data_9CJ6
# 
_entry.id   9CJ6 
# 
_audit_conform.dict_name       mmcif_pdbx.dic 
_audit_conform.dict_version    5.401 
_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   9CJ6         pdb_00009cj6 10.2210/pdb9cj6/pdb 
WWPDB D_1000285665 ?            ?                   
# 
loop_
_pdbx_audit_revision_history.ordinal 
_pdbx_audit_revision_history.data_content_type 
_pdbx_audit_revision_history.major_revision 
_pdbx_audit_revision_history.minor_revision 
_pdbx_audit_revision_history.revision_date 
1 'Structure model' 1 0 2024-12-11 
2 'Structure model' 1 1 2025-01-22 
# 
_pdbx_audit_revision_details.ordinal             1 
_pdbx_audit_revision_details.revision_ordinal    1 
_pdbx_audit_revision_details.data_content_type   'Structure model' 
_pdbx_audit_revision_details.provider            repository 
_pdbx_audit_revision_details.type                'Initial release' 
_pdbx_audit_revision_details.description         ? 
_pdbx_audit_revision_details.details             ? 
# 
_pdbx_audit_revision_group.ordinal             1 
_pdbx_audit_revision_group.revision_ordinal    2 
_pdbx_audit_revision_group.data_content_type   'Structure model' 
_pdbx_audit_revision_group.group               'Database references' 
# 
_pdbx_audit_revision_category.ordinal             1 
_pdbx_audit_revision_category.revision_ordinal    2 
_pdbx_audit_revision_category.data_content_type   'Structure model' 
_pdbx_audit_revision_category.category            citation 
# 
loop_
_pdbx_audit_revision_item.ordinal 
_pdbx_audit_revision_item.revision_ordinal 
_pdbx_audit_revision_item.data_content_type 
_pdbx_audit_revision_item.item 
1 2 'Structure model' '_citation.pdbx_database_id_PubMed' 
2 2 'Structure model' '_citation.title'                   
# 
_pdbx_database_status.status_code                     REL 
_pdbx_database_status.status_code_sf                  REL 
_pdbx_database_status.status_code_mr                  ? 
_pdbx_database_status.entry_id                        9CJ6 
_pdbx_database_status.recvd_initial_deposition_date   2024-07-05 
_pdbx_database_status.SG_entry                        N 
_pdbx_database_status.deposit_site                    RCSB 
_pdbx_database_status.process_site                    RCSB 
_pdbx_database_status.status_code_cs                  ? 
_pdbx_database_status.status_code_nmr_data            ? 
_pdbx_database_status.methods_development_category    ? 
_pdbx_database_status.pdb_format_compatible           Y 
# 
_pdbx_contact_author.id                 2 
_pdbx_contact_author.email              hiroshi.matsuo@nih.gov 
_pdbx_contact_author.name_first         Hiroshi 
_pdbx_contact_author.name_last          Matsuo 
_pdbx_contact_author.name_mi            ? 
_pdbx_contact_author.role               'principal investigator/group leader' 
_pdbx_contact_author.identifier_ORCID   0000-0002-4559-6157 
# 
loop_
_audit_author.name 
_audit_author.pdbx_ordinal 
_audit_author.identifier_ORCID 
'Maiti, A.'  1 0000-0002-9080-1025 
'Matsuo, H.' 2 0000-0002-4559-6157 
# 
_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                   CH 
_citation.database_id_Medline       ? 
_citation.details                   ? 
_citation.id                        primary 
_citation.journal_abbrev            Biomolecules 
_citation.journal_id_ASTM           ? 
_citation.journal_id_CSD            ? 
_citation.journal_id_ISSN           2218-273X 
_citation.journal_full              ? 
_citation.journal_issue             ? 
_citation.journal_volume            14 
_citation.language                  ? 
_citation.page_first                ? 
_citation.page_last                 ? 
_citation.title                     
'Affinity Tag-Free Purification of SARS-CoV-2 N Protein and Its Crystal Structure in Complex with ssDNA.' 
_citation.year                      2024 
_citation.database_id_CSD           ? 
_citation.pdbx_database_id_DOI      10.3390/biom14121538 
_citation.pdbx_database_id_PubMed   39766245 
_citation.pdbx_database_id_patent   ? 
_citation.unpublished_flag          ? 
# 
loop_
_citation_author.citation_id 
_citation_author.name 
_citation_author.ordinal 
_citation_author.identifier_ORCID 
primary 'Maiti, A.'  1 ? 
primary 'Matsuo, H.' 2 ? 
# 
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 Nucleoprotein                                                                 45689.645 1   ? ? ? ? 
2 polymer syn 
;DNA (5'-D(P*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*TP*T)-3')
;
6038.899  1   ? ? ? ? 
3 water   nat water                                                                         18.015    177 ? ? ? ? 
# 
_entity_name_com.entity_id   1 
_entity_name_com.name        'N,Nucleocapsid protein,NC,Protein N' 
# 
loop_
_entity_poly.entity_id 
_entity_poly.type 
_entity_poly.nstd_linkage 
_entity_poly.nstd_monomer 
_entity_poly.pdbx_seq_one_letter_code 
_entity_poly.pdbx_seq_one_letter_code_can 
_entity_poly.pdbx_strand_id 
_entity_poly.pdbx_target_identifier 
1 'polypeptide(L)'        no no 
;MSDNGPQNQRNAPRITFGGPSDSTGSNQNGERSGARSKQRRPQGLPNNTASWFTALTQHGKEDLKFPRGQGVPINTNSSP
DDQIGYYRRATRRIRGGDGKMKDLSPRWYFYYLGTGPEAGLPYGANKDGIIWVATEGALNTPKDHIGTRNPANNAAIVLQ
LPQGTTLPKGFYAEGSRGGSQASSRSSSRSRNSSRNSTPGSSRGTSPARMAGNGGDAALALLLLDRLNQLESKMSGKGQQ
QQGQTVTKKSAAEASKKPRQKRTATKAYNVTQAFGRRGPEQTQGNFGDQELIRQGTDYKHWPQIAQFAPSASAFFGMSRI
GMEVTPSGTWLTYTGAIKLDDKDPNFKDQVILLNKHIDAYKTFPPTEPKKDKKKKADETQALPQRQKKQQTVTLLPAADL
DDFSKQLQQSMSSADSTQA
;
;MSDNGPQNQRNAPRITFGGPSDSTGSNQNGERSGARSKQRRPQGLPNNTASWFTALTQHGKEDLKFPRGQGVPINTNSSP
DDQIGYYRRATRRIRGGDGKMKDLSPRWYFYYLGTGPEAGLPYGANKDGIIWVATEGALNTPKDHIGTRNPANNAAIVLQ
LPQGTTLPKGFYAEGSRGGSQASSRSSSRSRNSSRNSTPGSSRGTSPARMAGNGGDAALALLLLDRLNQLESKMSGKGQQ
QQGQTVTKKSAAEASKKPRQKRTATKAYNVTQAFGRRGPEQTQGNFGDQELIRQGTDYKHWPQIAQFAPSASAFFGMSRI
GMEVTPSGTWLTYTGAIKLDDKDPNFKDQVILLNKHIDAYKTFPPTEPKKDKKKKADETQALPQRQKKQQTVTLLPAADL
DDFSKQLQQSMSSADSTQA
;
A ? 
2 polydeoxyribonucleotide no no '(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)(DT)' 
TTTTTTTTTTTTTTTTTTTT B ? 
# 
_pdbx_entity_nonpoly.entity_id   3 
_pdbx_entity_nonpoly.name        water 
_pdbx_entity_nonpoly.comp_id     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   SER n 
1 3   ASP n 
1 4   ASN n 
1 5   GLY n 
1 6   PRO n 
1 7   GLN n 
1 8   ASN n 
1 9   GLN n 
1 10  ARG n 
1 11  ASN n 
1 12  ALA n 
1 13  PRO n 
1 14  ARG n 
1 15  ILE n 
1 16  THR n 
1 17  PHE n 
1 18  GLY n 
1 19  GLY n 
1 20  PRO n 
1 21  SER n 
1 22  ASP n 
1 23  SER n 
1 24  THR n 
1 25  GLY n 
1 26  SER n 
1 27  ASN n 
1 28  GLN n 
1 29  ASN n 
1 30  GLY n 
1 31  GLU n 
1 32  ARG n 
1 33  SER n 
1 34  GLY n 
1 35  ALA n 
1 36  ARG n 
1 37  SER n 
1 38  LYS n 
1 39  GLN n 
1 40  ARG n 
1 41  ARG n 
1 42  PRO n 
1 43  GLN n 
1 44  GLY n 
1 45  LEU n 
1 46  PRO n 
1 47  ASN n 
1 48  ASN n 
1 49  THR n 
1 50  ALA n 
1 51  SER n 
1 52  TRP n 
1 53  PHE n 
1 54  THR n 
1 55  ALA n 
1 56  LEU n 
1 57  THR n 
1 58  GLN n 
1 59  HIS n 
1 60  GLY n 
1 61  LYS n 
1 62  GLU n 
1 63  ASP n 
1 64  LEU n 
1 65  LYS n 
1 66  PHE n 
1 67  PRO n 
1 68  ARG n 
1 69  GLY n 
1 70  GLN n 
1 71  GLY n 
1 72  VAL n 
1 73  PRO n 
1 74  ILE n 
1 75  ASN n 
1 76  THR n 
1 77  ASN n 
1 78  SER n 
1 79  SER n 
1 80  PRO n 
1 81  ASP n 
1 82  ASP n 
1 83  GLN n 
1 84  ILE n 
1 85  GLY n 
1 86  TYR n 
1 87  TYR n 
1 88  ARG n 
1 89  ARG n 
1 90  ALA n 
1 91  THR n 
1 92  ARG n 
1 93  ARG n 
1 94  ILE n 
1 95  ARG n 
1 96  GLY n 
1 97  GLY n 
1 98  ASP n 
1 99  GLY n 
1 100 LYS n 
1 101 MET n 
1 102 LYS n 
1 103 ASP n 
1 104 LEU n 
1 105 SER n 
1 106 PRO n 
1 107 ARG n 
1 108 TRP n 
1 109 TYR n 
1 110 PHE n 
1 111 TYR n 
1 112 TYR n 
1 113 LEU n 
1 114 GLY n 
1 115 THR n 
1 116 GLY n 
1 117 PRO n 
1 118 GLU n 
1 119 ALA n 
1 120 GLY n 
1 121 LEU n 
1 122 PRO n 
1 123 TYR n 
1 124 GLY n 
1 125 ALA n 
1 126 ASN n 
1 127 LYS n 
1 128 ASP n 
1 129 GLY n 
1 130 ILE n 
1 131 ILE n 
1 132 TRP n 
1 133 VAL n 
1 134 ALA n 
1 135 THR n 
1 136 GLU n 
1 137 GLY n 
1 138 ALA n 
1 139 LEU n 
1 140 ASN n 
1 141 THR n 
1 142 PRO n 
1 143 LYS n 
1 144 ASP n 
1 145 HIS n 
1 146 ILE n 
1 147 GLY n 
1 148 THR n 
1 149 ARG n 
1 150 ASN n 
1 151 PRO n 
1 152 ALA n 
1 153 ASN n 
1 154 ASN n 
1 155 ALA n 
1 156 ALA n 
1 157 ILE n 
1 158 VAL n 
1 159 LEU n 
1 160 GLN n 
1 161 LEU n 
1 162 PRO n 
1 163 GLN n 
1 164 GLY n 
1 165 THR n 
1 166 THR n 
1 167 LEU n 
1 168 PRO n 
1 169 LYS n 
1 170 GLY n 
1 171 PHE n 
1 172 TYR n 
1 173 ALA n 
1 174 GLU n 
1 175 GLY n 
1 176 SER n 
1 177 ARG n 
1 178 GLY n 
1 179 GLY n 
1 180 SER n 
1 181 GLN n 
1 182 ALA n 
1 183 SER n 
1 184 SER n 
1 185 ARG n 
1 186 SER n 
1 187 SER n 
1 188 SER n 
1 189 ARG n 
1 190 SER n 
1 191 ARG n 
1 192 ASN n 
1 193 SER n 
1 194 SER n 
1 195 ARG n 
1 196 ASN n 
1 197 SER n 
1 198 THR n 
1 199 PRO n 
1 200 GLY n 
1 201 SER n 
1 202 SER n 
1 203 ARG n 
1 204 GLY n 
1 205 THR n 
1 206 SER n 
1 207 PRO n 
1 208 ALA n 
1 209 ARG n 
1 210 MET n 
1 211 ALA n 
1 212 GLY n 
1 213 ASN n 
1 214 GLY n 
1 215 GLY n 
1 216 ASP n 
1 217 ALA n 
1 218 ALA n 
1 219 LEU n 
1 220 ALA n 
1 221 LEU n 
1 222 LEU n 
1 223 LEU n 
1 224 LEU n 
1 225 ASP n 
1 226 ARG n 
1 227 LEU n 
1 228 ASN n 
1 229 GLN n 
1 230 LEU n 
1 231 GLU n 
1 232 SER n 
1 233 LYS n 
1 234 MET n 
1 235 SER n 
1 236 GLY n 
1 237 LYS n 
1 238 GLY n 
1 239 GLN n 
1 240 GLN n 
1 241 GLN n 
1 242 GLN n 
1 243 GLY n 
1 244 GLN n 
1 245 THR n 
1 246 VAL n 
1 247 THR n 
1 248 LYS n 
1 249 LYS n 
1 250 SER n 
1 251 ALA n 
1 252 ALA n 
1 253 GLU n 
1 254 ALA n 
1 255 SER n 
1 256 LYS n 
1 257 LYS n 
1 258 PRO n 
1 259 ARG n 
1 260 GLN n 
1 261 LYS n 
1 262 ARG n 
1 263 THR n 
1 264 ALA n 
1 265 THR n 
1 266 LYS n 
1 267 ALA n 
1 268 TYR n 
1 269 ASN n 
1 270 VAL n 
1 271 THR n 
1 272 GLN n 
1 273 ALA n 
1 274 PHE n 
1 275 GLY n 
1 276 ARG n 
1 277 ARG n 
1 278 GLY n 
1 279 PRO n 
1 280 GLU n 
1 281 GLN n 
1 282 THR n 
1 283 GLN n 
1 284 GLY n 
1 285 ASN n 
1 286 PHE n 
1 287 GLY n 
1 288 ASP n 
1 289 GLN n 
1 290 GLU n 
1 291 LEU n 
1 292 ILE n 
1 293 ARG n 
1 294 GLN n 
1 295 GLY n 
1 296 THR n 
1 297 ASP n 
1 298 TYR n 
1 299 LYS n 
1 300 HIS n 
1 301 TRP n 
1 302 PRO n 
1 303 GLN n 
1 304 ILE n 
1 305 ALA n 
1 306 GLN n 
1 307 PHE n 
1 308 ALA n 
1 309 PRO n 
1 310 SER n 
1 311 ALA n 
1 312 SER n 
1 313 ALA n 
1 314 PHE n 
1 315 PHE n 
1 316 GLY n 
1 317 MET n 
1 318 SER n 
1 319 ARG n 
1 320 ILE n 
1 321 GLY n 
1 322 MET n 
1 323 GLU n 
1 324 VAL n 
1 325 THR n 
1 326 PRO n 
1 327 SER n 
1 328 GLY n 
1 329 THR n 
1 330 TRP n 
1 331 LEU n 
1 332 THR n 
1 333 TYR n 
1 334 THR n 
1 335 GLY n 
1 336 ALA n 
1 337 ILE n 
1 338 LYS n 
1 339 LEU n 
1 340 ASP n 
1 341 ASP n 
1 342 LYS n 
1 343 ASP n 
1 344 PRO n 
1 345 ASN n 
1 346 PHE n 
1 347 LYS n 
1 348 ASP n 
1 349 GLN n 
1 350 VAL n 
1 351 ILE n 
1 352 LEU n 
1 353 LEU n 
1 354 ASN n 
1 355 LYS n 
1 356 HIS n 
1 357 ILE n 
1 358 ASP n 
1 359 ALA n 
1 360 TYR n 
1 361 LYS n 
1 362 THR n 
1 363 PHE n 
1 364 PRO n 
1 365 PRO n 
1 366 THR n 
1 367 GLU n 
1 368 PRO n 
1 369 LYS n 
1 370 LYS n 
1 371 ASP n 
1 372 LYS n 
1 373 LYS n 
1 374 LYS n 
1 375 LYS n 
1 376 ALA n 
1 377 ASP n 
1 378 GLU n 
1 379 THR n 
1 380 GLN n 
1 381 ALA n 
1 382 LEU n 
1 383 PRO n 
1 384 GLN n 
1 385 ARG n 
1 386 GLN n 
1 387 LYS n 
1 388 LYS n 
1 389 GLN n 
1 390 GLN n 
1 391 THR n 
1 392 VAL n 
1 393 THR n 
1 394 LEU n 
1 395 LEU n 
1 396 PRO n 
1 397 ALA n 
1 398 ALA n 
1 399 ASP n 
1 400 LEU n 
1 401 ASP n 
1 402 ASP n 
1 403 PHE n 
1 404 SER n 
1 405 LYS n 
1 406 GLN n 
1 407 LEU n 
1 408 GLN n 
1 409 GLN n 
1 410 SER n 
1 411 MET n 
1 412 SER n 
1 413 SER n 
1 414 ALA n 
1 415 ASP n 
1 416 SER n 
1 417 THR n 
1 418 GLN n 
1 419 ALA n 
2 1   DT  n 
2 2   DT  n 
2 3   DT  n 
2 4   DT  n 
2 5   DT  n 
2 6   DT  n 
2 7   DT  n 
2 8   DT  n 
2 9   DT  n 
2 10  DT  n 
2 11  DT  n 
2 12  DT  n 
2 13  DT  n 
2 14  DT  n 
2 15  DT  n 
2 16  DT  n 
2 17  DT  n 
2 18  DT  n 
2 19  DT  n 
2 20  DT  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                   419 
_entity_src_gen.gene_src_common_name               ? 
_entity_src_gen.gene_src_genus                     ? 
_entity_src_gen.pdbx_gene_src_gene                 ? 
_entity_src_gen.gene_src_species                   ? 
_entity_src_gen.gene_src_strain                    ? 
_entity_src_gen.gene_src_tissue                    ? 
_entity_src_gen.gene_src_tissue_fraction           ? 
_entity_src_gen.gene_src_details                   ? 
_entity_src_gen.pdbx_gene_src_fragment             ? 
_entity_src_gen.pdbx_gene_src_scientific_name      'Severe acute respiratory syndrome coronavirus 2' 
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id     2697049 
_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' 
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id     562 
_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                   ? 
# 
_pdbx_entity_src_syn.entity_id              2 
_pdbx_entity_src_syn.pdbx_src_id            1 
_pdbx_entity_src_syn.pdbx_alt_source_flag   sample 
_pdbx_entity_src_syn.pdbx_beg_seq_num       1 
_pdbx_entity_src_syn.pdbx_end_seq_num       20 
_pdbx_entity_src_syn.organism_scientific    'synthetic construct' 
_pdbx_entity_src_syn.organism_common_name   ? 
_pdbx_entity_src_syn.ncbi_taxonomy_id       32630 
_pdbx_entity_src_syn.details                ? 
