   1248 C CD  B GLU A 1 203 ? 18.581  73.760  3.661   0.55 65.12  ? 321 GLU A CD  1 
ATOM   1249 O OE1 A GLU A 1 203 ? 18.549  74.549  4.323   0.45 66.24  ? 321 GLU A OE1 1 
ATOM   1250 O OE1 B GLU A 1 203 ? 19.426  74.661  3.865   0.55 68.22  ? 321 GLU A OE1 1 
ATOM   1251 O OE2 A GLU A 1 203 ? 20.533  74.749  3.394   0.45 65.79  ? 321 GLU A OE2 1 
ATOM   1252 O OE2 B GLU A 1 203 ? 17.485  73.704  4.269   0.55 61.00  ? 321 GLU A OE2 1 
ATOM   1253 N N   . PRO A 1 204 ? 18.831  71.149  5.832   1.00 42.14  ? 322 PRO A N   1 
ATOM   1254 C CA  . PRO A 1 204 ? 17.826  70.297  6.509   1.00 40.44  ? 322 PRO A CA  1 
ATOM   1255 C C   . PRO A 1 204 ? 16.661  69.870  5.630   1.00 35.27  ? 322 PRO A C   1 
ATOM   1256 O O   . PRO A 1 204 ? 16.200  68.734  5.730   1.00 36.82  ? 322 PRO A O   1 
ATOM   1257 C CB  . PRO A 1 204 ? 17.355  71.185  7.665   1.00 41.46  ? 322 PRO A CB  1 
ATOM   1258 C CG  . PRO A 1 204 ? 18.574  72.047  7.976   1.00 55.55  ? 322 PRO A CG  1 
ATOM   1259 C CD  . PRO A 1 204 ? 19.166  72.351  6.618   1.00 45.06  ? 322 PRO A CD  1 
ATOM   1260 N N   . MET A 1 205 ? 16.213  70.731  4.730   1.00 37.55  ? 323 MET A N   1 
ATOM   1261 C CA  . MET A 1 205 ? 15.082  70.384  3.881   1.00 38.30  ? 323 MET A CA  1 
ATOM   1262 C C   . MET A 1 205 ? 15.445  69.266  2.919   1.00 37.30  ? 323 MET A C   1 
ATOM   1263 O O   . MET A 1 205 ? 14.643  68.360  2.664   1.00 34.34  ? 323 MET A O   1 
ATOM   1264 C CB  . MET A 1 205 ? 14.644  71.618  3.114   1.00 45.06  ? 323 MET A CB  1 
ATOM   1265 C CG  . MET A 1 205 ? 13.756  71.299  1.968   1.00 48.99  ? 323 MET A CG  1 
ATOM   1266 S SD  . MET A 1 205 ? 12.100  71.181  2.636   1.00 65.35  ? 323 MET A SD  1 
ATOM   1267 C CE  . MET A 1 205 ? 11.546  72.837  2.213   1.00 52.90  ? 323 MET A CE  1 
ATOM   1268 N N   . LEU A 1 206 ? 16.651  69.311  2.364   1.00 35.75  ? 324 LEU A N   1 
ATOM   1269 C CA  . LEU A 1 206 ? 17.032  68.290  1.407   1.00 31.28  ? 324 LEU A CA  1 
ATOM   1270 C C   . LEU A 1 206 ? 17.279  66.962  2.096   1.00 35.37  ? 324 LEU A C   1 
ATOM   1271 O O   . LEU A 1 206 ? 16.861  65.915  1.594   1.00 34.18  ? 324 LEU A O   1 
ATOM   1272 C CB  . LEU A 1 206 ? 18.275  68.726  0.629   1.00 40.96  ? 324 LEU A CB  1 
ATOM   1273 C CG  . LEU A 1 206 ? 18.114  69.997  -0.207  1.00 56.61  ? 324 LEU A CG  1 
ATOM   1274 N N   . LYS A 1 207 ? 17.981  66.988  3.230   1.00 34.67  ? 325 LYS A N   1 
ATOM   1275 C CA  . LYS A 1 207 ? 18.162  65.777  4.023   1.00 37.69  ? 325 LYS A CA  1 
ATOM   1276 C C   . LYS A 1 207 ? 16.818  65.156  4.367   1.00 36.35  ? 325 LYS A C   1 
ATOM   1277 O O   . LYS A 1 207 ? 16.650  63.934  4.292   1.00 35.03  ? 325 LYS A O   1 
ATOM   1278 C CB  . LYS A 1 207 ? 18.938  66.103  5.302   1.00 40.77  ? 325 LYS A CB  1 
ATOM   1279 C CG  . LYS A 1 207 ? 19.143  64.930  6.249   1.00 46.94  ? 325 LYS A CG  1 
ATOM   1280 C CD  . LYS A 1 207 ? 20.060  65.298  7.428   1.00 57.45  ? 325 LYS A CD  1 
ATOM   1281 N N   . PHE A 1 208 ? 15.834  65.992  4.709   1.00 33.00  ? 326 PHE A N   1 
ATOM   1282 C CA  . PHE A 1 208 ? 14.503  65.474  5.016   1.00 33.45  ? 326 PHE A CA  1 
ATOM   1283 C C   . PHE A 1 208 ? 13.924  64.697  3.839   1.00 26.61  ? 326 PHE A C   1 
ATOM   1284 O O   . PHE A 1 208 ? 13.401  63.583  4.009   1.00 27.96  ? 326 PHE A O   1 
ATOM   1285 C CB  . PHE A 1 208 ? 13.571  66.625  5.419   1.00 33.32  ? 326 PHE A CB  1 
ATOM   1286 C CG  . PHE A 1 208 ? 12.125  66.209  5.528   1.00 34.89  ? 326 PHE A CG  1 
ATOM   1287 C CD1 . PHE A 1 208 ? 11.647  65.655  6.706   1.00 34.72  ? 326 PHE A CD1 1 
ATOM   1288 C CD2 . PHE A 1 208 ? 11.262  66.330  4.443   1.00 30.16  ? 326 PHE A CD2 1 
ATOM   1289 C CE1 . PHE A 1 208 ? 10.316  65.250  6.810   1.00 28.12  ? 326 PHE A CE1 1 
ATOM   1290 C CE2 . PHE A 1 208 ? 9.931   65.898  4.541   1.00 30.23  ? 326 PHE A CE2 1 
ATOM   1291 C CZ  . PHE A 1 208 ? 9.477   65.370  5.727   1.00 28.09  ? 326 PHE A CZ  1 
ATOM   1292 N N   . HIS A 1 209 ? 14.016  65.251  2.620   1.00 25.18  ? 327 HIS A N   1 
ATOM   1293 C CA  . HIS A 1 209 ? 13.397  64.562  1.492   1.00 27.27  ? 327 HIS A CA  1 
ATOM   1294 C C   . HIS A 1 209 ? 14.105  63.255  1.191   1.00 33.13  ? 327 HIS A C   1 
ATOM   1295 O O   . HIS A 1 209 ? 13.456  62.236  0.913   1.00 26.40  ? 327 HIS A O   1 
ATOM   1296 C CB  . HIS A 1 209 ? 13.357  65.472  0.260   1.00 28.50  ? 327 HIS A CB  1 
ATOM   1297 C CG  . HIS A 1 209 ? 12.196  66.418  0.282   1.00 29.54  ? 327 HIS A CG  1 
ATOM   1298 N ND1 . HIS A 1 209 ? 10.910  66.026  -0.031  1.00 28.22  ? 327 HIS A ND1 1 
ATOM   1299 C CD2 . HIS A 1 209 ? 12.114  67.711  0.658   1.00 28.41  ? 327 HIS A CD2 1 
ATOM   1300 C CE1 . HIS A 1 209 ? 10.091  67.051  0.128   1.00 27.25  ? 327 HIS A CE1 1 
ATOM   1301 N NE2 . HIS A 1 209 ? 10.798  68.090  0.532   1.00 26.35  ? 327 HIS A NE2 1 
ATOM   1302 N N   . TYR A 1 210 ? 15.436  63.246  1.264   1.00 28.33  ? 328 TYR A N   1 
ATOM   1303 C CA  . TYR A 1 210 ? 16.146  61.995  1.025   1.00 26.32  ? 328 TYR A CA  1 
ATOM   1304 C C   . TYR A 1 210 ? 15.825  60.969  2.108   1.00 25.25  ? 328 TYR A C   1 
ATOM   1305 O O   . TYR A 1 210 ? 15.566  59.798  1.803   1.00 27.58  ? 328 TYR A O   1 
ATOM   1306 C CB  . TYR A 1 210 ? 17.655  62.242  0.954   1.00 30.90  ? 328 TYR A CB  1 
ATOM   1307 C CG  . TYR A 1 210 ? 18.113  62.718  -0.398  1.00 34.66  ? 328 TYR A CG  1 
ATOM   1308 C CD1 . TYR A 1 210 ? 18.268  61.830  -1.460  1.00 36.43  ? 328 TYR A CD1 1 
ATOM   1309 C CD2 . TYR A 1 210 ? 18.422  64.062  -0.610  1.00 39.43  ? 328 TYR A CD2 1 
ATOM   1310 C CE1 . TYR A 1 210 ? 18.707  62.270  -2.706  1.00 39.85  ? 328 TYR A CE1 1 
ATOM   1311 C CE2 . TYR A 1 210 ? 18.848  64.511  -1.849  1.00 39.33  ? 328 TYR A CE2 1 
ATOM   1312 C CZ  . TYR A 1 210 ? 18.986  63.613  -2.892  1.00 38.47  ? 328 TYR A CZ  1 
ATOM   1313 O OH  . TYR A 1 210 ? 19.420  64.051  -4.130  1.00 46.94  ? 328 TYR A OH  1 
ATOM   1314 N N   . MET A 1 211 ? 15.852  61.382  3.381   1.00 27.15  ? 329 MET A N   1 
ATOM   1315 C CA  . MET A 1 211 ? 15.636  60.410  4.451   1.00 28.38  ? 329 MET A CA  1 
ATOM   1316 C C   . MET A 1 211 ? 14.208  59.885  4.460   1.00 31.99  ? 329 MET A C   1 
ATOM   1317 O O   . MET A 1 211 ? 13.984  58.702  4.732   1.00 28.10  ? 329 MET A O   1 
ATOM   1318 C CB  . MET A 1 211 ? 15.971  60.994  5.816   1.00 30.33  ? 329 MET A CB  1 
ATOM   1319 C CG  . MET A 1 211 ? 17.464  61.211  6.051   1.00 39.73  ? 329 MET A CG  1 
ATOM   1320 S SD  . MET A 1 211 ? 17.714  62.073  7.616   1.00 63.05  ? 329 MET A SD  1 
ATOM   1321 C CE  . MET A 1 211 ? 16.757  61.048  8.738   1.00 49.17  ? 329 MET A CE  1 
ATOM   1322 N N   . LEU A 1 212 ? 13.224  60.742  4.178   1.00 27.92  ? 330 LEU A N   1 
ATOM   1323 C CA  . LEU A 1 212 ? 11.840  60.255  4.105   1.00 27.52  ? 330 LEU A CA  1 
ATOM   1324 C C   . LEU A 1 212 ? 11.629  59.327  2.908   1.00 29.28  ? 330 LEU A C   1 
ATOM   1325 O O   . LEU A 1 212 ? 10.989  58.272  3.027   1.00 28.27  ? 330 LEU A O   1 
ATOM   1326 C CB  . LEU A 1 212 ? 10.879  61.445  4.066   1.00 24.84  ? 330 LEU A CB  1 
ATOM   1327 C CG  . LEU A 1 212 ? 9.393   61.049  4.089   1.00 26.76  ? 330 LEU A CG  1 
ATOM   1328 C CD1 . LEU A 1 212 ? 9.063   60.178  5.294   1.00 25.64  ? 330 LEU A CD1 1 
ATOM   1329 C CD2 . LEU A 1 212 ? 8.511   62.318  4.042   1.00 23.09  ? 330 LEU A CD2 1 
ATOM   1330 N N   . LYS A 1 213 ? 12.176  59.681  1.751   1.00 24.94  ? 331 LYS A N   1 
ATOM   1331 C CA  . LYS A 1 213 ? 12.033  58.801  0.597   1.00 23.75  ? 331 LYS A CA  1 
ATOM   1332 C C   . LYS A 1 213 ? 12.614  57.419  0.873   1.00 32.60  ? 331 LYS A C   1 
ATOM   1333 O O   . LYS A 1 213 ? 12.072  56.416  0.401   1.00 27.09  ? 331 LYS A O   1 
ATOM   1334 C CB  . LYS A 1 213 ? 12.740  59.399  -0.612  1.00 28.68  ? 331 LYS A CB  1 
ATOM   1335 C CG  . LYS A 1 213 ? 12.309  58.777  -1.926  1.00 35.04  ? 331 LYS A CG  1 
ATOM   1336 C CD  . LYS A 1 213 ? 10.938  59.306  -2.326  1.00 27.13  ? 331 LYS A CD  1 
ATOM   1337 C CE  . LYS A 1 213 ? 10.444  58.640  -3.612  1.00 33.97  ? 331 LYS A CE  1 
ATOM   1338 N NZ  . LYS A 1 213 ? 9.237   59.350  -4.110  1.00 28.33  ? 331 LYS A NZ  1 
ATOM   1339 N N   . LYS A 1 214 ? 13.718  57.355  1.628   1.00 30.84  ? 332 LYS A N   1 
ATOM   1340 C CA  . LYS A 1 214 ? 14.350  56.083  1.970   1.00 37.88  ? 332 LYS A CA  1 
ATOM   1341 C C   . LYS A 1 214 ? 13.446  55.168  2.783   1.00 37.62  ? 332 LYS A C   1 
ATOM   1342 O O   . LYS A 1 214 ? 13.646  53.952  2.776   1.00 35.25  ? 332 LYS A O   1 
ATOM   1343 C CB  . LYS A 1 214 ? 15.645  56.354  2.750   1.00 39.89  ? 332 LYS A CB  1 
ATOM   1344 C CG  . LYS A 1 214 ? 16.706  55.276  2.619   1.00 53.04  ? 332 LYS A CG  1 
ATOM   1345 C CD  . LYS A 1 214 ? 18.093  55.851  2.896   1.00 53.02  ? 332 LYS A CD  1 
ATOM   1346 N N   . LEU A 1 215 ? 12.466  55.707  3.502   1.00 32.63  ? 333 LEU A N   1 
ATOM   1347 C CA  . LEU A 1 215 ? 11.594  54.811  4.251   1.00 27.21  ? 333 LEU A CA  1 
ATOM   1348 C C   . LEU A 1 215 ? 10.655  54.024  3.351   1.00 33.33  ? 333 LEU A C   1 
ATOM   1349 O O   . LEU A 1 215 ? 10.023  53.076  3.830   1.00 33.93  ? 333 LEU A O   1 
ATOM   1350 C CB  . LEU A 1 215 ? 10.795  55.610  5.276   1.00 33.98  ? 333 LEU A CB  1 
ATOM   1351 C CG  . LEU A 1 215 ? 11.645  56.337  6.315   1.00 34.77  ? 333 LEU A CG  1 
ATOM   1352 C CD1 . LEU A 1 215 ? 10.778  57.135  7.275   1.00 31.03  ? 333 LEU A CD1 1 
ATOM   1353 C CD2 . LEU A 1 215 ? 12.549  55.357  7.106   1.00 35.78  ? 333 LEU A CD2 1 
ATOM   1354 N N   . GLN A 1 216 ? 10.512  54.412  2.083   1.00 33.36  ? 334 GLN A N   1 
ATOM   1355 C CA  . GLN A 1 216 ? 9.666   53.697  1.119   1.00 27.95  ? 334 GLN A CA  1 
ATOM   1356 C C   . GLN A 1 216 ? 8.231   53.524  1.631   1.00 30.01  ? 334 GLN A C   1 
ATOM   1357 O O   . GLN A 1 216 ? 7.677   52.428  1.669   1.00 27.00  ? 334 GLN A O   1 
ATOM   1358 C CB  . GLN A 1 216 ? 10.291  52.349  0.745   1.00 40.15  ? 334 GLN A CB  1 
ATOM   1359 C CG  . GLN A 1 216 ? 11.599  52.490  -0.063  1.00 47.82  ? 334 GLN A CG  1 
ATOM   1360 C CD  . GLN A 1 216 ? 12.186  51.138  -0.468  1.00 58.93  ? 334 GLN A CD  1 
ATOM   1361 O OE1 . GLN A 1 216 ? 13.087  50.614  0.192   1.00 65.39  ? 334 GLN A OE1 1 
ATOM   1362 N NE2 . GLN A 1 216 ? 11.647  50.553  -1.536  1.00 62.79  ? 334 GLN A NE2 1 
ATOM   1363 N N   . LEU A 1 217 ? 7.620   54.647  1.997   1.00 25.83  ? 335 LEU A N   1 
ATOM   1364 C CA  . LEU A 1 217 ? 6.299   54.625  2.611   1.00 25.95  ? 335 LEU A CA  1 
ATOM   1365 C C   . LEU A 1 217 ? 5.221   54.313  1.577   1.00 30.16  ? 335 LEU A C   1 
ATOM   1366 O O   . LEU A 1 217 ? 5.383   54.588  0.389   1.00 28.75  ? 335 LEU A O   1 
ATOM   1367 C CB  . LEU A 1 217 ? 6.008   55.984  3.261   1.00 23.66  ? 335 LEU A CB  1 
ATOM   1368 C CG  . LEU A 1 217 ? 6.948   56.378  4.416   1.00 28.06  ? 335 LEU A CG  1 
ATOM   1369 C CD1 . LEU A 1 217 ? 6.390   57.587  5.146   1.00 29.00  ? 335 LEU A CD1 1 
ATOM   1370 C CD2 . LEU A 1 217 ? 7.129   55.215  5.387   1.00 25.95  ? 335 LEU A CD2 1 
ATOM   1371 N N   . HIS A 1 218 ? 4.095   53.770  2.051   1.00 24.29  ? 336 HIS A N   1 
ATOM   1372 C CA  . HIS A 1 218 ? 2.900   53.569  1.234   1.00 30.93  ? 336 HIS A CA  1 
ATOM   1373 C C   . HIS A 1 218 ? 2.118   54.876  1.128   1.00 28.59  ? 336 HIS A C   1 
ATOM   1374 O O   . HIS A 1 218 ? 2.289   55.782  1.946   1.00 26.92  ? 336 HIS A O   1 
ATOM   1375 C CB  . HIS A 1 218 ? 1.983   52.516  1.859   1.00 30.71  ? 336 HIS A CB  1 
ATOM   1376 C CG  . HIS A 1 218 ? 2.598   51.161  1.965   1.00 31.21  ? 336 HIS A CG  1 
ATOM   1377 N ND1 . HIS A 1 218 ? 2.006   50.132  2.667   1.00 35.84  ? 336 HIS A ND1 1 
ATOM   1378 C CD2 . HIS A 1 218 ? 3.751   50.662  1.459   1.00 36.50  ? 336 HIS A CD2 1 
ATOM   1379 C CE1 . HIS A 1 218 ? 2.761   49.051  2.574   1.00 36.54  ? 336 HIS A CE1 1 
ATOM   1380 N NE2 . HIS A 1 218 ? 3.832   49.348  1.862   1.00 36.30  ? 336 HIS A NE2 1 
ATOM   1381 N N   . GLU A 1 219 ? 1.228   54.963  0.128   1.00 28.10  ? 337 GLU A N   1 
ATOM   1382 C CA  . GLU A 1 219 ? 0.328   56.117  0.066   1.00 27.22  ? 337 GLU A CA  1 
ATOM   1383 C C   . GLU A 1 219 ? -0.386  56.310  1.388   1.00 22.67  ? 337 GLU A C   1 
ATOM   1384 O O   . GLU A 1 219 ? -0.585  57.446  1.834   1.00 26.90  ? 337 GLU A O   1 
ATOM   1385 C CB  . GLU A 1 219 ? -0.715  55.955  -1.047  1.00 31.63  ? 337 GLU A CB  1 
ATOM   1386 C CG  . GLU A 1 219 ? -0.140  55.828  -2.461  1.00 34.45  ? 337 GLU A CG  1 
ATOM   1387 C CD  . GLU A 1 219 ? 0.250   57.163  -3.095  1.00 35.58  ? 337 GLU A CD  1 
ATOM   1388 O OE1 . GLU A 1 219 ? 0.254   58.229  -2.414  1.00 29.73  ? 337 GLU A OE1 1 
ATOM   1389 O OE2 . GLU A 1 219 ? 0.554   57.133  -4.303  1.00 32.46  ? 337 GLU A OE2 1 
ATOM   1390 N N   . GLU A 1 220 ? -0.845  55.211  1.994   1.00 24.97  ? 338 GLU A N   1 
ATOM   1391 C CA  . GLU A 1 220 ? -1.598  55.301  3.244   1.00 25.42  ? 338 GLU A CA  1 
ATOM   1392 C C   . GLU A 1 220 ? -0.765  55.916  4.358   1.00 26.49  ? 338 GLU A C   1 
ATOM   1393 O O   . GLU A 1 220 ? -1.284  56.671  5.188   1.00 24.19  ? 338 GLU A O   1 
ATOM   1394 C CB  . GLU A 1 220 ? -2.102  53.904  3.656   1.00 27.87  ? 338 GLU A CB  1 
ATOM   1395 C CG  . GLU A 1 220 ? -3.225  53.399  2.746   1.00 26.76  ? 338 GLU A CG  1 
ATOM   1396 C CD  . GLU A 1 220 ? -2.734  52.741  1.482   1.00 38.70  ? 338 GLU A CD  1 
ATOM   1397 O OE1 . GLU A 1 220 ? -3.575  52.153  0.781   1.00 33.87  ? 338 GLU A OE1 1 
ATOM   1398 O OE2 . GLU A 1 220 ? -1.513  52.783  1.196   1.00 31.58  ? 338 GLU A OE2 1 
ATOM   1399 N N   . GLU A 1 221 ? 0.526   55.588  4.412   1.00 25.56  ? 339 GLU A N   1 
ATOM   1400 C CA  . GLU A 1 221 ? 1.368   56.151  5.463   1.00 24.45  ? 339 GLU A CA  1 
ATOM   1401 C C   . GLU A 1 221 ? 1.630   57.630  5.220   1.00 24.82  ? 339 GLU A C   1 
ATOM   1402 O O   . GLU A 1 221 ? 1.672   58.413  6.171   1.00 23.62  ? 339 GLU A O   1 
ATOM   1403 C CB  . GLU A 1 221 ? 2.668   55.344  5.562   1.00 28.44  ? 339 GLU A CB  1 
ATOM   1404 C CG  . GLU A 1 221 ? 2.369   53.884  5.940   1.00 28.93  ? 339 GLU A CG  1 
ATOM   1405 C CD  . GLU A 1 221 ? 3.482   52.897  5.616   1.00 33.84  ? 339 GLU A CD  1 
ATOM   1406 O OE1 . GLU A 1 221 ? 3.594   51.895  6.350   1.00 31.40  ? 339 GLU A OE1 1 
ATOM   1407 O OE2 . GLU A 1 221 ? 4.241   53.110  4.645   1.00 30.25  ? 339 GLU A OE2 1 
ATOM   1408 N N   . TYR A 1 222 ? 1.808   58.040  3.953   1.00 22.78  ? 340 TYR A N   1 
ATOM   1409 C CA  . TYR A 1 222 ? 1.932   59.473  3.670   1.00 22.91  ? 340 TYR A CA  1 
ATOM   1410 C C   . TYR A 1 222 ? 0.689   60.242  4.087   1.00 24.44  ? 340 TYR A C   1 
ATOM   1411 O O   . TYR A 1 222 ? 0.791   61.335  4.658   1.00 22.37  ? 340 TYR A O   1 
ATOM   1412 C CB  . TYR A 1 222 ? 2.176   59.717  2.186   1.00 24.79  ? 340 TYR A CB  1 
ATOM   1413 C CG  . TYR A 1 222 ? 3.622   59.618  1.768   1.00 25.06  ? 340 TYR A CG  1 
ATOM   1414 C CD1 . TYR A 1 222 ? 4.537   60.626  2.071   1.00 22.16  ? 340 TYR A CD1 1 
ATOM   1415 C CD2 . TYR A 1 222 ? 4.075   58.503  1.060   1.00 20.82  ? 340 TYR A CD2 1 
ATOM   1416 C CE1 . TYR A 1 222 ? 5.866   60.516  1.673   1.00 22.12  ? 340 TYR A CE1 1 
ATOM   1417 C CE2 . TYR A 1 222 ? 5.391   58.415  0.639   1.00 25.60  ? 340 TYR A CE2 1 
ATOM   1418 C CZ  . TYR A 1 222 ? 6.271   59.417  0.952   1.00 20.98  ? 340 TYR A CZ  1 
ATOM   1419 O OH  . TYR A 1 222 ? 7.574   59.308  0.523   1.00 25.77  ? 340 TYR A OH  1 
ATOM   1420 N N   . VAL A 1 223 ? -0.506  59.713  3.802   1.00 23.57  ? 341 VAL A N   1 
ATOM   1421 C CA  A VAL A 1 223 ? -1.683  60.506  4.122   0.80 22.83  ? 341 VAL A CA  1 
ATOM   1422 C CA  B VAL A 1 223 ? -1.687  60.506  4.126   0.20 22.98  ? 341 VAL A CA  1 
ATOM   1423 C C   . VAL A 1 223 ? -1.911  60.539  5.629   1.00 23.23  ? 341 VAL A C   1 
ATOM   1424 O O   . VAL A 1 223 ? -2.408  61.537  6.161   1.00 24.29  ? 341 VAL A O   1 
ATOM   1425 C CB  A VAL A 1 223 ? -2.919  60.014  3.343   0.80 25.61  ? 341 VAL A CB  1 
ATOM   1426 C CB  B VAL A 1 223 ? -2.940  60.009  3.387   0.20 25.51  ? 341 VAL A CB  1 
ATOM   1427 C CG1 A VAL A 1 223 ? -3.587  58.788  4.001   0.80 21.14  ? 341 VAL A CG1 1 
ATOM   1428 C CG1 B VAL A 1 223 ? -4.048  61.028  3.533   0.20 26.89  ? 341 VAL A CG1 1 
ATOM   1429 C CG2 A VAL A 1 223 ? -3.911  61.159  3.202   0.80 27.53  ? 341 VAL A CG2 1 
ATOM   1430 C CG2 B VAL A 1 223 ? -2.652  59.828  1.931   0.20 22.66  ? 341 VAL A CG2 1 
ATOM   1431 N N   . LEU A 1 224 ? -1.539  59.471  6.348   1.00 22.63  ? 342 LEU A N   1 
ATOM   1432 C CA  . LEU A 1 224 ? -1.609  59.539  7.815   1.00 25.28  ? 342 LEU A CA  1 
ATOM   1433 C C   . LEU A 1 224 ? -0.590  60.538  8.375   1.00 22.76  ? 342 LEU A C   1 
ATOM   1434 O O   . LEU A 1 224 ? -0.883  61.254  9.340   1.00 23.65  ? 342 LEU A O   1 
ATOM   1435 C CB  . LEU A 1 224 ? -1.400  58.143  8.423   1.00 25.96  ? 342 LEU A CB  1 
ATOM   1436 C CG  . LEU A 1 224 ? -2.631  57.237  8.271   1.00 24.39  ? 342 LEU A CG  1 
ATOM   1437 C CD1 . LEU A 1 224 ? -2.220  55.765  8.292   1.00 21.34  ? 342 LEU A CD1 1 
ATOM   1438 C CD2 . LEU A 1 224 ? -3.685  57.535  9.360   1.00 25.06  ? 342 LEU A CD2 1 
ATOM   1439 N N   . MET A 1 225 ? 0.621   60.617  7.793   1.00 24.02  ? 343 MET A N   1 
ATOM   1440 C CA  . MET A 1 225 ? 1.524   61.691  8.232   1.00 21.48  ? 343 MET A CA  1 
ATOM   1441 C C   . MET A 1 225 ? 0.918   63.066  7.995   1.00 24.40  ? 343 MET A C   1 
ATOM   1442 O O   . MET A 1 225 ? 1.059   63.963  8.835   1.00 25.09  ? 343 MET A O   1 
ATOM   1443 C CB  . MET A 1 225 ? 2.894   61.602  7.532   1.00 23.09  ? 343 MET A CB  1 
ATOM   1444 C CG  . MET A 1 225 ? 3.625   60.274  7.665   1.00 26.07  ? 343 MET A CG  1 
ATOM   1445 S SD  . MET A 1 225 ? 5.222   60.389  6.777   1.00 28.57  ? 343 MET A SD  1 
ATOM   1446 C CE  . MET A 1 225 ? 6.110   61.708  7.552   1.00 24.70  ? 343 MET A CE  1 
ATOM   1447 N N   . GLN A 1 226 ? 0.243   63.260  6.856   1.00 23.24  ? 344 GLN A N   1 
ATOM   1448 C CA  . GLN A 1 226 ? -0.410  64.548  6.614   1.00 21.97  ? 344 GLN A CA  1 
ATOM   1449 C C   . GLN A 1 226 ? -1.433  64.849  7.703   1.00 21.69  ? 344 GLN A C   1 
ATOM   1450 O O   . GLN A 1 226 ? -1.516  65.980  8.194   1.00 23.56  ? 344 GLN A O   1 
ATOM   1451 C CB  . GLN A 1 226 ? -1.086  64.566  5.239   1.00 20.72  ? 344 GLN A CB  1 
ATOM   1452 C CG  . GLN A 1 226 ? -0.089  64.540  4.073   1.00 23.69  ? 344 GLN A CG  1 
ATOM   1453 C CD  . GLN A 1 226 ? -0.751  64.392  2.691   1.00 28.18  ? 344 GLN A CD  1 
ATOM   1454 O OE1 . GLN A 1 226 ? -0.089  64.043  1.717   1.00 28.21  ? 344 GLN A OE1 1 
ATOM   1455 N NE2 . GLN A 1 226 ? -2.047  64.671  2.605   1.00 23.99  ? 344 GLN A NE2 1 
ATOM   1456 N N   . ALA A 1 227 ? -2.218  63.844  8.093   1.00 22.50  ? 345 ALA A N   1 
ATOM   1457 C CA  . ALA A 1 227 ? -3.245  64.060  9.111   1.00 26.48  ? 345 ALA A CA  1 
ATOM   1458 C C   . ALA A 1 227 ? -2.611  64.360  10.461  1.00 27.49  ? 345 ALA A C   1 
ATOM   1459 O O   . ALA A 1 227 ? -3.065  65.250  11.193  1.00 27.41  ? 345 ALA A O   1 
ATOM   1460 C CB  . ALA A 1 227 ? -4.146  62.819  9.206   1.00 26.24  ? 345 ALA A CB  1 
ATOM   1461 N N   . ILE A 1 228 ? -1.574  63.609  10.820  1.00 25.32  ? 346 ILE A N   1 
ATOM   1462 C CA  . ILE A 1 228 ? -0.910  63.857  12.101  1.00 24.28  ? 346 ILE A CA  1 
ATOM   1463 C C   . ILE A 1 228 ? -0.360  65.269  12.150  1.00 30.25  ? 346 ILE A C   1 
ATOM   1464 O O   . ILE A 1 228 ? -0.499  65.978  13.160  1.00 30.41  ? 346 ILE A O   1 
ATOM   1465 C CB  . ILE A 1 228 ? 0.187   62.807  12.345  1.00 27.00  ? 346 ILE A CB  1 
ATOM   1466 C CG1 . ILE A 1 228 ? -0.469  61.442  12.528  1.00 23.75  ? 346 ILE A CG1 1 
ATOM   1467 C CG2 . ILE A 1 228 ? 1.033   63.171  13.571  1.00 29.70  ? 346 ILE A CG2 1 
ATOM   1468 C CD1 . ILE A 1 228 ? 0.510   60.275  12.297  1.00 27.86  ? 346 ILE A CD1 1 
ATOM   1469 N N   . SER A 1 229 ? 0.274   65.703  11.059  1.00 28.81  ? 347 SER A N   1 
ATOM   1470 C CA  . SER A 1 229 ? 0.781   67.068  10.995  1.00 27.09  ? 347 SER A CA  1 
ATOM   1471 C C   . SER A 1 229 ? -0.351  68.077  11.029  1.00 28.28  ? 347 SER A C   1 
ATOM   1472 O O   . SER A 1 229 ? -0.250  69.109  11.714  1.00 28.88  ? 347 SER A O   1 
ATOM   1473 C CB  . SER A 1 229 ? 1.616   67.255  9.722   1.00 27.12  ? 347 SER A CB  1 
ATOM   1474 O OG  . SER A 1 229 ? 1.828   68.635  9.494   1.00 29.45  ? 347 SER A OG  1 
ATOM   1475 N N   . LEU A 1 230 ? -1.435  67.813  10.276  1.00 25.98  ? 348 LEU A N   1 
ATOM   1476 C CA  . LEU A 1 230 ? -2.536  68.775  10.204  1.00 27.14  ? 348 LEU A CA  1 
ATOM   1477 C C   . LEU A 1 230 ? -3.198  68.956  11.569  1.00 30.73  ? 348 LEU A C   1 
ATOM   1478 O O   . LEU A 1 230 ? -3.518  70.082  11.976  1.00 30.07  ? 348 LEU A O   1 
ATOM   1479 C CB  . LEU A 1 230 ? -3.576  68.321  9.176   1.00 27.13  ? 348 LEU A CB  1 
ATOM   1480 C CG  . LEU A 1 230 ? -4.823  69.198  8.924   1.00 29.60  ? 348 LEU A CG  1 
ATOM   1481 C CD1 . LEU A 1 230 ? -4.479  70.631  8.522   1.00 28.37  ? 348 LEU A CD1 1 
ATOM   1482 C CD2 . LEU A 1 230 ? -5.737  68.550  7.859   1.00 29.13  ? 348 LEU A CD2 1 
ATOM   1483 N N   . PHE A 1 231 ? -3.405  67.861  12.287  1.00 30.56  ? 349 PHE A N   1 
ATOM   1484 C CA  . PHE A 1 231 ? -4.097  67.895  13.575  1.00 35.46  ? 349 PHE A CA  1 
ATOM   1485 C C   . PHE A 1 231 ? -3.115  68.054  14.732  1.00 34.64  ? 349 PHE A C   1 
ATOM   1486 O O   . PHE A 1 231 ? -3.132  67.318  15.710  1.00 37.79  ? 349 PHE A O   1 
ATOM   1487 C CB  . PHE A 1 231 ? -4.959  66.642  13.719  1.00 30.07  ? 349 PHE A CB  1 
ATOM   1488 C CG  . PHE A 1 231 ? -6.179  66.642  12.818  1.00 31.26  ? 349 PHE A CG  1 
ATOM   1489 C CD1 . PHE A 1 231 ? -7.375  67.211  13.241  1.00 36.05  ? 349 PHE A CD1 1 
ATOM   1490 C CD2 . PHE A 1 231 ? -6.111  66.123  11.534  1.00 31.82  ? 349 PHE A CD2 1 
ATOM   1491 C CE1 . PHE A 1 231 ? -8.494  67.233  12.407  1.00 34.81  ? 349 PHE A CE1 1 
ATOM   1492 C CE2 . PHE A 1 231 ? -7.233  66.120  10.700  1.00 36.92  ? 349 PHE A CE2 1 
ATOM   1493 C CZ  . PHE A 1 231 ? -8.425  66.686  11.143  1.00 36.43  ? 349 PHE A CZ  1 
ATOM   1494 N N   . SER A 1 232 ? -2.230  69.041  14.633  1.00 42.13  ? 350 SER A N   1 
ATOM   1495 C CA  . SER A 1 232 ? -1.291  69.310  15.712  1.00 50.30  ? 350 SER A CA  1 
ATOM   1496 C C   . SER A 1 232 ? -1.944  70.256  16.709  1.00 48.17  ? 350 SER A C   1 
ATOM   1497 O O   . SER A 1 232 ? -2.254  71.397  16.345  1.00 48.76  ? 350 SER A O   1 
ATOM   1498 C CB  . SER A 1 232 ? -0.009  69.916  15.180  1.00 45.14  ? 350 SER A CB  1 
ATOM   1499 O OG  . SER A 1 232 ? 0.614   69.028  14.272  1.00 46.69  ? 350 SER A OG  1 
ATOM   1500 N N   . PRO A 1 233 ? -2.178  69.831  17.954  1.00 47.90  ? 351 PRO A N   1 
ATOM   1501 C CA  . PRO A 1 233 ? -2.933  70.675  18.900  1.00 54.42  ? 351 PRO A CA  1 
ATOM   1502 C C   . PRO A 1 233 ? -2.201  71.926  19.349  1.00 61.21  ? 351 PRO A C   1 
ATOM   1503 O O   . PRO A 1 233 ? -2.839  72.830  19.907  1.00 56.54  ? 351 PRO A O   1 
ATOM   1504 C CB  . PRO A 1 233 ? -3.190  69.727  20.084  1.00 51.15  ? 351 PRO A CB  1 
ATOM   1505 C CG  . PRO A 1 233 ? -2.054  68.737  20.031  1.00 48.88  ? 351 PRO A CG  1 
ATOM   1506 C CD  . PRO A 1 233 ? -1.725  68.561  18.557  1.00 38.82  ? 351 PRO A CD  1 
ATOM   1507 N N   . ASP A 1 234 ? -0.900  72.025  19.113  1.00 49.48  ? 352 ASP A N   1 
ATOM   1508 C CA  . ASP A 1 234 ? -0.097  73.078  19.706  1.00 56.57  ? 352 ASP A CA  1 
ATOM   1509 C C   . ASP A 1 234 ? 0.365   74.107  18.676  1.00 62.35  ? 352 ASP A C   1 
ATOM   1510 O O   . ASP A 1 234 ? 1.398   74.754  18.854  1.00 69.92  ? 352 ASP A O   1 
ATOM   1511 C CB  . ASP A 1 234 ? 1.078   72.449  20.442  1.00 64.07  ? 352 ASP A CB  1 
ATOM   1512 C CG  . ASP A 1 234 ? 1.978   71.682  19.522  1.00 72.70  ? 352 ASP A CG  1 
ATOM   1513 O OD1 . ASP A 1 234 ? 3.087   72.188  19.279  1.00 78.48  ? 352 ASP A OD1 1 
ATOM   1514 O OD2 . ASP A 1 234 ? 1.570   70.605  19.021  1.00 74.67  ? 352 ASP A OD2 1 
ATOM   1515 N N   . ARG A 1 235 ? -0.388  74.267  17.592  1.00 50.23  ? 353 ARG A N   1 
ATOM   1516 C CA  . ARG A 1 235 ? -0.163  75.386  16.693  1.00 49.13  ? 353 ARG A CA  1 
ATOM   1517 C C   . ARG A 1 235 ? -0.695  76.670  17.329  1.00 56.50  ? 353 ARG A C   1 
ATOM   1518 O O   . ARG A 1 235 ? -1.652  76.635  18.107  1.00 48.66  ? 353 ARG A O   1 
ATOM   1519 C CB  . ARG A 1 235 ? -0.871  75.170  15.356  1.00 44.35  ? 353 ARG A CB  1 
ATOM   1520 C CG  . ARG A 1 235 ? -0.601  73.840  14.703  1.00 41.21  ? 353 ARG A CG  1 
ATOM   1521 C CD  . ARG A 1 235 ? 0.783   73.779  14.079  1.00 47.36  ? 353 ARG A CD  1 
ATOM   1522 N NE  . ARG A 1 235 ? 0.880   72.624  13.194  1.00 41.09  ? 353 ARG A NE  1 
ATOM   1523 C CZ  . ARG A 1 235 ? 2.011   72.167  12.675  1.00 46.54  ? 353 ARG A CZ  1 
ATOM   1524 N NH1 . ARG A 1 235 ? 3.161   72.791  12.935  1.00 37.97  ? 353 ARG A NH1 1 
ATOM   1525 N NH2 . ARG A 1 235 ? 1.984   71.093  11.887  1.00 36.66  ? 353 ARG A NH2 1 
ATOM   1526 N N   . PRO A 1 236 ? -0.108  77.818  16.991  1.00 51.67  ? 354 PRO A N   1 