# 
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 
DT  'DNA linking'       y "THYMIDINE-5'-MONOPHOSPHATE" ? 'C10 H15 N2 O8 P' 322.208 
GLN 'L-peptide linking' y GLUTAMINE                    ? 'C5 H10 N2 O3'    146.144 
GLU 'L-peptide linking' y 'GLUTAMIC ACID'              ? 'C5 H9 N O4'      147.129 
GLY 'peptide linking'   y GLYCINE                      ? 'C2 H5 N O2'      75.067  
HIS 'L-peptide linking' y HISTIDINE                    ? 'C6 H10 N3 O2 1'  156.162 
HOH non-polymer         . WATER                        ? 'H2 O'            18.015  
ILE 'L-peptide linking' y ISOLEUCINE                   ? 'C6 H13 N O2'     131.173 
LEU 'L-peptide linking' y LEUCINE                      ? 'C6 H13 N O2'     131.173 
LYS 'L-peptide linking' y LYSINE                       ? 'C6 H15 N2 O2 1'  147.195 
MET 'L-peptide linking' y METHIONINE                   ? 'C5 H11 N O2 S'   149.211 
PHE 'L-peptide linking' y PHENYLALANINE                ? 'C9 H11 N O2'     165.189 
PRO 'L-peptide linking' y PROLINE                      ? 'C5 H9 N O2'      115.130 
SER 'L-peptide linking' y SERINE                       ? 'C3 H7 N O3'      105.093 
THR 'L-peptide linking' y THREONINE                    ? 'C4 H9 N O3'      119.119 
TRP 'L-peptide linking' y TRYPTOPHAN                   ? 'C11 H12 N2 O2'   204.225 
TYR 'L-peptide linking' y TYROSINE                     ? 'C9 H11 N O3'     181.189 
VAL 'L-peptide linking' y VALINE                       ? 'C5 H11 N O2'     117.146 
# 
loop_
_pdbx_poly_seq_scheme.asym_id 
_pdbx_poly_seq_scheme.entity_id 
_pdbx_poly_seq_scheme.seq_id 
_pdbx_poly_seq_scheme.mon_id 
_pdbx_poly_seq_scheme.ndb_seq_num 
_pdbx_poly_seq_scheme.pdb_seq_num 
_pdbx_poly_seq_scheme.auth_seq_num 
_pdbx_poly_seq_scheme.pdb_mon_id 
_pdbx_poly_seq_scheme.auth_mon_id 
_pdbx_poly_seq_scheme.pdb_strand_id 
_pdbx_poly_seq_scheme.pdb_ins_code 
_pdbx_poly_seq_scheme.hetero 
A 1 1   MET 1   1   ?   ?   ?   A . n 
A 1 2   SER 2   2   ?   ?   ?   A . n 
A 1 3   ASP 3   3   ?   ?   ?   A . n 
A 1 4   ASN 4   4   ?   ?   ?   A . n 
A 1 5   GLY 5   5   ?   ?   ?   A . n 
A 1 6   PRO 6   6   ?   ?   ?   A . n 
A 1 7   GLN 7   7   ?   ?   ?   A . n 
A 1 8   ASN 8   8   ?   ?   ?   A . n 
A 1 9   GLN 9   9   ?   ?   ?   A . n 
A 1 10  ARG 10  10  ?   ?   ?   A . n 
A 1 11  ASN 11  11  ?   ?   ?   A . n 
A 1 12  ALA 12  12  ?   ?   ?   A . n 
A 1 13  PRO 13  13  ?   ?   ?   A . n 
A 1 14  ARG 14  14  ?   ?   ?   A . n 
A 1 15  ILE 15  15  ?   ?   ?   A . n 
A 1 16  THR 16  16  ?   ?   ?   A . n 
A 1 17  PHE 17  17  ?   ?   ?   A . n 
A 1 18  GLY 18  18  ?   ?   ?   A . n 
A 1 19  GLY 19  19  ?   ?   ?   A . n 
A 1 20  PRO 20  20  ?   ?   ?   A . n 
A 1 21  SER 21  21  ?   ?   ?   A . n 
A 1 22  ASP 22  22  ?   ?   ?   A . n 
A 1 23  SER 23  23  ?   ?   ?   A . n 
A 1 24  THR 24  24  ?   ?   ?   A . n 
A 1 25  GLY 25  25  ?   ?   ?   A . n 
A 1 26  SER 26  26  ?   ?   ?   A . n 
A 1 27  ASN 27  27  ?   ?   ?   A . n 
A 1 28  GLN 28  28  ?   ?   ?   A . n 
A 1 29  ASN 29  29  ?   ?   ?   A . n 
A 1 30  GLY 30  30  ?   ?   ?   A . n 
A 1 31  GLU 31  31  ?   ?   ?   A . n 
A 1 32  ARG 32  32  ?   ?   ?   A . n 
A 1 33  SER 33  33  ?   ?   ?   A . n 
A 1 34  GLY 34  34  ?   ?   ?   A . n 
A 1 35  ALA 35  35  ?   ?   ?   A . n 
A 1 36  ARG 36  36  ?   ?   ?   A . n 
A 1 37  SER 37  37  ?   ?   ?   A . n 
A 1 38  LYS 38  38  ?   ?   ?   A . n 
A 1 39  GLN 39  39  39  GLN GLN A . n 
A 1 40  ARG 40  40  40  ARG ARG A . n 
A 1 41  ARG 41  41  41  ARG ARG A . n 
A 1 42  PRO 42  42  42  PRO PRO A . n 
A 1 43  GLN 43  43  43  GLN GLN A . n 
A 1 44  GLY 44  44  44  GLY GLY A . n 
A 1 45  LEU 45  45  45  LEU LEU A . n 
A 1 46  PRO 46  46  46  PRO PRO A . n 
A 1 47  ASN 47  47  47  ASN ASN A . n 
A 1 48  ASN 48  48  48  ASN ASN A . n 
A 1 49  THR 49  49  49  THR THR A . n 
A 1 50  ALA 50  50  50  ALA ALA A . n 
A 1 51  SER 51  51  51  SER SER A . n 
A 1 52  TRP 52  52  52  TRP TRP A . n 
A 1 53  PHE 53  53  53  PHE PHE A . n 
A 1 54  THR 54  54  54  THR THR A . n 
A 1 55  ALA 55  55  55  ALA ALA A . n 
A 1 56  LEU 56  56  56  LEU LEU A . n 
A 1 57  THR 57  57  57  THR THR A . n 
A 1 58  GLN 58  58  58  GLN GLN A . n 
A 1 59  HIS 59  59  59  HIS HIS A . n 
A 1 60  GLY 60  60  60  GLY GLY A . n 
A 1 61  LYS 61  61  61  LYS LYS A . n 
A 1 62  GLU 62  62  62  GLU GLU A . n 
A 1 63  ASP 63  63  63  ASP ASP A . n 
A 1 64  LEU 64  64  64  LEU LEU A . n 
A 1 65  LYS 65  65  65  LYS LYS A . n 
A 1 66  PHE 66  66  66  PHE PHE A . n 
A 1 67  PRO 67  67  67  PRO PRO A . n 
A 1 68  ARG 68  68  68  ARG ARG A . n 
A 1 69  GLY 69  69  69  GLY GLY A . n 
A 1 70  GLN 70  70  70  GLN GLN A . n 
A 1 71  GLY 71  71  71  GLY GLY A . n 
A 1 72  VAL 72  72  72  VAL VAL A . n 
A 1 73  PRO 73  73  73  PRO PRO A . n 
A 1 74  ILE 74  74  74  ILE ILE A . n 
A 1 75  ASN 75  75  75  ASN ASN A . n 
A 1 76  THR 76  76  76  THR THR A . n 
A 1 77  ASN 77  77  77  ASN ASN A . n 
A 1 78  SER 78  78  78  SER SER A . n 
A 1 79  SER 79  79  79  SER SER A . n 
A 1 80  PRO 80  80  80  PRO PRO A . n 
A 1 81  ASP 81  81  81  ASP ASP A . n 
A 1 82  ASP 82  82  82  ASP ASP A . n 
A 1 83  GLN 83  83  83  GLN GLN A . n 
A 1 84  ILE 84  84  84  ILE ILE A . n 
A 1 85  GLY 85  85  85  GLY GLY A . n 
A 1 86  TYR 86  86  86  TYR TYR A . n 
A 1 87  TYR 87  87  87  TYR TYR A . n 
A 1 88  ARG 88  88  88  ARG ARG A . n 
A 1 89  ARG 89  89  89  ARG ARG A . n 
A 1 90  ALA 90  90  90  ALA ALA A . n 
A 1 91  THR 91  91  91  THR THR A . n 
A 1 92  ARG 92  92  92  ARG ARG A . n 
A 1 93  ARG 93  93  93  ARG ARG A . n 
A 1 94  ILE 94  94  94  ILE ILE A . n 
A 1 95  ARG 95  95  95  ARG ARG A . n 
A 1 96  GLY 96  96  96  GLY GLY A . n 
A 1 97  GLY 97  97  97  GLY GLY A . n 
A 1 98  ASP 98  98  98  ASP ASP A . n 
A 1 99  GLY 99  99  99  GLY GLY A . n 
A 1 100 LYS 100 100 100 LYS LYS A . n 
A 1 101 MET 101 101 101 MET MET A . n 
A 1 102 LYS 102 102 102 LYS LYS A . n 
A 1 103 ASP 103 103 103 ASP ASP A . n 
A 1 104 LEU 104 104 104 LEU LEU A . n 
A 1 105 SER 105 105 105 SER SER A . n 
A 1 106 PRO 106 106 106 PRO PRO A . n 
A 1 107 ARG 107 107 107 ARG ARG A . n 
A 1 108 TRP 108 108 108 TRP TRP A . n 
A 1 109 TYR 109 109 109 TYR TYR A . n 
A 1 110 PHE 110 110 110 PHE PHE A . n 
A 1 111 TYR 111 111 111 TYR TYR A . n 
A 1 112 TYR 112 112 112 TYR TYR A . n 
A 1 113 LEU 113 113 113 LEU LEU A . n 
A 1 114 GLY 114 114 114 GLY GLY A . n 
A 1 115 THR 115 115 115 THR THR A . n 
A 1 116 GLY 116 116 116 GLY GLY A . n 
A 1 117 PRO 117 117 117 PRO PRO A . n 
A 1 118 GLU 118 118 118 GLU GLU A . n 
A 1 119 ALA 119 119 119 ALA ALA A . n 
A 1 120 GLY 120 120 120 GLY GLY A . n 
A 1 121 LEU 121 121 121 LEU LEU A . n 
A 1 122 PRO 122 122 122 PRO PRO A . n 
A 1 123 TYR 123 123 123 TYR TYR A . n 
A 1 124 GLY 124 124 124 GLY GLY A . n 
A 1 125 ALA 125 125 125 ALA ALA A . n 
A 1 126 ASN 126 126 126 ASN ASN A . n 
A 1 127 LYS 127 127 127 LYS LYS A . n 
A 1 128 ASP 128 128 128 ASP ASP A . n 
A 1 129 GLY 129 129 129 GLY GLY A . n 
A 1 130 ILE 130 130 130 ILE ILE A . n 
A 1 131 ILE 131 131 131 ILE ILE A . n 
A 1 132 TRP 132 132 132 TRP TRP A . n 
A 1 133 VAL 133 133 133 VAL VAL A . n 
A 1 134 ALA 134 134 134 ALA ALA A . n 
A 1 135 THR 135 135 135 THR THR A . n 
A 1 136 GLU 136 136 136 GLU GLU A . n 
A 1 137 GLY 137 137 137 GLY GLY A . n 
A 1 138 ALA 138 138 138 ALA ALA A . n 
A 1 139 LEU 139 139 139 LEU LEU A . n 
A 1 140 ASN 140 140 140 ASN ASN A . n 
A 1 141 THR 141 141 141 THR THR A . n 
A 1 142 PRO 142 142 142 PRO PRO A . n 
A 1 143 LYS 143 143 143 LYS LYS A . n 
A 1 144 ASP 144 144 144 ASP ASP A . n 
A 1 145 HIS 145 145 145 HIS HIS A . n 
A 1 146 ILE 146 146 146 ILE ILE A . n 
A 1 147 GLY 147 147 147 GLY GLY A . n 
A 1 148 THR 148 148 148 THR THR A . n 
A 1 149 ARG 149 149 149 ARG ARG A . n 
A 1 150 ASN 150 150 150 ASN ASN A . n 
A 1 151 PRO 151 151 151 PRO PRO A . n 
A 1 152 ALA 152 152 152 ALA ALA A . n 
A 1 153 ASN 153 153 153 ASN ASN A . n 
A 1 154 ASN 154 154 154 ASN ASN A . n 
A 1 155 ALA 155 155 155 ALA ALA A . n 
A 1 156 ALA 156 156 156 ALA ALA A . n 
A 1 157 ILE 157 157 157 ILE ILE A . n 
A 1 158 VAL 158 158 158 VAL VAL A . n 
A 1 159 LEU 159 159 159 LEU LEU A . n 
A 1 160 GLN 160 160 160 GLN GLN A . n 
A 1 161 LEU 161 161 161 LEU LEU A . n 
A 1 162 PRO 162 162 162 PRO PRO A . n 
A 1 163 GLN 163 163 163 GLN GLN A . n 
A 1 164 GLY 164 164 164 GLY GLY A . n 
A 1 165 THR 165 165 165 THR THR A . n 
A 1 166 THR 166 166 166 THR THR A . n 
A 1 167 LEU 167 167 167 LEU LEU A . n 
A 1 168 PRO 168 168 168 PRO PRO A . n 
A 1 169 LYS 169 169 169 LYS LYS A . n 
A 1 170 GLY 170 170 170 GLY GLY A . n 
A 1 171 PHE 171 171 171 PHE PHE A . n 
A 1 172 TYR 172 172 172 TYR TYR A . n 
A 1 173 ALA 173 173 173 ALA ALA A . n 
A 1 174 GLU 174 174 ?   ?   ?   A . n 
A 1 175 GLY 175 175 ?   ?   ?   A . n 
A 1 176 SER 176 176 ?   ?   ?   A . n 
A 1 177 ARG 177 177 ?   ?   ?   A . n 
A 1 178 GLY 178 178 ?   ?   ?   A . n 
A 1 179 GLY 179 179 ?   ?   ?   A . n 
A 1 180 SER 180 180 ?   ?   ?   A . n 
A 1 181 GLN 181 181 ?   ?   ?   A . n 
A 1 182 ALA 182 182 ?   ?   ?   A . n 
A 1 183 SER 183 183 ?   ?   ?   A . n 
A 1 184 SER 184 184 ?   ?   ?   A . n 
A 1 185 ARG 185 185 ?   ?   ?   A . n 
A 1 186 SER 186 186 ?   ?   ?   A . n 
A 1 187 SER 187 187 ?   ?   ?   A . n 
A 1 188 SER 188 188 ?   ?   ?   A . n 
A 1 189 ARG 189 189 ?   ?   ?   A . n 
A 1 190 SER 190 190 ?   ?   ?   A . n 
A 1 191 ARG 191 191 ?   ?   ?   A . n 
A 1 192 ASN 192 192 ?   ?   ?   A . n 
A 1 193 SER 193 193 ?   ?   ?   A . n 
A 1 194 SER 194 194 ?   ?   ?   A . n 
A 1 195 ARG 195 195 ?   ?   ?   A . n 
A 1 196 ASN 196 196 ?   ?   ?   A . n 
A 1 197 SER 197 197 ?   ?   ?   A . n 
A 1 198 THR 198 198 ?   ?   ?   A . n 
A 1 199 PRO 199 199 ?   ?   ?   A . n 
A 1 200 GLY 200 200 ?   ?   ?   A . n 
A 1 201 SER 201 201 ?   ?   ?   A . n 
A 1 202 SER 202 202 ?   ?   ?   A . n 
A 1 203 ARG 203 203 ?   ?   ?   A . n 
A 1 204 GLY 204 204 ?   ?   ?   A . n 
A 1 205 THR 205 205 ?   ?   ?   A . n 
A 1 206 SER 206 206 ?   ?   ?   A . n 
A 1 207 PRO 207 207 ?   ?   ?   A . n 
A 1 208 ALA 208 208 ?   ?   ?   A . n 
A 1 209 ARG 209 209 ?   ?   ?   A . n 
A 1 210 MET 210 210 ?   ?   ?   A . n 
A 1 211 ALA 211 211 ?   ?   ?   A . n 
A 1 212 GLY 212 212 ?   ?   ?   A . n 
A 1 213 ASN 213 213 ?   ?   ?   A . n 
A 1 214 GLY 214 214 ?   ?   ?   A . n 
A 1 215 GLY 215 215 ?   ?   ?   A . n 
A 1 216 ASP 216 216 ?   ?   ?   A . n 
A 1 217 ALA 217 217 ?   ?   ?   A . n 
A 1 218 ALA 218 218 ?   ?   ?   A . n 
A 1 219 LEU 219 219 ?   ?   ?   A . n 
A 1 220 ALA 220 220 ?   ?   ?   A . n 
A 1 221 LEU 221 221 ?   ?   ?   A . n 
A 1 222 LEU 222 222 ?   ?   ?   A . n 
A 1 223 LEU 223 223 ?   ?   ?   A . n 
A 1 224 LEU 224 224 ?   ?   ?   A . n 
A 1 225 ASP 225 225 ?   ?   ?   A . n 
A 1 226 ARG 226 226 ?   ?   ?   A . n 
A 1 227 LEU 227 227 ?   ?   ?   A . n 
A 1 228 ASN 228 228 ?   ?   ?   A . n 
A 1 229 GLN 229 229 ?   ?   ?   A . n 
A 1 230 LEU 230 230 ?   ?   ?   A . n 
A 1 231 GLU 231 231 ?   ?   ?   A . n 
A 1 232 SER 232 232 ?   ?   ?   A . n 
A 1 233 LYS 233 233 ?   ?   ?   A . n 
A 1 234 MET 234 234 ?   ?   ?   A . n 
A 1 235 SER 235 235 ?   ?   ?   A . n 
A 1 236 GLY 236 236 ?   ?   ?   A . n 
A 1 237 LYS 237 237 ?   ?   ?   A . n 
A 1 238 GLY 238 238 ?   ?   ?   A . n 
A 1 239 GLN 239 239 ?   ?   ?   A . n 
A 1 240 GLN 240 240 ?   ?   ?   A . n 
A 1 241 GLN 241 241 ?   ?   ?   A . n 
A 1 242 GLN 242 242 ?   ?   ?   A . n 
A 1 243 GLY 243 243 ?   ?   ?   A . n 
A 1 244 GLN 244 244 ?   ?   ?   A . n 
A 1 245 THR 245 245 ?   ?   ?   A . n 
A 1 246 VAL 246 246 ?   ?   ?   A . n 
A 1 247 THR 247 247 ?   ?   ?   A . n 
A 1 248 LYS 248 248 ?   ?   ?   A . n 
A 1 249 LYS 249 249 ?   ?   ?   A . n 
A 1 250 SER 250 250 ?   ?   ?   A . n 
A 1 251 ALA 251 251 ?   ?   ?   A . n 
A 1 252 ALA 252 252 ?   ?   ?   A . n 
A 1 253 GLU 253 253 ?   ?   ?   A . n 
A 1 254 ALA 254 254 ?   ?   ?   A . n 
A 1 255 SER 255 255 ?   ?   ?   A . n 
A 1 256 LYS 256 256 ?   ?   ?   A . n 
A 1 257 LYS 257 257 ?   ?   ?   A . n 
A 1 258 PRO 258 258 ?   ?   ?   A . n 
A 1 259 ARG 259 259 ?   ?   ?   A . n 
A 1 260 GLN 260 260 ?   ?   ?   A . n 
A 1 261 LYS 261 261 ?   ?   ?   A . n 
A 1 262 ARG 262 262 ?   ?   ?   A . n 
A 1 263 THR 263 263 ?   ?   ?   A . n 
A 1 264 ALA 264 264 ?   ?   ?   A . n 
A 1 265 THR 265 265 ?   ?   ?   A . n 
A 1 266 LYS 266 266 ?   ?   ?   A . n 
A 1 267 ALA 267 267 ?   ?   ?   A . n 
A 1 268 TYR 268 268 ?   ?   ?   A . n 
A 1 269 ASN 269 269 ?   ?   ?   A . n 
A 1 270 VAL 270 270 ?   ?   ?   A . n 
A 1 271 THR 271 271 ?   ?   ?   A . n 
A 1 272 GLN 272 272 ?   ?   ?   A . n 
A 1 273 ALA 273 273 ?   ?   ?   A . n 
A 1 274 PHE 274 274 ?   ?   ?   A . n 
A 1 275 GLY 275 275 ?   ?   ?   A . n 
A 1 276 ARG 276 276 ?   ?   ?   A . n 
A 1 277 ARG 277 277 ?   ?   ?   A . n 
A 1 278 GLY 278 278 ?   ?   ?   A . n 
A 1 279 PRO 279 279 ?   ?   ?   A . n 
A 1 280 GLU 280 280 ?   ?   ?   A . n 
A 1 281 GLN 281 281 ?   ?   ?   A . n 
A 1 282 THR 282 282 ?   ?   ?   A . n 
A 1 283 GLN 283 283 ?   ?   ?   A . n 
A 1 284 GLY 284 284 ?   ?   ?   A . n 
A 1 285 ASN 285 285 ?   ?   ?   A . n 
A 1 286 PHE 286 286 ?   ?   ?   A . n 
A 1 287 GLY 287 287 ?   ?   ?   A . n 
A 1 288 ASP 288 288 ?   ?   ?   A . n 
A 1 289 GLN 289 289 ?   ?   ?   A . n 
A 1 290 GLU 290 290 ?   ?   ?   A . n 
A 1 291 LEU 291 291 ?   ?   ?   A . n 
A 1 292 ILE 292 292 ?   ?   ?   A . n 
A 1 293 ARG 293 293 ?   ?   ?   A . n 
A 1 294 GLN 294 294 ?   ?   ?   A . n 
A 1 295 GLY 295 295 ?   ?   ?   A . n 
A 1 296 THR 296 296 ?   ?   ?   A . n 
A 1 297 ASP 297 297 ?   ?   ?   A . n 
A 1 298 TYR 298 298 ?   ?   ?   A . n 
A 1 299 LYS 299 299 ?   ?   ?   A . n 
A 1 300 HIS 300 300 ?   ?   ?   A . n 
A 1 301 TRP 301 301 ?   ?   ?   A . n 
A 1 302 PRO 302 302 ?   ?   ?   A . n 
A 1 303 GLN 303 303 ?   ?   ?   A . n 
A 1 304 ILE 304 304 ?   ?   ?   A . n 
A 1 305 ALA 305 305 ?   ?   ?   A . n 
A 1 306 GLN 306 306 ?   ?   ?   A . n 
A 1 307 PHE 307 307 ?   ?   ?   A . n 
A 1 308 ALA 308 308 ?   ?   ?   A . n 
A 1 309 PRO 309 309 ?   ?   ?   A . n 
A 1 310 SER 310 310 ?   ?   ?   A . n 
A 1 311 ALA 311 311 ?   ?   ?   A . n 
A 1 312 SER 312 312 ?   ?   ?   A . n 
A 1 313 ALA 313 313 ?   ?   ?   A . n 
A 1 314 PHE 314 314 ?   ?   ?   A . n 
A 1 315 PHE 315 315 ?   ?   ?   A . n 
A 1 316 GLY 316 316 ?   ?   ?   A . n 
A 1 317 MET 317 317 ?   ?   ?   A . n 
A 1 318 SER 318 318 ?   ?   ?   A . n 
A 1 319 ARG 319 319 ?   ?   ?   A . n 
A 1 320 ILE 320 320 ?   ?   ?   A . n 
A 1 321 GLY 321 321 ?   ?   ?   A . n 
A 1 322 MET 322 322 ?   ?   ?   A . n 
A 1 323 GLU 323 323 ?   ?   ?   A . n 
A 1 324 VAL 324 324 ?   ?   ?   A . n 
A 1 325 THR 325 325 ?   ?   ?   A . n 
A 1 326 PRO 326 326 ?   ?   ?   A . n 
A 1 327 SER 327 327 ?   ?   ?   A . n 
A 1 328 GLY 328 328 ?   ?   ?   A . n 
A 1 329 THR 329 329 ?   ?   ?   A . n 
A 1 330 TRP 330 330 ?   ?   ?   A . n 
A 1 331 LEU 331 331 ?   ?   ?   A . n 
A 1 332 THR 332 332 ?   ?   ?   A . n 
A 1 333 TYR 333 333 ?   ?   ?   A . n 
A 1 334 THR 334 334 ?   ?   ?   A . n 
A 1 335 GLY 335 335 ?   ?   ?   A . n 
A 1 336 ALA 336 336 ?   ?   ?   A . n 
A 1 337 ILE 337 337 ?   ?   ?   A . n 
A 1 338 LYS 338 338 ?   ?   ?   A . n 
A 1 339 LEU 339 339 ?   ?   ?   A . n 
A 1 340 ASP 340 340 ?   ?   ?   A . n 
A 1 341 ASP 341 341 ?   ?   ?   A . n 
A 1 342 LYS 342 342 ?   ?   ?   A . n 
A 1 343 ASP 343 343 ?   ?   ?   A . n 
A 1 344 PRO 344 344 ?   ?   ?   A . n 
A 1 345 ASN 345 345 ?   ?   ?   A . n 
A 1 346 PHE 346 346 ?   ?   ?   A . n 
A 1 347 LYS 347 347 ?   ?   ?   A . n 
A 1 348 ASP 348 348 ?   ?   ?   A . n 
A 1 349 GLN 349 349 ?   ?   ?   A . n 
A 1 350 VAL 350 350 ?   ?   ?   A . n 
A 1 351 ILE 351 351 ?   ?   ?   A . n 
A 1 352 LEU 352 352 ?   ?   ?   A . n 
A 1 353 LEU 353 353 ?   ?   ?   A . n 
A 1 354 ASN 354 354 ?   ?   ?   A . n 
A 1 355 LYS 355 355 ?   ?   ?   A . n 
A 1 356 HIS 356 356 ?   ?   ?   A . n 
A 1 357 ILE 357 357 ?   ?   ?   A . n 
A 1 358 ASP 358 358 ?   ?   ?   A . n 
A 1 359 ALA 359 359 ?   ?   ?   A . n 
A 1 360 TYR 360 360 ?   ?   ?   A . n 
A 1 361 LYS 361 361 ?   ?   ?   A . n 
A 1 362 THR 362 362 ?   ?   ?   A . n 
A 1 363 PHE 363 363 ?   ?   ?   A . n 
A 1 364 PRO 364 364 ?   ?   ?   A . n 
A 1 365 PRO 365 365 ?   ?   ?   A . n 
A 1 366 THR 366 366 ?   ?   ?   A . n 
A 1 367 GLU 367 367 ?   ?   ?   A . n 
A 1 368 PRO 368 368 ?   ?   ?   A . n 
A 1 369 LYS 369 369 ?   ?   ?   A . n 
A 1 370 LYS 370 370 ?   ?   ?   A . n 
A 1 371 ASP 371 371 ?   ?   ?   A . n 
A 1 372 LYS 372 372 ?   ?   ?   A . n 
A 1 373 LYS 373 373 ?   ?   ?   A . n 
A 1 374 LYS 374 374 ?   ?   ?   A . n 
A 1 375 LYS 375 375 ?   ?   ?   A . n 
A 1 376 ALA 376 376 ?   ?   ?   A . n 
A 1 377 ASP 377 377 ?   ?   ?   A . n 
A 1 378 GLU 378 378 ?   ?   ?   A . n 
A 1 379 THR 379 379 ?   ?   ?   A . n 
A 1 380 GLN 380 380 ?   ?   ?   A . n 
A 1 381 ALA 381 381 ?   ?   ?   A . n 
A 1 382 LEU 382 382 ?   ?   ?   A . n 
A 1 383 PRO 383 383 ?   ?   ?   A . n 
A 1 384 GLN 384 384 ?   ?   ?   A . n 
A 1 385 ARG 385 385 ?   ?   ?   A . n 
A 1 386 GLN 386 386 ?   ?   ?   A . n 
A 1 387 LYS 387 387 ?   ?   ?   A . n 
A 1 388 LYS 388 388 ?   ?   ?   A . n 
A 1 389 GLN 389 389 ?   ?   ?   A . n 
A 1 390 GLN 390 390 ?   ?   ?   A . n 
A 1 391 THR 391 391 ?   ?   ?   A . n 
A 1 392 VAL 392 392 ?   ?   ?   A . n 
A 1 393 THR 393 393 ?   ?   ?   A . n 
A 1 394 LEU 394 394 ?   ?   ?   A . n 
A 1 395 LEU 395 395 ?   ?   ?   A . n 
A 1 396 PRO 396 396 ?   ?   ?   A . n 
A 1 397 ALA 397 397 ?   ?   ?   A . n 
A 1 398 ALA 398 398 ?   ?   ?   A . n 
A 1 399 ASP 399 399 ?   ?   ?   A . n 
A 1 400 LEU 400 400 ?   ?   ?   A . n 
A 1 401 ASP 401 401 ?   ?   ?   A . n 
A 1 402 ASP 402 402 ?   ?   ?   A . n 
A 1 403 PHE 403 403 ?   ?   ?   A . n 
A 1 404 SER 404 404 ?   ?   ?   A . n 
A 1 405 LYS 405 405 ?   ?   ?   A . n 
A 1 406 GLN 406 406 ?   ?   ?   A . n 
A 1 407 LEU 407 407 ?   ?   ?   A . n 
A 1 408 GLN 408 408 ?   ?   ?   A . n 
A 1 409 GLN 409 409 ?   ?   ?   A . n 
A 1 410 SER 410 410 ?   ?   ?   A . n 
A 1 411 MET 411 411 ?   ?   ?   A . n 
A 1 412 SER 412 412 ?   ?   ?   A . n 
A 1 413 SER 413 413 ?   ?   ?   A . n 
A 1 414 ALA 414 414 ?   ?   ?   A . n 
A 1 415 ASP 415 415 ?   ?   ?   A . n 
A 1 416 SER 416 416 ?   ?   ?   A . n 
A 1 417 THR 417 417 ?   ?   ?   A . n 
A 1 418 GLN 418 418 ?   ?   ?   A . n 
A 1 419 ALA 419 419 ?   ?   ?   A . n 
B 2 1   DT  1   -1  -1  DT  DT  B . n 
B 2 2   DT  2   0   0   DT  DT  B . n 
B 2 3   DT  3   1   1   DT  DT  B . n 
B 2 4   DT  4   2   ?   ?   ?   B . n 
B 2 5   DT  5   3   ?   ?   ?   B . n 
B 2 6   DT  6   4   ?   ?   ?   B . n 
B 2 7   DT  7   5   ?   ?   ?   B . n 
B 2 8   DT  8   6   ?   ?   ?   B . n 
B 2 9   DT  9   7   ?   ?   ?   B . n 
B 2 10  DT  10  8   ?   ?   ?   B . n 
B 2 11  DT  11  9   ?   ?   ?   B . n 
B 2 12  DT  12  10  ?   ?   ?   B . n 
B 2 13  DT  13  11  ?   ?   ?   B . n 
B 2 14  DT  14  12  ?   ?   ?   B . n 
B 2 15  DT  15  13  ?   ?   ?   B . n 
B 2 16  DT  16  14  ?   ?   ?   B . n 
B 2 17  DT  17  15  ?   ?   ?   B . n 
B 2 18  DT  18  16  ?   ?   ?   B . n 
B 2 19  DT  19  17  ?   ?   ?   B . n 
B 2 20  DT  20  18  ?   ?   ?   B . n 
# 
loop_
_pdbx_nonpoly_scheme.asym_id 
_pdbx_nonpoly_scheme.entity_id 
_pdbx_nonpoly_scheme.mon_id 
_pdbx_nonpoly_scheme.ndb_seq_num 
_pdbx_nonpoly_scheme.pdb_seq_num 
_pdbx_nonpoly_scheme.auth_seq_num 
_pdbx_nonpoly_scheme.pdb_mon_id 
_pdbx_nonpoly_scheme.auth_mon_id 
_pdbx_nonpoly_scheme.pdb_strand_id 
_pdbx_nonpoly_scheme.pdb_ins_code 
C 3 HOH 1   501 201 HOH HOH A . 
C 3 HOH 2   502 87  HOH HOH A . 
C 3 HOH 3   503 50  HOH HOH A . 
C 3 HOH 4   504 105 HOH HOH A . 
C 3 HOH 5   505 98  HOH HOH A . 
C 3 HOH 6   506 118 HOH HOH A . 
C 3 HOH 7   507 125 HOH HOH A . 
C 3 HOH 8   508 104 HOH HOH A . 
C 3 HOH 9   509 129 HOH HOH A . 
C 3 HOH 10  510 172 HOH HOH A . 
C 3 HOH 11  511 15  HOH HOH A . 
C 3 HOH 12  512 77  HOH HOH A . 
C 3 HOH 13  513 167 HOH HOH A . 
C 3 HOH 14  514 202 HOH HOH A . 
C 3 HOH 15  515 88  HOH HOH A . 
C 3 HOH 16  516 55  HOH HOH A . 
C 3 HOH 17  517 45  HOH HOH A . 
C 3 HOH 18  518 113 HOH HOH A . 
C 3 HOH 19  519 48  HOH HOH A . 
C 3 HOH 20  520 31  HOH HOH A . 
C 3 HOH 21  521 159 HOH HOH A . 
C 3 HOH 22  522 70  HOH HOH A . 
C 3 HOH 23  523 101 HOH HOH A . 
C 3 HOH 24  524 22  HOH HOH A . 
C 3 HOH 25  525 38  HOH HOH A . 
C 3 HOH 26  526 18  HOH HOH A . 
C 3 HOH 27  527 44  HOH HOH A . 
C 3 HOH 28  528 190 HOH HOH A . 
C 3 HOH 29  529 185 HOH HOH A . 
C 3 HOH 30  530 63  HOH HOH A . 
C 3 HOH 31  531 71  HOH HOH A . 
C 3 HOH 32  532 60  HOH HOH A . 
C 3 HOH 33  533 49  HOH HOH A . 
C 3 HOH 34  534 100 HOH HOH A . 
C 3 HOH 35  535 57  HOH HOH A . 
C 3 HOH 36  536 69  HOH HOH A . 
C 3 HOH 37  537 81  HOH HOH A . 
C 3 HOH 38  538 35  HOH HOH A . 
C 3 HOH 39  539 198 HOH HOH A . 
C 3 HOH 40  540 17  HOH HOH A . 