ATOM   1527 C CA  . PRO A 1 236 ? -0.574  79.086  17.566  1.00 48.87  ? 354 PRO A CA  1 
ATOM   1528 C C   . PRO A 1 236 ? -2.041  79.324  17.250  1.00 54.64  ? 354 PRO A C   1 
ATOM   1529 O O   . PRO A 1 236 ? -2.474  79.196  16.103  1.00 44.39  ? 354 PRO A O   1 
ATOM   1530 C CB  . PRO A 1 236 ? 0.315   80.131  16.886  1.00 46.97  ? 354 PRO A CB  1 
ATOM   1531 C CG  . PRO A 1 236 ? 1.541   79.381  16.453  1.00 50.44  ? 354 PRO A CG  1 
ATOM   1532 C CD  . PRO A 1 236 ? 1.082   77.988  16.140  1.00 49.84  ? 354 PRO A CD  1 
ATOM   1533 N N   . GLY A 1 237 ? -2.810  79.676  18.279  1.00 49.69  ? 355 GLY A N   1 
ATOM   1534 C CA  . GLY A 1 237 ? -4.180  80.092  18.088  1.00 40.08  ? 355 GLY A CA  1 
ATOM   1535 C C   . GLY A 1 237 ? -5.215  79.001  18.215  1.00 50.61  ? 355 GLY A C   1 
ATOM   1536 O O   . GLY A 1 237 ? -6.412  79.309  18.199  1.00 55.73  ? 355 GLY A O   1 
ATOM   1537 N N   . VAL A 1 238 ? -4.808  77.739  18.333  1.00 46.43  ? 356 VAL A N   1 
ATOM   1538 C CA  . VAL A 1 238 ? -5.786  76.663  18.474  1.00 46.11  ? 356 VAL A CA  1 
ATOM   1539 C C   . VAL A 1 238 ? -6.509  76.801  19.809  1.00 57.51  ? 356 VAL A C   1 
ATOM   1540 O O   . VAL A 1 238 ? -5.882  77.022  20.855  1.00 61.94  ? 356 VAL A O   1 
ATOM   1541 C CB  . VAL A 1 238 ? -5.102  75.294  18.355  1.00 47.54  ? 356 VAL A CB  1 
ATOM   1542 C CG1 . VAL A 1 238 ? -6.118  74.177  18.561  1.00 41.70  ? 356 VAL A CG1 1 
ATOM   1543 C CG2 . VAL A 1 238 ? -4.415  75.174  17.003  1.00 45.42  ? 356 VAL A CG2 1 
ATOM   1544 N N   . LEU A 1 239 ? -7.834  76.665  19.779  1.00 52.20  ? 357 LEU A N   1 
ATOM   1545 C CA  . LEU A 1 239 ? -8.660  76.722  20.982  1.00 57.72  ? 357 LEU A CA  1 
ATOM   1546 C C   . LEU A 1 239 ? -9.128  75.354  21.461  1.00 57.16  ? 357 LEU A C   1 
ATOM   1547 O O   . LEU A 1 239 ? -9.077  75.074  22.663  1.00 64.82  ? 357 LEU A O   1 
ATOM   1548 C CB  . LEU A 1 239 ? -9.881  77.610  20.740  1.00 51.45  ? 357 LEU A CB  1 
ATOM   1549 C CG  . LEU A 1 239 ? -9.535  79.066  20.457  1.00 58.23  ? 357 LEU A CG  1 
ATOM   1550 C CD1 . LEU A 1 239 ? -10.782 79.929  20.526  1.00 53.16  ? 357 LEU A CD1 1 
ATOM   1551 C CD2 . LEU A 1 239 ? -8.457  79.561  21.410  1.00 62.38  ? 357 LEU A CD2 1 
ATOM   1552 N N   . GLN A 1 240 ? -9.599  74.495  20.557  1.00 51.55  ? 358 GLN A N   1 
ATOM   1553 C CA  . GLN A 1 240 ? -10.013 73.140  20.914  1.00 46.22  ? 358 GLN A CA  1 
ATOM   1554 C C   . GLN A 1 240 ? -8.807  72.202  20.985  1.00 52.63  ? 358 GLN A C   1 
ATOM   1555 O O   . GLN A 1 240 ? -8.759  71.149  20.347  1.00 52.39  ? 358 GLN A O   1 
ATOM   1556 C CB  . GLN A 1 240 ? -11.046 72.627  19.923  1.00 51.38  ? 358 GLN A CB  1 
ATOM   1557 C CG  . GLN A 1 240 ? -12.277 73.495  19.802  1.00 57.63  ? 358 GLN A CG  1 
ATOM   1558 C CD  . GLN A 1 240 ? -13.294 73.173  20.872  1.00 64.10  ? 358 GLN A CD  1 
ATOM   1559 O OE1 . GLN A 1 240 ? -12.970 73.124  22.060  1.00 66.45  ? 358 GLN A OE1 1 
ATOM   1560 N NE2 . GLN A 1 240 ? -14.527 72.919  20.454  1.00 75.51  ? 358 GLN A NE2 1 
ATOM   1561 N N   . HIS A 1 241 ? -7.826  72.604  21.801  1.00 52.93  ? 359 HIS A N   1 
ATOM   1562 C CA  . HIS A 1 241 ? -6.598  71.825  21.945  1.00 54.11  ? 359 HIS A CA  1 
ATOM   1563 C C   . HIS A 1 241 ? -6.895  70.377  22.325  1.00 58.45  ? 359 HIS A C   1 
ATOM   1564 O O   . HIS A 1 241 ? -6.271  69.449  21.796  1.00 51.34  ? 359 HIS A O   1 
ATOM   1565 C CB  . HIS A 1 241 ? -5.672  72.475  22.983  1.00 61.91  ? 359 HIS A CB  1 
ATOM   1566 C CG  . HIS A 1 241 ? -4.406  71.705  23.240  1.00 80.55  ? 359 HIS A CG  1 
ATOM   1567 N ND1 . HIS A 1 241 ? -3.155  72.213  22.954  1.00 84.75  ? 359 HIS A ND1 1 
ATOM   1568 C CD2 . HIS A 1 241 ? -4.195  70.471  23.764  1.00 78.71  ? 359 HIS A CD2 1 
ATOM   1569 C CE1 . HIS A 1 241 ? -2.232  71.324  23.280  1.00 80.03  ? 359 HIS A CE1 1 
ATOM   1570 N NE2 . HIS A 1 241 ? -2.837  70.256  23.770  1.00 71.16  ? 359 HIS A NE2 1 
ATOM   1571 N N   . ARG A 1 242 ? -7.848  70.163  23.235  1.00 46.20  ? 360 ARG A N   1 
ATOM   1572 C CA  . ARG A 1 242 ? -8.125  68.808  23.692  1.00 46.36  ? 360 ARG A CA  1 
ATOM   1573 C C   . ARG A 1 242 ? -8.716  67.967  22.573  1.00 39.09  ? 360 ARG A C   1 
ATOM   1574 O O   . ARG A 1 242 ? -8.337  66.801  22.405  1.00 47.18  ? 360 ARG A O   1 
ATOM   1575 C CB  . ARG A 1 242 ? -9.069  68.832  24.905  1.00 46.68  ? 360 ARG A CB  1 
ATOM   1576 N N   . VAL A 1 243 ? -9.666  68.527  21.813  1.00 36.07  ? 361 VAL A N   1 
ATOM   1577 C CA  . VAL A 1 243 ? -10.270 67.764  20.722  1.00 50.27  ? 361 VAL A CA  1 
ATOM   1578 C C   . VAL A 1 243 ? -9.227  67.471  19.652  1.00 44.43  ? 361 VAL A C   1 
ATOM   1579 O O   . VAL A 1 243 ? -9.173  66.365  19.100  1.00 40.91  ? 361 VAL A O   1 
ATOM   1580 C CB  . VAL A 1 243 ? -11.484 68.512  20.132  1.00 55.96  ? 361 VAL A CB  1 
ATOM   1581 C CG1 . VAL A 1 243 ? -11.950 67.837  18.851  1.00 43.32  ? 361 VAL A CG1 1 
ATOM   1582 C CG2 . VAL A 1 243 ? -12.631 68.586  21.150  1.00 57.38  ? 361 VAL A CG2 1 
ATOM   1583 N N   . VAL A 1 244 ? -8.363  68.449  19.362  1.00 39.47  ? 362 VAL A N   1 
ATOM   1584 C CA  . VAL A 1 244 ? -7.389  68.250  18.293  1.00 40.85  ? 362 VAL A CA  1 
ATOM   1585 C C   . VAL A 1 244 ? -6.351  67.228  18.722  1.00 37.94  ? 362 VAL A C   1 
ATOM   1586 O O   . VAL A 1 244 ? -5.986  66.326  17.956  1.00 40.10  ? 362 VAL A O   1 
ATOM   1587 C CB  . VAL A 1 244 ? -6.753  69.598  17.898  1.00 35.42  ? 362 VAL A CB  1 
ATOM   1588 C CG1 . VAL A 1 244 ? -5.613  69.395  16.884  1.00 36.27  ? 362 VAL A CG1 1 
ATOM   1589 C CG2 . VAL A 1 244 ? -7.813  70.521  17.348  1.00 37.61  ? 362 VAL A CG2 1 
ATOM   1590 N N   . ASP A 1 245 ? -5.890  67.329  19.970  1.00 35.48  ? 363 ASP A N   1 
ATOM   1591 C CA  . ASP A 1 245 ? -4.977  66.339  20.520  1.00 38.10  ? 363 ASP A CA  1 
ATOM   1592 C C   . ASP A 1 245 ? -5.555  64.935  20.468  1.00 36.89  ? 363 ASP A C   1 
ATOM   1593 O O   . ASP A 1 245 ? -4.836  63.981  20.154  1.00 38.67  ? 363 ASP A O   1 
ATOM   1594 C CB  . ASP A 1 245 ? -4.620  66.696  21.958  1.00 48.49  ? 363 ASP A CB  1 
ATOM   1595 C CG  . ASP A 1 245 ? -3.593  65.765  22.531  1.00 49.43  ? 363 ASP A CG  1 
ATOM   1596 O OD1 . ASP A 1 245 ? -2.407  65.953  22.208  1.00 51.60  ? 363 ASP A OD1 1 
ATOM   1597 O OD2 . ASP A 1 245 ? -3.965  64.842  23.286  1.00 60.41  ? 363 ASP A OD2 1 
ATOM   1598 N N   . GLN A 1 246 ? -6.844  64.777  20.795  1.00 36.38  ? 364 GLN A N   1 
ATOM   1599 C CA  A GLN A 1 246 ? -7.447  63.450  20.737  0.55 40.15  ? 364 GLN A CA  1 
ATOM   1600 C CA  B GLN A 1 246 ? -7.467  63.456  20.732  0.45 40.15  ? 364 GLN A CA  1 
ATOM   1601 C C   . GLN A 1 246 ? -7.497  62.932  19.304  1.00 37.78  ? 364 GLN A C   1 
ATOM   1602 O O   . GLN A 1 246 ? -7.289  61.736  19.064  1.00 34.90  ? 364 GLN A O   1 
ATOM   1603 C CB  A GLN A 1 246 ? -8.850  63.476  21.352  0.55 38.12  ? 364 GLN A CB  1 
ATOM   1604 C CB  B GLN A 1 246 ? -8.888  63.510  21.301  0.45 38.11  ? 364 GLN A CB  1 
ATOM   1605 C CG  A GLN A 1 246 ? -8.864  63.693  22.872  0.55 38.58  ? 364 GLN A CG  1 
ATOM   1606 C CG  B GLN A 1 246 ? -9.762  62.315  20.933  0.45 36.81  ? 364 GLN A CG  1 
ATOM   1607 N N   . LEU A 1 247 ? -7.773  63.812  18.341  1.00 38.34  ? 365 LEU A N   1 
ATOM   1608 C CA  . LEU A 1 247 ? -7.812  63.379  16.944  1.00 33.33  ? 365 LEU A CA  1 
ATOM   1609 C C   . LEU A 1 247 ? -6.421  63.005  16.454  1.00 29.65  ? 365 LEU A C   1 
ATOM   1610 O O   . LEU A 1 247 ? -6.253  62.013  15.735  1.00 36.72  ? 365 LEU A O   1 
ATOM   1611 C CB  . LEU A 1 247 ? -8.399  64.485  16.069  1.00 34.32  ? 365 LEU A CB  1 
ATOM   1612 C CG  . LEU A 1 247 ? -9.918  64.639  16.183  1.00 43.11  ? 365 LEU A CG  1 
ATOM   1613 C CD1 . LEU A 1 247 ? -10.344 66.029  15.724  1.00 38.96  ? 365 LEU A CD1 1 
ATOM   1614 C CD2 . LEU A 1 247 ? -10.619 63.542  15.404  1.00 44.81  ? 365 LEU A CD2 1 
ATOM   1615 N N   . GLN A 1 248 ? -5.412  63.786  16.843  1.00 32.88  ? 366 GLN A N   1 
ATOM   1616 C CA  . GLN A 1 248 ? -4.051  63.468  16.441  1.00 33.46  ? 366 GLN A CA  1 
ATOM   1617 C C   . GLN A 1 248 ? -3.632  62.115  16.978  1.00 42.63  ? 366 GLN A C   1 
ATOM   1618 O O   . GLN A 1 248 ? -3.050  61.303  16.245  1.00 32.71  ? 366 GLN A O   1 
ATOM   1619 C CB  . GLN A 1 248 ? -3.087  64.558  16.900  1.00 32.14  ? 366 GLN A CB  1 
ATOM   1620 C CG  . GLN A 1 248 ? -1.753  64.484  16.151  1.00 36.12  ? 366 GLN A CG  1 
ATOM   1621 C CD  . GLN A 1 248 ? -0.662  65.291  16.803  1.00 44.31  ? 366 GLN A CD  1 
ATOM   1622 O OE1 . GLN A 1 248 ? -0.471  65.215  18.008  1.00 38.82  ? 366 GLN A OE1 1 
ATOM   1623 N NE2 . GLN A 1 248 ? 0.120   65.998  15.996  1.00 36.47  ? 366 GLN A NE2 1 
ATOM   1624 N N   . GLU A 1 249 ? -3.952  61.834  18.247  1.00 35.03  ? 367 GLU A N   1 
ATOM   1625 C CA  . GLU A 1 249 ? -3.567  60.552  18.825  1.00 34.09  ? 367 GLU A CA  1 
ATOM   1626 C C   . GLU A 1 249 ? -4.211  59.396  18.075  1.00 29.27  ? 367 GLU A C   1 
ATOM   1627 O O   . GLU A 1 249 ? -3.571  58.361  17.849  1.00 35.17  ? 367 GLU A O   1 
ATOM   1628 C CB  . GLU A 1 249 ? -3.939  60.514  20.314  1.00 38.25  ? 367 GLU A CB  1 
ATOM   1629 C CG  . GLU A 1 249 ? -3.290  59.357  21.071  1.00 52.85  ? 367 GLU A CG  1 
ATOM   1630 C CD  . GLU A 1 249 ? -3.950  59.079  22.415  1.00 60.17  ? 367 GLU A CD  1 
ATOM   1631 O OE1 . GLU A 1 249 ? -4.786  59.902  22.859  1.00 60.07  ? 367 GLU A OE1 1 
ATOM   1632 O OE2 . GLU A 1 249 ? -3.636  58.034  23.023  1.00 72.41  ? 367 GLU A OE2 1 
ATOM   1633 N N   . GLN A 1 250 ? -5.492  59.542  17.703  1.00 32.63  ? 368 GLN A N   1 
ATOM   1634 C CA  A GLN A 1 250 ? -6.183  58.524  16.911  0.45 34.75  ? 368 GLN A CA  1 
ATOM   1635 C CA  B GLN A 1 250 ? -6.145  58.487  16.940  0.55 34.71  ? 368 GLN A CA  1 
ATOM   1636 C C   . GLN A 1 250 ? -5.474  58.285  15.585  1.00 32.52  ? 368 GLN A C   1 
ATOM   1637 O O   . GLN A 1 250 ? -5.359  57.147  15.119  1.00 31.94  ? 368 GLN A O   1 
ATOM   1638 C CB  A GLN A 1 250 ? -7.625  58.965  16.632  0.45 35.65  ? 368 GLN A CB  1 
ATOM   1639 C CB  B GLN A 1 250 ? -7.635  58.796  16.770  0.55 35.55  ? 368 GLN A CB  1 
ATOM   1640 C CG  A GLN A 1 250 ? -8.610  58.876  17.782  0.45 42.98  ? 368 GLN A CG  1 
ATOM   1641 C CG  B GLN A 1 250 ? -8.453  58.616  18.050  0.55 42.39  ? 368 GLN A CG  1 
ATOM   1642 C CD  A GLN A 1 250 ? -9.916  59.599  17.462  0.45 43.26  ? 368 GLN A CD  1 
ATOM   1643 C CD  B GLN A 1 250 ? -7.982  57.436  18.883  0.55 36.91  ? 368 GLN A CD  1 
ATOM   1644 O OE1 A GLN A 1 250 ? -10.345 59.670  16.300  0.45 37.78  ? 368 GLN A OE1 1 
ATOM   1645 O OE1 B GLN A 1 250 ? -7.932  56.303  18.401  0.55 37.66  ? 368 GLN A OE1 1 
ATOM   1646 N NE2 A GLN A 1 250 ? -10.546 60.156  18.492  0.45 48.98  ? 368 GLN A NE2 1 
ATOM   1647 N NE2 B GLN A 1 250 ? -7.634  57.696  20.139  0.55 40.64  ? 368 GLN A NE2 1 
ATOM   1648 N N   . PHE A 1 251 ? -5.038  59.371  14.930  1.00 30.15  ? 369 PHE A N   1 
ATOM   1649 C CA  . PHE A 1 251 ? -4.335  59.206  13.659  1.00 28.07  ? 369 PHE A CA  1 
ATOM   1650 C C   . PHE A 1 251 ? -2.992  58.516  13.856  1.00 28.56  ? 369 PHE A C   1 
ATOM   1651 O O   . PHE A 1 251 ? -2.609  57.651  13.059  1.00 27.45  ? 369 PHE A O   1 
ATOM   1652 C CB  . PHE A 1 251 ? -4.143  60.563  12.983  1.00 25.35  ? 369 PHE A CB  1 
ATOM   1653 C CG  . PHE A 1 251 ? -5.423  61.149  12.409  1.00 28.79  ? 369 PHE A CG  1 
ATOM   1654 C CD1 . PHE A 1 251 ? -6.166  60.445  11.472  1.00 33.07  ? 369 PHE A CD1 1 
ATOM   1655 C CD2 . PHE A 1 251 ? -5.839  62.421  12.770  1.00 30.01  ? 369 PHE A CD2 1 
ATOM   1656 C CE1 . PHE A 1 251 ? -7.331  60.987  10.926  1.00 32.88  ? 369 PHE A CE1 1 
ATOM   1657 C CE2 . PHE A 1 251 ? -7.015  62.972  12.232  1.00 34.42  ? 369 PHE A CE2 1 
ATOM   1658 C CZ  . PHE A 1 251 ? -7.747  62.255  11.310  1.00 31.85  ? 369 PHE A CZ  1 
ATOM   1659 N N   . ALA A 1 252 ? -2.263  58.880  14.916  1.00 28.11  ? 370 ALA A N   1 
ATOM   1660 C CA  . ALA A 1 252 ? -0.993  58.208  15.164  1.00 31.43  ? 370 ALA A CA  1 
ATOM   1661 C C   . ALA A 1 252 ? -1.211  56.740  15.508  1.00 30.63  ? 370 ALA A C   1 
ATOM   1662 O O   . ALA A 1 252 ? -0.459  55.881  15.045  1.00 30.40  ? 370 ALA A O   1 
ATOM   1663 C CB  . ALA A 1 252 ? -0.229  58.919  16.282  1.00 30.38  ? 370 ALA A CB  1 
ATOM   1664 N N   . ILE A 1 253 ? -2.233  56.434  16.322  1.00 32.92  ? 371 ILE A N   1 
ATOM   1665 C CA  . ILE A 1 253 ? -2.530  55.037  16.646  1.00 34.20  ? 371 ILE A CA  1 
ATOM   1666 C C   . ILE A 1 253 ? -2.897  54.260  15.392  1.00 33.11  ? 371 ILE A C   1 