C 3 HOH 41  541 40  HOH HOH A . 
C 3 HOH 42  542 94  HOH HOH A . 
C 3 HOH 43  543 61  HOH HOH A . 
C 3 HOH 44  544 1   HOH HOH A . 
C 3 HOH 45  545 7   HOH HOH A . 
C 3 HOH 46  546 95  HOH HOH A . 
C 3 HOH 47  547 51  HOH HOH A . 
C 3 HOH 48  548 56  HOH HOH A . 
C 3 HOH 49  549 8   HOH HOH A . 
C 3 HOH 50  550 16  HOH HOH A . 
C 3 HOH 51  551 6   HOH HOH A . 
C 3 HOH 52  552 85  HOH HOH A . 
C 3 HOH 53  553 27  HOH HOH A . 
C 3 HOH 54  554 90  HOH HOH A . 
C 3 HOH 55  555 12  HOH HOH A . 
C 3 HOH 56  556 47  HOH HOH A . 
C 3 HOH 57  557 5   HOH HOH A . 
C 3 HOH 58  558 177 HOH HOH A . 
C 3 HOH 59  559 116 HOH HOH A . 
C 3 HOH 60  560 19  HOH HOH A . 
C 3 HOH 61  561 41  HOH HOH A . 
C 3 HOH 62  562 43  HOH HOH A . 
C 3 HOH 63  563 2   HOH HOH A . 
C 3 HOH 64  564 75  HOH HOH A . 
C 3 HOH 65  565 89  HOH HOH A . 
C 3 HOH 66  566 33  HOH HOH A . 
C 3 HOH 67  567 42  HOH HOH A . 
C 3 HOH 68  568 117 HOH HOH A . 
C 3 HOH 69  569 11  HOH HOH A . 
C 3 HOH 70  570 108 HOH HOH A . 
C 3 HOH 71  571 126 HOH HOH A . 
C 3 HOH 72  572 163 HOH HOH A . 
C 3 HOH 73  573 4   HOH HOH A . 
C 3 HOH 74  574 25  HOH HOH A . 
C 3 HOH 75  575 23  HOH HOH A . 
C 3 HOH 76  576 10  HOH HOH A . 
C 3 HOH 77  577 84  HOH HOH A . 
C 3 HOH 78  578 119 HOH HOH A . 
C 3 HOH 79  579 123 HOH HOH A . 
C 3 HOH 80  580 137 HOH HOH A . 
C 3 HOH 81  581 52  HOH HOH A . 
C 3 HOH 82  582 128 HOH HOH A . 
C 3 HOH 83  583 68  HOH HOH A . 
C 3 HOH 84  584 103 HOH HOH A . 
C 3 HOH 85  585 80  HOH HOH A . 
C 3 HOH 86  586 93  HOH HOH A . 
C 3 HOH 87  587 26  HOH HOH A . 
C 3 HOH 88  588 36  HOH HOH A . 
C 3 HOH 89  589 150 HOH HOH A . 
C 3 HOH 90  590 9   HOH HOH A . 
C 3 HOH 91  591 30  HOH HOH A . 
C 3 HOH 92  592 130 HOH HOH A . 
C 3 HOH 93  593 161 HOH HOH A . 
C 3 HOH 94  594 86  HOH HOH A . 
C 3 HOH 95  595 14  HOH HOH A . 
C 3 HOH 96  596 24  HOH HOH A . 
C 3 HOH 97  597 138 HOH HOH A . 
C 3 HOH 98  598 107 HOH HOH A . 
C 3 HOH 99  599 180 HOH HOH A . 
C 3 HOH 100 600 37  HOH HOH A . 
C 3 HOH 101 601 65  HOH HOH A . 
C 3 HOH 102 602 59  HOH HOH A . 
C 3 HOH 103 603 29  HOH HOH A . 
C 3 HOH 104 604 32  HOH HOH A . 
C 3 HOH 105 605 147 HOH HOH A . 
C 3 HOH 106 606 149 HOH HOH A . 
C 3 HOH 107 607 195 HOH HOH A . 
C 3 HOH 108 608 79  HOH HOH A . 
C 3 HOH 109 609 74  HOH HOH A . 
C 3 HOH 110 610 102 HOH HOH A . 
C 3 HOH 111 611 21  HOH HOH A . 
C 3 HOH 112 612 91  HOH HOH A . 
C 3 HOH 113 613 197 HOH HOH A . 
C 3 HOH 114 614 28  HOH HOH A . 
C 3 HOH 115 615 78  HOH HOH A . 
C 3 HOH 116 616 54  HOH HOH A . 
C 3 HOH 117 617 99  HOH HOH A . 
C 3 HOH 118 618 170 HOH HOH A . 
C 3 HOH 119 619 58  HOH HOH A . 
C 3 HOH 120 620 175 HOH HOH A . 
C 3 HOH 121 621 136 HOH HOH A . 
C 3 HOH 122 622 13  HOH HOH A . 
C 3 HOH 123 623 20  HOH HOH A . 
C 3 HOH 124 624 109 HOH HOH A . 
C 3 HOH 125 625 154 HOH HOH A . 
C 3 HOH 126 626 139 HOH HOH A . 
C 3 HOH 127 627 152 HOH HOH A . 
C 3 HOH 128 628 199 HOH HOH A . 
C 3 HOH 129 629 156 HOH HOH A . 
C 3 HOH 130 630 182 HOH HOH A . 
C 3 HOH 131 631 64  HOH HOH A . 
C 3 HOH 132 632 72  HOH HOH A . 
C 3 HOH 133 633 141 HOH HOH A . 
C 3 HOH 134 634 160 HOH HOH A . 
C 3 HOH 135 635 122 HOH HOH A . 
C 3 HOH 136 636 140 HOH HOH A . 
C 3 HOH 137 637 169 HOH HOH A . 
C 3 HOH 138 638 191 HOH HOH A . 
C 3 HOH 139 639 194 HOH HOH A . 
C 3 HOH 140 640 73  HOH HOH A . 
C 3 HOH 141 641 39  HOH HOH A . 
C 3 HOH 142 642 151 HOH HOH A . 
C 3 HOH 143 643 153 HOH HOH A . 
C 3 HOH 144 644 148 HOH HOH A . 
C 3 HOH 145 645 96  HOH HOH A . 
C 3 HOH 146 646 157 HOH HOH A . 
C 3 HOH 147 647 133 HOH HOH A . 
C 3 HOH 148 648 181 HOH HOH A . 
C 3 HOH 149 649 115 HOH HOH A . 
C 3 HOH 150 650 176 HOH HOH A . 
C 3 HOH 151 651 82  HOH HOH A . 
C 3 HOH 152 652 165 HOH HOH A . 
C 3 HOH 153 653 134 HOH HOH A . 
C 3 HOH 154 654 110 HOH HOH A . 
C 3 HOH 155 655 112 HOH HOH A . 
C 3 HOH 156 656 66  HOH HOH A . 
C 3 HOH 157 657 53  HOH HOH A . 
C 3 HOH 158 658 173 HOH HOH A . 
C 3 HOH 159 659 168 HOH HOH A . 
C 3 HOH 160 660 62  HOH HOH A . 
C 3 HOH 161 661 171 HOH HOH A . 
C 3 HOH 162 662 166 HOH HOH A . 
C 3 HOH 163 663 135 HOH HOH A . 
C 3 HOH 164 664 111 HOH HOH A . 
C 3 HOH 165 665 192 HOH HOH A . 
C 3 HOH 166 666 200 HOH HOH A . 
C 3 HOH 167 667 92  HOH HOH A . 
C 3 HOH 168 668 106 HOH HOH A . 
D 3 HOH 1   101 121 HOH HOH B . 
D 3 HOH 2   102 131 HOH HOH B . 
D 3 HOH 3   103 120 HOH HOH B . 
D 3 HOH 4   104 83  HOH HOH B . 
D 3 HOH 5   105 34  HOH HOH B . 
D 3 HOH 6   106 155 HOH HOH B . 
D 3 HOH 7   107 179 HOH HOH B . 
D 3 HOH 8   108 97  HOH HOH B . 
D 3 HOH 9   109 178 HOH HOH B . 
# 
loop_
_pdbx_unobs_or_zero_occ_atoms.id 
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num 
_pdbx_unobs_or_zero_occ_atoms.polymer_flag 
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag 
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id 
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id 
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id 
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code 
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id 
_pdbx_unobs_or_zero_occ_atoms.label_alt_id 
_pdbx_unobs_or_zero_occ_atoms.label_asym_id 
_pdbx_unobs_or_zero_occ_atoms.label_comp_id 
_pdbx_unobs_or_zero_occ_atoms.label_seq_id 
_pdbx_unobs_or_zero_occ_atoms.label_atom_id 
1  1 Y 1 A ARG 40  ? CG    ? A ARG 40  CG    
2  1 Y 1 A ARG 40  ? CD    ? A ARG 40  CD    
3  1 Y 1 A ARG 40  ? NE    ? A ARG 40  NE    
4  1 Y 1 A ARG 40  ? CZ    ? A ARG 40  CZ    
5  1 Y 1 A ARG 40  ? NH1   ? A ARG 40  NH1   
6  1 Y 1 A ARG 40  ? NH2   ? A ARG 40  NH2   
7  1 Y 1 A ARG 41  ? CZ    ? A ARG 41  CZ    
8  1 Y 1 A ARG 41  ? NH1   ? A ARG 41  NH1   
9  1 Y 1 A ARG 41  ? NH2   ? A ARG 41  NH2   
10 1 Y 1 A LYS 169 ? CD    ? A LYS 169 CD    
11 1 Y 1 A LYS 169 ? CE    ? A LYS 169 CE    
12 1 Y 1 A LYS 169 ? NZ    ? A LYS 169 NZ    
13 1 Y 1 B DT  1   ? "C5'" ? B DT  3   "C5'" 
14 1 Y 1 B DT  1   ? "C4'" ? B DT  3   "C4'" 
15 1 Y 1 B DT  1   ? "O4'" ? B DT  3   "O4'" 
16 1 Y 1 B DT  1   ? "C3'" ? B DT  3   "C3'" 
17 1 Y 1 B DT  1   ? "O3'" ? B DT  3   "O3'" 
18 1 Y 1 B DT  1   ? "C2'" ? B DT  3   "C2'" 
19 1 Y 1 B DT  1   ? "C1'" ? B DT  3   "C1'" 
20 1 Y 1 B DT  1   ? N1    ? B DT  3   N1    
21 1 Y 1 B DT  1   ? C2    ? B DT  3   C2    
22 1 Y 1 B DT  1   ? O2    ? B DT  3   O2    
23 1 Y 1 B DT  1   ? N3    ? B DT  3   N3    
24 1 Y 1 B DT  1   ? C4    ? B DT  3   C4    
25 1 Y 1 B DT  1   ? O4    ? B DT  3   O4    
26 1 Y 1 B DT  1   ? C5    ? B DT  3   C5    
27 1 Y 1 B DT  1   ? C7    ? B DT  3   C7    
28 1 Y 1 B DT  1   ? C6    ? B DT  3   C6    
# 
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   ? ? ? '(1.21.1_5286: ???)' 1 
? 'data scaling'   ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? .                    2 
? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? .                    3 
? phasing          ? ? ? ? ? ? ? ? ? ? ? PHASER   ? ? ? .                    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                     9CJ6 
_cell.details                      ? 
_cell.formula_units_Z              ? 
_cell.length_a                     90.891 
_cell.length_a_esd                 ? 
_cell.length_b                     90.891 
_cell.length_b_esd                 ? 
_cell.length_c                     36.341 
_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                         9CJ6 
_symmetry.cell_setting                     ? 
_symmetry.Int_Tables_number                80 
_symmetry.space_group_name_Hall            ? 
_symmetry.space_group_name_H-M             'I 41' 
_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                   9CJ6 
_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             1.64 
_exptl_crystal.density_method               ? 
_exptl_crystal.density_percent_sol          25.27 
_exptl_crystal.description                  ? 
_exptl_crystal.F_000                        ? 
_exptl_crystal.id                           1 
_exptl_crystal.preparation                  ? 
_exptl_crystal.size_max                     ? 
_exptl_crystal.size_mid                     ? 
_exptl_crystal.size_min                     ? 
_exptl_crystal.size_rad                     ? 
_exptl_crystal.colour_lustre                ? 
_exptl_crystal.colour_modifier              ? 
_exptl_crystal.colour_primary               ? 
_exptl_crystal.density_meas                 ? 
_exptl_crystal.density_meas_esd             ? 
_exptl_crystal.density_meas_gt              ? 
_exptl_crystal.density_meas_lt              ? 
_exptl_crystal.density_meas_temp            ? 
_exptl_crystal.density_meas_temp_esd        ? 
_exptl_crystal.density_meas_temp_gt         ? 
_exptl_crystal.density_meas_temp_lt         ? 
_exptl_crystal.pdbx_crystal_image_url       ? 
_exptl_crystal.pdbx_crystal_image_format    ? 
_exptl_crystal.pdbx_mosaicity               ? 
_exptl_crystal.pdbx_mosaicity_esd           ? 
_exptl_crystal.pdbx_mosaic_method           ? 
_exptl_crystal.pdbx_mosaic_block_size       ? 
_exptl_crystal.pdbx_mosaic_block_size_esd   ? 
# 
_exptl_crystal_grow.apparatus       ? 
_exptl_crystal_grow.atmosphere      ? 
_exptl_crystal_grow.crystal_id      1 
_exptl_crystal_grow.details         ? 
_exptl_crystal_grow.method          'VAPOR DIFFUSION, SITTING DROP' 
_exptl_crystal_grow.method_ref      ? 
_exptl_crystal_grow.pH              7.4 
_exptl_crystal_grow.pressure        ? 
_exptl_crystal_grow.pressure_esd    ? 
_exptl_crystal_grow.seeding         ? 
_exptl_crystal_grow.seeding_ref     ? 
_exptl_crystal_grow.temp_details    ? 
_exptl_crystal_grow.temp_esd        ? 
_exptl_crystal_grow.time            ? 
_exptl_crystal_grow.pdbx_details    '0.2M HEPES, pH 7.4 + 20% PEG4000' 
_exptl_crystal_grow.pdbx_pH_range   ? 
_exptl_crystal_grow.temp            277 
# 
_diffrn.ambient_environment              ? 
_diffrn.ambient_temp                     100 
_diffrn.ambient_temp_details             ? 
_diffrn.ambient_temp_esd                 ? 
_diffrn.crystal_id                       1 
_diffrn.crystal_support                  ? 
_diffrn.crystal_treatment                ? 
_diffrn.details                          ? 
_diffrn.id                               1 
_diffrn.ambient_pressure                 ? 
_diffrn.ambient_pressure_esd             ? 
_diffrn.ambient_pressure_gt              ? 
_diffrn.ambient_pressure_lt              ? 
_diffrn.ambient_temp_gt                  ? 
_diffrn.ambient_temp_lt                  ? 
_diffrn.pdbx_serial_crystal_experiment   N 
# 
_diffrn_detector.details                      ? 
_diffrn_detector.detector                     PIXEL 
_diffrn_detector.diffrn_id                    1 
_diffrn_detector.type                         'DECTRIS EIGER X 16M' 
_diffrn_detector.area_resol_mean              ? 
_diffrn_detector.dtime                        ? 
_diffrn_detector.pdbx_frames_total            ? 
_diffrn_detector.pdbx_collection_time_total   ? 
_diffrn_detector.pdbx_collection_date         2023-03-10 
_diffrn_detector.pdbx_frequency               ? 
_diffrn_detector.id                           ? 
_diffrn_detector.number_of_axes               ? 
# 
_diffrn_radiation.collimation                      ? 
_diffrn_radiation.diffrn_id                        1 
_diffrn_radiation.filter_edge                      ? 
_diffrn_radiation.inhomogeneity                    ? 
_diffrn_radiation.monochromator                    ? 
_diffrn_radiation.polarisn_norm                    ? 
_diffrn_radiation.polarisn_ratio                   ? 
_diffrn_radiation.probe                            ? 
_diffrn_radiation.type                             ? 
_diffrn_radiation.xray_symbol                      ? 
_diffrn_radiation.wavelength_id                    1 
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l   M 
_diffrn_radiation.pdbx_wavelength_list             ? 
_diffrn_radiation.pdbx_wavelength                  ? 
_diffrn_radiation.pdbx_diffrn_protocol             'SINGLE WAVELENGTH' 
_diffrn_radiation.pdbx_analyzer                    ? 
_diffrn_radiation.pdbx_scattering_type             x-ray 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   1.0 
_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                        'APS BEAMLINE 22-ID' 
_diffrn_source.voltage                     ? 
_diffrn_source.take-off_angle              ? 
_diffrn_source.pdbx_wavelength_list        1.0 
_diffrn_source.pdbx_wavelength             ? 
_diffrn_source.pdbx_synchrotron_beamline   22-ID 
_diffrn_source.pdbx_synchrotron_site       APS 
# 
_reflns.B_iso_Wilson_estimate                          ? 
_reflns.entry_id                                       9CJ6 
_reflns.data_reduction_details                         ? 
_reflns.data_reduction_method                          ? 
_reflns.d_resolution_high                              1.55 
_reflns.d_resolution_low                               50.00 
_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                                     21606 
_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                           99.8 
_reflns.R_free_details                                 ? 
_reflns.Rmerge_F_all                                   ? 
_reflns.Rmerge_F_obs                                   ? 
_reflns.Friedel_coverage                               ? 
_reflns.number_gt                                      ? 
_reflns.threshold_expression                           ? 
_reflns.pdbx_redundancy                                12.9 
_reflns.pdbx_netI_over_av_sigmaI                       ? 
_reflns.pdbx_netI_over_sigmaI                          10.8 
_reflns.pdbx_res_netI_over_av_sigmaI_2                 ? 
_reflns.pdbx_res_netI_over_sigmaI_2                    ? 
_reflns.pdbx_chi_squared                               0.958 
_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                                0.070 
_reflns.pdbx_Rpim_I_all                                0.019 
_reflns.pdbx_d_opt                                     ? 
_reflns.pdbx_number_measured_all                       278517 
_reflns.pdbx_diffrn_id                                 1 
_reflns.pdbx_ordinal                                   1 
_reflns.pdbx_CC_half                                   0.998 
_reflns.pdbx_CC_star                                   0.999 
_reflns.pdbx_R_split                                   ? 
_reflns.pdbx_Rmerge_I_obs                              0.067 
_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                        ? 
# 
loop_
_reflns_shell.d_res_high 
_reflns_shell.d_res_low 
_reflns_shell.meanI_over_sigI_all 
_reflns_shell.meanI_over_sigI_obs 
_reflns_shell.number_measured_all 
_reflns_shell.number_measured_obs 
_reflns_shell.number_possible 
_reflns_shell.number_unique_all 
_reflns_shell.number_unique_obs 
_reflns_shell.percent_possible_obs 
_reflns_shell.Rmerge_F_all 
_reflns_shell.Rmerge_F_obs 
_reflns_shell.meanI_over_sigI_gt 
_reflns_shell.meanI_over_uI_all 
_reflns_shell.meanI_over_uI_gt 
_reflns_shell.number_measured_gt 
_reflns_shell.number_unique_gt 
_reflns_shell.percent_possible_gt 
_reflns_shell.Rmerge_F_gt 
_reflns_shell.Rmerge_I_gt 
_reflns_shell.pdbx_redundancy 
_reflns_shell.pdbx_chi_squared 
_reflns_shell.pdbx_netI_over_sigmaI_all 
_reflns_shell.pdbx_netI_over_sigmaI_obs 
_reflns_shell.pdbx_Rrim_I_all 
_reflns_shell.pdbx_Rpim_I_all 
_reflns_shell.pdbx_rejects 
_reflns_shell.pdbx_ordinal 
_reflns_shell.pdbx_diffrn_id 
_reflns_shell.pdbx_CC_half 
_reflns_shell.pdbx_CC_star 
_reflns_shell.pdbx_R_split 
_reflns_shell.percent_possible_all 
_reflns_shell.Rmerge_I_all 
_reflns_shell.Rmerge_I_obs 
_reflns_shell.pdbx_Rsym_value 
_reflns_shell.pdbx_percent_possible_ellipsoidal 
_reflns_shell.pdbx_percent_possible_spherical 
_reflns_shell.pdbx_percent_possible_ellipsoidal_anomalous 
_reflns_shell.pdbx_percent_possible_spherical_anomalous 
_reflns_shell.pdbx_redundancy_anomalous 
_reflns_shell.pdbx_CC_half_anomalous 
_reflns_shell.pdbx_absDiff_over_sigma_anomalous 
_reflns_shell.pdbx_percent_possible_anomalous 
1.55 1.61  ? ? ? ? ? ? 2097 ? ? ? ? ? ? ? ? ? ? ? 11.6 0.666 ? ? 0.680 0.186 ? 1  1 0.945 0.986 ? 98.6  ? 0.653 ? ? ? ? ? ? ? ? ? 
1.61 1.67  ? ? ? ? ? ? 2155 ? ? ? ? ? ? ? ? ? ? ? 12.8 0.748 ? ? 0.518 0.140 ? 2  1 0.969 0.992 ? 100.0 ? 0.499 ? ? ? ? ? ? ? ? ? 
1.67 1.75  ? ? ? ? ? ? 2175 ? ? ? ? ? ? ? ? ? ? ? 13.0 0.840 ? ? 0.349 0.095 ? 3  1 0.981 0.995 ? 100.0 ? 0.336 ? ? ? ? ? ? ? ? ? 
1.75 1.84  ? ? ? ? ? ? 2111 ? ? ? ? ? ? ? ? ? ? ? 11.9 0.908 ? ? 0.257 0.074 ? 4  1 0.987 0.997 ? 99.9  ? 0.246 ? ? ? ? ? ? ? ? ? 
1.84 1.95  ? ? ? ? ? ? 2168 ? ? ? ? ? ? ? ? ? ? ? 13.6 1.285 ? ? 0.184 0.049 ? 5  1 0.993 0.998 ? 100.0 ? 0.178 ? ? ? ? ? ? ? ? ? 
1.95 2.10  ? ? ? ? ? ? 2158 ? ? ? ? ? ? ? ? ? ? ? 13.7 1.088 ? ? 0.138 0.037 ? 6  1 0.995 0.999 ? 100.0 ? 0.133 ? ? ? ? ? ? ? ? ? 
2.10 2.32  ? ? ? ? ? ? 2151 ? ? ? ? ? ? ? ? ? ? ? 13.4 1.030 ? ? 0.105 0.028 ? 7  1 0.997 0.999 ? 100.0 ? 0.101 ? ? ? ? ? ? ? ? ? 
2.32 2.65  ? ? ? ? ? ? 2180 ? ? ? ? ? ? ? ? ? ? ? 12.3 0.823 ? ? 0.081 0.023 ? 8  1 0.997 0.999 ? 99.9  ? 0.078 ? ? ? ? ? ? ? ? ? 
2.65 3.34  ? ? ? ? ? ? 2189 ? ? ? ? ? ? ? ? ? ? ? 13.7 0.949 ? ? 0.058 0.016 ? 9  1 0.998 0.999 ? 100.0 ? 0.056 ? ? ? ? ? ? ? ? ? 
3.34 50.00 ? ? ? ? ? ? 2222 ? ? ? ? ? ? ? ? ? ? ? 12.8 1.162 ? ? 0.042 0.012 ? 10 1 0.999 1.000 ? 99.4  ? 0.040 ? ? ? ? ? ? ? ? ? 
# 
_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                                 9CJ6 
_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                            1.55 
_refine.ls_d_res_low                             33.74 
_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                     20986 
_refine.ls_number_reflns_R_free                  1050 
_refine.ls_number_reflns_R_work                  ? 
_refine.ls_number_restraints                     ? 
_refine.ls_percent_reflns_obs                    96.96 
_refine.ls_percent_reflns_R_free                 5.00 
_refine.ls_R_factor_all                          ? 
_refine.ls_R_factor_obs                          0.1804 
_refine.ls_R_factor_R_free                       0.2044 
_refine.ls_R_factor_R_free_error                 ? 
_refine.ls_R_factor_R_free_error_details         ? 
_refine.ls_R_factor_R_work                       0.1790 
_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                          1.37 
_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             1.10 
_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                 23.94 
_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                            0.17 
_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        1042 
_refine_hist.pdbx_number_atoms_nucleic_acid   44 
_refine_hist.pdbx_number_atoms_ligand         0 
_refine_hist.number_atoms_solvent             177 
_refine_hist.number_atoms_total               1263 
_refine_hist.d_res_high                       1.55 
_refine_hist.d_res_low                        33.74 
# 
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' ? 13.854 ? 419 ? f_dihedral_angle_d ? ? 
'X-RAY DIFFRACTION' ? 0.057  ? 159 ? f_chiral_restr     ? ? 
'X-RAY DIFFRACTION' ? 0.008  ? 201 ? 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' 1.55 1.62  . . 92  2049 80.00  . . . . 0.2451 . . . . . . . . . . . 0.3015 
'X-RAY DIFFRACTION' 1.62 1.71  . . 123 2460 96.00  . . . . 0.2151 . . . . . . . . . . . 0.2511 
'X-RAY DIFFRACTION' 1.71 1.82  . . 134 2550 100.00 . . . . 0.2129 . . . . . . . . . . . 0.2799 
'X-RAY DIFFRACTION' 1.82 1.96  . . 149 2532 100.00 . . . . 0.2047 . . . . . . . . . . . 0.2676 
'X-RAY DIFFRACTION' 1.96 2.15  . . 150 2564 100.00 . . . . 0.1899 . . . . . . . . . . . 0.2149 
'X-RAY DIFFRACTION' 2.15 2.47  . . 128 2562 100.00 . . . . 0.1658 . . . . . . . . . . . 0.1925 
'X-RAY DIFFRACTION' 2.47 3.10  . . 104 2600 100.00 . . . . 0.1777 . . . . . . . . . . . 0.1462 
'X-RAY DIFFRACTION' 3.11 33.74 . . 170 2619 100.00 . . . . 0.1535 . . . . . . . . . . . 0.1874 
# 
_struct.entry_id                     9CJ6 
_struct.title                        'Crystal Structure of SARS-CoV-2 N-NTD with part of N-arm complex with ssDNA.' 
_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        9CJ6 
_struct_keywords.text            'STRUCTURAL PROTEIN, VIRAL PROTEIN, Nucleocapsid, PROTEIN-DNA complex, VIRAL PROTEIN-DNA complex' 
_struct_keywords.pdbx_keywords   'VIRAL PROTEIN/DNA' 
# 
loop_
_struct_asym.id 
_struct_asym.pdbx_blank_PDB_chainid_flag 
_struct_asym.pdbx_modified 
_struct_asym.entity_id 
_struct_asym.details 
A N N 1 ? 
B N N 2 ? 
C N N 3 ? 
D N N 3 ? 
# 
loop_
_struct_ref.id 
_struct_ref.db_name 
_struct_ref.db_code 
_struct_ref.pdbx_db_accession 
_struct_ref.pdbx_db_isoform 
_struct_ref.entity_id 
_struct_ref.pdbx_seq_one_letter_code 
_struct_ref.pdbx_align_begin 
1 UNP NCAP_SARS2 P0DTC9 ? 1 
;MSDNGPQNQRNAPRITFGGPSDSTGSNQNGERSGARSKQRRPQGLPNNTASWFTALTQHGKEDLKFPRGQGVPINTNSSP
DDQIGYYRRATRRIRGGDGKMKDLSPRWYFYYLGTGPEAGLPYGANKDGIIWVATEGALNTPKDHIGTRNPANNAAIVLQ
LPQGTTLPKGFYAEGSRGGSQASSRSSSRSRNSSRNSTPGSSRGTSPARMAGNGGDAALALLLLDRLNQLESKMSGKGQQ
QQGQTVTKKSAAEASKKPRQKRTATKAYNVTQAFGRRGPEQTQGNFGDQELIRQGTDYKHWPQIAQFAPSASAFFGMSRI
GMEVTPSGTWLTYTGAIKLDDKDPNFKDQVILLNKHIDAYKTFPPTEPKKDKKKKADETQALPQRQKKQQTVTLLPAADL
DDFSKQLQQSMSSADSTQA
;
1 
2 PDB 9CJ6       9CJ6   ? 2 ? 1 
# 
loop_
_struct_ref_seq.align_id 
_struct_ref_seq.ref_id 
_struct_ref_seq.pdbx_PDB_id_code 
_struct_ref_seq.pdbx_strand_id 
_struct_ref_seq.seq_align_beg 
_struct_ref_seq.pdbx_seq_align_beg_ins_code 
_struct_ref_seq.seq_align_end 
_struct_ref_seq.pdbx_seq_align_end_ins_code 
_struct_ref_seq.pdbx_db_accession 
_struct_ref_seq.db_align_beg 
_struct_ref_seq.pdbx_db_align_beg_ins_code 
_struct_ref_seq.db_align_end 
_struct_ref_seq.pdbx_db_align_end_ins_code 
_struct_ref_seq.pdbx_auth_seq_align_beg 
_struct_ref_seq.pdbx_auth_seq_align_end 
1 1 9CJ6 A 1 ? 419 ? P0DTC9 1  ? 419 ? 1  419 
2 2 9CJ6 B 1 ? 20  ? 9CJ6   -1 ? 18  ? -1 18  
# 
_pdbx_struct_assembly.id                   1 
_pdbx_struct_assembly.details              author_defined_assembly 
_pdbx_struct_assembly.method_details       ? 
_pdbx_struct_assembly.oligomeric_details   dimeric 
_pdbx_struct_assembly.oligomeric_count     2 
# 
_pdbx_struct_assembly_gen.assembly_id       1 
_pdbx_struct_assembly_gen.oper_expression   1 
_pdbx_struct_assembly_gen.asym_id_list      A,B,C,D 
# 
_pdbx_struct_oper_list.id                   1 
_pdbx_struct_oper_list.type                 'identity operation' 
_pdbx_struct_oper_list.name                 1_555 
_pdbx_struct_oper_list.symmetry_operation   x,y,z 
_pdbx_struct_oper_list.matrix[1][1]         1.0000000000 
_pdbx_struct_oper_list.matrix[1][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[1][3]         0.0000000000 
_pdbx_struct_oper_list.vector[1]            0.0000000000 
_pdbx_struct_oper_list.matrix[2][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[2][2]         1.0000000000 
_pdbx_struct_oper_list.matrix[2][3]         0.0000000000 
_pdbx_struct_oper_list.vector[2]            0.0000000000 
_pdbx_struct_oper_list.matrix[3][1]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][2]         0.0000000000 
_pdbx_struct_oper_list.matrix[3][3]         1.0000000000 
_pdbx_struct_oper_list.vector[3]            0.0000000000 
# 
_struct_conf.conf_type_id            HELX_P 
_struct_conf.id                      HELX_P1 
_struct_conf.pdbx_PDB_helix_id       AA1 
_struct_conf.beg_label_comp_id       SER 
_struct_conf.beg_label_asym_id       A 
_struct_conf.beg_label_seq_id        79 
_struct_conf.pdbx_beg_PDB_ins_code   ? 
_struct_conf.end_label_comp_id       ASP 
_struct_conf.end_label_asym_id       A 
_struct_conf.end_label_seq_id        82 
_struct_conf.pdbx_end_PDB_ins_code   ? 
_struct_conf.beg_auth_comp_id        SER 
_struct_conf.beg_auth_asym_id        A 
_struct_conf.beg_auth_seq_id         79 
_struct_conf.end_auth_comp_id        ASP 
_struct_conf.end_auth_asym_id        A 
_struct_conf.end_auth_seq_id         82 
_struct_conf.pdbx_PDB_helix_class    5 
_struct_conf.details                 ? 
_struct_conf.pdbx_PDB_helix_length   4 
# 
_struct_conf_type.id          HELX_P 
_struct_conf_type.criteria    ? 
_struct_conf_type.reference   ? 
# 
loop_
_struct_sheet.id 
_struct_sheet.type 
_struct_sheet.number_strands 
_struct_sheet.details 
AA1 ? 4 ? 
AA2 ? 2 ? 
# 
loop_
_struct_sheet_order.sheet_id 
_struct_sheet_order.range_id_1 
_struct_sheet_order.range_id_2 
_struct_sheet_order.offset 
_struct_sheet_order.sense 
AA1 1 2 ? anti-parallel 
AA1 2 3 ? anti-parallel 
AA1 3 4 ? anti-parallel 
AA2 1 2 ? anti-parallel 
# 
loop_
_struct_sheet_range.sheet_id 
_struct_sheet_range.id 
_struct_sheet_range.beg_label_comp_id 
_struct_sheet_range.beg_label_asym_id 
_struct_sheet_range.beg_label_seq_id 
_struct_sheet_range.pdbx_beg_PDB_ins_code 
_struct_sheet_range.end_label_comp_id 
_struct_sheet_range.end_label_asym_id 
_struct_sheet_range.end_label_seq_id 
_struct_sheet_range.pdbx_end_PDB_ins_code 
_struct_sheet_range.beg_auth_comp_id 
_struct_sheet_range.beg_auth_asym_id 
_struct_sheet_range.beg_auth_seq_id 
_struct_sheet_range.end_auth_comp_id 
_struct_sheet_range.end_auth_asym_id 
_struct_sheet_range.end_auth_seq_id 
AA1 1 LEU A 56  ? THR A 57  ? LEU A 56  THR A 57  
AA1 2 ARG A 107 ? TYR A 112 ? ARG A 107 TYR A 112 
AA1 3 ILE A 84  ? ALA A 90  ? ILE A 84  ALA A 90  
AA1 4 ILE A 130 ? ALA A 134 ? ILE A 130 ALA A 134 
AA2 1 ARG A 93  ? ARG A 95  ? ARG A 93  ARG A 95  
AA2 2 MET A 101 ? ASP A 103 ? MET A 101 ASP A 103 
# 
loop_
_pdbx_struct_sheet_hbond.sheet_id 
_pdbx_struct_sheet_hbond.range_id_1 
_pdbx_struct_sheet_hbond.range_id_2 
_pdbx_struct_sheet_hbond.range_1_label_atom_id 
_pdbx_struct_sheet_hbond.range_1_label_comp_id 
_pdbx_struct_sheet_hbond.range_1_label_asym_id 
_pdbx_struct_sheet_hbond.range_1_label_seq_id 
_pdbx_struct_sheet_hbond.range_1_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_1_auth_atom_id 
_pdbx_struct_sheet_hbond.range_1_auth_comp_id 
_pdbx_struct_sheet_hbond.range_1_auth_asym_id 
_pdbx_struct_sheet_hbond.range_1_auth_seq_id 
_pdbx_struct_sheet_hbond.range_2_label_atom_id 
_pdbx_struct_sheet_hbond.range_2_label_comp_id 
_pdbx_struct_sheet_hbond.range_2_label_asym_id 
_pdbx_struct_sheet_hbond.range_2_label_seq_id 
_pdbx_struct_sheet_hbond.range_2_PDB_ins_code 
_pdbx_struct_sheet_hbond.range_2_auth_atom_id 
_pdbx_struct_sheet_hbond.range_2_auth_comp_id 
_pdbx_struct_sheet_hbond.range_2_auth_asym_id 
_pdbx_struct_sheet_hbond.range_2_auth_seq_id 
AA1 1 2 N LEU A 56  ? N LEU A 56  O TRP A 108 ? O TRP A 108 
AA1 2 3 O TYR A 111 ? O TYR A 111 N TYR A 86  ? N TYR A 86  
AA1 3 4 N GLY A 85  ? N GLY A 85  O VAL A 133 ? O VAL A 133 
AA2 1 2 N ILE A 94  ? N ILE A 94  O LYS A 102 ? O LYS A 102 
# 
_pdbx_entry_details.entry_id                   9CJ6 
_pdbx_entry_details.compound_details           ? 
_pdbx_entry_details.source_details             ? 
_pdbx_entry_details.nonpolymer_details         ? 
_pdbx_entry_details.sequence_details           ? 
_pdbx_entry_details.has_ligand_of_interest     ? 
_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 O   A HOH 530 ? ? O A HOH 603 ? ? 1.76 
2  1 O   A HOH 620 ? ? O A HOH 645 ? ? 1.76 
3  1 O   A HOH 645 ? ? O B HOH 108 ? ? 1.89 
4  1 O   A HOH 584 ? ? O A HOH 610 ? ? 1.91 
5  1 O   A HOH 605 ? ? O A HOH 644 ? ? 1.96 
6  1 O   A HOH 517 ? ? O A HOH 645 ? ? 1.98 
7  1 O   A HOH 530 ? ? O A HOH 614 ? ? 2.00 
8  1 O   A HOH 531 ? ? O A HOH 630 ? ? 2.01 
9  1 O   A HOH 609 ? ? O A HOH 627 ? ? 2.02 
10 1 NH2 A ARG 92  ? ? O A HOH 501 ? ? 2.11 
11 1 O   A HOH 564 ? ? O A HOH 627 ? ? 2.15 
# 
loop_
_pdbx_validate_symm_contact.id 
_pdbx_validate_symm_contact.PDB_model_num 
_pdbx_validate_symm_contact.auth_atom_id_1 
_pdbx_validate_symm_contact.auth_asym_id_1 
_pdbx_validate_symm_contact.auth_comp_id_1 
_pdbx_validate_symm_contact.auth_seq_id_1 
_pdbx_validate_symm_contact.PDB_ins_code_1 
_pdbx_validate_symm_contact.label_alt_id_1 
_pdbx_validate_symm_contact.site_symmetry_1 
_pdbx_validate_symm_contact.auth_atom_id_2 
_pdbx_validate_symm_contact.auth_asym_id_2 
_pdbx_validate_symm_contact.auth_comp_id_2 
_pdbx_validate_symm_contact.auth_seq_id_2 
_pdbx_validate_symm_contact.PDB_ins_code_2 
_pdbx_validate_symm_contact.label_alt_id_2 
_pdbx_validate_symm_contact.site_symmetry_2 
_pdbx_validate_symm_contact.dist 
1 1 O A HOH 552 ? ? 1_555 O A HOH 637 ? ? 1_556 2.13 
2 1 O A HOH 523 ? ? 1_555 O A HOH 558 ? ? 1_554 2.14 
3 1 O A HOH 589 ? ? 1_555 O A HOH 606 ? ? 8_545 2.18 
# 
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 ASN A 77  ? A -95.89  36.59 
2 1 ASN A 77  ? B -98.73  39.32 
3 1 ASP A 98  ? ? -68.15  1.99  
4 1 LYS A 143 ? ? -101.22 55.43 
# 
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 1   ? A MET 1   
2   1 Y 1 A SER 2   ? A SER 2   
3   1 Y 1 A ASP 3   ? A ASP 3   
4   1 Y 1 A ASN 4   ? A ASN 4   
5   1 Y 1 A GLY 5   ? A GLY 5   
6   1 Y 1 A PRO 6   ? A PRO 6   
7   1 Y 1 A GLN 7   ? A GLN 7   
8   1 Y 1 A ASN 8   ? A ASN 8   
9   1 Y 1 A GLN 9   ? A GLN 9   
10  1 Y 1 A ARG 10  ? A ARG 10  
11  1 Y 1 A ASN 11  ? A ASN 11  
12  1 Y 1 A ALA 12  ? A ALA 12  
13  1 Y 1 A PRO 13  ? A PRO 13  
14  1 Y 1 A ARG 14  ? A ARG 14  
15  1 Y 1 A ILE 15  ? A ILE 15  
16  1 Y 1 A THR 16  ? A THR 16  
17  1 Y 1 A PHE 17  ? A PHE 17  
18  1 Y 1 A GLY 18  ? A GLY 18  
19  1 Y 1 A GLY 19  ? A GLY 19  
20  1 Y 1 A PRO 20  ? A PRO 20  
21  1 Y 1 A SER 21  ? A SER 21  
22  1 Y 1 A ASP 22  ? A ASP 22  
23  1 Y 1 A SER 23  ? A SER 23  
24  1 Y 1 A THR 24  ? A THR 24  
25  1 Y 1 A GLY 25  ? A GLY 25  
26  1 Y 1 A SER 26  ? A SER 26  
27  1 Y 1 A ASN 27  ? A ASN 27  
28  1 Y 1 A GLN 28  ? A GLN 28  
29  1 Y 1 A ASN 29  ? A ASN 29  
30  1 Y 1 A GLY 30  ? A GLY 30  
31  1 Y 1 A GLU 31  ? A GLU 31  
32  1 Y 1 A ARG 32  ? A ARG 32  
33  1 Y 1 A SER 33  ? A SER 33  
34  1 Y 1 A GLY 34  ? A GLY 34  
35  1 Y 1 A ALA 35  ? A ALA 35  
36  1 Y 1 A ARG 36  ? A ARG 36  
37  1 Y 1 A SER 37  ? A SER 37  
38  1 Y 1 A LYS 38  ? A LYS 38  
39  1 Y 1 A GLU 174 ? A GLU 174 
40  1 Y 1 A GLY 175 ? A GLY 175 
41  1 Y 1 A SER 176 ? A SER 176 
42  1 Y 1 A ARG 177 ? A ARG 177 
43  1 Y 1 A GLY 178 ? A GLY 178 
44  1 Y 1 A GLY 179 ? A GLY 179 
45  1 Y 1 A SER 180 ? A SER 180 
46  1 Y 1 A GLN 181 ? A GLN 181 
47  1 Y 1 A ALA 182 ? A ALA 182 
48  1 Y 1 A SER 183 ? A SER 183 
49  1 Y 1 A SER 184 ? A SER 184 
50  1 Y 1 A ARG 185 ? A ARG 185 
51  1 Y 1 A SER 186 ? A SER 186 
52  1 Y 1 A SER 187 ? A SER 187 
53  1 Y 1 A SER 188 ? A SER 188 
54  1 Y 1 A ARG 189 ? A ARG 189 
55  1 Y 1 A SER 190 ? A SER 190 
56  1 Y 1 A ARG 191 ? A ARG 191 
57  1 Y 1 A ASN 192 ? A ASN 192 
58  1 Y 1 A SER 193 ? A SER 193 
59  1 Y 1 A SER 194 ? A SER 194 
60  1 Y 1 A ARG 195 ? A ARG 195 
61  1 Y 1 A ASN 196 ? A ASN 196 
62  1 Y 1 A SER 197 ? A SER 197 
63  1 Y 1 A THR 198 ? A THR 198 
64  1 Y 1 A PRO 199 ? A PRO 199 
65  1 Y 1 A GLY 200 ? A GLY 200 
66  1 Y 1 A SER 201 ? A SER 201 
67  1 Y 1 A SER 202 ? A SER 202 
68  1 Y 1 A ARG 203 ? A ARG 203 
69  1 Y 1 A GLY 204 ? A GLY 204 
70  1 Y 1 A THR 205 ? A THR 205 
71  1 Y 1 A SER 206 ? A SER 206 
72  1 Y 1 A PRO 207 ? A PRO 207 
73  1 Y 1 A ALA 208 ? A ALA 208 
74  1 Y 1 A ARG 209 ? A ARG 209 
75  1 Y 1 A MET 210 ? A MET 210 
76  1 Y 1 A ALA 211 ? A ALA 211 
77  1 Y 1 A GLY 212 ? A GLY 212 
78  1 Y 1 A ASN 213 ? A ASN 213 
79  1 Y 1 A GLY 214 ? A GLY 214 
80  1 Y 1 A GLY 215 ? A GLY 215 
81  1 Y 1 A ASP 216 ? A ASP 216 
82  1 Y 1 A ALA 217 ? A ALA 217 
83  1 Y 1 A ALA 218 ? A ALA 218 
84  1 Y 1 A LEU 219 ? A LEU 219 
85  1 Y 1 A ALA 220 ? A ALA 220 
86  1 Y 1 A LEU 221 ? A LEU 221 
87  1 Y 1 A LEU 222 ? A LEU 222 
88  1 Y 1 A LEU 223 ? A LEU 223 
89  1 Y 1 A LEU 224 ? A LEU 224 
90  1 Y 1 A ASP 225 ? A ASP 225 
91  1 Y 1 A ARG 226 ? A ARG 226 
92  1 Y 1 A LEU 227 ? A LEU 227 
93  1 Y 1 A ASN 228 ? A ASN 228 
94  1 Y 1 A GLN 229 ? A GLN 229 
95  1 Y 1 A LEU 230 ? A LEU 230 
96  1 Y 1 A GLU 231 ? A GLU 231 
97  1 Y 1 A SER 232 ? A SER 232 
98  1 Y 1 A LYS 233 ? A LYS 233 
99  1 Y 1 A MET 234 ? A MET 234 
100 1 Y 1 A SER 235 ? A SER 235 
101 1 Y 1 A GLY 236 ? A GLY 236 
102 1 Y 1 A LYS 237 ? A LYS 237 
103 1 Y 1 A GLY 238 ? A GLY 238 
104 1 Y 1 A GLN 239 ? A GLN 239 
105 1 Y 1 A GLN 240 ? A GLN 240 
106 1 Y 1 A GLN 241 ? A GLN 241 
107 1 Y 1 A GLN 242 ? A GLN 242 
108 1 Y 1 A GLY 243 ? A GLY 243 
109 1 Y 1 A GLN 244 ? A GLN 244 
110 1 Y 1 A THR 245 ? A THR 245 
111 1 Y 1 A VAL 246 ? A VAL 246 
112 1 Y 1 A THR 247 ? A THR 247 
113 1 Y 1 A LYS 248 ? A LYS 248 
114 1 Y 1 A LYS 249 ? A LYS 249 
115 1 Y 1 A SER 250 ? A SER 250 
116 1 Y 1 A ALA 251 ? A ALA 251 
117 1 Y 1 A ALA 252 ? A ALA 252 
118 1 Y 1 A GLU 253 ? A GLU 253 
119 1 Y 1 A ALA 254 ? A ALA 254 
120 1 Y 1 A SER 255 ? A SER 255 
121 1 Y 1 A LYS 256 ? A LYS 256 
122 1 Y 1 A LYS 257 ? A LYS 257 
123 1 Y 1 A PRO 258 ? A PRO 258 
124 1 Y 1 A ARG 259 ? A ARG 259 
125 1 Y 1 A GLN 260 ? A GLN 260 
126 1 Y 1 A LYS 261 ? A LYS 261 
127 1 Y 1 A ARG 262 ? A ARG 262 
128 1 Y 1 A THR 263 ? A THR 263 
129 1 Y 1 A ALA 264 ? A ALA 264 
130 1 Y 1 A THR 265 ? A THR 265 
131 1 Y 1 A LYS 266 ? A LYS 266 
132 1 Y 1 A ALA 267 ? A ALA 267 
133 1 Y 1 A TYR 268 ? A TYR 268 
134 1 Y 1 A ASN 269 ? A ASN 269 
135 1 Y 1 A VAL 270 ? A VAL 270 
136 1 Y 1 A THR 271 ? A THR 271 
137 1 Y 1 A GLN 272 ? A GLN 272 
138 1 Y 1 A ALA 273 ? A ALA 273 
139 1 Y 1 A PHE 274 ? A PHE 274 
140 1 Y 1 A GLY 275 ? A GLY 275 
141 1 Y 1 A ARG 276 ? A ARG 276 
142 1 Y 1 A ARG 277 ? A ARG 277 
143 1 Y 1 A GLY 278 ? A GLY 278 
144 1 Y 1 A PRO 279 ? A PRO 279 
145 1 Y 1 A GLU 280 ? A GLU 280 
146 1 Y 1 A GLN 281 ? A GLN 281 
147 1 Y 1 A THR 282 ? A THR 282 
148 1 Y 1 A GLN 283 ? A GLN 283 
149 1 Y 1 A GLY 284 ? A GLY 284 
150 1 Y 1 A ASN 285 ? A ASN 285 
151 1 Y 1 A PHE 286 ? A PHE 286 
152 1 Y 1 A GLY 287 ? A GLY 287 
153 1 Y 1 A ASP 288 ? A ASP 288 
154 1 Y 1 A GLN 289 ? A GLN 289 
155 1 Y 1 A GLU 290 ? A GLU 290 
156 1 Y 1 A LEU 291 ? A LEU 291 
157 1 Y 1 A ILE 292 ? A ILE 292 
158 1 Y 1 A ARG 293 ? A ARG 293 
159 1 Y 1 A GLN 294 ? A GLN 294 
160 1 Y 1 A GLY 295 ? A GLY 295 
161 1 Y 1 A THR 296 ? A THR 296 
162 1 Y 1 A ASP 297 ? A ASP 297 
163 1 Y 1 A TYR 298 ? A TYR 298 
164 1 Y 1 A LYS 299 ? A LYS 299 
165 1 Y 1 A HIS 300 ? A HIS 300 
166 1 Y 1 A TRP 301 ? A TRP 301 
167 1 Y 1 A PRO 302 ? A PRO 302 
168 1 Y 1 A GLN 303 ? A GLN 303 
169 1 Y 1 A ILE 304 ? A ILE 304 
170 1 Y 1 A ALA 305 ? A ALA 305 
171 1 Y 1 A GLN 306 ? A GLN 306 
172 1 Y 1 A PHE 307 ? A PHE 307 
173 1 Y 1 A ALA 308 ? A ALA 308 
174 1 Y 1 A PRO 309 ? A PRO 309 
175 1 Y 1 A SER 310 ? A SER 310 
176 1 Y 1 A ALA 311 ? A ALA 311 
177 1 Y 1 A SER 312 ? A SER 312 
178 1 Y 1 A ALA 313 ? A ALA 313 
179 1 Y 1 A PHE 314 ? A PHE 314 
180 1 Y 1 A PHE 315 ? A PHE 315 
181 1 Y 1 A GLY 316 ? A GLY 316 
182 1 Y 1 A MET 317 ? A MET 317 
183 1 Y 1 A SER 318 ? A SER 318 
184 1 Y 1 A ARG 319 ? A ARG 319 
185 1 Y 1 A ILE 320 ? A ILE 320 
186 1 Y 1 A GLY 321 ? A GLY 321 
187 1 Y 1 A MET 322 ? A MET 322 
188 1 Y 1 A GLU 323 ? A GLU 323 
189 1 Y 1 A VAL 324 ? A VAL 324 
190 1 Y 1 A THR 325 ? A THR 325 
191 1 Y 1 A PRO 326 ? A PRO 326 
192 1 Y 1 A SER 327 ? A SER 327 
193 1 Y 1 A GLY 328 ? A GLY 328 
194 1 Y 1 A THR 329 ? A THR 329 
195 1 Y 1 A TRP 330 ? A TRP 330 
196 1 Y 1 A LEU 331 ? A LEU 331 
197 1 Y 1 A THR 332 ? A THR 332 
198 1 Y 1 A TYR 333 ? A TYR 333 
199 1 Y 1 A THR 334 ? A THR 334 
200 1 Y 1 A GLY 335 ? A GLY 335 
201 1 Y 1 A ALA 336 ? A ALA 336 
202 1 Y 1 A ILE 337 ? A ILE 337 
203 1 Y 1 A LYS 338 ? A LYS 338 
204 1 Y 1 A LEU 339 ? A LEU 339 
205 1 Y 1 A ASP 340 ? A ASP 340 
206 1 Y 1 A ASP 341 ? A ASP 341 
207 1 Y 1 A LYS 342 ? A LYS 342 
208 1 Y 1 A ASP 343 ? A ASP 343 
209 1 Y 1 A PRO 344 ? A PRO 344 
210 1 Y 1 A ASN 345 ? A ASN 345 
211 1 Y 1 A PHE 346 ? A PHE 346 
212 1 Y 1 A LYS 347 ? A LYS 347 
213 1 Y 1 A ASP 348 ? A ASP 348 
214 1 Y 1 A GLN 349 ? A GLN 349 
215 1 Y 1 A VAL 350 ? A VAL 350 
216 1 Y 1 A ILE 351 ? A ILE 351 
217 1 Y 1 A LEU 352 ? A LEU 352 
218 1 Y 1 A LEU 353 ? A LEU 353 
219 1 Y 1 A ASN 354 ? A ASN 354 
220 1 Y 1 A LYS 355 ? A LYS 355 
221 1 Y 1 A HIS 356 ? A HIS 356 
222 1 Y 1 A ILE 357 ? A ILE 357 
223 1 Y 1 A ASP 358 ? A ASP 358 
224 1 Y 1 A ALA 359 ? A ALA 359 
225 1 Y 1 A TYR 360 ? A TYR 360 
226 1 Y 1 A LYS 361 ? A LYS 361 
227 1 Y 1 A THR 362 ? A THR 362 
228 1 Y 1 A PHE 363 ? A PHE 363 
229 1 Y 1 A PRO 364 ? A PRO 364 
230 1 Y 1 A PRO 365 ? A PRO 365 
231 1 Y 1 A THR 366 ? A THR 366 
232 1 Y 1 A GLU 367 ? A GLU 367 
233 1 Y 1 A PRO 368 ? A PRO 368 
234 1 Y 1 A LYS 369 ? A LYS 369 
235 1 Y 1 A LYS 370 ? A LYS 370 
236 1 Y 1 A ASP 371 ? A ASP 371 
237 1 Y 1 A LYS 372 ? A LYS 372 
238 1 Y 1 A LYS 373 ? A LYS 373 
239 1 Y 1 A LYS 374 ? A LYS 374 
240 1 Y 1 A LYS 375 ? A LYS 375 
241 1 Y 1 A ALA 376 ? A ALA 376 
242 1 Y 1 A ASP 377 ? A ASP 377 
243 1 Y 1 A GLU 378 ? A GLU 378 
244 1 Y 1 A THR 379 ? A THR 379 
245 1 Y 1 A GLN 380 ? A GLN 380 
246 1 Y 1 A ALA 381 ? A ALA 381 
247 1 Y 1 A LEU 382 ? A LEU 382 
248 1 Y 1 A PRO 383 ? A PRO 383 
249 1 Y 1 A GLN 384 ? A GLN 384 
250 1 Y 1 A ARG 385 ? A ARG 385 
251 1 Y 1 A GLN 386 ? A GLN 386 
252 1 Y 1 A LYS 387 ? A LYS 387 
253 1 Y 1 A LYS 388 ? A LYS 388 
254 1 Y 1 A GLN 389 ? A GLN 389 
255 1 Y 1 A GLN 390 ? A GLN 390 
256 1 Y 1 A THR 391 ? A THR 391 
257 1 Y 1 A VAL 392 ? A VAL 392 
258 1 Y 1 A THR 393 ? A THR 393 
259 1 Y 1 A LEU 394 ? A LEU 394 
260 1 Y 1 A LEU 395 ? A LEU 395 
261 1 Y 1 A PRO 396 ? A PRO 396 
262 1 Y 1 A ALA 397 ? A ALA 397 
263 1 Y 1 A ALA 398 ? A ALA 398 
264 1 Y 1 A ASP 399 ? A ASP 399 
265 1 Y 1 A LEU 400 ? A LEU 400 
266 1 Y 1 A ASP 401 ? A ASP 401 
267 1 Y 1 A ASP 402 ? A ASP 402 
268 1 Y 1 A PHE 403 ? A PHE 403 
269 1 Y 1 A SER 404 ? A SER 404 
270 1 Y 1 A LYS 405 ? A LYS 405 
271 1 Y 1 A GLN 406 ? A GLN 406 
272 1 Y 1 A LEU 407 ? A LEU 407 
273 1 Y 1 A GLN 408 ? A GLN 408 
274 1 Y 1 A GLN 409 ? A GLN 409 
275 1 Y 1 A SER 410 ? A SER 410 
276 1 Y 1 A MET 411 ? A MET 411 
277 1 Y 1 A SER 412 ? A SER 412 