ATOM   1667 O O   . ILE A 1 253 ? -2.438  53.125  15.189  1.00 30.34  ? 371 ILE A O   1 
ATOM   1668 C CB  . ILE A 1 253 ? -3.644  54.946  17.710  1.00 33.99  ? 371 ILE A CB  1 
ATOM   1669 C CG1 . ILE A 1 253 ? -3.160  55.525  19.041  1.00 42.77  ? 371 ILE A CG1 1 
ATOM   1670 C CG2 . ILE A 1 253 ? -4.157  53.499  17.850  1.00 37.00  ? 371 ILE A CG2 1 
ATOM   1671 C CD1 . ILE A 1 253 ? -4.238  55.527  20.129  1.00 46.26  ? 371 ILE A CD1 1 
ATOM   1672 N N   . THR A 1 254 ? -3.730  54.852  14.529  1.00 28.40  ? 372 THR A N   1 
ATOM   1673 C CA  . THR A 1 254 ? -4.038  54.204  13.255  1.00 29.45  ? 372 THR A CA  1 
ATOM   1674 C C   . THR A 1 254 ? -2.771  53.918  12.461  1.00 28.13  ? 372 THR A C   1 
ATOM   1675 O O   . THR A 1 254 ? -2.609  52.824  11.895  1.00 30.45  ? 372 THR A O   1 
ATOM   1676 C CB  . THR A 1 254 ? -5.005  55.082  12.455  1.00 34.56  ? 372 THR A CB  1 
ATOM   1677 O OG1 . THR A 1 254 ? -6.270  55.129  13.128  1.00 34.81  ? 372 THR A OG1 1 
ATOM   1678 C CG2 . THR A 1 254 ? -5.200  54.553  11.035  1.00 27.61  ? 372 THR A CG2 1 
ATOM   1679 N N   . LEU A 1 255 ? -1.851  54.889  12.406  1.00 26.89  ? 373 LEU A N   1 
ATOM   1680 C CA  . LEU A 1 255 ? -0.625  54.666  11.647  1.00 29.85  ? 373 LEU A CA  1 
ATOM   1681 C C   . LEU A 1 255 ? 0.201   53.552  12.269  1.00 27.85  ? 373 LEU A C   1 
ATOM   1682 O O   . LEU A 1 255 ? 0.724   52.691  11.557  1.00 26.60  ? 373 LEU A O   1 
ATOM   1683 C CB  . LEU A 1 255 ? 0.196   55.961  11.555  1.00 26.15  ? 373 LEU A CB  1 
ATOM   1684 C CG  . LEU A 1 255 ? 1.578   55.823  10.913  1.00 28.11  ? 373 LEU A CG  1 
ATOM   1685 C CD1 . LEU A 1 255 ? 1.474   55.419  9.437   1.00 23.31  ? 373 LEU A CD1 1 
ATOM   1686 C CD2 . LEU A 1 255 ? 2.401   57.130  11.056  1.00 27.63  ? 373 LEU A CD2 1 
ATOM   1687 N N   . LYS A 1 256 ? 0.348   53.570  13.605  1.00 30.46  ? 374 LYS A N   1 
ATOM   1688 C CA  . LYS A 1 256 ? 1.092   52.517  14.296  1.00 32.84  ? 374 LYS A CA  1 
ATOM   1689 C C   . LYS A 1 256 ? 0.503   51.145  13.977  1.00 27.57  ? 374 LYS A C   1 
ATOM   1690 O O   . LYS A 1 256 ? 1.238   50.191  13.675  1.00 29.94  ? 374 LYS A O   1 
ATOM   1691 C CB  . LYS A 1 256 ? 1.056   52.781  15.811  1.00 28.73  ? 374 LYS A CB  1 
ATOM   1692 C CG  . LYS A 1 256 ? 1.887   51.794  16.669  1.00 33.10  ? 374 LYS A CG  1 
ATOM   1693 C CD  . LYS A 1 256 ? 2.104   52.381  18.067  1.00 34.82  ? 374 LYS A CD  1 
ATOM   1694 C CE  . LYS A 1 256 ? 2.964   51.463  18.937  1.00 46.92  ? 374 LYS A CE  1 
ATOM   1695 N NZ  . LYS A 1 256 ? 2.292   50.186  19.236  1.00 55.17  ? 374 LYS A NZ  1 
ATOM   1696 N N   . SER A 1 257 ? -0.830  51.036  14.026  1.00 29.54  ? 375 SER A N   1 
ATOM   1697 C CA  . SER A 1 257 ? -1.489  49.764  13.740  1.00 34.20  ? 375 SER A CA  1 
ATOM   1698 C C   . SER A 1 257 ? -1.381  49.388  12.274  1.00 32.80  ? 375 SER A C   1 
ATOM   1699 O O   . SER A 1 257 ? -1.223  48.207  11.955  1.00 31.50  ? 375 SER A O   1 
ATOM   1700 C CB  . SER A 1 257 ? -2.970  49.804  14.138  1.00 34.29  ? 375 SER A CB  1 
ATOM   1701 O OG  . SER A 1 257 ? -3.142  50.121  15.500  1.00 41.84  ? 375 SER A OG  1 
ATOM   1702 N N   . TYR A 1 258 ? -1.531  50.355  11.358  1.00 30.76  ? 376 TYR A N   1 
ATOM   1703 C CA  . TYR A 1 258 ? -1.325  50.039  9.949   1.00 25.62  ? 376 TYR A CA  1 
ATOM   1704 C C   . TYR A 1 258 ? 0.028   49.366  9.740   1.00 29.16  ? 376 TYR A C   1 
ATOM   1705 O O   . TYR A 1 258 ? 0.125   48.318  9.089   1.00 32.05  ? 376 TYR A O   1 
ATOM   1706 C CB  . TYR A 1 258 ? -1.446  51.314  9.089   1.00 27.29  ? 376 TYR A CB  1 
ATOM   1707 C CG  . TYR A 1 258 ? -1.214  51.067  7.615   1.00 38.38  ? 376 TYR A CG  1 
ATOM   1708 C CD1 . TYR A 1 258 ? -2.263  50.741  6.760   1.00 34.95  ? 376 TYR A CD1 1 
ATOM   1709 C CD2 . TYR A 1 258 ? 0.069   51.109  7.083   1.00 30.76  ? 376 TYR A CD2 1 
ATOM   1710 C CE1 . TYR A 1 258 ? -2.035  50.508  5.418   1.00 27.68  ? 376 TYR A CE1 1 
ATOM   1711 C CE2 . TYR A 1 258 ? 0.299   50.860  5.734   1.00 31.36  ? 376 TYR A CE2 1 
ATOM   1712 C CZ  . TYR A 1 258 ? -0.766  50.560  4.917   1.00 30.93  ? 376 TYR A CZ  1 
ATOM   1713 O OH  . TYR A 1 258 ? -0.558  50.304  3.583   1.00 35.26  ? 376 TYR A OH  1 
ATOM   1714 N N   . ILE A 1 259 ? 1.086   49.950  10.310  1.00 27.25  ? 377 ILE A N   1 
ATOM   1715 C CA  . ILE A 1 259 ? 2.434   49.421  10.111  1.00 25.41  ? 377 ILE A CA  1 
ATOM   1716 C C   . ILE A 1 259 ? 2.555   48.038  10.728  1.00 32.34  ? 377 ILE A C   1 
ATOM   1717 O O   . ILE A 1 259 ? 3.184   47.145  10.155  1.00 33.09  ? 377 ILE A O   1 
ATOM   1718 C CB  . ILE A 1 259 ? 3.471   50.394  10.693  1.00 29.02  ? 377 ILE A CB  1 
ATOM   1719 C CG1 . ILE A 1 259 ? 3.512   51.665  9.833   1.00 27.94  ? 377 ILE A CG1 1 
ATOM   1720 C CG2 . ILE A 1 259 ? 4.857   49.739  10.773  1.00 29.11  ? 377 ILE A CG2 1 
ATOM   1721 C CD1 . ILE A 1 259 ? 4.238   52.834  10.493  1.00 30.47  ? 377 ILE A CD1 1 
ATOM   1722 N N   . GLU A 1 260 ? 1.941   47.834  11.900  1.00 32.10  ? 378 GLU A N   1 
ATOM   1723 C CA  . GLU A 1 260 ? 2.068   46.532  12.549  1.00 34.47  ? 378 GLU A CA  1 
ATOM   1724 C C   . GLU A 1 260 ? 1.400   45.452  11.721  1.00 40.25  ? 378 GLU A C   1 
ATOM   1725 O O   . GLU A 1 260 ? 1.938   44.350  11.578  1.00 40.35  ? 378 GLU A O   1 
ATOM   1726 C CB  . GLU A 1 260 ? 1.471   46.549  13.956  1.00 37.98  ? 378 GLU A CB  1 
ATOM   1727 C CG  . GLU A 1 260 ? 2.399   47.075  15.033  1.00 49.65  ? 378 GLU A CG  1 
ATOM   1728 C CD  . GLU A 1 260 ? 1.636   47.612  16.230  1.00 59.38  ? 378 GLU A CD  1 
ATOM   1729 O OE1 . GLU A 1 260 ? 2.263   48.300  17.062  1.00 61.28  ? 378 GLU A OE1 1 
ATOM   1730 O OE2 . GLU A 1 260 ? 0.417   47.329  16.352  1.00 60.34  ? 378 GLU A OE2 1 
ATOM   1731 N N   . CYS A 1 261 ? 0.239   45.761  11.143  1.00 33.55  ? 379 CYS A N   1 
ATOM   1732 C CA  . CYS A 1 261 ? -0.501  44.757  10.395  1.00 44.99  ? 379 CYS A CA  1 
ATOM   1733 C C   . CYS A 1 261 ? 0.068   44.494  9.011   1.00 43.70  ? 379 CYS A C   1 
ATOM   1734 O O   . CYS A 1 261 ? -0.141  43.401  8.483   1.00 45.98  ? 379 CYS A O   1 
ATOM   1735 C CB  . CYS A 1 261 ? -1.971  45.174  10.264  1.00 45.22  ? 379 CYS A CB  1 
ATOM   1736 S SG  . CYS A 1 261 ? -2.782  45.343  11.843  1.00 72.32  ? 379 CYS A SG  1 
ATOM   1737 N N   . ASN A 1 262 ? 0.782   45.449  8.403   1.00 44.40  ? 380 ASN A N   1 
ATOM   1738 C CA  . ASN A 1 262 ? 1.151   45.326  6.997   1.00 42.36  ? 380 ASN A CA  1 
ATOM   1739 C C   . ASN A 1 262 ? 2.647   45.339  6.726   1.00 46.74  ? 380 ASN A C   1 
ATOM   1740 O O   . ASN A 1 262 ? 3.038   45.266  5.560   1.00 46.66  ? 380 ASN A O   1 
ATOM   1741 C CB  . ASN A 1 262 ? 0.509   46.450  6.179   1.00 44.57  ? 380 ASN A CB  1 
ATOM   1742 C CG  . ASN A 1 262 ? -0.992  46.450  6.276   1.00 46.30  ? 380 ASN A CG  1 
ATOM   1743 O OD1 . ASN A 1 262 ? -1.642  45.410  6.173   1.00 65.73  ? 380 ASN A OD1 1 
ATOM   1744 N ND2 . ASN A 1 262 ? -1.554  47.617  6.523   1.00 46.07  ? 380 ASN A ND2 1 
ATOM   1745 N N   . ARG A 1 263 ? 3.495   45.451  7.746   1.00 42.90  ? 381 ARG A N   1 
ATOM   1746 C CA  . ARG A 1 263 ? 4.942   45.549  7.546   1.00 43.35  ? 381 ARG A CA  1 
ATOM   1747 C C   . ARG A 1 263 ? 5.706   44.690  8.548   1.00 48.84  ? 381 ARG A C   1 
ATOM   1748 O O   . ARG A 1 263 ? 6.282   45.193  9.525   1.00 46.08  ? 381 ARG A O   1 
ATOM   1749 C CB  . ARG A 1 263 ? 5.395   47.003  7.623   1.00 44.67  ? 381 ARG A CB  1 
ATOM   1750 C CG  . ARG A 1 263 ? 4.882   47.847  6.463   1.00 41.20  ? 381 ARG A CG  1 
ATOM   1751 C CD  . ARG A 1 263 ? 5.478   49.170  6.671   1.00 43.99  ? 381 ARG A CD  1 
ATOM   1752 N NE  . ARG A 1 263 ? 5.320   50.150  5.603   1.00 43.77  ? 381 ARG A NE  1 
ATOM   1753 C CZ  . ARG A 1 263 ? 6.086   50.218  4.521   1.00 40.45  ? 381 ARG A CZ  1 
ATOM   1754 N NH1 . ARG A 1 263 ? 7.025   49.307  4.289   1.00 38.82  ? 381 ARG A NH1 1 
ATOM   1755 N NH2 . ARG A 1 263 ? 5.895   51.202  3.662   1.00 37.10  ? 381 ARG A NH2 1 
ATOM   1756 N N   . PRO A 1 264 ? 5.764   43.378  8.315   1.00 50.32  ? 382 PRO A N   1 
ATOM   1757 C CA  . PRO A 1 264 ? 6.452   42.483  9.254   1.00 47.38  ? 382 PRO A CA  1 
ATOM   1758 C C   . PRO A 1 264 ? 7.962   42.412  9.071   1.00 56.76  ? 382 PRO A C   1 
ATOM   1759 O O   . PRO A 1 264 ? 8.633   41.748  9.873   1.00 59.56  ? 382 PRO A O   1 
ATOM   1760 C CB  . PRO A 1 264 ? 5.807   41.128  8.943   1.00 56.85  ? 382 PRO A CB  1 
ATOM   1761 C CG  . PRO A 1 264 ? 5.540   41.201  7.469   1.00 50.81  ? 382 PRO A CG  1 
ATOM   1762 C CD  . PRO A 1 264 ? 5.182   42.649  7.173   1.00 49.59  ? 382 PRO A CD  1 
ATOM   1763 N N   . GLN A 1 265 ? 8.518   43.089  8.072   1.00 47.09  ? 383 GLN A N   1 
ATOM   1764 C CA  . GLN A 1 265 ? 9.904   42.862  7.689   1.00 50.96  ? 383 GLN A CA  1 
ATOM   1765 C C   . GLN A 1 265 ? 10.866  43.494  8.700   1.00 53.39  ? 383 GLN A C   1 
ATOM   1766 O O   . GLN A 1 265 ? 10.559  44.526  9.307   1.00 48.00  ? 383 GLN A O   1 
ATOM   1767 C CB  . GLN A 1 265 ? 10.159  43.429  6.296   1.00 57.33  ? 383 GLN A CB  1 
ATOM   1768 C CG  . GLN A 1 265 ? 9.487   42.647  5.160   1.00 52.98  ? 383 GLN A CG  1 
ATOM   1769 C CD  . GLN A 1 265 ? 8.042   43.080  4.908   1.00 64.78  ? 383 GLN A CD  1 
ATOM   1770 O OE1 . GLN A 1 265 ? 7.537   44.018  5.534   1.00 56.51  ? 383 GLN A OE1 1 
ATOM   1771 N NE2 . GLN A 1 265 ? 7.381   42.409  3.972   1.00 58.97  ? 383 GLN A NE2 1 
ATOM   1772 N N   . PRO A 1 266 ? 12.036  42.882  8.910   1.00 52.16  ? 384 PRO A N   1 
ATOM   1773 C CA  . PRO A 1 266 ? 13.029  43.494  9.808   1.00 50.55  ? 384 PRO A CA  1 
ATOM   1774 C C   . PRO A 1 266 ? 13.436  44.898  9.395   1.00 52.88  ? 384 PRO A C   1 
ATOM   1775 O O   . PRO A 1 266 ? 13.874  45.681  10.247  1.00 50.65  ? 384 PRO A O   1 
ATOM   1776 C CB  . PRO A 1 266 ? 14.217  42.524  9.724   1.00 58.89  ? 384 PRO A CB  1 
ATOM   1777 C CG  . PRO A 1 266 ? 13.579  41.197  9.415   1.00 58.92  ? 384 PRO A CG  1 
ATOM   1778 C CD  . PRO A 1 266 ? 12.446  41.534  8.469   1.00 57.89  ? 384 PRO A CD  1 
ATOM   1779 N N   . ALA A 1 267 ? 13.319  45.249  8.114   1.00 48.99  ? 385 ALA A N   1 
ATOM   1780 C CA  . ALA A 1 267 ? 13.709  46.594  7.718   1.00 50.29  ? 385 ALA A CA  1 
ATOM   1781 C C   . ALA A 1 267 ? 12.754  47.638  8.268   1.00 58.03  ? 385 ALA A C   1 
ATOM   1782 O O   . ALA A 1 267 ? 13.122  48.816  8.350   1.00 49.63  ? 385 ALA A O   1 
ATOM   1783 C CB  . ALA A 1 267 ? 13.792  46.710  6.194   1.00 54.59  ? 385 ALA A CB  1 
ATOM   1784 N N   . HIS A 1 268 ? 11.544  47.228  8.661   1.00 50.79  ? 386 HIS A N   1 
ATOM   1785 C CA  . HIS A 1 268 ? 10.521  48.154  9.122   1.00 45.67  ? 386 HIS A CA  1 
ATOM   1786 C C   . HIS A 1 268 ? 10.349  48.103  10.629  1.00 39.79  ? 386 HIS A C   1 
ATOM   1787 O O   . HIS A 1 268 ? 9.378   48.656  11.157  1.00 30.85  ? 386 HIS A O   1 
ATOM   1788 C CB  . HIS A 1 268 ? 9.201   47.877  8.398   1.00 38.36  ? 386 HIS A CB  1 
ATOM   1789 C CG  . HIS A 1 268 ? 9.371   47.743  6.914   1.00 41.14  ? 386 HIS A CG  1 
ATOM   1790 N ND1 . HIS A 1 268 ? 9.959   48.726  6.147   1.00 45.68  ? 386 HIS A ND1 1 
ATOM   1791 C CD2 . HIS A 1 268 ? 9.075   46.728  6.065   1.00 45.46  ? 386 HIS A CD2 1 
ATOM   1792 C CE1 . HIS A 1 268 ? 10.007  48.326  4.886   1.00 47.19  ? 386 HIS A CE1 1 
ATOM   1793 N NE2 . HIS A 1 268 ? 9.473   47.119  4.810   1.00 44.12  ? 386 HIS A NE2 1 
ATOM   1794 N N   . ARG A 1 269 ? 11.271  47.456  11.337  1.00 34.88  ? 387 ARG A N   1 
ATOM   1795 C CA  . ARG A 1 269 ? 11.260  47.588  12.781  1.00 34.78  ? 387 ARG A CA  1 
ATOM   1796 C C   . ARG A 1 269 ? 11.463  49.049  13.115  1.00 30.39  ? 387 ARG A C   1 
ATOM   1797 O O   . ARG A 1 269 ? 12.304  49.727  12.515  1.00 36.37  ? 387 ARG A O   1 
ATOM   1798 C CB  . ARG A 1 269 ? 12.353  46.723  13.430  1.00 36.92  ? 387 ARG A CB  1 
ATOM   1799 C CG  . ARG A 1 269 ? 12.031  45.249  13.424  1.00 36.83  ? 387 ARG A CG  1 
ATOM   1800 C CD  . ARG A 1 269 ? 13.143  44.448  14.053  1.00 37.07  ? 387 ARG A CD  1 
ATOM   1801 N NE  . ARG A 1 269 ? 13.305  44.705  15.490  1.00 31.89  ? 387 ARG A NE  1 
ATOM   1802 C CZ  . ARG A 1 269 ? 14.348  44.292  16.210  1.00 29.18  ? 387 ARG A CZ  1 
ATOM   1803 N NH1 . ARG A 1 269 ? 15.341  43.616  15.633  1.00 24.97  ? 387 ARG A NH1 1 
ATOM   1804 N NH2 . ARG A 1 269 ? 14.395  44.545  17.515  1.00 27.12  ? 387 ARG A NH2 1 
ATOM   1805 N N   . PHE A 1 270 ? 10.668  49.542  14.047  1.00 30.44  ? 388 PHE A N   1 
ATOM   1806 C CA  . PHE A 1 270 ? 10.746  50.914  14.511  1.00 30.74  ? 388 PHE A CA  1 