278 1 Y 1 A SER 413 ? A SER 413 
279 1 Y 1 A ALA 414 ? A ALA 414 
280 1 Y 1 A ASP 415 ? A ASP 415 
281 1 Y 1 A SER 416 ? A SER 416 
282 1 Y 1 A THR 417 ? A THR 417 
283 1 Y 1 A GLN 418 ? A GLN 418 
284 1 Y 1 A ALA 419 ? A ALA 419 
285 1 Y 1 B DT  2   ? B DT  4   
286 1 Y 1 B DT  3   ? B DT  5   
287 1 Y 1 B DT  4   ? B DT  6   
288 1 Y 1 B DT  5   ? B DT  7   
289 1 Y 1 B DT  6   ? B DT  8   
290 1 Y 1 B DT  7   ? B DT  9   
291 1 Y 1 B DT  8   ? B DT  10  
292 1 Y 1 B DT  9   ? B DT  11  
293 1 Y 1 B DT  10  ? B DT  12  
294 1 Y 1 B DT  11  ? B DT  13  
295 1 Y 1 B DT  12  ? B DT  14  
296 1 Y 1 B DT  13  ? B DT  15  
297 1 Y 1 B DT  14  ? B DT  16  
298 1 Y 1 B DT  15  ? B DT  17  
299 1 Y 1 B DT  16  ? B DT  18  
300 1 Y 1 B DT  17  ? B DT  19  
301 1 Y 1 B DT  18  ? B DT  20  
# 
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  
DT  OP3    O N N 74  
DT  P      P N N 75  
DT  OP1    O N N 76  
DT  OP2    O N N 77  
DT  "O5'"  O N N 78  
DT  "C5'"  C N N 79  
DT  "C4'"  C N R 80  
DT  "O4'"  O N N 81  
DT  "C3'"  C N S 82  
DT  "O3'"  O N N 83  
DT  "C2'"  C N N 84  
DT  "C1'"  C N R 85  
DT  N1     N N N 86  
DT  C2     C N N 87  
DT  O2     O N N 88  
DT  N3     N N N 89  
DT  C4     C N N 90  
DT  O4     O N N 91  
DT  C5     C N N 92  
DT  C7     C N N 93  
DT  C6     C N N 94  
DT  HOP3   H N N 95  
DT  HOP2   H N N 96  
DT  "H5'"  H N N 97  
DT  "H5''" H N N 98  
DT  "H4'"  H N N 99  
DT  "H3'"  H N N 100 
DT  "HO3'" H N N 101 
DT  "H2'"  H N N 102 
DT  "H2''" H N N 103 
DT  "H1'"  H N N 104 
DT  H3     H N N 105 
DT  H71    H N N 106 
DT  H72    H N N 107 
DT  H73    H N N 108 
DT  H6     H N N 109 
GLN N      N N N 110 
GLN CA     C N S 111 
GLN C      C N N 112 
GLN O      O N N 113 
GLN CB     C N N 114 
GLN CG     C N N 115 
GLN CD     C N N 116 
GLN OE1    O N N 117 
GLN NE2    N N N 118 
GLN OXT    O N N 119 
GLN H      H N N 120 
GLN H2     H N N 121 
GLN HA     H N N 122 
GLN HB2    H N N 123 
GLN HB3    H N N 124 
GLN HG2    H N N 125 
GLN HG3    H N N 126 
GLN HE21   H N N 127 
GLN HE22   H N N 128 
GLN HXT    H N N 129 
GLU N      N N N 130 
GLU CA     C N S 131 
GLU C      C N N 132 
GLU O      O N N 133 
GLU CB     C N N 134 
GLU CG     C N N 135 
GLU CD     C N N 136 
GLU OE1    O N N 137 
GLU OE2    O N N 138 
GLU OXT    O N N 139 
GLU H      H N N 140 
GLU H2     H N N 141 
GLU HA     H N N 142 
GLU HB2    H N N 143 
GLU HB3    H N N 144 
GLU HG2    H N N 145 
GLU HG3    H N N 146 
GLU HE2    H N N 147 
GLU HXT    H N N 148 
GLY N      N N N 149 
GLY CA     C N N 150 
GLY C      C N N 151 
GLY O      O N N 152 
GLY OXT    O N N 153 
GLY H      H N N 154 
GLY H2     H N N 155 
GLY HA2    H N N 156 
GLY HA3    H N N 157 
GLY HXT    H N N 158 
HIS N      N N N 159 
HIS CA     C N S 160 
HIS C      C N N 161 
HIS O      O N N 162 
HIS CB     C N N 163 
HIS CG     C Y N 164 
HIS ND1    N Y N 165 
HIS CD2    C Y N 166 
HIS CE1    C Y N 167 
HIS NE2    N Y N 168 
HIS OXT    O N N 169 
HIS H      H N N 170 
HIS H2     H N N 171 
HIS HA     H N N 172 
HIS HB2    H N N 173 
HIS HB3    H N N 174 
HIS HD1    H N N 175 
HIS HD2    H N N 176 
HIS HE1    H N N 177 
HIS HE2    H N N 178 
HIS HXT    H N N 179 
HOH O      O N N 180 
HOH H1     H N N 181 
HOH H2     H N N 182 
ILE N      N N N 183 
ILE CA     C N S 184 
ILE C      C N N 185 
ILE O      O N N 186 
ILE CB     C N S 187 
ILE CG1    C N N 188 
ILE CG2    C N N 189 
ILE CD1    C N N 190 
ILE OXT    O N N 191 
ILE H      H N N 192 
ILE H2     H N N 193 
ILE HA     H N N 194 
ILE HB     H N N 195 
ILE HG12   H N N 196 
ILE HG13   H N N 197 
ILE HG21   H N N 198 
ILE HG22   H N N 199 
ILE HG23   H N N 200 
ILE HD11   H N N 201 
ILE HD12   H N N 202 
ILE HD13   H N N 203 
ILE HXT    H N N 204 
LEU N      N N N 205 
LEU CA     C N S 206 
LEU C      C N N 207 
LEU O      O N N 208 
LEU CB     C N N 209 
LEU CG     C N N 210 
LEU CD1    C N N 211 
LEU CD2    C N N 212 
LEU OXT    O N N 213 
LEU H      H N N 214 
LEU H2     H N N 215 
LEU HA     H N N 216 
LEU HB2    H N N 217 
LEU HB3    H N N 218 
LEU HG     H N N 219 
LEU HD11   H N N 220 
LEU HD12   H N N 221 
LEU HD13   H N N 222 
LEU HD21   H N N 223 
LEU HD22   H N N 224 
LEU HD23   H N N 225 
LEU HXT    H N N 226 
LYS N      N N N 227 
LYS CA     C N S 228 
LYS C      C N N 229 
LYS O      O N N 230 
LYS CB     C N N 231 
LYS CG     C N N 232 
LYS CD     C N N 233 
LYS CE     C N N 234 
LYS NZ     N N N 235 
LYS OXT    O N N 236 
LYS H      H N N 237 
LYS H2     H N N 238 
LYS HA     H N N 239 
LYS HB2    H N N 240 
LYS HB3    H N N 241 
LYS HG2    H N N 242 
LYS HG3    H N N 243 
LYS HD2    H N N 244 
LYS HD3    H N N 245 
LYS HE2    H N N 246 
LYS HE3    H N N 247 
LYS HZ1    H N N 248 
LYS HZ2    H N N 249 
LYS HZ3    H N N 250 
LYS HXT    H N N 251 
MET N      N N N 252 
MET CA     C N S 253 
MET C      C N N 254 
MET O      O N N 255 
MET CB     C N N 256 
MET CG     C N N 257 
MET SD     S N N 258 
MET CE     C N N 259 
MET OXT    O N N 260 
MET H      H N N 261 
MET H2     H N N 262 
MET HA     H N N 263 
MET HB2    H N N 264 
MET HB3    H N N 265 
MET HG2    H N N 266 
MET HG3    H N N 267 
MET HE1    H N N 268 
MET HE2    H N N 269 
MET HE3    H N N 270 
MET HXT    H N N 271 
PHE N      N N N 272 
PHE CA     C N S 273 
PHE C      C N N 274 
PHE O      O N N 275 
PHE CB     C N N 276 
PHE CG     C Y N 277 
PHE CD1    C Y N 278 
PHE CD2    C Y N 279 
PHE CE1    C Y N 280 
PHE CE2    C Y N 281 
PHE CZ     C Y N 282 
PHE OXT    O N N 283 
PHE H      H N N 284 
PHE H2     H N N 285 
PHE HA     H N N 286 
PHE HB2    H N N 287 
PHE HB3    H N N 288 
PHE HD1    H N N 289 
PHE HD2    H N N 290 
PHE HE1    H N N 291 
PHE HE2    H N N 292 
PHE HZ     H N N 293 
PHE HXT    H N N 294 
PRO N      N N N 295 
PRO CA     C N S 296 
PRO C      C N N 297 
PRO O      O N N 298 
PRO CB     C N N 299 
PRO CG     C N N 300 
PRO CD     C N N 301 
PRO OXT    O N N 302 
PRO H      H N N 303 
PRO HA     H N N 304 
PRO HB2    H N N 305 
PRO HB3    H N N 306 
PRO HG2    H N N 307 
PRO HG3    H N N 308 
PRO HD2    H N N 309 
PRO HD3    H N N 310 
PRO HXT    H N N 311 
SER N      N N N 312 
SER CA     C N S 313 
SER C      C N N 314 
SER O      O N N 315 
SER CB     C N N 316 
SER OG     O N N 317 
SER OXT    O N N 318 
SER H      H N N 319 
SER H2     H N N 320 
SER HA     H N N 321 
SER HB2    H N N 322 
SER HB3    H N N 323 
SER HG     H N N 324 
SER HXT    H N N 325 
THR N      N N N 326 
THR CA     C N S 327 
THR C      C N N 328 
THR O      O N N 329 
THR CB     C N R 330 
THR OG1    O N N 331 
THR CG2    C N N 332 
THR OXT    O N N 333 
THR H      H N N 334 
THR H2     H N N 335 
THR HA     H N N 336 
THR HB     H N N 337 
THR HG1    H N N 338 
THR HG21   H N N 339 
THR HG22   H N N 340 
THR HG23   H N N 341 
THR HXT    H N N 342 
TRP N      N N N 343 
TRP CA     C N S 344 
TRP C      C N N 345 
TRP O      O N N 346 
TRP CB     C N N 347 
TRP CG     C Y N 348 
TRP CD1    C Y N 349 
TRP CD2    C Y N 350 
TRP NE1    N Y N 351 
TRP CE2    C Y N 352 
TRP CE3    C Y N 353 
TRP CZ2    C Y N 354 
TRP CZ3    C Y N 355 
TRP CH2    C Y N 356 
TRP OXT    O N N 357 
TRP H      H N N 358 
TRP H2     H N N 359 
TRP HA     H N N 360 
TRP HB2    H N N 361 
TRP HB3    H N N 362 
TRP HD1    H N N 363 
TRP HE1    H N N 364 
TRP HE3    H N N 365 
TRP HZ2    H N N 366 
TRP HZ3    H N N 367 
TRP HH2    H N N 368 
TRP HXT    H N N 369 
TYR N      N N N 370 
TYR CA     C N S 371 
TYR C      C N N 372 
TYR O      O N N 373 
TYR CB     C N N 374 
TYR CG     C Y N 375 
TYR CD1    C Y N 376 
TYR CD2    C Y N 377 
TYR CE1    C Y N 378 
TYR CE2    C Y N 379 
TYR CZ     C Y N 380 
TYR OH     O N N 381 
TYR OXT    O N N 382 
TYR H      H N N 383 
TYR H2     H N N 384 
TYR HA     H N N 385 
TYR HB2    H N N 386 
TYR HB3    H N N 387 
TYR HD1    H N N 388 
TYR HD2    H N N 389 
TYR HE1    H N N 390 
TYR HE2    H N N 391 
TYR HH     H N N 392 
TYR HXT    H N N 393 
VAL N      N N N 394 
VAL CA     C N S 395 
VAL C      C N N 396 
VAL O      O N N 397 
VAL CB     C N N 398 
VAL CG1    C N N 399 
VAL CG2    C N N 400 
VAL OXT    O N N 401 
VAL H      H N N 402 
VAL H2     H N N 403 
VAL HA     H N N 404 
VAL HB     H N N 405 
VAL HG11   H N N 406 
VAL HG12   H N N 407 
VAL HG13   H N N 408 
VAL HG21   H N N 409 
VAL HG22   H N N 410 
VAL HG23   H N N 411 
VAL HXT    H N N 412 
# 
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  
DT  OP3   P      sing N N 70  
DT  OP3   HOP3   sing N N 71  
DT  P     OP1    doub N N 72  
DT  P     OP2    sing N N 73  
DT  P     "O5'"  sing N N 74  
DT  OP2   HOP2   sing N N 75  
DT  "O5'" "C5'"  sing N N 76  
DT  "C5'" "C4'"  sing N N 77  
DT  "C5'" "H5'"  sing N N 78  
DT  "C5'" "H5''" sing N N 79  
DT  "C4'" "O4'"  sing N N 80  
DT  "C4'" "C3'"  sing N N 81  
DT  "C4'" "H4'"  sing N N 82  
DT  "O4'" "C1'"  sing N N 83  
DT  "C3'" "O3'"  sing N N 84  
DT  "C3'" "C2'"  sing N N 85  
DT  "C3'" "H3'"  sing N N 86  
DT  "O3'" "HO3'" sing N N 87  
DT  "C2'" "C1'"  sing N N 88  
DT  "C2'" "H2'"  sing N N 89  
DT  "C2'" "H2''" sing N N 90  
DT  "C1'" N1     sing N N 91  
DT  "C1'" "H1'"  sing N N 92  
DT  N1    C2     sing N N 93  
DT  N1    C6     sing N N 94  
DT  C2    O2     doub N N 95  
DT  C2    N3     sing N N 96  
DT  N3    C4     sing N N 97  
DT  N3    H3     sing N N 98  
DT  C4    O4     doub N N 99  
DT  C4    C5     sing N N 100 
DT  C5    C7     sing N N 101 
DT  C5    C6     doub N N 102 
DT  C7    H71    sing N N 103 
DT  C7    H72    sing N N 104 
DT  C7    H73    sing N N 105 
DT  C6    H6     sing N N 106 
GLN N     CA     sing N N 107 
GLN N     H      sing N N 108 
GLN N     H2     sing N N 109 
GLN CA    C      sing N N 110 
GLN CA    CB     sing N N 111 
GLN CA    HA     sing N N 112 
GLN C     O      doub N N 113 
GLN C     OXT    sing N N 114 
GLN CB    CG     sing N N 115 
GLN CB    HB2    sing N N 116 
GLN CB    HB3    sing N N 117 
GLN CG    CD     sing N N 118 
GLN CG    HG2    sing N N 119 
GLN CG    HG3    sing N N 120 
GLN CD    OE1    doub N N 121 
GLN CD    NE2    sing N N 122 
GLN NE2   HE21   sing N N 123 
GLN NE2   HE22   sing N N 124 
GLN OXT   HXT    sing N N 125 
GLU N     CA     sing N N 126 
GLU N     H      sing N N 127 
GLU N     H2     sing N N 128 
GLU CA    C      sing N N 129 
GLU CA    CB     sing N N 130 
GLU CA    HA     sing N N 131 
GLU C     O      doub N N 132 
GLU C     OXT    sing N N 133 
GLU CB    CG     sing N N 134 
GLU CB    HB2    sing N N 135 
GLU CB    HB3    sing N N 136 
GLU CG    CD     sing N N 137 
GLU CG    HG2    sing N N 138 
GLU CG    HG3    sing N N 139 
GLU CD    OE1    doub N N 140 
GLU CD    OE2    sing N N 141 
GLU OE2   HE2    sing N N 142 
GLU OXT   HXT    sing N N 143 
GLY N     CA     sing N N 144 
GLY N     H      sing N N 145 
GLY N     H2     sing N N 146 
GLY CA    C      sing N N 147 
GLY CA    HA2    sing N N 148 
GLY CA    HA3    sing N N 149 
GLY C     O      doub N N 150 
GLY C     OXT    sing N N 151 
GLY OXT   HXT    sing N N 152 
HIS N     CA     sing N N 153 
HIS N     H      sing N N 154 
HIS N     H2     sing N N 155 
HIS CA    C      sing N N 156 
HIS CA    CB     sing N N 157 
HIS CA    HA     sing N N 158 
HIS C     O      doub N N 159 
HIS C     OXT    sing N N 160 
HIS CB    CG     sing N N 161 
HIS CB    HB2    sing N N 162 
HIS CB    HB3    sing N N 163 
HIS CG    ND1    sing Y N 164 
HIS CG    CD2    doub Y N 165 
HIS ND1   CE1    doub Y N 166 
HIS ND1   HD1    sing N N 167 
HIS CD2   NE2    sing Y N 168 
HIS CD2   HD2    sing N N 169 
HIS CE1   NE2    sing Y N 170 
HIS CE1   HE1    sing N N 171 
HIS NE2   HE2    sing N N 172 
HIS OXT   HXT    sing N N 173 
HOH O     H1     sing N N 174 
HOH O     H2     sing N N 175 
ILE N     CA     sing N N 176 
ILE N     H      sing N N 177 
ILE N     H2     sing N N 178 
ILE CA    C      sing N N 179 
ILE CA    CB     sing N N 180 
ILE CA    HA     sing N N 181 
ILE C     O      doub N N 182 
ILE C     OXT    sing N N 183 
ILE CB    CG1    sing N N 184 
ILE CB    CG2    sing N N 185 
ILE CB    HB     sing N N 186 
ILE CG1   CD1    sing N N 187 
ILE CG1   HG12   sing N N 188 
ILE CG1   HG13   sing N N 189 
ILE CG2   HG21   sing N N 190 
ILE CG2   HG22   sing N N 191 
ILE CG2   HG23   sing N N 192 
ILE CD1   HD11   sing N N 193 
ILE CD1   HD12   sing N N 194 
ILE CD1   HD13   sing N N 195 
ILE OXT   HXT    sing N N 196 
LEU N     CA     sing N N 197 
LEU N     H      sing N N 198 
LEU N     H2     sing N N 199 
LEU CA    C      sing N N 200 
LEU CA    CB     sing N N 201 
LEU CA    HA     sing N N 202 
LEU C     O      doub N N 203 
LEU C     OXT    sing N N 204 
LEU CB    CG     sing N N 205 
LEU CB    HB2    sing N N 206 
LEU CB    HB3    sing N N 207 
LEU CG    CD1    sing N N 208 
LEU CG    CD2    sing N N 209 
LEU CG    HG     sing N N 210 
LEU CD1   HD11   sing N N 211 
LEU CD1   HD12   sing N N 212 
LEU CD1   HD13   sing N N 213 
LEU CD2   HD21   sing N N 214 
LEU CD2   HD22   sing N N 215 
LEU CD2   HD23   sing N N 216 
LEU OXT   HXT    sing N N 217 
LYS N     CA     sing N N 218 
LYS N     H      sing N N 219 
LYS N     H2     sing N N 220 
LYS CA    C      sing N N 221 
LYS CA    CB     sing N N 222 
LYS CA    HA     sing N N 223 
LYS C     O      doub N N 224 
LYS C     OXT    sing N N 225 
LYS CB    CG     sing N N 226 
LYS CB    HB2    sing N N 227 
LYS CB    HB3    sing N N 228 
LYS CG    CD     sing N N 229 
LYS CG    HG2    sing N N 230 
LYS CG    HG3    sing N N 231 
LYS CD    CE     sing N N 232 
LYS CD    HD2    sing N N 233 
LYS CD    HD3    sing N N 234 
LYS CE    NZ     sing N N 235 
LYS CE    HE2    sing N N 236 
LYS CE    HE3    sing N N 237 
LYS NZ    HZ1    sing N N 238 
LYS NZ    HZ2    sing N N 239 
LYS NZ    HZ3    sing N N 240 
LYS OXT   HXT    sing N N 241 
MET N     CA     sing N N 242 
MET N     H      sing N N 243 
MET N     H2     sing N N 244 
MET CA    C      sing N N 245 
MET CA    CB     sing N N 246 
MET CA    HA     sing N N 247 
MET C     O      doub N N 248 
MET C     OXT    sing N N 249 
MET CB    CG     sing N N 250 
MET CB    HB2    sing N N 251 
MET CB    HB3    sing N N 252 
MET CG    SD     sing N N 253 
MET CG    HG2    sing N N 254 
MET CG    HG3    sing N N 255 
MET SD    CE     sing N N 256 
MET CE    HE1    sing N N 257 
MET CE    HE2    sing N N 258 
MET CE    HE3    sing N N 259 
MET OXT   HXT    sing N N 260 
PHE N     CA     sing N N 261 
PHE N     H      sing N N 262 
PHE N     H2     sing N N 263 
PHE CA    C      sing N N 264 
PHE CA    CB     sing N N 265 
PHE CA    HA     sing N N 266 
PHE C     O      doub N N 267 
PHE C     OXT    sing N N 268 
PHE CB    CG     sing N N 269 
PHE CB    HB2    sing N N 270 
PHE CB    HB3    sing N N 271 
PHE CG    CD1    doub Y N 272 
PHE CG    CD2    sing Y N 273 
PHE CD1   CE1    sing Y N 274 
PHE CD1   HD1    sing N N 275 
PHE CD2   CE2    doub Y N 276 
PHE CD2   HD2    sing N N 277 
PHE CE1   CZ     doub Y N 278 
PHE CE1   HE1    sing N N 279 
PHE CE2   CZ     sing Y N 280 
PHE CE2   HE2    sing N N 281 
PHE CZ    HZ     sing N N 282 
PHE OXT   HXT    sing N N 283 
PRO N     CA     sing N N 284 
PRO N     CD     sing N N 285 
PRO N     H      sing N N 286 
PRO CA    C      sing N N 287 
PRO CA    CB     sing N N 288 
PRO CA    HA     sing N N 289 
PRO C     O      doub N N 290 
PRO C     OXT    sing N N 291 
PRO CB    CG     sing N N 292 
PRO CB    HB2    sing N N 293 
PRO CB    HB3    sing N N 294 
PRO CG    CD     sing N N 295 
PRO CG    HG2    sing N N 296 
PRO CG    HG3    sing N N 297 
PRO CD    HD2    sing N N 298 
PRO CD    HD3    sing N N 299 
PRO OXT   HXT    sing N N 300 
SER N     CA     sing N N 301 
SER N     H      sing N N 302 
SER N     H2     sing N N 303 
SER CA    C      sing N N 304 
SER CA    CB     sing N N 305 
SER CA    HA     sing N N 306 
SER C     O      doub N N 307 
SER C     OXT    sing N N 308 
SER CB    OG     sing N N 309 
SER CB    HB2    sing N N 310 
SER CB    HB3    sing N N 311 
SER OG    HG     sing N N 312 
SER OXT   HXT    sing N N 313 
THR N     CA     sing N N 314 
THR N     H      sing N N 315 
THR N     H2     sing N N 316 
THR CA    C      sing N N 317 
THR CA    CB     sing N N 318 
THR CA    HA     sing N N 319 
THR C     O      doub N N 320 
THR C     OXT    sing N N 321 
THR CB    OG1    sing N N 322 
THR CB    CG2    sing N N 323 
THR CB    HB     sing N N 324 
THR OG1   HG1    sing N N 325 
THR CG2   HG21   sing N N 326 
THR CG2   HG22   sing N N 327 
THR CG2   HG23   sing N N 328 
THR OXT   HXT    sing N N 329 
TRP N     CA     sing N N 330 
TRP N     H      sing N N 331 
TRP N     H2     sing N N 332 
TRP CA    C      sing N N 333 
TRP CA    CB     sing N N 334 
TRP CA    HA     sing N N 335 
TRP C     O      doub N N 336 
TRP C     OXT    sing N N 337 
TRP CB    CG     sing N N 338 
TRP CB    HB2    sing N N 339 
TRP CB    HB3    sing N N 340 
TRP CG    CD1    doub Y N 341 
TRP CG    CD2    sing Y N 342 
TRP CD1   NE1    sing Y N 343 
TRP CD1   HD1    sing N N 344 
TRP CD2   CE2    doub Y N 345 
TRP CD2   CE3    sing Y N 346 
TRP NE1   CE2    sing Y N 347 
TRP NE1   HE1    sing N N 348 
TRP CE2   CZ2    sing Y N 349 
TRP CE3   CZ3    doub Y N 350 
TRP CE3   HE3    sing N N 351 
TRP CZ2   CH2    doub Y N 352 
TRP CZ2   HZ2    sing N N 353 
TRP CZ3   CH2    sing Y N 354 
TRP CZ3   HZ3    sing N N 355 
TRP CH2   HH2    sing N N 356 
TRP OXT   HXT    sing N N 357 
TYR N     CA     sing N N 358 
TYR N     H      sing N N 359 
TYR N     H2     sing N N 360 
TYR CA    C      sing N N 361 
TYR CA    CB     sing N N 362 
TYR CA    HA     sing N N 363 
TYR C     O      doub N N 364 
TYR C     OXT    sing N N 365 
TYR CB    CG     sing N N 366 
TYR CB    HB2    sing N N 367 
TYR CB    HB3    sing N N 368 
TYR CG    CD1    doub Y N 369 
TYR CG    CD2    sing Y N 370 
TYR CD1   CE1    sing Y N 371 
TYR CD1   HD1    sing N N 372 
TYR CD2   CE2    doub Y N 373 
TYR CD2   HD2    sing N N 374 
TYR CE1   CZ     doub Y N 375 
TYR CE1   HE1    sing N N 376 
TYR CE2   CZ     sing Y N 377 
TYR CE2   HE2    sing N N 378 
TYR CZ    OH     sing N N 379 
TYR OH    HH     sing N N 380 
TYR OXT   HXT    sing N N 381 
VAL N     CA     sing N N 382 
VAL N     H      sing N N 383 
VAL N     H2     sing N N 384 
VAL CA    C      sing N N 385 
VAL CA    CB     sing N N 386 
VAL CA    HA     sing N N 387 
VAL C     O      doub N N 388 
VAL C     OXT    sing N N 389 
VAL CB    CG1    sing N N 390 
VAL CB    CG2    sing N N 391 
VAL CB    HB     sing N N 392 
VAL CG1   HG11   sing N N 393 
VAL CG1   HG12   sing N N 394 
VAL CG1   HG13   sing N N 395 
VAL CG2   HG21   sing N N 396 
VAL CG2   HG22   sing N N 397 
VAL CG2   HG23   sing N N 398 
VAL OXT   HXT    sing N N 399 
# 
_pdbx_audit_support.funding_organization   'National Institutes of Health/National Cancer Institute (NIH/NCI)' 
_pdbx_audit_support.country                'United States' 
_pdbx_audit_support.grant_number           'under contract 75N91019D00024' 
_pdbx_audit_support.ordinal                1 
# 
_pdbx_initial_refinement_model.id               1 
_pdbx_initial_refinement_model.entity_id_list   1 
_pdbx_initial_refinement_model.type             'experimental model' 
_pdbx_initial_refinement_model.source_name      PDB 
_pdbx_initial_refinement_model.accession_code   7N0R 
_pdbx_initial_refinement_model.details          'Chain: A' 
# 
_atom_sites.entry_id                    9CJ6 
_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]   0.011002 
_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]   0.011002 
_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]   0.027517 
_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 
H 
N 
O 
P 
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     . GLN A 1 39  ? 32.557  -1.394  13.593  1.00 41.88 ? 39  GLN A N     1 
ATOM   2    C CA    . GLN A 1 39  ? 32.115  -1.386  14.979  1.00 50.32 ? 39  GLN A CA    1 
ATOM   3    C C     . GLN A 1 39  ? 30.606  -1.573  15.038  1.00 41.09 ? 39  GLN A C     1 
ATOM   4    O O     . GLN A 1 39  ? 30.109  -2.524  15.641  1.00 48.07 ? 39  GLN A O     1 
ATOM   5    C CB    . GLN A 1 39  ? 32.501  -0.079  15.682  1.00 54.53 ? 39  GLN A CB    1 
ATOM   6    C CG    . GLN A 1 39  ? 33.895  0.440   15.364  1.00 50.01 ? 39  GLN A CG    1 
ATOM   7    C CD    . GLN A 1 39  ? 34.066  1.902   15.747  1.00 55.70 ? 39  GLN A CD    1 
ATOM   8    O OE1   . GLN A 1 39  ? 33.355  2.414   16.615  1.00 55.66 ? 39  GLN A OE1   1 
ATOM   9    N NE2   . GLN A 1 39  ? 35.005  2.585   15.090  1.00 44.81 ? 39  GLN A NE2   1 
ATOM   10   N N     . ARG A 1 40  ? 29.879  -0.654  14.407  1.00 33.75 ? 40  ARG A N     1 
ATOM   11   C CA    . ARG A 1 40  ? 28.420  -0.637  14.468  1.00 41.61 ? 40  ARG A CA    1 
ATOM   12   C C     . ARG A 1 40  ? 27.889  -1.376  13.245  1.00 30.82 ? 40  ARG A C     1 
ATOM   13   O O     . ARG A 1 40  ? 27.824  -0.819  12.143  1.00 27.42 ? 40  ARG A O     1 
ATOM   14   C CB    . ARG A 1 40  ? 27.899  0.795   14.537  1.00 29.64 ? 40  ARG A CB    1 
ATOM   15   N N     . ARG A 1 41  ? 27.514  -2.636  13.436  1.00 27.89 ? 41  ARG A N     1 
ATOM   16   C CA    . ARG A 1 41  ? 27.026  -3.423  12.315  1.00 25.81 ? 41  ARG A CA    1 
ATOM   17   C C     . ARG A 1 41  ? 25.584  -3.047  12.024  1.00 22.13 ? 41  ARG A C     1 
ATOM   18   O O     . ARG A 1 41  ? 24.772  -2.948  12.953  1.00 23.10 ? 41  ARG A O     1 
ATOM   19   C CB    . ARG A 1 41  ? 27.143  -4.914  12.603  1.00 25.39 ? 41  ARG A CB    1 
ATOM   20   C CG    . ARG A 1 41  ? 28.591  -5.339  12.776  1.00 31.72 ? 41  ARG A CG    1 
ATOM   21   C CD    . ARG A 1 41  ? 28.791  -6.815  12.569  1.00 28.25 ? 41  ARG A CD    1 
ATOM   22   N NE    . ARG A 1 41  ? 30.202  -7.168  12.689  1.00 39.75 ? 41  ARG A NE    1 
ATOM   23   N N     . PRO A 1 42  ? 25.233  -2.815  10.767  1.00 18.09 ? 42  PRO A N     1 
ATOM   24   C CA    . PRO A 1 42  ? 23.874  -2.387  10.443  1.00 15.99 ? 42  PRO A CA    1 
ATOM   25   C C     . PRO A 1 42  ? 22.835  -3.417  10.845  1.00 19.56 ? 42  PRO A C     1 
ATOM   26   O O     . PRO A 1 42  ? 23.112  -4.614  10.946  1.00 23.36 ? 42  PRO A O     1 
ATOM   27   C CB    . PRO A 1 42  ? 23.920  -2.199  8.923   1.00 20.63 ? 42  PRO A CB    1 
ATOM   28   C CG    . PRO A 1 42  ? 25.369  -1.833  8.675   1.00 13.55 ? 42  PRO A CG    1 
ATOM   29   C CD    . PRO A 1 42  ? 26.169  -2.639  9.645   1.00 18.76 ? 42  PRO A CD    1 
ATOM   30   N N     . GLN A 1 43  ? 21.626  -2.898  11.080  1.00 20.49 ? 43  GLN A N     1 
ATOM   31   C CA    . GLN A 1 43  ? 20.459  -3.734  11.427  1.00 16.25 ? 43  GLN A CA    1 
ATOM   32   C C     . GLN A 1 43  ? 19.237  -3.117  10.743  1.00 20.43 ? 43  GLN A C     1 
ATOM   33   O O     . GLN A 1 43  ? 19.120  -1.908  10.733  1.00 19.47 ? 43  GLN A O     1 
ATOM   34   C CB    . GLN A 1 43  ? 20.250  -3.777  12.945  1.00 21.36 ? 43  GLN A CB    1 
ATOM   35   C CG    . GLN A 1 43  ? 21.461  -4.224  13.745  1.00 32.95 ? 43  GLN A CG    1 
ATOM   36   C CD    . GLN A 1 43  ? 21.536  -5.728  13.797  1.00 46.85 ? 43  GLN A CD    1 
ATOM   37   O OE1   . GLN A 1 43  ? 20.523  -6.409  13.926  1.00 50.45 ? 43  GLN A OE1   1 
ATOM   38   N NE2   . GLN A 1 43  ? 22.741  -6.256  13.674  1.00 40.33 ? 43  GLN A NE2   1 
ATOM   39   N N     . GLY A 1 44  ? 18.367  -3.932  10.158  1.00 18.60 ? 44  GLY A N     1 
ATOM   40   C CA    . GLY A 1 44  ? 17.152  -3.429  9.548   1.00 19.07 ? 44  GLY A CA    1 
ATOM   41   C C     . GLY A 1 44  ? 15.965  -3.442  10.513  1.00 16.38 ? 44  GLY A C     1 
ATOM   42   O O     . GLY A 1 44  ? 16.078  -3.831  11.670  1.00 20.27 ? 44  GLY A O     1 
ATOM   43   N N     . LEU A 1 45  ? 14.818  -2.997  10.015  1.00 21.84 ? 45  LEU A N     1 
ATOM   44   C CA    . LEU A 1 45  ? 13.606  -3.169  10.799  1.00 19.78 ? 45  LEU A CA    1 
ATOM   45   C C     . LEU A 1 45  ? 13.294  -4.663  10.882  1.00 23.35 ? 45  LEU A C     1 
ATOM   46   O O     . LEU A 1 45  ? 13.595  -5.420  9.958   1.00 23.97 ? 45  LEU A O     1 
ATOM   47   C CB    . LEU A 1 45  ? 12.445  -2.388  10.192  1.00 23.72 ? 45  LEU A CB    1 
ATOM   48   C CG    . LEU A 1 45  ? 12.631  -0.860  10.311  1.00 23.82 ? 45  LEU A CG    1 
ATOM   49   C CD1   . LEU A 1 45  ? 11.633  -0.101  9.463   1.00 28.62 ? 45  LEU A CD1   1 
ATOM   50   C CD2   . LEU A 1 45  ? 12.540  -0.396  11.767  1.00 25.16 ? 45  LEU A CD2   1 
ATOM   51   N N     . PRO A 1 46  ? 12.753  -5.123  12.004  1.00 21.49 ? 46  PRO A N     1 
ATOM   52   C CA    . PRO A 1 46  ? 12.501  -6.561  12.154  1.00 23.36 ? 46  PRO A CA    1 
ATOM   53   C C     . PRO A 1 46  ? 11.382  -7.040  11.246  1.00 18.42 ? 46  PRO A C     1 
ATOM   54   O O     . PRO A 1 46  ? 10.477  -6.291  10.871  1.00 23.35 ? 46  PRO A O     1 
ATOM   55   C CB    . PRO A 1 46  ? 12.113  -6.697  13.632  1.00 20.23 ? 46  PRO A CB    1 
ATOM   56   C CG    . PRO A 1 46  ? 11.517  -5.392  13.960  1.00 21.64 ? 46  PRO A CG    1 
ATOM   57   C CD    . PRO A 1 46  ? 12.303  -4.360  13.177  1.00 25.08 ? 46  PRO A CD    1 
ATOM   58   N N     . ASN A 1 47  ? 11.466  -8.313  10.874  1.00 19.41 ? 47  ASN A N     1 
ATOM   59   C CA    . ASN A 1 47  ? 10.368  -8.985  10.199  1.00 18.84 ? 47  ASN A CA    1 
ATOM   60   C C     . ASN A 1 47  ? 9.539   -9.638  11.290  1.00 17.13 ? 47  ASN A C     1 
ATOM   61   O O     . ASN A 1 47  ? 9.996   -10.598 11.910  1.00 17.31 ? 47  ASN A O     1 
ATOM   62   C CB    . ASN A 1 47  ? 10.866  -10.031 9.208   1.00 19.08 ? 47  ASN A CB    1 
ATOM   63   C CG    . ASN A 1 47  ? 9.734   -10.898 8.673   1.00 22.18 ? 47  ASN A CG    1 
ATOM   64   O OD1   . ASN A 1 47  ? 8.567   -10.543 8.793   1.00 24.75 ? 47  ASN A OD1   1 
ATOM   65   N ND2   . ASN A 1 47  ? 10.080  -12.045 8.083   1.00 27.06 ? 47  ASN A ND2   1 
ATOM   66   N N     . ASN A 1 48  ? 8.340   -9.107  11.532  1.00 16.99 ? 48  ASN A N     1 
ATOM   67   C CA    . ASN A 1 48  ? 7.430   -9.612  12.554  1.00 20.09 ? 48  ASN A CA    1 
ATOM   68   C C     . ASN A 1 48  ? 6.246   -10.351 11.953  1.00 15.55 ? 48  ASN A C     1 
ATOM   69   O O     . ASN A 1 48  ? 5.252   -10.586 12.655  1.00 19.14 ? 48  ASN A O     1 
ATOM   70   C CB    . ASN A 1 48  ? 6.914   -8.461  13.415  1.00 19.11 ? 48  ASN A CB    1 
ATOM   71   C CG    . ASN A 1 48  ? 7.953   -7.946  14.380  1.00 25.80 ? 48  ASN A CG    1 
ATOM   72   O OD1   . ASN A 1 48  ? 8.712   -8.719  14.963  1.00 36.63 ? 48  ASN A OD1   1 
ATOM   73   N ND2   . ASN A 1 48  ? 7.984   -6.638  14.568  1.00 27.57 ? 48  ASN A ND2   1 
ATOM   74   H HA    . ASN A 1 48  ? 7.923   -10.228 13.118  1.00 24.15 ? 48  ASN A HA    1 
ATOM   75   N N     . THR A 1 49  ? 6.342   -10.733 10.679  1.00 13.59 ? 49  THR A N     1 
ATOM   76   C CA    . THR A 1 49  ? 5.185   -11.115 9.879   1.00 17.51 ? 49  THR A CA    1 
ATOM   77   C C     . THR A 1 49  ? 5.229   -12.562 9.413   1.00 15.78 ? 49  THR A C     1 
ATOM   78   O O     . THR A 1 49  ? 4.447   -12.924 8.524   1.00 13.89 ? 49  THR A O     1 
ATOM   79   C CB    . THR A 1 49  ? 5.083   -10.215 8.637   1.00 23.35 ? 49  THR A CB    1 
ATOM   80   O OG1   . THR A 1 49  ? 6.097   -10.608 7.698   1.00 33.56 ? 49  THR A OG1   1 
ATOM   81   C CG2   . THR A 1 49  ? 5.298   -8.762  8.995   1.00 32.36 ? 49  THR A CG2   1 
ATOM   82   H H     . THR A 1 49  ? 7.085   -10.779 10.249  1.00 16.35 ? 49  THR A H     1 
ATOM   83   H HA    . THR A 1 49  ? 4.397   -10.998 10.433  1.00 21.05 ? 49  THR A HA    1 
ATOM   84   H HB    . THR A 1 49  ? 4.199   -10.303 8.248   1.00 28.06 ? 49  THR A HB    1 
ATOM   85   H HG1   . THR A 1 49  ? 6.046   -10.135 7.006   1.00 40.31 ? 49  THR A HG1   1 
ATOM   86   H HG21  . THR A 1 49  ? 5.212   -8.209  8.203   1.00 38.87 ? 49  THR A HG21  1 
ATOM   87   H HG22  . THR A 1 49  ? 4.639   -8.481  9.649   1.00 38.87 ? 49  THR A HG22  1 
ATOM   88   H HG23  . THR A 1 49  ? 6.185   -8.641  9.369   1.00 38.87 ? 49  THR A HG23  1 
ATOM   89   N N     . ALA A 1 50  ? 6.153   -13.391 9.920   1.00 13.03 ? 50  ALA A N     1 
ATOM   90   C CA    . ALA A 1 50  ? 6.245   -14.761 9.432   1.00 12.61 ? 50  ALA A CA    1 
ATOM   91   C C     . ALA A 1 50  ? 5.152   -15.640 10.047  1.00 6.98  ? 50  ALA A C     1 
ATOM   92   O O     . ALA A 1 50  ? 4.615   -15.344 11.118  1.00 9.59  ? 50  ALA A O     1 
ATOM   93   C CB    . ALA A 1 50  ? 7.623   -15.366 9.723   1.00 11.11 ? 50  ALA A CB    1 
ATOM   94   H H     . ALA A 1 50  ? 6.721   -13.182 10.531  1.00 15.67 ? 50  ALA A H     1 
ATOM   95   H HA    . ALA A 1 50  ? 6.123   -14.754 8.470   1.00 15.17 ? 50  ALA A HA    1 
ATOM   96   H HB1   . ALA A 1 50  ? 7.732   -16.173 9.197   1.00 13.37 ? 50  ALA A HB1   1 
ATOM   97   H HB2   . ALA A 1 50  ? 8.308   -14.721 9.485   1.00 13.37 ? 50  ALA A HB2   1 
ATOM   98   H HB3   . ALA A 1 50  ? 7.682   -15.577 10.668  1.00 13.37 ? 50  ALA A HB3   1 
ATOM   99   N N     . SER A 1 51  ? 4.811   -16.693 9.326   1.00 7.15  ? 51  SER A N     1 
ATOM   100  C CA    . SER A 1 51  ? 3.979   -17.755 9.878   1.00 7.10  ? 51  SER A CA    1 
ATOM   101  C C     . SER A 1 51  ? 4.675   -18.342 11.089  1.00 9.15  ? 51  SER A C     1 
ATOM   102  O O     . SER A 1 51  ? 5.899   -18.478 11.104  1.00 8.74  ? 51  SER A O     1 
ATOM   103  C CB    . SER A 1 51  ? 3.752   -18.830 8.832   1.00 9.92  ? 51  SER A CB    1 
ATOM   104  O OG    . SER A 1 51  ? 3.064   -19.962 9.351   1.00 7.56  ? 51  SER A OG    1 
ATOM   105  H H     . SER A 1 51  ? 5.048   -16.822 8.509   1.00 8.62  ? 51  SER A H     1 
ATOM   106  H HA    . SER A 1 51  ? 3.112   -17.408 10.141  1.00 8.56  ? 51  SER A HA    1 
ATOM   107  H HB2   . SER A 1 51  ? 3.225   -18.452 8.110   1.00 11.94 ? 51  SER A HB2   1 
ATOM   108  H HB3   . SER A 1 51  ? 4.615   -19.121 8.496   1.00 11.94 ? 51  SER A HB3   1 
ATOM   109  H HG    . SER A 1 51  ? 2.381   -19.715 9.773   1.00 9.11  ? 51  SER A HG    1 
ATOM   110  N N     . TRP A 1 52  ? 3.886   -18.724 12.091  1.00 8.46  ? 52  TRP A N     1 
ATOM   111  C CA    . TRP A 1 52  ? 4.438   -19.468 13.209  1.00 8.26  ? 52  TRP A CA    1 
ATOM   112  C C     . TRP A 1 52  ? 4.837   -20.878 12.836  1.00 9.75  ? 52  TRP A C     1 
ATOM   113  O O     . TRP A 1 52  ? 5.554   -21.516 13.625  1.00 10.26 ? 52  TRP A O     1 
ATOM   114  C CB    . TRP A 1 52  ? 3.431   -19.541 14.368  1.00 8.46  ? 52  TRP A CB    1 
ATOM   115  C CG    . TRP A 1 52  ? 3.364   -18.298 15.165  1.00 10.06 ? 52  TRP A CG    1 
ATOM   116  C CD1   . TRP A 1 52  ? 2.371   -17.341 15.166  1.00 11.76 ? 52  TRP A CD1   1 
ATOM   117  C CD2   . TRP A 1 52  ? 4.351   -17.845 16.089  1.00 9.18  ? 52  TRP A CD2   1 
ATOM   118  N NE1   . TRP A 1 52  ? 2.699   -16.328 16.046  1.00 13.77 ? 52  TRP A NE1   1 
ATOM   119  C CE2   . TRP A 1 52  ? 3.912   -16.617 16.617  1.00 12.05 ? 52  TRP A CE2   1 
ATOM   120  C CE3   . TRP A 1 52  ? 5.571   -18.362 16.519  1.00 13.18 ? 52  TRP A CE3   1 
ATOM   121  C CZ2   . TRP A 1 52  ? 4.659   -15.902 17.560  1.00 13.53 ? 52  TRP A CZ2   1 
ATOM   122  C CZ3   . TRP A 1 52  ? 6.313   -17.630 17.465  1.00 14.29 ? 52  TRP A CZ3   1 
ATOM   123  C CH2   . TRP A 1 52  ? 5.851   -16.436 17.960  1.00 16.95 ? 52  TRP A CH2   1 
ATOM   124  H H     . TRP A 1 52  ? 3.043   -18.566 12.143  1.00 10.19 ? 52  TRP A H     1 
ATOM   125  H HA    . TRP A 1 52  ? 5.224   -18.990 13.519  1.00 9.95  ? 52  TRP A HA    1 
ATOM   126  H HB2   . TRP A 1 52  ? 2.547   -19.710 14.005  1.00 10.19 ? 52  TRP A HB2   1 
ATOM   127  H HB3   . TRP A 1 52  ? 3.689   -20.263 14.963  1.00 10.19 ? 52  TRP A HB3   1 
ATOM   128  H HD1   . TRP A 1 52  ? 1.598   -17.372 14.651  1.00 14.15 ? 52  TRP A HD1   1 
ATOM   129  H HE1   . TRP A 1 52  ? 2.221   -15.632 16.210  1.00 16.56 ? 52  TRP A HE1   1 
ATOM   130  H HE3   . TRP A 1 52  ? 5.887   -19.172 16.189  1.00 15.85 ? 52  TRP A HE3   1 
ATOM   131  H HZ2   . TRP A 1 52  ? 4.354   -15.093 17.903  1.00 16.28 ? 52  TRP A HZ2   1 
ATOM   132  H HZ3   . TRP A 1 52  ? 7.130   -17.961 17.760  1.00 17.18 ? 52  TRP A HZ3   1 
ATOM   133  H HH2   . TRP A 1 52  ? 6.364   -15.978 18.586  1.00 20.38 ? 52  TRP A HH2   1 
ATOM   134  N N     . PHE A 1 53  ? 4.400   -21.395 11.688  1.00 8.35  ? 53  PHE A N     1 
ATOM   135  C CA    . PHE A 1 53  ? 4.554   -22.798 11.361  1.00 7.68  ? 53  PHE A CA    1 
ATOM   136  C C     . PHE A 1 53  ? 5.378   -22.971 10.094  1.00 9.14  ? 53  PHE A C     1 
ATOM   137  O O     . PHE A 1 53  ? 5.417   -22.086 9.242   1.00 9.27  ? 53  PHE A O     1 
ATOM   138  C CB    . PHE A 1 53  ? 3.199   -23.484 11.142  1.00 8.40  ? 53  PHE A CB    1 
ATOM   139  C CG    . PHE A 1 53  ? 2.264   -23.341 12.288  1.00 7.56  ? 53  PHE A CG    1 
ATOM   140  C CD1   . PHE A 1 53  ? 1.412   -22.258 12.366  1.00 9.74  ? 53  PHE A CD1   1 
ATOM   141  C CD2   . PHE A 1 53  ? 2.221   -24.295 13.309  1.00 11.55 ? 53  PHE A CD2   1 
ATOM   142  C CE1   . PHE A 1 53  ? 0.550   -22.113 13.421  1.00 9.62  ? 53  PHE A CE1   1 
ATOM   143  C CE2   . PHE A 1 53  ? 1.358   -24.147 14.361  1.00 10.58 ? 53  PHE A CE2   1 
ATOM   144  C CZ    . PHE A 1 53  ? 0.526   -23.054 14.428  1.00 10.82 ? 53  PHE A CZ    1 
ATOM   145  H H     . PHE A 1 53  ? 4.005   -20.939 11.075  1.00 10.05 ? 53  PHE A H     1 
ATOM   146  H HA    . PHE A 1 53  ? 5.015   -23.226 12.098  1.00 9.26  ? 53  PHE A HA    1 
ATOM   147  H HB2   . PHE A 1 53  ? 2.774   -23.094 10.363  1.00 10.12 ? 53  PHE A HB2   1 
ATOM   148  H HB3   . PHE A 1 53  ? 3.349   -24.432 10.999  1.00 10.12 ? 53  PHE A HB3   1 
ATOM   149  H HD1   . PHE A 1 53  ? 1.424   -21.617 11.693  1.00 11.73 ? 53  PHE A HD1   1 
ATOM   150  H HD2   . PHE A 1 53  ? 2.782   -25.036 13.273  1.00 13.89 ? 53  PHE A HD2   1 
ATOM   151  H HE1   . PHE A 1 53  ? -0.021  -21.379 13.457  1.00 11.59 ? 53  PHE A HE1   1 
ATOM   152  H HE2   . PHE A 1 53  ? 1.334   -24.788 15.034  1.00 12.74 ? 53  PHE A HE2   1 
ATOM   153  H HZ    . PHE A 1 53  ? -0.050  -22.950 15.150  1.00 13.02 ? 53  PHE A HZ    1 
ATOM   154  N N     . THR A 1 54  ? 6.020   -24.129 9.958   1.00 8.92  ? 54  THR A N     1 
ATOM   155  C CA    . THR A 1 54  ? 6.626   -24.484 8.688   1.00 9.31  ? 54  THR A CA    1 
ATOM   156  C C     . THR A 1 54  ? 5.552   -24.607 7.600   1.00 11.03 ? 54  THR A C     1 
ATOM   157  O O     . THR A 1 54  ? 4.360   -24.736 7.872   1.00 9.43  ? 54  THR A O     1 
ATOM   158  C CB    . THR A 1 54  ? 7.418   -25.779 8.823   1.00 11.12 ? 54  THR A CB    1 
ATOM   159  O OG1   . THR A 1 54  ? 6.549   -26.855 9.198   1.00 10.36 ? 54  THR A OG1   1 
ATOM   160  C CG2   . THR A 1 54  ? 8.533   -25.620 9.884   1.00 9.43  ? 54  THR A CG2   1 
ATOM   161  H H     . THR A 1 54  ? 6.115   -24.716 10.579  1.00 10.74 ? 54  THR A H     1 