ATOM   1807 C C   . PHE A 1 270 ? 10.293  51.906  13.444  1.00 27.87  ? 388 PHE A C   1 
ATOM   1808 O O   . PHE A 1 270 ? 10.524  53.109  13.615  1.00 26.45  ? 388 PHE A O   1 
ATOM   1809 C CB  . PHE A 1 270 ? 12.166  51.286  14.971  1.00 29.70  ? 388 PHE A CB  1 
ATOM   1810 C CG  . PHE A 1 270 ? 12.811  50.254  15.874  1.00 29.79  ? 388 PHE A CG  1 
ATOM   1811 C CD1 . PHE A 1 270 ? 12.207  49.891  17.070  1.00 33.94  ? 388 PHE A CD1 1 
ATOM   1812 C CD2 . PHE A 1 270 ? 14.032  49.677  15.532  1.00 37.51  ? 388 PHE A CD2 1 
ATOM   1813 C CE1 . PHE A 1 270 ? 12.797  48.952  17.913  1.00 34.81  ? 388 PHE A CE1 1 
ATOM   1814 C CE2 . PHE A 1 270 ? 14.636  48.734  16.381  1.00 32.26  ? 388 PHE A CE2 1 
ATOM   1815 C CZ  . PHE A 1 270 ? 13.998  48.377  17.564  1.00 29.83  ? 388 PHE A CZ  1 
ATOM   1816 N N   . LEU A 1 271 ? 9.643   51.448  12.365  1.00 32.64  ? 389 LEU A N   1 
ATOM   1817 C CA  . LEU A 1 271 ? 9.231   52.377  11.310  1.00 28.79  ? 389 LEU A CA  1 
ATOM   1818 C C   . LEU A 1 271 ? 8.307   53.450  11.852  1.00 31.85  ? 389 LEU A C   1 
ATOM   1819 O O   . LEU A 1 271 ? 8.462   54.633  11.521  1.00 28.71  ? 389 LEU A O   1 
ATOM   1820 C CB  . LEU A 1 271 ? 8.547   51.642  10.159  1.00 32.22  ? 389 LEU A CB  1 
ATOM   1821 C CG  . LEU A 1 271 ? 8.058   52.584  9.035   1.00 33.19  ? 389 LEU A CG  1 
ATOM   1822 C CD1 . LEU A 1 271 ? 9.212   53.414  8.480   1.00 27.75  ? 389 LEU A CD1 1 
ATOM   1823 C CD2 . LEU A 1 271 ? 7.381   51.808  7.903   1.00 30.77  ? 389 LEU A CD2 1 
ATOM   1824 N N   . PHE A 1 272 ? 7.337   53.069  12.697  1.00 27.57  ? 390 PHE A N   1 
ATOM   1825 C CA  . PHE A 1 272 ? 6.436   54.072  13.238  1.00 27.14  ? 390 PHE A CA  1 
ATOM   1826 C C   . PHE A 1 272 ? 7.216   55.160  13.951  1.00 35.92  ? 390 PHE A C   1 
ATOM   1827 O O   . PHE A 1 272 ? 6.959   56.352  13.747  1.00 27.91  ? 390 PHE A O   1 
ATOM   1828 C CB  . PHE A 1 272 ? 5.399   53.445  14.184  1.00 27.62  ? 390 PHE A CB  1 
ATOM   1829 C CG  . PHE A 1 272 ? 4.596   54.460  14.938  1.00 31.37  ? 390 PHE A CG  1 
ATOM   1830 C CD1 . PHE A 1 272 ? 3.641   55.226  14.284  1.00 31.18  ? 390 PHE A CD1 1 
ATOM   1831 C CD2 . PHE A 1 272 ? 4.799   54.673  16.293  1.00 31.72  ? 390 PHE A CD2 1 
ATOM   1832 C CE1 . PHE A 1 272 ? 2.898   56.182  14.980  1.00 28.50  ? 390 PHE A CE1 1 
ATOM   1833 C CE2 . PHE A 1 272 ? 4.068   55.622  16.986  1.00 28.05  ? 390 PHE A CE2 1 
ATOM   1834 C CZ  . PHE A 1 272 ? 3.117   56.379  16.340  1.00 28.73  ? 390 PHE A CZ  1 
ATOM   1835 N N   . LEU A 1 273 ? 8.205   54.769  14.771  1.00 26.33  ? 391 LEU A N   1 
ATOM   1836 C CA  . LEU A 1 273 ? 8.950   55.762  15.522  1.00 26.41  ? 391 LEU A CA  1 
ATOM   1837 C C   . LEU A 1 273 ? 9.816   56.596  14.602  1.00 23.15  ? 391 LEU A C   1 
ATOM   1838 O O   . LEU A 1 273 ? 10.014  57.788  14.863  1.00 27.13  ? 391 LEU A O   1 
ATOM   1839 C CB  . LEU A 1 273 ? 9.808   55.090  16.606  1.00 28.43  ? 391 LEU A CB  1 
ATOM   1840 C CG  . LEU A 1 273 ? 8.982   54.493  17.763  1.00 28.67  ? 391 LEU A CG  1 
ATOM   1841 C CD1 . LEU A 1 273 ? 9.938   53.845  18.749  1.00 33.56  ? 391 LEU A CD1 1 
ATOM   1842 C CD2 . LEU A 1 273 ? 8.119   55.527  18.472  1.00 31.42  ? 391 LEU A CD2 1 
ATOM   1843 N N   . LYS A 1 274 ? 10.349  55.998  13.534  1.00 24.36  ? 392 LYS A N   1 
ATOM   1844 C CA  . LYS A 1 274 ? 11.110  56.789  12.566  1.00 31.64  ? 392 LYS A CA  1 
ATOM   1845 C C   . LYS A 1 274 ? 10.230  57.838  11.911  1.00 29.15  ? 392 LYS A C   1 
ATOM   1846 O O   . LYS A 1 274 ? 10.656  58.982  11.712  1.00 26.93  ? 392 LYS A O   1 
ATOM   1847 C CB  . LYS A 1 274 ? 11.718  55.897  11.495  1.00 26.08  ? 392 LYS A CB  1 
ATOM   1848 C CG  . LYS A 1 274 ? 12.799  54.961  12.009  1.00 31.56  ? 392 LYS A CG  1 
ATOM   1849 C CD  . LYS A 1 274 ? 13.339  54.070  10.884  1.00 33.21  ? 392 LYS A CD  1 
ATOM   1850 C CE  . LYS A 1 274 ? 14.338  53.056  11.463  1.00 37.69  ? 392 LYS A CE  1 
ATOM   1851 N NZ  . LYS A 1 274 ? 15.055  52.293  10.421  1.00 41.06  ? 392 LYS A NZ  1 
ATOM   1852 N N   . ILE A 1 275 ? 9.005   57.456  11.546  1.00 28.90  ? 393 ILE A N   1 
ATOM   1853 C CA  . ILE A 1 275 ? 8.075   58.409  10.933  1.00 28.20  ? 393 ILE A CA  1 
ATOM   1854 C C   . ILE A 1 275 ? 7.760   59.533  11.901  1.00 29.32  ? 393 ILE A C   1 
ATOM   1855 O O   . ILE A 1 275 ? 7.777   60.714  11.531  1.00 26.69  ? 393 ILE A O   1 
ATOM   1856 C CB  . ILE A 1 275 ? 6.800   57.687  10.465  1.00 25.92  ? 393 ILE A CB  1 
ATOM   1857 C CG1 . ILE A 1 275 ? 7.118   56.776  9.276   1.00 22.88  ? 393 ILE A CG1 1 
ATOM   1858 C CG2 . ILE A 1 275 ? 5.707   58.719  10.099  1.00 28.14  ? 393 ILE A CG2 1 
ATOM   1859 C CD1 . ILE A 1 275 ? 5.959   55.814  8.897   1.00 23.44  ? 393 ILE A CD1 1 
ATOM   1860 N N   . MET A 1 276 ? 7.478   59.199  13.168  1.00 26.65  ? 394 MET A N   1 
ATOM   1861 C CA  . MET A 1 276 ? 7.154   60.276  14.099  1.00 23.30  ? 394 MET A CA  1 
ATOM   1862 C C   . MET A 1 276 ? 8.346   61.201  14.308  1.00 26.60  ? 394 MET A C   1 
ATOM   1863 O O   . MET A 1 276 ? 8.172   62.420  14.431  1.00 26.44  ? 394 MET A O   1 
ATOM   1864 C CB  . MET A 1 276 ? 6.639   59.713  15.428  1.00 29.66  ? 394 MET A CB  1 
ATOM   1865 C CG  . MET A 1 276 ? 5.412   58.830  15.214  1.00 33.97  ? 394 MET A CG  1 
ATOM   1866 S SD  . MET A 1 276 ? 3.966   59.809  14.672  1.00 35.33  ? 394 MET A SD  1 
ATOM   1867 C CE  . MET A 1 276 ? 3.767   60.973  16.007  1.00 31.24  ? 394 MET A CE  1 
ATOM   1868 N N   . ALA A 1 277 ? 9.563   60.661  14.296  1.00 28.12  ? 395 ALA A N   1 
ATOM   1869 C CA  . ALA A 1 277 ? 10.734  61.527  14.401  1.00 30.20  ? 395 ALA A CA  1 
ATOM   1870 C C   . ALA A 1 277 ? 10.867  62.442  13.180  1.00 32.40  ? 395 ALA A C   1 
ATOM   1871 O O   . ALA A 1 277 ? 11.256  63.611  13.314  1.00 30.43  ? 395 ALA A O   1 
ATOM   1872 C CB  . ALA A 1 277 ? 11.995  60.681  14.593  1.00 32.77  ? 395 ALA A CB  1 
ATOM   1873 N N   . MET A 1 278 ? 10.535  61.941  11.979  1.00 28.80  ? 396 MET A N   1 
ATOM   1874 C CA  A MET A 1 278 ? 10.566  62.799  10.793  0.55 28.16  ? 396 MET A CA  1 
ATOM   1875 C CA  B MET A 1 278 ? 10.577  62.808  10.804  0.45 28.17  ? 396 MET A CA  1 
ATOM   1876 C C   . MET A 1 278 ? 9.534   63.915  10.889  1.00 26.78  ? 396 MET A C   1 
ATOM   1877 O O   . MET A 1 278 ? 9.781   65.038  10.423  1.00 28.66  ? 396 MET A O   1 
ATOM   1878 C CB  A MET A 1 278 ? 10.325  61.987  9.523   0.55 26.94  ? 396 MET A CB  1 
ATOM   1879 C CB  B MET A 1 278 ? 10.371  61.983  9.541   0.45 26.89  ? 396 MET A CB  1 
ATOM   1880 C CG  A MET A 1 278 ? 11.374  60.945  9.271   0.55 31.82  ? 396 MET A CG  1 
ATOM   1881 C CG  B MET A 1 278 ? 11.367  60.861  9.442   0.45 31.92  ? 396 MET A CG  1 
ATOM   1882 S SD  A MET A 1 278 ? 12.976  61.702  8.989   0.55 38.01  ? 396 MET A SD  1 
ATOM   1883 S SD  B MET A 1 278 ? 12.053  60.589  7.820   0.45 29.88  ? 396 MET A SD  1 
ATOM   1884 C CE  A MET A 1 278 ? 12.772  62.393  7.351   0.55 32.01  ? 396 MET A CE  1 
ATOM   1885 C CE  B MET A 1 278 ? 12.738  62.214  7.481   0.45 32.09  ? 396 MET A CE  1 
ATOM   1886 N N   . LEU A 1 279 ? 8.371   63.625  11.469  1.00 26.82  ? 397 LEU A N   1 
ATOM   1887 C CA  . LEU A 1 279 ? 7.365   64.676  11.628  1.00 24.23  ? 397 LEU A CA  1 
ATOM   1888 C C   . LEU A 1 279 ? 7.842   65.754  12.584  1.00 33.23  ? 397 LEU A C   1 
ATOM   1889 O O   . LEU A 1 279 ? 7.578   66.943  12.369  1.00 29.78  ? 397 LEU A O   1 
ATOM   1890 C CB  . LEU A 1 279 ? 6.027   64.085  12.098  1.00 25.48  ? 397 LEU A CB  1 
ATOM   1891 C CG  . LEU A 1 279 ? 5.263   63.328  10.989  1.00 30.13  ? 397 LEU A CG  1 
ATOM   1892 C CD1 . LEU A 1 279 ? 4.066   62.536  11.567  1.00 30.65  ? 397 LEU A CD1 1 
ATOM   1893 C CD2 . LEU A 1 279 ? 4.826   64.293  9.859   1.00 28.30  ? 397 LEU A CD2 1 
ATOM   1894 N N   . THR A 1 280 ? 8.518   65.359  13.664  1.00 29.45  ? 398 THR A N   1 
ATOM   1895 C CA  . THR A 1 280 ? 9.143   66.349  14.530  1.00 35.26  ? 398 THR A CA  1 
ATOM   1896 C C   . THR A 1 280 ? 10.145  67.187  13.749  1.00 28.17  ? 398 THR A C   1 
ATOM   1897 O O   . THR A 1 280 ? 10.147  68.418  13.842  1.00 32.32  ? 398 THR A O   1 
ATOM   1898 C CB  . THR A 1 280 ? 9.803   65.648  15.720  1.00 31.50  ? 398 THR A CB  1 
ATOM   1899 O OG1 . THR A 1 280 ? 8.777   65.034  16.502  1.00 35.87  ? 398 THR A OG1 1 
ATOM   1900 C CG2 . THR A 1 280 ? 10.587  66.627  16.571  1.00 33.62  ? 398 THR A CG2 1 
ATOM   1901 N N   . GLU A 1 281 ? 10.985  66.537  12.946  1.00 29.41  ? 399 GLU A N   1 
ATOM   1902 C CA  . GLU A 1 281 ? 11.969  67.276  12.161  1.00 31.83  ? 399 GLU A CA  1 
ATOM   1903 C C   . GLU A 1 281 ? 11.284  68.183  11.151  1.00 37.48  ? 399 GLU A C   1 
ATOM   1904 O O   . GLU A 1 281 ? 11.705  69.322  10.933  1.00 32.11  ? 399 GLU A O   1 
ATOM   1905 C CB  . GLU A 1 281 ? 12.907  66.289  11.467  1.00 32.56  ? 399 GLU A CB  1 
ATOM   1906 C CG  . GLU A 1 281 ? 13.887  66.873  10.466  1.00 42.92  ? 399 GLU A CG  1 
ATOM   1907 C CD  . GLU A 1 281 ? 14.876  67.852  11.099  1.00 56.03  ? 399 GLU A CD  1 
ATOM   1908 O OE1 . GLU A 1 281 ? 15.374  68.760  10.386  1.00 52.24  ? 399 GLU A OE1 1 
ATOM   1909 O OE2 . GLU A 1 281 ? 15.097  67.757  12.326  1.00 50.42  ? 399 GLU A OE2 1 
ATOM   1910 N N   . LEU A 1 282 ? 10.199  67.705  10.553  1.00 30.63  ? 400 LEU A N   1 
ATOM   1911 C CA  . LEU A 1 282 ? 9.478   68.532  9.595   1.00 28.77  ? 400 LEU A CA  1 
ATOM   1912 C C   . LEU A 1 282 ? 8.949   69.789  10.264  1.00 26.79  ? 400 LEU A C   1 
ATOM   1913 O O   . LEU A 1 282 ? 8.970   70.874  9.675   1.00 31.85  ? 400 LEU A O   1 
ATOM   1914 C CB  . LEU A 1 282 ? 8.340   67.713  8.976   1.00 26.21  ? 400 LEU A CB  1 
ATOM   1915 C CG  . LEU A 1 282 ? 7.472   68.410  7.938   1.00 28.61  ? 400 LEU A CG  1 
ATOM   1916 C CD1 . LEU A 1 282 ? 8.366   69.020  6.866   1.00 32.09  ? 400 LEU A CD1 1 
ATOM   1917 C CD2 . LEU A 1 282 ? 6.532   67.367  7.370   1.00 30.33  ? 400 LEU A CD2 1 
ATOM   1918 N N   . ARG A 1 283 ? 8.489   69.670  11.509  1.00 28.32  ? 401 ARG A N   1 
ATOM   1919 C CA  . ARG A 1 283 ? 8.006   70.849  12.218  1.00 30.90  ? 401 ARG A CA  1 
ATOM   1920 C C   . ARG A 1 283 ? 9.127   71.850  12.441  1.00 36.22  ? 401 ARG A C   1 
ATOM   1921 O O   . ARG A 1 283 ? 8.926   73.058  12.280  1.00 33.43  ? 401 ARG A O   1 
ATOM   1922 C CB  . ARG A 1 283 ? 7.375   70.447  13.548  1.00 35.10  ? 401 ARG A CB  1 
ATOM   1923 C CG  . ARG A 1 283 ? 6.845   71.647  14.274  1.00 46.14  ? 401 ARG A CG  1 
ATOM   1924 C CD  . ARG A 1 283 ? 5.558   71.281  14.968  1.00 62.10  ? 401 ARG A CD  1 
ATOM   1925 N NE  . ARG A 1 283 ? 4.989   72.419  15.673  1.00 56.63  ? 401 ARG A NE  1 
ATOM   1926 C CZ  . ARG A 1 283 ? 4.160   72.299  16.693  1.00 61.50  ? 401 ARG A CZ  1 
ATOM   1927 N NH1 . ARG A 1 283 ? 3.668   73.378  17.293  1.00 73.87  ? 401 ARG A NH1 1 
ATOM   1928 N NH2 . ARG A 1 283 ? 3.816   71.089  17.105  1.00 73.07  ? 401 ARG A NH2 1 
ATOM   1929 N N   . SER A 1 284 ? 10.316  71.365  12.799  1.00 34.71  ? 402 SER A N   1 
ATOM   1930 C CA  A SER A 1 284 ? 11.483  72.240  12.926  0.61 37.97  ? 402 SER A CA  1 
ATOM   1931 C CA  B SER A 1 284 ? 11.470  72.257  12.929  0.39 37.99  ? 402 SER A CA  1 
ATOM   1932 C C   . SER A 1 284 ? 11.814  72.930  11.606  1.00 37.87  ? 402 SER A C   1 
ATOM   1933 O O   . SER A 1 284 ? 12.055  74.144  11.569  1.00 38.57  ? 402 SER A O   1 
ATOM   1934 C CB  A SER A 1 284 ? 12.684  71.430  13.420  0.61 37.48  ? 402 SER A CB  1 
ATOM   1935 C CB  B SER A 1 284 ? 12.678  71.489  13.465  0.39 37.50  ? 402 SER A CB  1 
ATOM   1936 O OG  A SER A 1 284 ? 13.847  72.231  13.445  0.61 41.79  ? 402 SER A OG  1 
ATOM   1937 O OG  B SER A 1 284 ? 12.437  71.057  14.787  0.39 38.25  ? 402 SER A OG  1 
ATOM   1938 N N   . ILE A 1 285 ? 11.857  72.158  10.507  1.00 32.94  ? 403 ILE A N   1 
ATOM   1939 C CA  . ILE A 1 285 ? 12.090  72.729  9.173   1.00 34.74  ? 403 ILE A CA  1 
ATOM   1940 C C   . ILE A 1 285 ? 11.036  73.775  8.834   1.00 37.56  ? 403 ILE A C   1 
ATOM   1941 O O   . ILE A 1 285 ? 11.338  74.812  8.224   1.00 33.59  ? 403 ILE A O   1 
ATOM   1942 C CB  . ILE A 1 285 ? 12.107  71.612  8.118   1.00 35.65  ? 403 ILE A CB  1 
ATOM   1943 C CG1 . ILE A 1 285 ? 13.359  70.746  8.282   1.00 36.25  ? 403 ILE A CG1 1 
ATOM   1944 C CG2 . ILE A 1 285 ? 12.030  72.182  6.732   1.00 36.68  ? 403 ILE A CG2 1 
ATOM   1945 C CD1 . ILE A 1 285 ? 13.280  69.467  7.498   1.00 38.72  ? 403 ILE A CD1 1 