ATOM   162  H HA    . THR A 1 54  ? 7.246   -23.791 8.411   1.00 11.21 ? 54  THR A HA    1 
ATOM   163  H HB    . THR A 1 54  ? 7.830   -25.991 7.971   1.00 13.38 ? 54  THR A HB    1 
ATOM   164  H HG1   . THR A 1 54  ? 6.731   -27.541 8.749   1.00 12.46 ? 54  THR A HG1   1 
ATOM   165  H HG21  . THR A 1 54  ? 9.019   -26.454 9.982   1.00 11.35 ? 54  THR A HG21  1 
ATOM   166  H HG22  . THR A 1 54  ? 9.152   -24.924 9.613   1.00 11.35 ? 54  THR A HG22  1 
ATOM   167  H HG23  . THR A 1 54  ? 8.144   -25.380 10.740  1.00 11.35 ? 54  THR A HG23  1 
ATOM   168  N N     . ALA A 1 55  ? 5.982   -24.591 6.353   1.00 11.03 ? 55  ALA A N     1 
ATOM   169  C CA    . ALA A 1 55  ? 5.036   -24.622 5.246   1.00 12.16 ? 55  ALA A CA    1 
ATOM   170  C C     . ALA A 1 55  ? 4.654   -26.042 4.844   1.00 13.20 ? 55  ALA A C     1 
ATOM   171  O O     . ALA A 1 55  ? 5.400   -27.002 5.048   1.00 15.48 ? 55  ALA A O     1 
ATOM   172  C CB    . ALA A 1 55  ? 5.628   -23.904 4.026   1.00 15.52 ? 55  ALA A CB    1 
ATOM   173  H H     . ALA A 1 55  ? 6.809   -24.562 6.119   1.00 13.27 ? 55  ALA A H     1 
ATOM   174  H HA    . ALA A 1 55  ? 4.226   -24.173 5.535   1.00 14.63 ? 55  ALA A HA    1 
ATOM   175  H HB1   . ALA A 1 55  ? 5.767   -24.551 3.316   1.00 18.66 ? 55  ALA A HB1   1 
ATOM   176  H HB2   . ALA A 1 55  ? 5.009   -23.218 3.732   1.00 18.66 ? 55  ALA A HB2   1 
ATOM   177  H HB3   . ALA A 1 55  ? 6.474   -23.502 4.276   1.00 18.66 ? 55  ALA A HB3   1 
ATOM   178  N N     . LEU A 1 56  ? 3.493   -26.156 4.196   1.00 11.47 ? 56  LEU A N     1 
ATOM   179  C CA    . LEU A 1 56  ? 3.109   -27.358 3.467   1.00 11.63 ? 56  LEU A CA    1 
ATOM   180  C C     . LEU A 1 56  ? 3.563   -27.197 2.021   1.00 12.62 ? 56  LEU A C     1 
ATOM   181  O O     . LEU A 1 56  ? 3.072   -26.321 1.307   1.00 14.34 ? 56  LEU A O     1 
ATOM   182  C CB    . LEU A 1 56  ? 1.606   -27.590 3.545   1.00 16.07 ? 56  LEU A CB    1 
ATOM   183  C CG    . LEU A 1 56  ? 1.033   -27.893 4.920   1.00 18.17 ? 56  LEU A CG    1 
ATOM   184  C CD1   . LEU A 1 56  ? -0.461  -28.082 4.845   1.00 13.51 ? 56  LEU A CD1   1 
ATOM   185  C CD2   . LEU A 1 56  ? 1.698   -29.144 5.473   1.00 22.73 ? 56  LEU A CD2   1 
ATOM   186  H H     . LEU A 1 56  ? 2.899   -25.534 4.165   1.00 13.81 ? 56  LEU A H     1 
ATOM   187  H HA    . LEU A 1 56  ? 3.550   -28.128 3.857   1.00 14.00 ? 56  LEU A HA    1 
ATOM   188  H HB2   . LEU A 1 56  ? 1.162   -26.790 3.222   1.00 19.32 ? 56  LEU A HB2   1 
ATOM   189  H HB3   . LEU A 1 56  ? 1.389   -28.343 2.974   1.00 19.32 ? 56  LEU A HB3   1 
ATOM   190  H HG    . LEU A 1 56  ? 1.205   -27.148 5.517   1.00 21.84 ? 56  LEU A HG    1 
ATOM   191  H HD11  . LEU A 1 56  ? -0.822  -28.105 5.745   1.00 16.24 ? 56  LEU A HD11  1 
ATOM   192  H HD12  . LEU A 1 56  ? -0.848  -27.342 4.352   1.00 16.24 ? 56  LEU A HD12  1 
ATOM   193  H HD13  . LEU A 1 56  ? -0.651  -28.917 4.390   1.00 16.24 ? 56  LEU A HD13  1 
ATOM   194  H HD21  . LEU A 1 56  ? 1.114   -29.545 6.136   1.00 27.32 ? 56  LEU A HD21  1 
ATOM   195  H HD22  . LEU A 1 56  ? 1.851   -29.768 4.747   1.00 27.32 ? 56  LEU A HD22  1 
ATOM   196  H HD23  . LEU A 1 56  ? 2.542   -28.898 5.882   1.00 27.32 ? 56  LEU A HD23  1 
ATOM   197  N N     . THR A 1 57  ? 4.506   -28.024 1.593   1.00 14.25 ? 57  THR A N     1 
ATOM   198  C CA    . THR A 1 57  ? 5.022   -27.945 0.234   1.00 10.97 ? 57  THR A CA    1 
ATOM   199  C C     . THR A 1 57  ? 4.133   -28.708 -0.732  1.00 15.10 ? 57  THR A C     1 
ATOM   200  O O     . THR A 1 57  ? 3.787   -29.873 -0.499  1.00 12.60 ? 57  THR A O     1 
ATOM   201  C CB    . THR A 1 57  ? 6.456   -28.484 0.180   1.00 14.45 ? 57  THR A CB    1 
ATOM   202  O OG1   . THR A 1 57  ? 7.282   -27.691 1.041   1.00 19.92 ? 57  THR A OG1   1 
ATOM   203  C CG2   . THR A 1 57  ? 7.009   -28.439 -1.239  1.00 20.42 ? 57  THR A CG2   1 
ATOM   204  H H     . THR A 1 57  ? 4.866   -28.642 2.071   1.00 17.14 ? 57  THR A H     1 
ATOM   205  H HA    . THR A 1 57  ? 5.028   -27.016 -0.045  1.00 13.21 ? 57  THR A HA    1 
ATOM   206  H HB    . THR A 1 57  ? 6.466   -29.410 0.468   1.00 17.38 ? 57  THR A HB    1 
ATOM   207  H HG1   . THR A 1 57  ? 7.275   -26.890 0.789   1.00 23.94 ? 57  THR A HG1   1 
ATOM   208  H HG21  . THR A 1 57  ? 7.973   -28.537 -1.222  1.00 24.54 ? 57  THR A HG21  1 
ATOM   209  H HG22  . THR A 1 57  ? 6.628   -29.159 -1.766  1.00 24.54 ? 57  THR A HG22  1 
ATOM   210  H HG23  . THR A 1 57  ? 6.786   -27.592 -1.655  1.00 24.54 ? 57  THR A HG23  1 
ATOM   211  N N     . GLN A 1 58  ? 3.772   -28.042 -1.826  1.00 12.45 ? 58  GLN A N     1 
ATOM   212  C CA    . GLN A 1 58  ? 2.972   -28.625 -2.893  1.00 13.03 ? 58  GLN A CA    1 
ATOM   213  C C     . GLN A 1 58  ? 3.889   -29.307 -3.892  1.00 19.01 ? 58  GLN A C     1 
ATOM   214  O O     . GLN A 1 58  ? 4.563   -28.627 -4.670  1.00 18.54 ? 58  GLN A O     1 
ATOM   215  C CB    . GLN A 1 58  ? 2.159   -27.546 -3.597  1.00 11.69 ? 58  GLN A CB    1 
ATOM   216  C CG    . GLN A 1 58  ? 1.255   -28.088 -4.671  1.00 15.28 ? 58  GLN A CG    1 
ATOM   217  C CD    . GLN A 1 58  ? 0.564   -26.990 -5.441  1.00 14.32 ? 58  GLN A CD    1 
ATOM   218  O OE1   . GLN A 1 58  ? 0.190   -25.945 -4.887  1.00 15.77 ? 58  GLN A OE1   1 
ATOM   219  N NE2   . GLN A 1 58  ? 0.402   -27.213 -6.750  1.00 16.18 ? 58  GLN A NE2   1 
ATOM   220  H H     . GLN A 1 58  ? 3.988   -27.223 -1.976  1.00 14.97 ? 58  GLN A H     1 
ATOM   221  H HA    . GLN A 1 58  ? 2.375   -29.286 -2.509  1.00 15.68 ? 58  GLN A HA    1 
ATOM   222  H HB2   . GLN A 1 58  ? 1.606   -27.092 -2.942  1.00 14.07 ? 58  GLN A HB2   1 
ATOM   223  H HB3   . GLN A 1 58  ? 2.768   -26.914 -4.011  1.00 14.07 ? 58  GLN A HB3   1 
ATOM   224  H HG2   . GLN A 1 58  ? 1.781   -28.611 -5.295  1.00 18.37 ? 58  GLN A HG2   1 
ATOM   225  H HG3   . GLN A 1 58  ? 0.574   -28.645 -4.262  1.00 18.37 ? 58  GLN A HG3   1 
ATOM   226  H HE21  . GLN A 1 58  ? 0.684   -27.946 -7.100  1.00 19.46 ? 58  GLN A HE21  1 
ATOM   227  H HE22  . GLN A 1 58  ? 0.014   -26.623 -7.242  1.00 19.46 ? 58  GLN A HE22  1 
ATOM   228  N N     . HIS A 1 59  ? 3.879   -30.645 -3.901  1.00 18.37 ? 59  HIS A N     1 
ATOM   229  C CA    . HIS A 1 59  ? 4.735   -31.420 -4.788  1.00 19.17 ? 59  HIS A CA    1 
ATOM   230  C C     . HIS A 1 59  ? 4.055   -31.794 -6.089  1.00 20.27 ? 59  HIS A C     1 
ATOM   231  O O     . HIS A 1 59  ? 4.751   -32.146 -7.050  1.00 22.85 ? 59  HIS A O     1 
ATOM   232  C CB    . HIS A 1 59  ? 5.205   -32.691 -4.082  1.00 23.89 ? 59  HIS A CB    1 
ATOM   233  C CG    . HIS A 1 59  ? 6.049   -32.422 -2.881  1.00 26.16 ? 59  HIS A CG    1 
ATOM   234  N ND1   . HIS A 1 59  ? 7.370   -32.038 -2.973  1.00 26.61 ? 59  HIS A ND1   1 
ATOM   235  C CD2   . HIS A 1 59  ? 5.757   -32.454 -1.559  1.00 23.98 ? 59  HIS A CD2   1 
ATOM   236  C CE1   . HIS A 1 59  ? 7.857   -31.852 -1.759  1.00 30.00 ? 59  HIS A CE1   1 
ATOM   237  N NE2   . HIS A 1 59  ? 6.901   -32.104 -0.883  1.00 25.88 ? 59  HIS A NE2   1 
ATOM   238  H H     . HIS A 1 59  ? 3.379   -31.127 -3.394  1.00 22.08 ? 59  HIS A H     1 
ATOM   239  H HA    . HIS A 1 59  ? 5.518   -30.891 -5.005  1.00 23.04 ? 59  HIS A HA    1 
ATOM   240  H HB2   . HIS A 1 59  ? 4.428   -33.195 -3.793  1.00 28.71 ? 59  HIS A HB2   1 
ATOM   241  H HB3   . HIS A 1 59  ? 5.730   -33.219 -4.703  1.00 28.71 ? 59  HIS A HB3   1 
ATOM   242  H HD2   . HIS A 1 59  ? 4.936   -32.673 -1.180  1.00 28.82 ? 59  HIS A HD2   1 
ATOM   243  H HE1   . HIS A 1 59  ? 8.725   -31.588 -1.555  1.00 36.04 ? 59  HIS A HE1   1 
ATOM   244  H HE2   . HIS A 1 59  ? 6.981   -32.056 -0.028  1.00 31.09 ? 59  HIS A HE2   1 
ATOM   245  N N     . GLY A 1 60  ? 2.725   -31.708 -6.143  1.00 18.57 ? 60  GLY A N     1 
ATOM   246  C CA    . GLY A 1 60  ? 1.951   -32.100 -7.290  1.00 19.78 ? 60  GLY A CA    1 
ATOM   247  C C     . GLY A 1 60  ? 1.290   -30.920 -7.963  1.00 17.21 ? 60  GLY A C     1 
ATOM   248  O O     . GLY A 1 60  ? 1.627   -29.757 -7.709  1.00 17.58 ? 60  GLY A O     1 
ATOM   249  H H     . GLY A 1 60  ? 2.243   -31.412 -5.496  1.00 22.32 ? 60  GLY A H     1 
ATOM   250  H HA2   . GLY A 1 60  ? 2.530   -32.536 -7.935  1.00 23.78 ? 60  GLY A HA2   1 
ATOM   251  H HA3   . GLY A 1 60  ? 1.261   -32.722 -7.014  1.00 23.78 ? 60  GLY A HA3   1 
ATOM   252  N N     . LYS A 1 61  ? 0.318   -31.225 -8.823  1.00 21.37 ? 61  LYS A N     1 
ATOM   253  C CA    . LYS A 1 61  ? -0.407  -30.218 -9.583  1.00 19.74 ? 61  LYS A CA    1 
ATOM   254  C C     . LYS A 1 61  ? -1.630  -29.671 -8.860  1.00 22.70 ? 61  LYS A C     1 
ATOM   255  O O     . LYS A 1 61  ? -2.235  -28.722 -9.352  1.00 26.13 ? 61  LYS A O     1 
ATOM   256  C CB    . LYS A 1 61  ? -0.846  -30.797 -10.933 1.00 24.89 ? 61  LYS A CB    1 
ATOM   257  C CG    . LYS A 1 61  ? -1.964  -31.828 -10.845 1.00 28.08 ? 61  LYS A CG    1 
ATOM   258  C CD    . LYS A 1 61  ? -2.169  -32.531 -12.158 1.00 36.84 ? 61  LYS A CD    1 
ATOM   259  C CE    . LYS A 1 61  ? -3.598  -32.981 -12.272 1.00 39.39 ? 61  LYS A CE    1 
ATOM   260  N NZ    . LYS A 1 61  ? -3.817  -33.738 -13.523 1.00 57.14 ? 61  LYS A NZ    1 
ATOM   261  H H     . LYS A 1 61  ? 0.057   -32.028 -8.984  1.00 25.68 ? 61  LYS A H     1 
ATOM   262  H HA    . LYS A 1 61  ? 0.193   -29.473 -9.747  1.00 23.72 ? 61  LYS A HA    1 
ATOM   263  H HB2   . LYS A 1 61  ? -1.161  -30.071 -11.494 1.00 29.91 ? 61  LYS A HB2   1 
ATOM   264  H HB3   . LYS A 1 61  ? -0.082  -31.228 -11.348 1.00 29.91 ? 61  LYS A HB3   1 
ATOM   265  H HG2   . LYS A 1 61  ? -1.737  -32.492 -10.176 1.00 33.74 ? 61  LYS A HG2   1 
ATOM   266  H HG3   . LYS A 1 61  ? -2.792  -31.384 -10.604 1.00 33.74 ? 61  LYS A HG3   1 
ATOM   267  H HD2   . LYS A 1 61  ? -1.973  -31.925 -12.890 1.00 44.25 ? 61  LYS A HD2   1 
ATOM   268  H HD3   . LYS A 1 61  ? -1.592  -33.309 -12.208 1.00 44.25 ? 61  LYS A HD3   1 
ATOM   269  H HE2   . LYS A 1 61  ? -3.816  -33.557 -11.523 1.00 47.30 ? 61  LYS A HE2   1 
ATOM   270  H HE3   . LYS A 1 61  ? -4.182  -32.206 -12.276 1.00 47.30 ? 61  LYS A HE3   1 
ATOM   271  H HZ1   . LYS A 1 61  ? -4.675  -33.960 -13.599 1.00 68.60 ? 61  LYS A HZ1   1 
ATOM   272  H HZ2   . LYS A 1 61  ? -3.584  -33.241 -14.224 1.00 68.60 ? 61  LYS A HZ2   1 
ATOM   273  H HZ3   . LYS A 1 61  ? -3.326  -34.480 -13.520 1.00 68.60 ? 61  LYS A HZ3   1 
ATOM   274  N N     . GLU A 1 62  ? -2.017  -30.240 -7.715  1.00 20.37 ? 62  GLU A N     1 
ATOM   275  C CA    . GLU A 1 62  ? -3.231  -29.835 -7.018  1.00 19.84 ? 62  GLU A CA    1 
ATOM   276  C C     . GLU A 1 62  ? -2.927  -28.716 -6.021  1.00 17.43 ? 62  GLU A C     1 
ATOM   277  O O     . GLU A 1 62  ? -1.990  -28.834 -5.233  1.00 15.36 ? 62  GLU A O     1 
ATOM   278  C CB    . GLU A 1 62  ? -3.836  -31.036 -6.280  1.00 24.80 ? 62  GLU A CB    1 
ATOM   279  C CG    . GLU A 1 62  ? -4.338  -32.189 -7.175  1.00 32.60 ? 62  GLU A CG    1 
ATOM   280  C CD    . GLU A 1 62  ? -3.217  -33.064 -7.734  1.00 51.07 ? 62  GLU A CD    1 
ATOM   281  O OE1   . GLU A 1 62  ? -2.082  -33.004 -7.206  1.00 47.08 ? 62  GLU A OE1   1 
ATOM   282  O OE2   . GLU A 1 62  ? -3.474  -33.819 -8.707  1.00 56.75 ? 62  GLU A OE2   1 
ATOM   283  H H     . GLU A 1 62  ? -1.584  -30.869 -7.320  1.00 24.48 ? 62  GLU A H     1 
ATOM   284  H HA    . GLU A 1 62  ? -3.872  -29.498 -7.663  1.00 23.84 ? 62  GLU A HA    1 
ATOM   285  H HB2   . GLU A 1 62  ? -3.158  -31.404 -5.690  1.00 29.80 ? 62  GLU A HB2   1 
ATOM   286  H HB3   . GLU A 1 62  ? -4.593  -30.724 -5.761  1.00 29.80 ? 62  GLU A HB3   1 
ATOM   287  H HG2   . GLU A 1 62  ? -4.924  -32.758 -6.653  1.00 39.15 ? 62  GLU A HG2   1 
ATOM   288  H HG3   . GLU A 1 62  ? -4.822  -31.813 -7.927  1.00 39.15 ? 62  GLU A HG3   1 
ATOM   289  N N     . ASP A 1 63  ? -3.713  -27.636 -6.059  1.00 15.72 ? 63  ASP A N     1 
ATOM   290  C CA    . ASP A 1 63  ? -3.693  -26.643 -4.990  1.00 16.17 ? 63  ASP A CA    1 
ATOM   291  C C     . ASP A 1 63  ? -4.005  -27.312 -3.658  1.00 13.06 ? 63  ASP A C     1 
ATOM   292  O O     . ASP A 1 63  ? -4.692  -28.330 -3.602  1.00 16.64 ? 63  ASP A O     1 
ATOM   293  C CB    . ASP A 1 63  ? -4.743  -25.548 -5.201  1.00 17.70 ? 63  ASP A CB    1 
ATOM   294  C CG    . ASP A 1 63  ? -4.469  -24.677 -6.402  1.00 34.31 ? 63  ASP A CG    1 
ATOM   295  O OD1   . ASP A 1 63  ? -3.369  -24.777 -6.987  1.00 27.52 ? 63  ASP A OD1   1 
ATOM   296  O OD2   . ASP A 1 63  ? -5.371  -23.892 -6.756  1.00 30.84 ? 63  ASP A OD2   1 
ATOM   297  H H     . ASP A 1 63  ? -4.266  -27.458 -6.694  1.00 18.90 ? 63  ASP A H     1 
ATOM   298  H HA    . ASP A 1 63  ? -2.813  -26.235 -4.981  1.00 19.44 ? 63  ASP A HA    1 
ATOM   299  H HB2   . ASP A 1 63  ? -5.609  -25.965 -5.328  1.00 21.28 ? 63  ASP A HB2   1 
ATOM   300  H HB3   . ASP A 1 63  ? -4.762  -24.976 -4.418  1.00 21.28 ? 63  ASP A HB3   1 
ATOM   301  N N     . LEU A 1 64  ? -3.551  -26.686 -2.571  1.00 11.77 ? 64  LEU A N     1 
ATOM   302  C CA    . LEU A 1 64  ? -4.019  -27.089 -1.252  1.00 11.69 ? 64  LEU A CA    1 
ATOM   303  C C     . LEU A 1 64  ? -5.508  -26.803 -1.130  1.00 11.78 ? 64  LEU A C     1 
ATOM   304  O O     . LEU A 1 64  ? -6.008  -25.803 -1.646  1.00 13.34 ? 64  LEU A O     1 
ATOM   305  C CB    . LEU A 1 64  ? -3.247  -26.342 -0.175  1.00 8.95  ? 64  LEU A CB    1 
ATOM   306  C CG    . LEU A 1 64  ? -3.499  -26.786 1.258   1.00 14.60 ? 64  LEU A CG    1 
ATOM   307  C CD1   . LEU A 1 64  ? -3.144  -28.255 1.346   1.00 11.63 ? 64  LEU A CD1   1 
ATOM   308  C CD2   . LEU A 1 64  ? -2.673  -25.926 2.189   1.00 13.61 ? 64  LEU A CD2   1 
ATOM   309  H H     . LEU A 1 64  ? -2.985  -26.039 -2.574  1.00 14.16 ? 64  LEU A H     1 
ATOM   310  H HA    . LEU A 1 64  ? -3.871  -28.039 -1.119  1.00 14.07 ? 64  LEU A HA    1 
ATOM   311  H HB2   . LEU A 1 64  ? -2.299  -26.456 -0.349  1.00 10.78 ? 64  LEU A HB2   1 
ATOM   312  H HB3   . LEU A 1 64  ? -3.483  -25.403 -0.231  1.00 10.78 ? 64  LEU A HB3   1 
ATOM   313  H HG    . LEU A 1 64  ? -4.424  -26.682 1.530   1.00 17.56 ? 64  LEU A HG    1 
ATOM   314  H HD11  . LEU A 1 64  ? -2.934  -28.475 2.267   1.00 13.99 ? 64  LEU A HD11  1 
ATOM   315  H HD12  . LEU A 1 64  ? -3.901  -28.782 1.045   1.00 13.99 ? 64  LEU A HD12  1 
ATOM   316  H HD13  . LEU A 1 64  ? -2.375  -28.429 0.780   1.00 13.99 ? 64  LEU A HD13  1 
ATOM   317  H HD21  . LEU A 1 64  ? -2.914  -26.131 3.106   1.00 16.37 ? 64  LEU A HD21  1 
ATOM   318  H HD22  . LEU A 1 64  ? -1.733  -26.116 2.043   1.00 16.37 ? 64  LEU A HD22  1 
ATOM   319  H HD23  . LEU A 1 64  ? -2.854  -24.992 2.000   1.00 16.37 ? 64  LEU A HD23  1 
ATOM   320  N N     . LYS A 1 65  ? -6.202  -27.702 -0.433  1.00 14.26 ? 65  LYS A N     1 
ATOM   321  C CA    . LYS A 1 65  ? -7.619  -27.520 -0.082  1.00 12.51 ? 65  LYS A CA    1 
ATOM   322  C C     . LYS A 1 65  ? -7.862  -28.409 1.133   1.00 9.24  ? 65  LYS A C     1 
ATOM   323  O O     . LYS A 1 65  ? -7.102  -29.353 1.308   1.00 12.70 ? 65  LYS A O     1 
ATOM   324  C CB    . LYS A 1 65  ? -8.573  -27.956 -1.195  1.00 18.18 ? 65  LYS A CB    1 
ATOM   325  C CG    . LYS A 1 65  ? -8.434  -29.396 -1.651  1.00 26.32 ? 65  LYS A CG    1 
ATOM   326  C CD    . LYS A 1 65  ? -9.452  -29.790 -2.691  1.00 35.85 ? 65  LYS A CD    1 
ATOM   327  C CE    . LYS A 1 65  ? -9.530  -31.287 -2.897  1.00 44.38 ? 65  LYS A CE    1 
ATOM   328  N NZ    . LYS A 1 65  ? -8.190  -31.902 -3.050  1.00 46.85 ? 65  LYS A NZ    1 
ATOM   329  H H     . LYS A 1 65  ? -5.851  -28.492 -0.134  1.00 17.15 ? 65  LYS A H     1 
ATOM   330  H HA    . LYS A 1 65  ? -7.782  -26.580 0.156   1.00 15.05 ? 65  LYS A HA    1 
ATOM   331  H HB2   . LYS A 1 65  ? -9.491  -27.819 -0.885  1.00 21.86 ? 65  LYS A HB2   1 
ATOM   332  H HB3   . LYS A 1 65  ? -8.431  -27.373 -1.968  1.00 21.86 ? 65  LYS A HB3   1 
ATOM   333  H HG2   . LYS A 1 65  ? -7.534  -29.525 -2.017  1.00 31.62 ? 65  LYS A HG2   1 
ATOM   334  H HG3   . LYS A 1 65  ? -8.531  -29.991 -0.879  1.00 31.62 ? 65  LYS A HG3   1 
ATOM   335  H HD2   . LYS A 1 65  ? -10.332 -29.460 -2.416  1.00 43.05 ? 65  LYS A HD2   1 
ATOM   336  H HD3   . LYS A 1 65  ? -9.221  -29.363 -3.542  1.00 43.05 ? 65  LYS A HD3   1 
ATOM   337  H HE2   . LYS A 1 65  ? -9.980  -31.695 -2.135  1.00 53.29 ? 65  LYS A HE2   1 
ATOM   338  H HE3   . LYS A 1 65  ? -10.057 -31.477 -3.694  1.00 53.29 ? 65  LYS A HE3   1 
ATOM   339  H HZ1   . LYS A 1 65  ? -8.261  -32.687 -3.495  1.00 56.26 ? 65  LYS A HZ1   1 
ATOM   340  H HZ2   . LYS A 1 65  ? -7.646  -31.345 -3.516  1.00 56.26 ? 65  LYS A HZ2   1 
ATOM   341  H HZ3   . LYS A 1 65  ? -7.824  -32.060 -2.233  1.00 56.26 ? 65  LYS A HZ3   1 
ATOM   342  N N     . PHE A 1 66  ? -8.861  -28.088 1.938   1.00 13.40 ? 66  PHE A N     1 
ATOM   343  C CA    . PHE A 1 66  ? -9.263  -28.921 3.064   1.00 12.50 ? 66  PHE A CA    1 
ATOM   344  C C     . PHE A 1 66  ? -10.783 -28.962 3.117   1.00 11.77 ? 66  PHE A C     1 
ATOM   345  O O     . PHE A 1 66  ? -11.438 -27.930 2.927   1.00 15.17 ? 66  PHE A O     1 
ATOM   346  C CB    . PHE A 1 66  ? -8.748  -28.408 4.418   1.00 13.14 ? 66  PHE A CB    1 
ATOM   347  C CG    . PHE A 1 66  ? -7.282  -28.615 4.632   1.00 10.17 ? 66  PHE A CG    1 
ATOM   348  C CD1   . PHE A 1 66  ? -6.772  -29.864 4.963   1.00 9.66  ? 66  PHE A CD1   1 
ATOM   349  C CD2   . PHE A 1 66  ? -6.402  -27.564 4.498   1.00 12.34 ? 66  PHE A CD2   1 