ATOM   1946 N N   . ASN A 1 286 ? 9.776   73.496  9.181   1.00 32.64  ? 404 ASN A N   1 
ATOM   1947 C CA  . ASN A 1 286 ? 8.699   74.470  8.986   1.00 30.96  ? 404 ASN A CA  1 
ATOM   1948 C C   . ASN A 1 286 ? 9.025   75.787  9.673   1.00 36.53  ? 404 ASN A C   1 
ATOM   1949 O O   . ASN A 1 286 ? 8.910   76.859  9.068   1.00 31.28  ? 404 ASN A O   1 
ATOM   1950 C CB  . ASN A 1 286 ? 7.380   73.904  9.527   1.00 32.90  ? 404 ASN A CB  1 
ATOM   1951 C CG  . ASN A 1 286 ? 6.169   74.787  9.196   1.00 39.31  ? 404 ASN A CG  1 
ATOM   1952 O OD1 . ASN A 1 286 ? 6.236   75.671  8.344   1.00 41.42  ? 404 ASN A OD1 1 
ATOM   1953 N ND2 . ASN A 1 286 ? 5.062   74.558  9.899   1.00 42.62  ? 404 ASN A ND2 1 
ATOM   1954 N N   . ALA A 1 287 ? 9.448   75.724  10.939  1.00 34.30  ? 405 ALA A N   1 
ATOM   1955 C CA  . ALA A 1 287 ? 9.762   76.949  11.673  1.00 38.61  ? 405 ALA A CA  1 
ATOM   1956 C C   . ALA A 1 287 ? 10.935  77.690  11.035  1.00 42.04  ? 405 ALA A C   1 
ATOM   1957 O O   . ALA A 1 287 ? 10.889  78.913  10.869  1.00 45.17  ? 405 ALA A O   1 
ATOM   1958 C CB  . ALA A 1 287 ? 10.047  76.626  13.141  1.00 33.48  ? 405 ALA A CB  1 
ATOM   1959 N N   . GLN A 1 288 ? 12.003  76.965  10.681  1.00 39.72  ? 406 GLN A N   1 
ATOM   1960 C CA  . GLN A 1 288 ? 13.126  77.573  9.964   1.00 41.82  ? 406 GLN A CA  1 
ATOM   1961 C C   . GLN A 1 288 ? 12.651  78.310  8.717   1.00 44.14  ? 406 GLN A C   1 
ATOM   1962 O O   . GLN A 1 288 ? 12.994  79.476  8.487   1.00 39.25  ? 406 GLN A O   1 
ATOM   1963 C CB  . GLN A 1 288 ? 14.131  76.500  9.536   1.00 51.00  ? 406 GLN A CB  1 
ATOM   1964 C CG  . GLN A 1 288 ? 14.929  75.810  10.618  1.00 58.41  ? 406 GLN A CG  1 
ATOM   1965 C CD  . GLN A 1 288 ? 15.712  74.619  10.051  1.00 66.58  ? 406 GLN A CD  1 
ATOM   1966 O OE1 . GLN A 1 288 ? 16.250  73.797  10.798  1.00 68.60  ? 406 GLN A OE1 1 
ATOM   1967 N NE2 . GLN A 1 288 ? 15.770  74.525  8.714   1.00 64.20  ? 406 GLN A NE2 1 
ATOM   1968 N N   . HIS A 1 289 ? 11.866  77.629  7.883   1.00 34.25  ? 407 HIS A N   1 
ATOM   1969 C CA  A HIS A 1 289 ? 11.473  78.257  6.629   0.52 40.33  ? 407 HIS A CA  1 
ATOM   1970 C CA  B HIS A 1 289 ? 11.414  78.192  6.615   0.48 40.34  ? 407 HIS A CA  1 
ATOM   1971 C C   . HIS A 1 289 ? 10.474  79.380  6.810   1.00 38.24  ? 407 HIS A C   1 
ATOM   1972 O O   . HIS A 1 289 ? 10.503  80.335  6.025   1.00 42.48  ? 407 HIS A O   1 
ATOM   1973 C CB  A HIS A 1 289 ? 10.950  77.239  5.624   0.52 46.36  ? 407 HIS A CB  1 
ATOM   1974 C CB  B HIS A 1 289 ? 10.785  77.062  5.790   0.48 45.93  ? 407 HIS A CB  1 
ATOM   1975 C CG  A HIS A 1 289 ? 12.032  76.597  4.820   0.52 51.01  ? 407 HIS A CG  1 
ATOM   1976 C CG  B HIS A 1 289 ? 10.012  77.505  4.585   0.48 48.97  ? 407 HIS A CG  1 
ATOM   1977 N ND1 A HIS A 1 289 ? 12.243  76.919  3.497   0.52 51.79  ? 407 HIS A ND1 1 
ATOM   1978 N ND1 B HIS A 1 289 ? 8.827   78.206  4.672   0.48 45.76  ? 407 HIS A ND1 1 
ATOM   1979 C CD2 A HIS A 1 289 ? 12.990  75.699  5.149   0.52 54.95  ? 407 HIS A CD2 1 
ATOM   1980 C CD2 B HIS A 1 289 ? 10.273  77.372  3.263   0.48 50.69  ? 407 HIS A CD2 1 
ATOM   1981 C CE1 A HIS A 1 289 ? 13.269  76.227  3.038   0.52 58.24  ? 407 HIS A CE1 1 
ATOM   1982 C CE1 B HIS A 1 289 ? 8.369   78.445  3.457   0.48 49.38  ? 407 HIS A CE1 1 
ATOM   1983 N NE2 A HIS A 1 289 ? 13.740  75.478  4.019   0.52 58.79  ? 407 HIS A NE2 1 
ATOM   1984 N NE2 B HIS A 1 289 ? 9.235   77.961  2.584   0.48 51.21  ? 407 HIS A NE2 1 
ATOM   1985 N N   . THR A 1 290 ? 9.620   79.338  7.827   1.00 39.23  ? 408 THR A N   1 
ATOM   1986 C CA  . THR A 1 290 ? 8.750   80.492  8.041   1.00 35.81  ? 408 THR A CA  1 
ATOM   1987 C C   . THR A 1 290 ? 9.591   81.731  8.332   1.00 41.41  ? 408 THR A C   1 
ATOM   1988 O O   . THR A 1 290 ? 9.392   82.793  7.732   1.00 34.34  ? 408 THR A O   1 
ATOM   1989 C CB  . THR A 1 290 ? 7.762   80.221  9.179   1.00 41.33  ? 408 THR A CB  1 
ATOM   1990 O OG1 . THR A 1 290 ? 6.832   79.213  8.767   1.00 44.52  ? 408 THR A OG1 1 
ATOM   1991 C CG2 . THR A 1 290 ? 6.988   81.493  9.549   1.00 43.08  ? 408 THR A CG2 1 
ATOM   1992 N N   . GLN A 1 291 ? 10.565  81.601  9.227   1.00 35.90  ? 409 GLN A N   1 
ATOM   1993 C CA  . GLN A 1 291 ? 11.413  82.750  9.533   1.00 38.53  ? 409 GLN A CA  1 
ATOM   1994 C C   . GLN A 1 291 ? 12.214  83.157  8.305   1.00 41.08  ? 409 GLN A C   1 
ATOM   1995 O O   . GLN A 1 291 ? 12.330  84.345  7.989   1.00 40.28  ? 409 GLN A O   1 
ATOM   1996 C CB  . GLN A 1 291 ? 12.324  82.420  10.713  1.00 37.00  ? 409 GLN A CB  1 
ATOM   1997 C CG  . GLN A 1 291 ? 11.557  82.350  12.057  1.00 52.76  ? 409 GLN A CG  1 
ATOM   1998 C CD  . GLN A 1 291 ? 10.568  83.509  12.265  1.00 66.36  ? 409 GLN A CD  1 
ATOM   1999 O OE1 . GLN A 1 291 ? 10.958  84.679  12.344  1.00 65.89  ? 409 GLN A OE1 1 
ATOM   2000 N NE2 . GLN A 1 291 ? 9.278   83.176  12.355  1.00 63.85  ? 409 GLN A NE2 1 
ATOM   2001 N N   . ARG A 1 292 ? 12.716  82.175  7.565   1.00 42.23  ? 410 ARG A N   1 
ATOM   2002 C CA  . ARG A 1 292 ? 13.468  82.465  6.354   1.00 43.13  ? 410 ARG A CA  1 
ATOM   2003 C C   . ARG A 1 292 ? 12.616  83.247  5.350   1.00 41.53  ? 410 ARG A C   1 
ATOM   2004 O O   . ARG A 1 292 ? 13.065  84.251  4.788   1.00 42.10  ? 410 ARG A O   1 
ATOM   2005 C CB  . ARG A 1 292 ? 13.958  81.145  5.761   1.00 53.93  ? 410 ARG A CB  1 
ATOM   2006 C CG  . ARG A 1 292 ? 14.876  81.255  4.584   1.00 61.92  ? 410 ARG A CG  1 
ATOM   2007 C CD  . ARG A 1 292 ? 15.325  79.861  4.157   1.00 73.14  ? 410 ARG A CD  1 
ATOM   2008 N NE  . ARG A 1 292 ? 15.883  79.048  5.237   1.00 71.32  ? 410 ARG A NE  1 
ATOM   2009 C CZ  . ARG A 1 292 ? 16.821  78.121  5.051   1.00 83.31  ? 410 ARG A CZ  1 
ATOM   2010 N NH1 . ARG A 1 292 ? 17.276  77.407  6.073   1.00 85.94  ? 410 ARG A NH1 1 
ATOM   2011 N NH2 . ARG A 1 292 ? 17.301  77.902  3.835   1.00 80.61  ? 410 ARG A NH2 1 
ATOM   2012 N N   . LEU A 1 293 ? 11.364  82.833  5.142   1.00 35.02  ? 411 LEU A N   1 
ATOM   2013 C CA  . LEU A 1 293 ? 10.525  83.531  4.168   1.00 43.80  ? 411 LEU A CA  1 
ATOM   2014 C C   . LEU A 1 293 ? 10.132  84.925  4.641   1.00 35.61  ? 411 LEU A C   1 
ATOM   2015 O O   . LEU A 1 293 ? 10.049  85.853  3.830   1.00 34.08  ? 411 LEU A O   1 
ATOM   2016 C CB  . LEU A 1 293 ? 9.278   82.711  3.842   1.00 38.67  ? 411 LEU A CB  1 
ATOM   2017 C CG  . LEU A 1 293 ? 9.617   81.404  3.127   1.00 55.46  ? 411 LEU A CG  1 
ATOM   2018 N N   . LEU A 1 294 ? 9.855   85.090  5.934   1.00 38.79  ? 412 LEU A N   1 
ATOM   2019 C CA  . LEU A 1 294 ? 9.521   86.423  6.427   1.00 44.67  ? 412 LEU A CA  1 
ATOM   2020 C C   . LEU A 1 294 ? 10.690  87.393  6.269   1.00 44.87  ? 412 LEU A C   1 
ATOM   2021 O O   . LEU A 1 294 ? 10.468  88.583  6.025   1.00 46.90  ? 412 LEU A O   1 
ATOM   2022 C CB  . LEU A 1 294 ? 9.070   86.345  7.880   1.00 39.09  ? 412 LEU A CB  1 
ATOM   2023 C CG  . LEU A 1 294 ? 7.744   85.603  8.082   1.00 49.14  ? 412 LEU A CG  1 
ATOM   2024 C CD1 . LEU A 1 294 ? 7.346   85.588  9.554   1.00 56.22  ? 412 LEU A CD1 1 
ATOM   2025 C CD2 . LEU A 1 294 ? 6.633   86.215  7.239   1.00 52.40  ? 412 LEU A CD2 1 
ATOM   2026 N N   . ARG A 1 295 ? 11.932  86.908  6.391   1.00 40.81  ? 413 ARG A N   1 
ATOM   2027 C CA  . ARG A 1 295 ? 13.086  87.768  6.138   1.00 48.95  ? 413 ARG A CA  1 
ATOM   2028 C C   . ARG A 1 295 ? 13.143  88.189  4.678   1.00 44.23  ? 413 ARG A C   1 
ATOM   2029 O O   . ARG A 1 295 ? 13.280  89.380  4.375   1.00 49.43  ? 413 ARG A O   1 
ATOM   2030 C CB  . ARG A 1 295 ? 14.382  87.067  6.542   1.00 47.97  ? 413 ARG A CB  1 
ATOM   2031 C CG  . ARG A 1 295 ? 14.609  87.004  8.044   1.00 53.84  ? 413 ARG A CG  1 
ATOM   2032 C CD  . ARG A 1 295 ? 16.059  86.634  8.365   1.00 56.72  ? 413 ARG A CD  1 
ATOM   2033 N NE  . ARG A 1 295 ? 16.412  85.283  7.921   1.00 56.04  ? 413 ARG A NE  1 
ATOM   2034 C CZ  . ARG A 1 295 ? 16.212  84.189  8.650   1.00 56.81  ? 413 ARG A CZ  1 
ATOM   2035 N NH1 . ARG A 1 295 ? 15.669  84.293  9.856   1.00 48.04  ? 413 ARG A NH1 1 
ATOM   2036 N NH2 . ARG A 1 295 ? 16.557  82.999  8.181   1.00 52.71  ? 413 ARG A NH2 1 
ATOM   2037 N N   . ILE A 1 296 ? 13.044  87.227  3.757   1.00 40.65  ? 414 ILE A N   1 
ATOM   2038 C CA  . ILE A 1 296 ? 13.070  87.553  2.334   1.00 36.20  ? 414 ILE A CA  1 
ATOM   2039 C C   . ILE A 1 296 ? 11.919  88.480  1.978   1.00 43.26  ? 414 ILE A C   1 
ATOM   2040 O O   . ILE A 1 296 ? 12.097  89.471  1.262   1.00 45.69  ? 414 ILE A O   1 
ATOM   2041 C CB  . ILE A 1 296 ? 13.035  86.273  1.486   1.00 36.15  ? 414 ILE A CB  1 
ATOM   2042 C CG1 . ILE A 1 296 ? 14.285  85.426  1.743   1.00 44.65  ? 414 ILE A CG1 1 
ATOM   2043 C CG2 . ILE A 1 296 ? 12.846  86.619  0.022   1.00 41.49  ? 414 ILE A CG2 1 
ATOM   2044 C CD1 . ILE A 1 296 ? 14.201  84.047  1.160   1.00 47.90  ? 414 ILE A CD1 1 
ATOM   2045 N N   . GLN A 1 297 ? 10.718  88.160  2.468   1.00 38.07  ? 415 GLN A N   1 
ATOM   2046 C CA  . GLN A 1 297 ? 9.542   88.978  2.200   1.00 36.84  ? 415 GLN A CA  1 
ATOM   2047 C C   . GLN A 1 297 ? 9.753   90.405  2.671   1.00 46.83  ? 415 GLN A C   1 
ATOM   2048 O O   . GLN A 1 297 ? 9.241   91.353  2.062   1.00 43.38  ? 415 GLN A O   1 
ATOM   2049 C CB  . GLN A 1 297 ? 8.326   88.377  2.908   1.00 32.87  ? 415 GLN A CB  1 
ATOM   2050 C CG  . GLN A 1 297 ? 7.071   89.239  2.883   1.00 37.15  ? 415 GLN A CG  1 
ATOM   2051 C CD  . GLN A 1 297 ? 6.387   89.234  1.525   1.00 39.30  ? 415 GLN A CD  1 
ATOM   2052 O OE1 . GLN A 1 297 ? 6.770   88.475  0.621   1.00 36.20  ? 415 GLN A OE1 1 
ATOM   2053 N NE2 . GLN A 1 297 ? 5.369   90.081  1.370   1.00 38.90  ? 415 GLN A NE2 1 
ATOM   2054 N N   . ASP A 1 298 ? 10.509  90.575  3.752   1.00 45.29  ? 416 ASP A N   1 
ATOM   2055 C CA  . ASP A 1 298 ? 10.667  91.902  4.320   1.00 51.59  ? 416 ASP A CA  1 
ATOM   2056 C C   . ASP A 1 298 ? 11.523  92.799  3.435   1.00 50.80  ? 416 ASP A C   1 
ATOM   2057 O O   . ASP A 1 298 ? 11.291  94.012  3.384   1.00 65.82  ? 416 ASP A O   1 
ATOM   2058 C CB  . ASP A 1 298 ? 11.266  91.807  5.714   1.00 58.92  ? 416 ASP A CB  1 
ATOM   2059 C CG  . ASP A 1 298 ? 11.511  93.162  6.307   1.00 70.76  ? 416 ASP A CG  1 
ATOM   2060 O OD1 . ASP A 1 298 ? 12.669  93.452  6.677   1.00 72.15  ? 416 ASP A OD1 1 
ATOM   2061 O OD2 . ASP A 1 298 ? 10.536  93.943  6.369   1.00 65.10  ? 416 ASP A OD2 1 
ATOM   2062 N N   . ILE A 1 299 ? 12.503  92.240  2.726   1.00 49.65  ? 417 ILE A N   1 
ATOM   2063 C CA  . ILE A 1 299 ? 13.325  93.058  1.843   1.00 60.71  ? 417 ILE A CA  1 
ATOM   2064 C C   . ILE A 1 299 ? 12.919  92.945  0.371   1.00 60.47  ? 417 ILE A C   1 
ATOM   2065 O O   . ILE A 1 299 ? 13.222  93.858  -0.413  1.00 55.14  ? 417 ILE A O   1 
ATOM   2066 C CB  . ILE A 1 299 ? 14.822  92.723  2.015   1.00 64.05  ? 417 ILE A CB  1 
ATOM   2067 C CG1 . ILE A 1 299 ? 15.140  91.356  1.433   1.00 61.22  ? 417 ILE A CG1 1 
ATOM   2068 C CG2 . ILE A 1 299 ? 15.212  92.737  3.497   1.00 68.20  ? 417 ILE A CG2 1 
ATOM   2069 C CD1 . ILE A 1 299 ? 16.561  91.255  0.942   1.00 74.01  ? 417 ILE A CD1 1 
ATOM   2070 N N   . HIS A 1 300 ? 12.221  91.880  -0.021  1.00 46.19  ? 418 HIS A N   1 
ATOM   2071 C CA  . HIS A 1 300 ? 11.846  91.677  -1.420  1.00 44.96  ? 418 HIS A CA  1 
ATOM   2072 C C   . HIS A 1 300 ? 10.489  90.980  -1.462  1.00 48.50  ? 418 HIS A C   1 
ATOM   2073 O O   . HIS A 1 300 ? 10.407  89.741  -1.441  1.00 45.46  ? 418 HIS A O   1 
ATOM   2074 C CB  . HIS A 1 300 ? 12.903  90.865  -2.165  1.00 48.55  ? 418 HIS A CB  1 
ATOM   2075 C CG  . HIS A 1 300 ? 12.690  90.817  -3.644  1.00 54.55  ? 418 HIS A CG  1 
ATOM   2076 N ND1 . HIS A 1 300 ? 12.016  89.789  -4.267  1.00 61.03  ? 418 HIS A ND1 1 
ATOM   2077 C CD2 . HIS A 1 300 ? 13.043  91.682  -4.623  1.00 52.89  ? 418 HIS A CD2 1 
ATOM   2078 C CE1 . HIS A 1 300 ? 11.970  90.020  -5.567  1.00 57.15  ? 418 HIS A CE1 1 
ATOM   2079 N NE2 . HIS A 1 300 ? 12.586  91.163  -5.809  1.00 58.60  ? 418 HIS A NE2 1 
ATOM   2080 N N   . PRO A 1 301 ? 9.395   91.750  -1.514  1.00 44.64  ? 419 PRO A N   1 
ATOM   2081 C CA  . PRO A 1 301 ? 8.057   91.141  -1.445  1.00 41.35  ? 419 PRO A CA  1 
ATOM   2082 C C   . PRO A 1 301 ? 7.821   90.146  -2.570  1.00 41.79  ? 419 PRO A C   1 
ATOM   2083 O O   . PRO A 1 301 ? 8.177   90.383  -3.727  1.00 44.97  ? 419 PRO A O   1 
ATOM   2084 C CB  . PRO A 1 301 ? 7.108   92.345  -1.553  1.00 42.98  ? 419 PRO A CB  1 
ATOM   2085 C CG  . PRO A 1 301 ? 7.942   93.527  -1.132  1.00 46.89  ? 419 PRO A CG  1 
ATOM   2086 C CD  . PRO A 1 301 ? 9.324   93.219  -1.634  1.00 44.62  ? 419 PRO A CD  1 
ATOM   2087 N N   . PHE A 1 302 ? 7.207   89.017  -2.214  1.00 37.14  ? 420 PHE A N   1 
ATOM   2088 C CA  . PHE A 1 302 ? 6.908   87.979  -3.194  1.00 39.27  ? 420 PHE A CA  1 
ATOM   2089 C C   . PHE A 1 302 ? 5.714   87.108  -2.815  1.00 35.31  ? 420 PHE A C   1 
ATOM   2090 O O   . PHE A 1 302 ? 5.186   86.406  -3.680  1.00 31.50  ? 420 PHE A O   1 
ATOM   2091 C CB  . PHE A 1 302 ? 8.136   87.094  -3.409  1.00 33.82  ? 420 PHE A CB  1 
ATOM   2092 C CG  . PHE A 1 302 ? 8.401   86.173  -2.268  1.00 38.44  ? 420 PHE A CG  1 
ATOM   2093 C CD1 . PHE A 1 302 ? 9.023   86.634  -1.125  1.00 32.67  ? 420 PHE A CD1 1 
ATOM   2094 C CD2 . PHE A 1 302 ? 7.976   84.862  -2.312  1.00 40.92  ? 420 PHE A CD2 1 
ATOM   2095 C CE1 . PHE A 1 302 ? 9.256   85.799  -0.051  1.00 34.10  ? 420 PHE A CE1 1 
ATOM   2096 C CE2 . PHE A 1 302 ? 8.204   84.026  -1.253  1.00 42.60  ? 420 PHE A CE2 1 
ATOM   2097 C CZ  . PHE A 1 302 ? 8.844   84.496  -0.113  1.00 46.06  ? 420 PHE A CZ  1 
ATOM   2098 N N   . ALA A 1 303 ? 5.281   87.123  -1.547  1.00 30.75  ? 421 ALA A N   1 
ATOM   2099 C CA  . ALA A 1 303 ? 4.179   86.250  -1.147  1.00 31.82  ? 421 ALA A CA  1 
ATOM   2100 C C   . ALA A 1 303 ? 2.882   86.649  -1.856  1.00 33.35  ? 421 ALA A C   1 
ATOM   2101 O O   . ALA A 1 303 ? 2.499   87.828  -1.878  1.00 33.66  ? 421 ALA A O   1 
ATOM   2102 C CB  . ALA A 1 303 ? 3.986   86.281  0.367   1.00 29.08  ? 421 ALA A CB  1 
ATOM   2103 N N   . THR A 1 304 ? 2.211   85.659  -2.438  1.00 31.12  ? 422 THR A N   1 
ATOM   2104 C CA  . THR A 1 304 ? 0.888   85.852  -3.012  1.00 27.07  ? 422 THR A CA  1 
ATOM   2105 C C   . THR A 1 304 ? -0.102  86.179  -1.899  1.00 28.19  ? 422 THR A C   1 
ATOM   2106 O O   . THR A 1 304 ? 0.188   85.989  -0.709  1.00 27.26  ? 422 THR A O   1 
ATOM   2107 C CB  . THR A 1 304 ? 0.440   84.591  -3.754  1.00 31.98  ? 422 THR A CB  1 
ATOM   2108 O OG1 . THR A 1 304 ? 0.370   83.505  -2.815  1.00 29.27  ? 422 THR A OG1 1 
ATOM   2109 C CG2 . THR A 1 304 ? 1.416   84.236  -4.872  1.00 29.61  ? 422 THR A CG2 1 
ATOM   2110 N N   . PRO A 1 305 ? -1.291  86.671  -2.253  1.00 28.64  ? 423 PRO A N   1 
ATOM   2111 C CA  . PRO A 1 305 ? -2.313  86.872  -1.214  1.00 24.16  ? 423 PRO A CA  1 
ATOM   2112 C C   . PRO A 1 305 ? -2.618  85.622  -0.399  1.00 25.65  ? 423 PRO A C   1 
ATOM   2113 O O   . PRO A 1 305 ? -2.826  85.735  0.813   1.00 29.04  ? 423 PRO A O   1 
ATOM   2114 C CB  . PRO A 1 305 ? -3.528  87.349  -2.027  1.00 25.28  ? 423 PRO A CB  1 
ATOM   2115 C CG  . PRO A 1 305 ? -2.892  88.133  -3.170  1.00 29.53  ? 423 PRO A CG  1 
ATOM   2116 C CD  . PRO A 1 305 ? -1.677  87.296  -3.538  1.00 31.49  ? 423 PRO A CD  1 
ATOM   2117 N N   . LEU A 1 306 ? -2.661  84.432  -1.009  1.00 27.59  ? 424 LEU A N   1 
ATOM   2118 C CA  . LEU A 1 306 ? -2.925  83.243  -0.193  1.00 22.83  ? 424 LEU A CA  1 
ATOM   2119 C C   . LEU A 1 306 ? -1.777  82.990  0.770   1.00 24.36  ? 424 LEU A C   1 
ATOM   2120 O O   . LEU A 1 306 ? -1.996  82.659  1.943   1.00 27.44  ? 424 LEU A O   1 
ATOM   2121 C CB  . LEU A 1 306 ? -3.176  82.015  -1.079  1.00 28.46  ? 424 LEU A CB  1 
ATOM   2122 C CG  . LEU A 1 306 ? -3.452  80.713  -0.313  1.00 29.99  ? 424 LEU A CG  1 
ATOM   2123 C CD1 . LEU A 1 306 ? -4.648  80.870  0.657   1.00 30.34  ? 424 LEU A CD1 1 
ATOM   2124 C CD2 . LEU A 1 306 ? -3.677  79.521  -1.277  1.00 30.72  ? 424 LEU A CD2 1 
ATOM   2125 N N   . MET A 1 307 ? -0.541  83.164  0.309   1.00 30.53  ? 425 MET A N   1 
ATOM   2126 C CA  . MET A 1 307 ? 0.576   82.975  1.227   1.00 27.53  ? 425 MET A CA  1 
ATOM   2127 C C   . MET A 1 307 ? 0.541   83.998  2.345   1.00 27.76  ? 425 MET A C   1 
ATOM   2128 O O   . MET A 1 307 ? 0.810   83.667  3.510   1.00 30.76  ? 425 MET A O   1 
ATOM   2129 C CB  . MET A 1 307 ? 1.913   83.062  0.503   1.00 26.22  ? 425 MET A CB  1 
ATOM   2130 C CG  . MET A 1 307 ? 2.276   81.839  -0.324  1.00 32.29  ? 425 MET A CG  1 
ATOM   2131 S SD  . MET A 1 307 ? 3.395   82.273  -1.668  1.00 32.78  ? 425 MET A SD  1 
ATOM   2132 C CE  . MET A 1 307 ? 4.858   82.196  -0.649  1.00 27.03  ? 425 MET A CE  1 
ATOM   2133 N N   . GLN A 1 308 ? 0.246   85.267  2.010   1.00 26.52  ? 426 GLN A N   1 
ATOM   2134 C CA  . GLN A 1 308 ? 0.160   86.283  3.057   1.00 28.62  ? 426 GLN A CA  1 
ATOM   2135 C C   . GLN A 1 308 ? -0.858  85.887  4.112   1.00 29.89  ? 426 GLN A C   1 
ATOM   2136 O O   . GLN A 1 308 ? -0.598  85.993  5.318   1.00 33.62  ? 426 GLN A O   1 
ATOM   2137 C CB  . GLN A 1 308 ? -0.199  87.655  2.467   1.00 30.77  ? 426 GLN A CB  1 
ATOM   2138 C CG  . GLN A 1 308 ? 0.802   88.242  1.491   1.00 30.89  ? 426 GLN A CG  1 
ATOM   2139 C CD  . GLN A 1 308 ? 0.242   89.504  0.852   1.00 35.14  ? 426 GLN A CD  1 
ATOM   2140 O OE1 . GLN A 1 308 ? -0.270  90.381  1.548   1.00 33.08  ? 426 GLN A OE1 1 
ATOM   2141 N NE2 . GLN A 1 308 ? 0.325   89.596  -0.462  1.00 30.31  ? 426 GLN A NE2 1 
ATOM   2142 N N   . GLU A 1 309 ? -2.024  85.428  3.669   1.00 30.78  ? 427 GLU A N   1 
ATOM   2143 C CA  . GLU A 1 309 ? -3.052  84.989  4.604   1.00 36.65  ? 427 GLU A CA  1 
ATOM   2144 C C   . GLU A 1 309 ? -2.535  83.858  5.488   1.00 36.41  ? 427 GLU A C   1 
ATOM   2145 O O   . GLU A 1 309 ? -2.693  83.894  6.713   1.00 30.90  ? 427 GLU A O   1 
ATOM   2146 C CB  . GLU A 1 309 ? -4.295  84.561  3.823   1.00 32.55  ? 427 GLU A CB  1 
ATOM   2147 C CG  . GLU A 1 309 ? -5.535  84.317  4.680   1.00 41.76  ? 427 GLU A CG  1 
ATOM   2148 C CD  . GLU A 1 309 ? -6.148  85.604  5.262   1.00 53.03  ? 427 GLU A CD  1 
ATOM   2149 O OE1 . GLU A 1 309 ? -5.807  86.734  4.830   1.00 38.78  ? 427 GLU A OE1 1 
ATOM   2150 O OE2 . GLU A 1 309 ? -6.972  85.473  6.189   1.00 52.11  ? 427 GLU A OE2 1 
ATOM   2151 N N   . LEU A 1 310 ? -1.845  82.879  4.896   1.00 31.90  ? 428 LEU A N   1 
ATOM   2152 C CA  . LEU A 1 310 ? -1.343  81.760  5.690   1.00 33.33  ? 428 LEU A CA  1 
ATOM   2153 C C   . LEU A 1 310 ? -0.236  82.176  6.640   1.00 38.35  ? 428 LEU A C   1 
ATOM   2154 O O   . LEU A 1 310 ? -0.075  81.562  7.703   1.00 34.57  ? 428 LEU A O   1 
ATOM   2155 C CB  . LEU A 1 310 ? -0.843  80.637  4.772   1.00 35.64  ? 428 LEU A CB  1 
ATOM   2156 C CG  . LEU A 1 310 ? -1.955  79.848  4.073   1.00 35.47  ? 428 LEU A CG  1 
ATOM   2157 C CD1 . LEU A 1 310 ? -1.395  79.015  2.919   1.00 32.92  ? 428 LEU A CD1 1 
ATOM   2158 C CD2 . LEU A 1 310 ? -2.659  78.935  5.073   1.00 36.95  ? 428 LEU A CD2 1 
ATOM   2159 N N   . PHE A 1 311 ? 0.547   83.186  6.278   1.00 33.65  ? 429 PHE A N   1 
ATOM   2160 C CA  . PHE A 1 311 ? 1.677   83.609  7.090   1.00 38.16  ? 429 PHE A CA  1 
ATOM   2161 C C   . PHE A 1 311 ? 1.337   84.809  7.967   1.00 44.14  ? 429 PHE A C   1 
ATOM   2162 O O   . PHE A 1 311 ? 2.228   85.381  8.601   1.00 54.22  ? 429 PHE A O   1 
ATOM   2163 C CB  . PHE A 1 311 ? 2.881   83.909  6.187   1.00 42.40  ? 429 PHE A CB  1 
ATOM   2164 C CG  . PHE A 1 311 ? 3.620   82.669  5.729   1.00 51.21  ? 429 PHE A CG  1 
ATOM   2165 C CD1 . PHE A 1 311 ? 3.030   81.779  4.835   1.00 58.27  ? 429 PHE A CD1 1 
ATOM   2166 C CD2 . PHE A 1 311 ? 4.889   82.380  6.209   1.00 62.10  ? 429 PHE A CD2 1 
ATOM   2167 C CE1 . PHE A 1 311 ? 3.704   80.628  4.418   1.00 69.46  ? 429 PHE A CE1 1 
ATOM   2168 C CE2 . PHE A 1 311 ? 5.569   81.240  5.798   1.00 63.73  ? 429 PHE A CE2 1 
ATOM   2169 C CZ  . PHE A 1 311 ? 4.977   80.361  4.902   1.00 75.75  ? 429 PHE A CZ  1 
ATOM   2170 N N   . GLY A 1 312 ? 0.062   85.196  8.020   1.00 40.73  ? 430 GLY A N   1 
ATOM   2171 C CA  . GLY A 1 312 ? -0.406  86.257  8.890   1.00 45.60  ? 430 GLY A CA  1 
ATOM   2172 C C   . GLY A 1 312 ? -0.118  87.674  8.432   1.00 50.01  ? 430 GLY A C   1 
ATOM   2173 O O   . GLY A 1 312 ? -0.287  88.602  9.227   1.00 45.70  ? 430 GLY A O   1 
ATOM   2174 N N   . ILE A 1 313 ? 0.311   87.876  7.186   1.00 41.56  ? 431 ILE A N   1 
ATOM   2175 C CA  . ILE A 1 313 ? 0.622   89.218  6.696   1.00 40.46  ? 431 ILE A CA  1 
ATOM   2176 C C   . ILE A 1 313 ? -0.676  89.985  6.450   1.00 43.26  ? 431 ILE A C   1 
ATOM   2177 O O   . ILE A 1 313 ? -1.575  89.518  5.737   1.00 40.59  ? 431 ILE A O   1 
ATOM   2178 C CB  . ILE A 1 313 ? 1.501   89.125  5.435   1.00 43.07  ? 431 ILE A CB  1 
ATOM   2179 C CG1 . ILE A 1 313 ? 2.773   88.330  5.752   1.00 39.94  ? 431 ILE A CG1 1 
ATOM   2180 C CG2 . ILE A 1 313 ? 1.854   90.508  4.888   1.00 49.17  ? 431 ILE A CG2 1 
ATOM   2181 C CD1 . ILE A 1 313 ? 3.613   87.956  4.533   1.00 43.16  ? 431 ILE A CD1 1 
ATOM   2182 N N   . THR A 1 314 ? -0.792  91.172  7.049   1.00 45.84  ? 432 THR A N   1 
ATOM   2183 C CA  . THR A 1 314 ? -2.069  91.880  7.041   1.00 42.25  ? 432 THR A CA  1 
ATOM   2184 C C   . THR A 1 314 ? -2.271  92.778  5.823   1.00 48.61  ? 432 THR A C   1 
ATOM   2185 O O   . THR A 1 314 ? -3.417  93.146  5.527   1.00 36.50  ? 432 THR A O   1 
ATOM   2186 C CB  . THR A 1 314 ? -2.214  92.761  8.287   1.00 49.87  ? 432 THR A CB  1 
ATOM   2187 O OG1 . THR A 1 314 ? -1.261  93.833  8.221   1.00 44.46  ? 432 THR A OG1 1 
ATOM   2188 C CG2 . THR A 1 314 ? -1.973  91.948  9.565   1.00 52.57  ? 432 THR A CG2 1 
ATOM   2189 N N   . GLY A 1 315 ? -1.204  93.170  5.135   1.00 41.56  ? 433 GLY A N   1 
ATOM   2190 C CA  . GLY A 1 315 ? -1.309  94.122  4.048   1.00 46.46  ? 433 GLY A CA  1 
ATOM   2191 C C   . GLY A 1 315 ? -1.081  95.576  4.433   1.00 44.63  ? 433 GLY A C   1 
ATOM   2192 O O   . GLY A 1 315 ? -1.185  96.450  3.563   1.00 46.73  ? 433 GLY A O   1 
ATOM   2193 N N   . SER A 1 316 ? -0.782  95.861  5.700   1.00 51.50  ? 434 SER A N   1 
ATOM   2194 C CA  . SER A 1 316 ? -0.459  97.201  6.182   1.00 57.05  ? 434 SER A CA  1 
ATOM   2195 C C   . SER A 1 316 ? 1.028   97.308  6.503   1.00 62.99  ? 434 SER A C   1 
ATOM   2196 O O   . SER A 1 316 ? 1.603   96.399  7.108   1.00 66.03  ? 434 SER A O   1 
ATOM   2197 C CB  . SER A 1 316 ? -1.259  97.541  7.446   1.00 54.59  ? 434 SER A CB  1 
ATOM   2198 O OG  . SER A 1 316 ? -2.609  97.837  7.151   1.00 59.42  ? 434 SER A OG  1 
ATOM   2199 N N   . LEU A 1 317 ? 1.642   98.426  6.112   1.00 70.46  ? 435 LEU A N   1 
ATOM   2200 C CA  . LEU A 1 317 ? 3.050   98.685  6.438   1.00 75.73  ? 435 LEU A CA  1 
ATOM   2201 C C   . LEU A 1 317 ? 3.206   98.994  7.926   1.00 73.00  ? 435 LEU A C   1 
ATOM   2202 O O   . LEU A 1 317 ? 3.679   98.161  8.703   1.00 72.82  ? 435 LEU A O   1 
ATOM   2203 C CB  . LEU A 1 317 ? 3.608   99.842  5.599   1.00 64.73  ? 435 LEU A CB  1 
HETATM 2204 C C1  . XFQ B 2 .   ? 13.001  72.472  -1.148  1.00 66.19  ? 501 XFQ A C1  1 
HETATM 2205 C C2  . XFQ B 2 .   ? 12.093  72.817  -2.292  1.00 76.83  ? 501 XFQ A C2  1 
HETATM 2206 C C3  . XFQ B 2 .   ? 11.285  73.880  -2.266  1.00 80.50  ? 501 XFQ A C3  1 
HETATM 2207 C C4  . XFQ B 2 .   ? 9.860   73.838  -2.026  1.00 76.61  ? 501 XFQ A C4  1 
HETATM 2208 C C5  . XFQ B 2 .   ? 8.897   74.461  -2.935  1.00 75.71  ? 501 XFQ A C5  1 
HETATM 2209 C C8  . XFQ B 2 .   ? 9.850   72.353  -5.284  1.00 67.33  ? 501 XFQ A C8  1 
HETATM 2210 C C6  . XFQ B 2 .   ? 8.943   74.487  -4.299  1.00 83.70  ? 501 XFQ A C6  1 
HETATM 2211 C C7  . XFQ B 2 .   ? 9.836   73.866  -5.317  1.00 72.98  ? 501 XFQ A C7  1 
HETATM 2212 C C10 . XFQ B 2 .   ? 9.777   71.659  -4.160  1.00 67.29  ? 501 XFQ A C10 1 
HETATM 2213 C C11 . XFQ B 2 .   ? 10.899  70.957  -3.467  1.00 60.80  ? 501 XFQ A C11 1 
HETATM 2214 C C12 . XFQ B 2 .   ? 12.142  71.860  -3.457  1.00 72.06  ? 501 XFQ A C12 1 
HETATM 2215 C C14 . XFQ B 2 .   ? 7.143   75.575  -3.711  1.00 56.70  ? 501 XFQ A C14 1 
HETATM 2216 C C15 . XFQ B 2 .   ? 7.700   75.182  -2.563  1.00 68.99  ? 501 XFQ A C15 1 
HETATM 2217 C C16 . XFQ B 2 .   ? 7.173   75.409  -1.170  1.00 65.09  ? 501 XFQ A C16 1 
HETATM 2218 C C9  . XFQ B 2 .   ? 9.973   71.683  -6.610  1.00 58.46  ? 501 XFQ A C9  1 
HETATM 2219 O O13 . XFQ B 2 .   ? 7.874   75.171  -4.800  1.00 88.40  ? 501 XFQ A O13 1 
HETATM 2220 O O17 . XFQ B 2 .   ? 9.404   73.232  -1.048  1.00 81.96  ? 501 XFQ A O17 1 
HETATM 2221 O O   . HOH C 3 .   ? -3.395  65.130  -11.481 1.00 38.47  ? 601 HOH A O   1 
HETATM 2222 O O   . HOH C 3 .   ? -18.509 66.834  9.538   1.00 65.21  ? 602 HOH A O   1 
HETATM 2223 O O   . HOH C 3 .   ? 14.179  62.277  -12.913 1.00 61.43  ? 603 HOH A O   1 
HETATM 2224 O O   . HOH C 3 .   ? -8.012  78.822  16.817  1.00 51.77  ? 604 HOH A O   1 
HETATM 2225 O O   . HOH C 3 .   ? 4.396   48.900  16.800  1.00 51.03  ? 605 HOH A O   1 
HETATM 2226 O O   . HOH C 3 .   ? 14.527  85.871  11.037  1.00 56.69  ? 606 HOH A O   1 
HETATM 2227 O O   . HOH C 3 .   ? 7.598   48.188  12.735  1.00 37.72  ? 607 HOH A O   1 
HETATM 2228 O O   . HOH C 3 .   ? 16.440  53.919  9.181   1.00 48.04  ? 608 HOH A O   1 
HETATM 2229 O O   . HOH C 3 .   ? 6.890   77.892  6.662   1.00 49.58  ? 609 HOH A O   1 
HETATM 2230 O O   . HOH C 3 .   ? -7.534  59.859  21.392  1.00 52.01  ? 610 HOH A O   1 
HETATM 2231 O O   . HOH C 3 .   ? 1.058   55.065  -5.646  1.00 41.61  ? 611 HOH A O   1 
HETATM 2232 O O   . HOH C 3 .   ? 15.375  57.360  6.346   1.00 33.73  ? 612 HOH A O   1 
HETATM 2233 O O   . HOH C 3 .   ? 8.934   92.231  -5.291  1.00 52.06  ? 613 HOH A O   1 
HETATM 2234 O O   . HOH C 3 .   ? -11.674 57.215  -2.249  1.00 31.77  ? 614 HOH A O   1 
HETATM 2235 O O   . HOH C 3 .   ? 9.060   48.011  15.290  1.00 38.12  ? 615 HOH A O   1 
HETATM 2236 O O   . HOH C 3 .   ? -2.680  100.203 6.216   1.00 45.28  ? 616 HOH A O   1 
HETATM 2237 O O   . HOH C 3 .   ? -0.398  79.461  -8.305  1.00 30.17  ? 617 HOH A O   1 
HETATM 2238 O O   . HOH C 3 .   ? -1.786  95.680  1.193   1.00 34.29  ? 618 HOH A O   1 
HETATM 2239 O O   . HOH C 3 .   ? -8.975  51.609  5.098   1.00 44.59  ? 619 HOH A O   1 
HETATM 2240 O O   . HOH C 3 .   ? 8.797   45.176  11.076  1.00 47.36  ? 620 HOH A O   1 
HETATM 2241 O O   . HOH C 3 .   ? -1.826  72.033  12.127  1.00 45.10  ? 621 HOH A O   1 
HETATM 2242 O O   . HOH C 3 .   ? -0.698  59.455  -0.342  1.00 29.70  ? 622 HOH A O   1 
HETATM 2243 O O   . HOH C 3 .   ? -11.597 65.851  -7.008  1.00 37.55  ? 623 HOH A O   1 
HETATM 2244 O O   . HOH C 3 .   ? 10.298  70.255  16.062  1.00 44.64  ? 624 HOH A O   1 
HETATM 2245 O O   . HOH C 3 .   ? 4.868   67.588  11.481  1.00 36.26  ? 625 HOH A O   1 
HETATM 2246 O O   . HOH C 3 .   ? 0.871   81.899  10.132  1.00 43.90  ? 626 HOH A O   1 
HETATM 2247 O O   . HOH C 3 .   ? 1.903   79.569  7.737   1.00 44.48  ? 627 HOH A O   1 
HETATM 2248 O O   . HOH C 3 .   ? -3.395  49.672  -0.104  1.00 45.60  ? 628 HOH A O   1 
HETATM 2249 O O   . HOH C 3 .   ? -2.281  48.938  2.120   1.00 48.02  ? 629 HOH A O   1 
HETATM 2250 O O   . HOH C 3 .   ? -5.623  62.565  -7.592  1.00 36.01  ? 630 HOH A O   1 
HETATM 2251 O O   . HOH C 3 .   ? 13.213  64.251  14.983  1.00 39.75  ? 631 HOH A O   1 
HETATM 2252 O O   . HOH C 3 .   ? 7.240   55.453  -1.305  1.00 37.88  ? 632 HOH A O   1 
HETATM 2253 O O   . HOH C 3 .   ? 10.862  51.622  5.897   1.00 46.77  ? 633 HOH A O   1 
HETATM 2254 O O   . HOH C 3 .   ? 8.048   49.788  1.660   1.00 42.38  ? 634 HOH A O   1 
HETATM 2255 O O   . HOH C 3 .   ? -0.174  68.894  -7.359  1.00 41.86  ? 635 HOH A O   1 
HETATM 2256 O O   . HOH C 3 .   ? 5.783   62.505  -10.445 1.00 41.64  ? 636 HOH A O   1 
HETATM 2257 O O   . HOH C 3 .   ? 15.271  52.680  1.033   1.00 58.30  ? 637 HOH A O   1 
HETATM 2258 O O   . HOH C 3 .   ? -4.029  85.674  8.259   1.00 51.17  ? 638 HOH A O   1 
HETATM 2259 O O   . HOH C 3 .   ? -14.551 60.637  2.149   1.00 52.96  ? 639 HOH A O   1 
HETATM 2260 O O   . HOH C 3 .   ? -0.626  51.207  -0.840  1.00 48.52  ? 640 HOH A O   1 
HETATM 2261 O O   . HOH C 3 .   ? 0.698   84.867  -9.700  1.00 52.27  ? 641 HOH A O   1 
HETATM 2262 O O   . HOH C 3 .   ? 6.023   48.192  0.703   1.00 52.83  ? 642 HOH A O   1 
HETATM 2263 O O   . HOH C 3 .   ? -8.373  75.445  -1.714  1.00 33.25  ? 643 HOH A O   1 
HETATM 2264 O O   . HOH C 3 .   ? -6.721  70.105  -5.429  1.00 48.60  ? 644 HOH A O   1 
HETATM 2265 O O   . HOH C 3 .   ? 9.214   85.797  -12.723 1.00 36.22  ? 645 HOH A O   1 
HETATM 2266 O O   . HOH C 3 .   ? -1.439  78.633  13.605  1.00 44.74  ? 646 HOH A O   1 
HETATM 2267 O O   . HOH C 3 .   ? -12.315 70.485  -0.439  1.00 38.78  ? 647 HOH A O   1 
HETATM 2268 O O   . HOH C 3 .   ? 15.327  82.734  -6.662  1.00 54.12  ? 648 HOH A O   1 
HETATM 2269 O O   . HOH C 3 .   ? -1.183  70.189  -2.762  1.00 26.77  ? 649 HOH A O   1 
HETATM 2270 O O   . HOH C 3 .   ? 16.550  58.697  -0.521  1.00 39.41  ? 650 HOH A O   1 
HETATM 2271 O O   . HOH C 3 .   ? 11.981  86.134  10.230  1.00 45.08  ? 651 HOH A O   1 
HETATM 2272 O O   . HOH C 3 .   ? 3.695   76.920  11.075  1.00 52.69  ? 652 HOH A O   1 
HETATM 2273 O O   . HOH C 3 .   ? -14.763 74.153  6.560   1.00 60.46  ? 653 HOH A O   1 
HETATM 2274 O O   . HOH C 3 .   ? 7.422   58.589  -2.149  1.00 30.21  ? 654 HOH A O   1 
HETATM 2275 O O   . HOH C 3 .   ? 10.050  83.410  -11.251 1.00 35.14  ? 655 HOH A O   1 
HETATM 2276 O O   . HOH C 3 .   ? -8.193  87.702  7.322   1.00 51.02  ? 656 HOH A O   1 
HETATM 2277 O O   . HOH C 3 .   ? 16.472  67.303  8.105   1.00 40.00  ? 657 HOH A O   1 
HETATM 2278 O O   . HOH C 3 .   ? -4.167  81.550  14.029  1.00 58.32  ? 658 HOH A O   1 
HETATM 2279 O O   . HOH C 3 .   ? -16.620 68.815  2.810   1.00 64.99  ? 659 HOH A O   1 
HETATM 2280 O O   . HOH C 3 .   ? 9.019   57.069  1.448   1.00 27.39  ? 660 HOH A O   1 
HETATM 2281 O O   . HOH C 3 .   ? -3.144  78.757  -7.741  1.00 42.87  ? 661 HOH A O   1 
HETATM 2282 O O   . HOH C 3 .   ? -8.640  61.159  14.542  1.00 45.24  ? 662 HOH A O   1 
HETATM 2283 O O   . HOH C 3 .   ? 1.852   68.926  -15.791 1.00 39.69  ? 663 HOH A O   1 
HETATM 2284 O O   . HOH C 3 .   ? 13.793  43.420  6.043   1.00 57.37  ? 664 HOH A O   1 
HETATM 2285 O O   . HOH C 3 .   ? 13.441  57.860  -5.670  1.00 41.52  ? 665 HOH A O   1 
HETATM 2286 O O   . HOH C 3 .   ? -14.533 56.498  5.553   1.00 53.63  ? 666 HOH A O   1 
HETATM 2287 O O   . HOH C 3 .   ? -2.716  76.966  -11.672 1.00 46.99  ? 667 HOH A O   1 
HETATM 2288 O O   . HOH C 3 .   ? 1.305   92.705  1.831   1.00 46.04  ? 668 HOH A O   1 
HETATM 2289 O O   . HOH C 3 .   ? 3.788   63.798  -12.062 1.00 46.61  ? 669 HOH A O   1 
HETATM 2290 O O   . HOH C 3 .   ? -0.271  82.069  -7.621  1.00 33.89  ? 670 HOH A O   1 
HETATM 2291 O O   . HOH C 3 .   ? 6.764   85.192  -16.001 1.00 42.26  ? 671 HOH A O   1 
HETATM 2292 O O   . HOH C 3 .   ? 9.565   61.084  -8.861  1.00 43.83  ? 672 HOH A O   1 
HETATM 2293 O O   . HOH C 3 .   ? -7.747  88.540  3.798   1.00 30.47  ? 673 HOH A O   1 
HETATM 2294 O O   . HOH C 3 .   ? 13.484  59.150  11.454  1.00 36.30  ? 674 HOH A O   1 
HETATM 2295 O O   . HOH C 3 .   ? 6.702   50.491  13.724  1.00 31.59  ? 675 HOH A O   1 
HETATM 2296 O O   . HOH C 3 .   ? 14.948  90.686  6.279   1.00 53.57  ? 676 HOH A O   1 
HETATM 2297 O O   . HOH C 3 .   ? 9.699   58.931  17.455  1.00 29.73  ? 677 HOH A O   1 
HETATM 2298 O O   . HOH C 3 .   ? 1.550   93.838  5.857   1.00 45.55  ? 678 HOH A O   1 
HETATM 2299 O O   . HOH C 3 .   ? -13.919 50.429  15.270  1.00 51.27  ? 679 HOH A O   1 
HETATM 2300 O O   . HOH C 3 .   ? -7.143  54.854  16.067  1.00 39.96  ? 680 HOH A O   1 
HETATM 2301 O O   . HOH C 3 .   ? 9.837   56.027  -1.344  1.00 37.60  ? 681 HOH A O   1 
HETATM 2302 O O   . HOH C 3 .   ? 2.657   76.207  7.258   1.00 49.21  ? 682 HOH A O   1 
HETATM 2303 O O   . HOH C 3 .   ? 6.458   46.065  3.819   1.00 50.69  ? 683 HOH A O   1 
HETATM 2304 O O   . HOH C 3 .   ? 5.317   59.908  -7.872  1.00 48.35  ? 684 HOH A O   1 
HETATM 2305 O O   . HOH C 3 .   ? -3.265  71.655  -5.589  1.00 45.90  ? 685 HOH A O   1 
HETATM 2306 O O   . HOH C 3 .   ? 8.978   80.334  12.830  1.00 47.85  ? 686 HOH A O   1 
HETATM 2307 O O   . HOH C 3 .   ? 4.060   49.941  14.293  1.00 39.57  ? 687 HOH A O   1 
HETATM 2308 O O   . HOH C 3 .   ? -13.556 46.469  14.161  1.00 63.91  ? 688 HOH A O   1 
HETATM 2309 O O   . HOH C 3 .   ? -13.676 66.353  14.731  1.00 45.54  ? 689 HOH A O   1 
HETATM 2310 O O   . HOH C 3 .   ? 0.082   79.921  -11.146 1.00 36.43  ? 690 HOH A O   1 
HETATM 2311 O O   . HOH C 3 .   ? 1.389   52.691  -1.683  1.00 33.96  ? 691 HOH A O   1 
HETATM 2312 O O   . HOH C 3 .   ? 2.915   79.977  -17.523 1.00 46.74  ? 692 HOH A O   1 
HETATM 2313 O O   . HOH C 3 .   ? 14.166  66.914  14.967  1.00 50.85  ? 693 HOH A O   1 
HETATM 2314 O O   . HOH C 3 .   ? -3.999  88.181  6.693   1.00 43.29  ? 694 HOH A O   1 
HETATM 2315 O O   . HOH C 3 .   ? 5.613   46.274  12.166  1.00 41.44  ? 695 HOH A O   1 
HETATM 2316 O O   . HOH C 3 .   ? 6.040   63.604  16.064  1.00 38.18  ? 696 HOH A O   1 
HETATM 2317 O O   . HOH C 3 .   ? -8.246  81.614  13.441  1.00 42.91  ? 697 HOH A O   1 
HETATM 2318 O O   . HOH C 3 .   ? 6.645   74.678  13.236  1.00 49.18  ? 698 HOH A O   1 
HETATM 2319 O O   . HOH C 3 .   ? -7.535  72.819  -4.898  1.00 50.15  ? 699 HOH A O   1 
HETATM 2320 O O   . HOH C 3 .   ? -1.397  63.537  20.286  1.00 49.98  ? 700 HOH A O   1 
HETATM 2321 O O   . HOH C 3 .   ? 11.738  86.911  -12.049 1.00 49.94  ? 701 HOH A O   1 
HETATM 2322 O O   . HOH C 3 .   ? 15.331  42.489  12.840  1.00 42.45  ? 702 HOH A O   1 
HETATM 2323 O O   . HOH C 3 .   ? -9.927  62.954  -8.278  1.00 47.92  ? 703 HOH A O   1 
HETATM 2324 O O   . HOH C 3 .   ? 13.320  75.211  14.093  1.00 49.29  ? 704 HOH A O   1 
HETATM 2325 O O   . HOH C 3 .   ? 6.061   65.301  -18.896 1.00 53.29  ? 705 HOH A O   1 
HETATM 2326 O O   . HOH C 3 .   ? -10.725 75.096  -0.738  1.00 43.28  ? 706 HOH A O   1 
HETATM 2327 O O   . HOH C 3 .   ? -5.205  82.114  -4.110  1.00 46.12  ? 707 HOH A O   1 
HETATM 2328 O O   . HOH C 3 .   ? 1.357   71.897  -15.911 1.00 54.24  ? 708 HOH A O   1 
HETATM 2329 O O   . HOH C 3 .   ? 6.438   76.857  11.461  1.00 55.69  ? 709 HOH A O   1 
HETATM 2330 O O   . HOH C 3 .   ? -7.358  67.179  -7.920  1.00 44.22  ? 710 HOH A O   1 
HETATM 2331 O O   . HOH C 3 .   ? -4.735  73.264  -6.354  1.00 47.67  ? 711 HOH A O   1 
HETATM 2332 O O   . HOH C 3 .   ? -12.137 72.627  -1.927  1.00 48.01  ? 712 HOH A O   1 
HETATM 2333 O O   . HOH C 3 .   ? 3.815   75.670  14.060  1.00 53.10  ? 713 HOH A O   1 
HETATM 2334 O O   . HOH C 3 .   ? -5.882  82.479  12.988  1.00 49.63  ? 714 HOH A O   1 
HETATM 2335 O O   . HOH C 3 .   ? 7.923   51.740  15.787  1.00 30.20  ? 715 HOH A O   1 
HETATM 2336 O O   . HOH C 3 .   ? -5.345  91.197  7.202   1.00 45.25  ? 716 HOH A O   1 
HETATM 2337 O O   . HOH C 3 .   ? 14.044  56.061  -3.551  1.00 46.51  ? 717 HOH A O   1 
HETATM 2338 O O   . HOH C 3 .   ? 3.580   82.365  9.919   1.00 52.12  ? 718 HOH A O   1 
HETATM 2339 O O   . HOH C 3 .   ? 15.854  64.752  8.085   1.00 44.41  ? 719 HOH A O   1 
HETATM 2340 O O   . HOH C 3 .   ? -2.121  69.568  -5.562  1.00 40.36  ? 720 HOH A O   1 
HETATM 2341 O O   . HOH C 3 .   ? 11.357  88.654  9.631   1.00 54.98  ? 721 HOH A O   1 
HETATM 2342 O O   . HOH C 3 .   ? 15.420  56.477  -1.600  1.00 47.77  ? 722 HOH A O   1 
HETATM 2343 O O   . HOH C 3 .   ? 5.338   43.937  13.258  1.00 57.46  ? 723 HOH A O   1 
HETATM 2344 O O   . HOH C 3 .   ? -14.488 56.194  0.378   1.00 52.84  ? 724 HOH A O   1 
HETATM 2345 O O   . HOH C 3 .   ? 11.388  54.982  -3.190  1.00 47.35  ? 725 HOH A O   1 
HETATM 2346 O O   . HOH C 3 .   ? 3.784   64.570  15.651  1.00 50.12  ? 726 HOH A O   1 
HETATM 2347 O O   . HOH C 3 .   ? -9.022  75.979  -4.294  1.00 44.25  ? 727 HOH A O   1 
HETATM 2348 O O   . HOH C 3 .   ? 8.713   49.564  17.542  1.00 44.59  ? 728 HOH A O   1 
HETATM 2349 O O   . HOH C 3 .   ? -8.690  79.539  1.501   1.00 48.17  ? 729 HOH A O   1 
HETATM 2350 O O   . HOH C 3 .   ? 8.481   43.973  13.345  1.00 46.18  ? 730 HOH A O   1 
HETATM 2351 O O   . HOH C 3 .   ? 6.502   62.168  18.411  1.00 40.33  ? 731 HOH A O   1 
HETATM 2352 O O   . HOH C 3 .   ? -1.750  83.976  -6.332  1.00 32.31  ? 732 HOH A O   1 
HETATM 2353 O O   . HOH C 3 .   ? 0.496   80.126  12.447  1.00 49.68  ? 733 HOH A O   1 
HETATM 2354 O O   . HOH C 3 .   ? 1.312   53.012  -4.478  1.00 54.15  ? 734 HOH A O   1 
HETATM 2355 O O   . HOH C 3 .   ? 15.823  54.466  6.379   1.00 44.27  ? 735 HOH A O   1 
HETATM 2356 O O   . HOH C 3 .   ? 7.076   60.579  -9.772  1.00 48.02  ? 736 HOH A O   1 
HETATM 2357 O O   . HOH C 3 .   ? -13.391 53.195  -2.537  1.00 42.67  ? 737 HOH A O   1 
HETATM 2358 O O   . HOH C 3 .   ? -5.705  52.421  -3.219  1.00 43.84  ? 738 HOH A O   1 
HETATM 2359 O O   . HOH C 3 .   ? 6.974   79.044  13.126  1.00 46.61  ? 739 HOH A O   1 
HETATM 2360 O O   . HOH C 3 .   ? 14.880  61.709  11.412  1.00 55.76  ? 740 HOH A O   1 
HETATM 2361 O O   . HOH C 3 .   ? -9.977  83.089  12.655  1.00 57.74  ? 741 HOH A O   1 
HETATM 2362 O O   . HOH C 3 .   ? 7.535   87.608  -12.514 1.00 50.19  ? 742 HOH A O   1 
HETATM 2363 O O   . HOH C 3 .   ? -7.506  78.070  -0.917  1.00 46.03  ? 743 HOH A O   1 
HETATM 2364 O O   . HOH C 3 .   ? 19.635  58.494  -0.338  1.00 56.57  ? 744 HOH A O   1 
# 