ATOM   350  C CE1   . PHE A 1 66  ? -5.428  -30.042 5.155   1.00 11.04 ? 66  PHE A CE1   1 
ATOM   351  C CE2   . PHE A 1 66  ? -5.038  -27.742 4.708   1.00 10.60 ? 66  PHE A CE2   1 
ATOM   352  C CZ    . PHE A 1 66  ? -4.552  -28.968 5.020   1.00 11.31 ? 66  PHE A CZ    1 
ATOM   353  H H     . PHE A 1 66  ? -9.342  -27.381 1.840   1.00 16.12 ? 66  PHE A H     1 
ATOM   354  H HA    . PHE A 1 66  ? -8.904  -29.810 2.922   1.00 15.04 ? 66  PHE A HA    1 
ATOM   355  H HB2   . PHE A 1 66  ? -8.923  -27.456 4.476   1.00 15.81 ? 66  PHE A HB2   1 
ATOM   356  H HB3   . PHE A 1 66  ? -9.218  -28.876 5.126   1.00 15.81 ? 66  PHE A HB3   1 
ATOM   357  H HD1   . PHE A 1 66  ? -7.350  -30.587 5.056   1.00 11.64 ? 66  PHE A HD1   1 
ATOM   358  H HD2   . PHE A 1 66  ? -6.724  -26.724 4.263   1.00 14.85 ? 66  PHE A HD2   1 
ATOM   359  H HE1   . PHE A 1 66  ? -5.099  -30.883 5.376   1.00 13.29 ? 66  PHE A HE1   1 
ATOM   360  H HE2   . PHE A 1 66  ? -4.459  -27.018 4.634   1.00 12.75 ? 66  PHE A HE2   1 
ATOM   361  H HZ    . PHE A 1 66  ? -3.638  -29.091 5.143   1.00 13.60 ? 66  PHE A HZ    1 
ATOM   362  N N     . PRO A 1 67  ? -11.357 -30.126 3.407   1.00 11.27 ? 67  PRO A N     1 
ATOM   363  C CA    . PRO A 1 67  ? -12.777 -30.178 3.735   1.00 12.45 ? 67  PRO A CA    1 
ATOM   364  C C     . PRO A 1 67  ? -13.092 -29.285 4.924   1.00 14.19 ? 67  PRO A C     1 
ATOM   365  O O     . PRO A 1 67  ? -12.265 -29.021 5.795   1.00 11.35 ? 67  PRO A O     1 
ATOM   366  C CB    . PRO A 1 67  ? -13.002 -31.656 4.072   1.00 14.46 ? 67  PRO A CB    1 
ATOM   367  C CG    . PRO A 1 67  ? -11.889 -32.379 3.443   1.00 15.63 ? 67  PRO A CG    1 
ATOM   368  C CD    . PRO A 1 67  ? -10.723 -31.447 3.495   1.00 13.06 ? 67  PRO A CD    1 
ATOM   369  H HA    . PRO A 1 67  ? -13.327 -29.927 2.977   1.00 14.97 ? 67  PRO A HA    1 
ATOM   370  H HB2   . PRO A 1 67  ? -12.993 -31.778 5.035   1.00 17.39 ? 67  PRO A HB2   1 
ATOM   371  H HB3   . PRO A 1 67  ? -13.853 -31.949 3.709   1.00 17.39 ? 67  PRO A HB3   1 
ATOM   372  H HG2   . PRO A 1 67  ? -11.703 -33.191 3.939   1.00 18.79 ? 67  PRO A HG2   1 
ATOM   373  H HG3   . PRO A 1 67  ? -12.116 -32.595 2.525   1.00 18.79 ? 67  PRO A HG3   1 
ATOM   374  H HD2   . PRO A 1 67  ? -10.238 -31.544 4.329   1.00 15.70 ? 67  PRO A HD2   1 
ATOM   375  H HD3   . PRO A 1 67  ? -10.126 -31.596 2.745   1.00 15.70 ? 67  PRO A HD3   1 
ATOM   376  N N     . ARG A 1 68  ? -14.341 -28.858 4.985   1.00 12.91 ? 68  ARG A N     1 
ATOM   377  C CA    . ARG A 1 68  ? -14.800 -28.061 6.105   1.00 12.58 ? 68  ARG A CA    1 
ATOM   378  C C     . ARG A 1 68  ? -14.482 -28.770 7.410   1.00 13.63 ? 68  ARG A C     1 
ATOM   379  O O     . ARG A 1 68  ? -14.697 -29.979 7.540   1.00 13.65 ? 68  ARG A O     1 
ATOM   380  C CB    . ARG A 1 68  ? -16.313 -27.842 5.973   1.00 20.48 ? 68  ARG A CB    1 
ATOM   381  C CG    . ARG A 1 68  ? -16.920 -26.934 7.017   1.00 27.56 ? 68  ARG A CG    1 
ATOM   382  C CD    . ARG A 1 68  ? -18.452 -26.984 6.991   1.00 38.31 ? 68  ARG A CD    1 
ATOM   383  N NE    . ARG A 1 68  ? -19.020 -25.716 7.431   1.00 54.30 ? 68  ARG A NE    1 
ATOM   384  C CZ    . ARG A 1 68  ? -19.015 -24.613 6.694   1.00 60.57 ? 68  ARG A CZ    1 
ATOM   385  N NH1   . ARG A 1 68  ? -18.485 -24.597 5.480   1.00 59.84 ? 68  ARG A NH1   1 
ATOM   386  N NH2   . ARG A 1 68  ? -19.549 -23.499 7.186   1.00 64.73 ? 68  ARG A NH2   1 
ATOM   387  H H     . ARG A 1 68  ? -14.942 -29.016 4.391   1.00 15.52 ? 68  ARG A H     1 
ATOM   388  H HA    . ARG A 1 68  ? -14.361 -27.196 6.110   1.00 15.13 ? 68  ARG A HA    1 
ATOM   389  H HB2   . ARG A 1 68  ? -16.491 -27.447 5.105   1.00 24.62 ? 68  ARG A HB2   1 
ATOM   390  H HB3   . ARG A 1 68  ? -16.755 -28.702 6.044   1.00 24.62 ? 68  ARG A HB3   1 
ATOM   391  H HG2   . ARG A 1 68  ? -16.621 -27.212 7.896   1.00 33.12 ? 68  ARG A HG2   1 
ATOM   392  H HG3   . ARG A 1 68  ? -16.643 -26.020 6.846   1.00 33.12 ? 68  ARG A HG3   1 
ATOM   393  H HD2   . ARG A 1 68  ? -18.755 -27.160 6.086   1.00 46.01 ? 68  ARG A HD2   1 
ATOM   394  H HD3   . ARG A 1 68  ? -18.763 -27.684 7.587   1.00 46.01 ? 68  ARG A HD3   1 
ATOM   395  H HE    . ARG A 1 68  ? -19.379 -25.680 8.211   1.00 65.20 ? 68  ARG A HE    1 
ATOM   396  H HH11  . ARG A 1 68  ? -18.135 -25.312 5.154   1.00 71.84 ? 68  ARG A HH11  1 
ATOM   397  H HH12  . ARG A 1 68  ? -18.492 -23.872 5.018   1.00 71.84 ? 68  ARG A HH12  1 
ATOM   398  H HH21  . ARG A 1 68  ? -19.893 -23.499 7.975   1.00 77.71 ? 68  ARG A HH21  1 
ATOM   399  H HH22  . ARG A 1 68  ? -19.551 -22.778 6.717   1.00 77.71 ? 68  ARG A HH22  1 
ATOM   400  N N     . GLY A 1 69  ? -13.949 -28.016 8.367   1.00 10.04 ? 69  GLY A N     1 
ATOM   401  C CA    . GLY A 1 69  ? -13.633 -28.523 9.673   1.00 10.03 ? 69  GLY A CA    1 
ATOM   402  C C     . GLY A 1 69  ? -12.224 -29.051 9.804   1.00 8.94  ? 69  GLY A C     1 
ATOM   403  O O     . GLY A 1 69  ? -11.806 -29.372 10.916  1.00 9.63  ? 69  GLY A O     1 
ATOM   404  H H     . GLY A 1 69  ? -13.760 -27.182 8.269   1.00 12.09 ? 69  GLY A H     1 
ATOM   405  H HA2   . GLY A 1 69  ? -13.748 -27.811 10.322  1.00 12.07 ? 69  GLY A HA2   1 
ATOM   406  H HA3   . GLY A 1 69  ? -14.245 -29.245 9.885   1.00 12.07 ? 69  GLY A HA3   1 
ATOM   407  N N     . GLN A 1 70  ? -11.494 -29.164 8.700   1.00 8.66  ? 70  GLN A N     1 
ATOM   408  C CA    . GLN A 1 70  ? -10.133 -29.686 8.699   1.00 8.35  ? 70  GLN A CA    1 
ATOM   409  C C     . GLN A 1 70  ? -9.136  -28.582 8.370   1.00 10.21 ? 70  GLN A C     1 
ATOM   410  O O     . GLN A 1 70  ? -9.496  -27.547 7.797   1.00 9.43  ? 70  GLN A O     1 
ATOM   411  C CB    . GLN A 1 70  ? -9.958  -30.815 7.676   1.00 9.26  ? 70  GLN A CB    1 
ATOM   412  C CG    . GLN A 1 70  ? -10.815 -32.068 7.879   1.00 10.89 ? 70  GLN A CG    1 
ATOM   413  C CD    . GLN A 1 70  ? -10.267 -33.258 7.124   1.00 13.33 ? 70  GLN A CD    1 
ATOM   414  O OE1   . GLN A 1 70  ? -9.047  -33.376 6.941   1.00 13.50 ? 70  GLN A OE1   1 
ATOM   415  N NE2   . GLN A 1 70  ? -11.149 -34.141 6.664   1.00 13.52 ? 70  GLN A NE2   1 
ATOM   416  H H     . GLN A 1 70  ? -11.774 -28.938 7.919   1.00 10.43 ? 70  GLN A H     1 
ATOM   417  H HA    . GLN A 1 70  ? -9.945  -30.034 9.585   1.00 10.06 ? 70  GLN A HA    1 
ATOM   418  H HB2   . GLN A 1 70  ? -10.176 -30.462 6.799   1.00 11.15 ? 70  GLN A HB2   1 
ATOM   419  H HB3   . GLN A 1 70  ? -9.031  -31.099 7.698   1.00 11.15 ? 70  GLN A HB3   1 
ATOM   420  H HG2   . GLN A 1 70  ? -10.836 -32.290 8.823   1.00 13.11 ? 70  GLN A HG2   1 
ATOM   421  H HG3   . GLN A 1 70  ? -11.714 -31.894 7.559   1.00 13.11 ? 70  GLN A HG3   1 
ATOM   422  H HE21  . GLN A 1 70  ? -11.990 -34.021 6.801   1.00 16.26 ? 70  GLN A HE21  1 
ATOM   423  H HE22  . GLN A 1 70  ? -10.879 -34.832 6.230   1.00 16.26 ? 70  GLN A HE22  1 
ATOM   424  N N     . GLY A 1 71  ? -7.863  -28.859 8.681   1.00 8.37  ? 71  GLY A N     1 
ATOM   425  C CA    . GLY A 1 71  ? -6.739  -28.102 8.172   1.00 7.33  ? 71  GLY A CA    1 
ATOM   426  C C     . GLY A 1 71  ? -6.049  -27.171 9.144   1.00 8.01  ? 71  GLY A C     1 
ATOM   427  O O     . GLY A 1 71  ? -4.970  -26.652 8.802   1.00 9.46  ? 71  GLY A O     1 
ATOM   428  H H     . GLY A 1 71  ? -7.630  -29.503 9.202   1.00 10.08 ? 71  GLY A H     1 
ATOM   429  H HA2   . GLY A 1 71  ? -6.072  -28.728 7.851   1.00 8.83  ? 71  GLY A HA2   1 
ATOM   430  H HA3   . GLY A 1 71  ? -7.050  -27.562 7.428   1.00 8.83  ? 71  GLY A HA3   1 
ATOM   431  N N     . VAL A 1 72  ? -6.598  -26.913 10.323  1.00 6.79  ? 72  VAL A N     1 
ATOM   432  C CA    . VAL A 1 72  ? -5.937  -26.018 11.275  1.00 7.27  ? 72  VAL A CA    1 
ATOM   433  C C     . VAL A 1 72  ? -4.775  -26.768 11.922  1.00 8.40  ? 72  VAL A C     1 
ATOM   434  O O     . VAL A 1 72  ? -4.987  -27.871 12.437  1.00 9.15  ? 72  VAL A O     1 
ATOM   435  C CB    . VAL A 1 72  ? -6.908  -25.516 12.327  1.00 9.86  ? 72  VAL A CB    1 
ATOM   436  C CG1   . VAL A 1 72  ? -6.186  -24.665 13.335  1.00 10.14 ? 72  VAL A CG1   1 
ATOM   437  C CG2   . VAL A 1 72  ? -8.051  -24.695 11.672  1.00 7.78  ? 72  VAL A CG2   1 
ATOM   438  H H     . VAL A 1 72  ? -7.346  -27.237 10.597  1.00 8.18  ? 72  VAL A H     1 
ATOM   439  H HA    . VAL A 1 72  ? -5.591  -25.249 10.795  1.00 8.77  ? 72  VAL A HA    1 
ATOM   440  H HB    . VAL A 1 72  ? -7.298  -26.281 12.778  1.00 11.87 ? 72  VAL A HB    1 
ATOM   441  H HG11  . VAL A 1 72  ? -6.819  -24.053 13.742  1.00 12.20 ? 72  VAL A HG11  1 
ATOM   442  H HG12  . VAL A 1 72  ? -5.797  -25.239 14.013  1.00 12.20 ? 72  VAL A HG12  1 
ATOM   443  H HG13  . VAL A 1 72  ? -5.488  -24.165 12.884  1.00 12.20 ? 72  VAL A HG13  1 
ATOM   444  H HG21  . VAL A 1 72  ? -8.612  -24.323 12.370  1.00 9.38  ? 72  VAL A HG21  1 
ATOM   445  H HG22  . VAL A 1 72  ? -7.663  -23.981 11.143  1.00 9.38  ? 72  VAL A HG22  1 
ATOM   446  H HG23  . VAL A 1 72  ? -8.575  -25.281 11.104  1.00 9.38  ? 72  VAL A HG23  1 
ATOM   447  N N     . PRO A 1 73  ? -3.549  -26.240 11.877  1.00 8.15  ? 73  PRO A N     1 
ATOM   448  C CA    . PRO A 1 73  ? -2.421  -26.930 12.504  1.00 9.10  ? 73  PRO A CA    1 
ATOM   449  C C     . PRO A 1 73  ? -2.605  -27.099 14.001  1.00 9.59  ? 73  PRO A C     1 
ATOM   450  O O     . PRO A 1 73  ? -3.295  -26.328 14.678  1.00 10.35 ? 73  PRO A O     1 
ATOM   451  C CB    . PRO A 1 73  ? -1.233  -26.008 12.218  1.00 11.61 ? 73  PRO A CB    1 
ATOM   452  C CG    . PRO A 1 73  ? -1.622  -25.211 11.005  1.00 13.13 ? 73  PRO A CG    1 
ATOM   453  C CD    . PRO A 1 73  ? -3.118  -25.058 11.099  1.00 10.47 ? 73  PRO A CD    1 
ATOM   454  H HA    . PRO A 1 73  ? -2.293  -27.797 12.088  1.00 10.96 ? 73  PRO A HA    1 
ATOM   455  H HB2   . PRO A 1 73  ? -1.080  -25.426 12.979  1.00 13.97 ? 73  PRO A HB2   1 
ATOM   456  H HB3   . PRO A 1 73  ? -0.441  -26.540 12.042  1.00 13.97 ? 73  PRO A HB3   1 
ATOM   457  H HG2   . PRO A 1 73  ? -1.184  -24.346 11.024  1.00 15.80 ? 73  PRO A HG2   1 
ATOM   458  H HG3   . PRO A 1 73  ? -1.373  -25.691 10.200  1.00 15.80 ? 73  PRO A HG3   1 
ATOM   459  H HD2   . PRO A 1 73  ? -3.350  -24.239 11.564  1.00 12.60 ? 73  PRO A HD2   1 
ATOM   460  H HD3   . PRO A 1 73  ? -3.520  -25.064 10.216  1.00 12.60 ? 73  PRO A HD3   1 
ATOM   461  N N     . ILE A 1 74  ? -1.886  -28.090 14.538  1.00 12.05 ? 74  ILE A N     1 
ATOM   462  C CA    . ILE A 1 74  ? -1.896  -28.315 15.977  1.00 11.22 ? 74  ILE A CA    1 
ATOM   463  C C     . ILE A 1 74  ? -1.078  -27.248 16.685  1.00 12.01 ? 74  ILE A C     1 
ATOM   464  O O     . ILE A 1 74  ? 0.086   -27.000 16.338  1.00 11.12 ? 74  ILE A O     1 
ATOM   465  C CB    . ILE A 1 74  ? -1.360  -29.716 16.298  1.00 13.05 ? 74  ILE A CB    1 
ATOM   466  C CG1   . ILE A 1 74  ? -2.291  -30.772 15.728  1.00 11.10 ? 74  ILE A CG1   1 
ATOM   467  C CG2   . ILE A 1 74  ? -1.204  -29.887 17.817  1.00 12.87 ? 74  ILE A CG2   1 
ATOM   468  C CD1   . ILE A 1 74  ? -1.703  -32.129 15.647  1.00 13.36 ? 74  ILE A CD1   1 
ATOM   469  H H     . ILE A 1 74  ? -1.392  -28.636 14.093  1.00 14.49 ? 74  ILE A H     1 
ATOM   470  H HA    . ILE A 1 74  ? -2.811  -28.246 16.292  1.00 13.50 ? 74  ILE A HA    1 
ATOM   471  H HB    . ILE A 1 74  ? -0.488  -29.821 15.886  1.00 15.69 ? 74  ILE A HB    1 
ATOM   472  H HG12  . ILE A 1 74  ? -3.078  -30.827 16.293  1.00 13.36 ? 74  ILE A HG12  1 
ATOM   473  H HG13  . ILE A 1 74  ? -2.545  -30.509 14.830  1.00 13.36 ? 74  ILE A HG13  1 
ATOM   474  H HG21  . ILE A 1 74  ? -1.127  -30.832 18.022  1.00 15.48 ? 74  ILE A HG21  1 
ATOM   475  H HG22  . ILE A 1 74  ? -0.405  -29.420 18.107  1.00 15.48 ? 74  ILE A HG22  1 
ATOM   476  H HG23  . ILE A 1 74  ? -1.984  -29.516 18.259  1.00 15.48 ? 74  ILE A HG23  1 
ATOM   477  H HD11  . ILE A 1 74  ? -2.385  -32.752 15.353  1.00 16.08 ? 74  ILE A HD11  1 
ATOM   478  H HD12  . ILE A 1 74  ? -0.969  -32.117 15.013  1.00 16.08 ? 74  ILE A HD12  1 
ATOM   479  H HD13  . ILE A 1 74  ? -1.377  -32.385 16.525  1.00 16.08 ? 74  ILE A HD13  1 
ATOM   480  N N     . ASN A 1 75  ? -1.679  -26.630 17.699  1.00 10.79 ? 75  ASN A N     1 
ATOM   481  C CA    . ASN A 1 75  ? -1.007  -25.675 18.569  1.00 9.03  ? 75  ASN A CA    1 
ATOM   482  C C     . ASN A 1 75  ? -1.545  -25.885 19.981  1.00 16.52 ? 75  ASN A C     1 
ATOM   483  O O     . ASN A 1 75  ? -2.691  -25.539 20.268  1.00 15.25 ? 75  ASN A O     1 
ATOM   484  C CB    . ASN A 1 75  ? -1.240  -24.246 18.078  1.00 13.82 ? 75  ASN A CB    1 
ATOM   485  C CG    . ASN A 1 75  ? -0.793  -23.172 19.071  1.00 16.01 ? 75  ASN A CG    1 
ATOM   486  O OD1   . ASN A 1 75  ? -0.199  -23.430 20.125  1.00 12.55 ? 75  ASN A OD1   1 
ATOM   487  N ND2   . ASN A 1 75  ? -1.092  -21.931 18.718  1.00 13.10 ? 75  ASN A ND2   1 
ATOM   488  H H     . ASN A 1 75  ? -2.504  -26.753 17.909  1.00 12.99 ? 75  ASN A H     1 
ATOM   489  H HA    . ASN A 1 75  ? -0.050  -25.836 18.584  1.00 10.87 ? 75  ASN A HA    1 
ATOM   490  H HB2   . ASN A 1 75  ? -0.743  -24.113 17.256  1.00 16.62 ? 75  ASN A HB2   1 
ATOM   491  H HB3   . ASN A 1 75  ? -2.188  -24.122 17.916  1.00 16.62 ? 75  ASN A HB3   1 
ATOM   492  H HD21  . ASN A 1 75  ? -0.872  -21.274 19.228  1.00 15.76 ? 75  ASN A HD21  1 
ATOM   493  H HD22  . ASN A 1 75  ? -1.506  -21.782 17.979  1.00 15.76 ? 75  ASN A HD22  1 
ATOM   494  N N     . THR A 1 76  ? -0.727  -26.470 20.861  1.00 16.77 ? 76  THR A N     1 
ATOM   495  C CA    . THR A 1 76  ? -1.220  -26.780 22.195  1.00 16.83 ? 76  THR A CA    1 
ATOM   496  C C     . THR A 1 76  ? -1.371  -25.548 23.070  1.00 23.09 ? 76  THR A C     1 
ATOM   497  O O     . THR A 1 76  ? -2.022  -25.631 24.122  1.00 23.64 ? 76  THR A O     1 
ATOM   498  C CB    . THR A 1 76  ? -0.291  -27.795 22.883  1.00 18.63 ? 76  THR A CB    1 
ATOM   499  O OG1   . THR A 1 76  ? 0.998   -27.214 23.080  1.00 24.08 ? 76  THR A OG1   1 
ATOM   500  C CG2   . THR A 1 76  ? -0.163  -29.047 22.056  1.00 24.48 ? 76  THR A CG2   1 
ATOM   501  H H     . THR A 1 76  ? 0.091   -26.688 20.711  1.00 20.16 ? 76  THR A H     1 
ATOM   502  H HA    . THR A 1 76  ? -2.095  -27.191 22.109  1.00 20.24 ? 76  THR A HA    1 
ATOM   503  H HB    . THR A 1 76  ? -0.664  -28.040 23.744  1.00 22.39 ? 76  THR A HB    1 
ATOM   504  H HG1   . THR A 1 76  ? 1.545   -27.804 23.320  1.00 28.94 ? 76  THR A HG1   1 
ATOM   505  H HG21  . THR A 1 76  ? 0.121   -29.787 22.615  1.00 29.42 ? 76  THR A HG21  1 
ATOM   506  H HG22  . THR A 1 76  ? -1.018  -29.268 21.653  1.00 29.42 ? 76  THR A HG22  1 
ATOM   507  H HG23  . THR A 1 76  ? 0.492   -28.915 21.352  1.00 29.42 ? 76  THR A HG23  1 
ATOM   508  N N     A ASN A 1 77  ? -0.783  -24.417 22.674  0.52 18.24 ? 77  ASN A N     1 
ATOM   509  N N     B ASN A 1 77  ? -0.790  -24.420 22.674  0.48 18.25 ? 77  ASN A N     1 
ATOM   510  C CA    A ASN A 1 77  ? -0.881  -23.151 23.398  0.52 18.79 ? 77  ASN A CA    1 
ATOM   511  C CA    B ASN A 1 77  ? -0.891  -23.176 23.429  0.48 18.79 ? 77  ASN A CA    1 
ATOM   512  C C     A ASN A 1 77  ? -1.974  -22.262 22.843  0.52 23.13 ? 77  ASN A C     1 
ATOM   513  C C     B ASN A 1 77  ? -1.961  -22.271 22.845  0.48 23.13 ? 77  ASN A C     1 
ATOM   514  O O     A ASN A 1 77  ? -1.820  -21.037 22.768  0.52 24.67 ? 77  ASN A O     1 
ATOM   515  O O     B ASN A 1 77  ? -1.777  -21.051 22.748  0.48 24.65 ? 77  ASN A O     1 
ATOM   516  C CB    A ASN A 1 77  ? 0.450   -22.413 23.354  0.52 21.71 ? 77  ASN A CB    1 
ATOM   517  C CB    B ASN A 1 77  ? 0.458   -22.469 23.453  0.48 21.69 ? 77  ASN A CB    1 
ATOM   518  C CG    A ASN A 1 77  ? 1.370   -22.815 24.466  0.52 24.13 ? 77  ASN A CG    1 
ATOM   519  C CG    B ASN A 1 77  ? 0.613   -21.541 24.642  0.48 24.85 ? 77  ASN A CG    1 
ATOM   520  O OD1   A ASN A 1 77  ? 0.986   -23.563 25.365  0.52 23.81 ? 77  ASN A OD1   1 
ATOM   521  O OD1   B ASN A 1 77  ? -0.142  -21.618 25.618  0.48 27.97 ? 77  ASN A OD1   1 
ATOM   522  N ND2   A ASN A 1 77  ? 2.598   -22.306 24.427  0.52 19.97 ? 77  ASN A ND2   1 
ATOM   523  N ND2   B ASN A 1 77  ? 1.601   -20.661 24.572  0.48 26.86 ? 77  ASN A ND2   1 
ATOM   524  H H     A ASN A 1 77  ? -0.304  -24.358 21.962  0.52 21.92 ? 77  ASN A H     1 
ATOM   525  H H     B ASN A 1 77  ? -0.323  -24.350 21.956  0.48 21.94 ? 77  ASN A H     1 
ATOM   526  H HA    A ASN A 1 77  ? -1.092  -23.349 24.323  0.52 22.58 ? 77  ASN A HA    1 
ATOM   527  H HA    B ASN A 1 77  ? -1.133  -23.377 24.346  0.48 22.58 ? 77  ASN A HA    1 
ATOM   528  H HB2   A ASN A 1 77  ? 0.892   -22.608 22.513  0.52 26.10 ? 77  ASN A HB2   1 
ATOM   529  H HB2   B ASN A 1 77  ? 1.163   -23.134 23.499  0.48 26.07 ? 77  ASN A HB2   1 
ATOM   530  H HB3   A ASN A 1 77  ? 0.286   -21.460 23.429  0.52 26.10 ? 77  ASN A HB3   1 
ATOM   531  H HB3   B ASN A 1 77  ? 0.553   -21.941 22.646  0.48 26.07 ? 77  ASN A HB3   1 
ATOM   532  H HD21  A ASN A 1 77  ? 2.825   -21.779 23.787  0.52 24.00 ? 77  ASN A HD21  1 
ATOM   533  H HD21  B ASN A 1 77  ? 2.110   -20.640 23.879  0.48 32.27 ? 77  ASN A HD21  1 
ATOM   534  H HD22  A ASN A 1 77  ? 3.166   -22.505 25.042  0.52 24.00 ? 77  ASN A HD22  1 
ATOM   535  H HD22  B ASN A 1 77  ? 1.733   -20.110 25.219  0.48 32.27 ? 77  ASN A HD22  1 
ATOM   536  N N     . SER A 1 78  ? -3.078  -22.857 22.420  1.00 18.59 ? 78  SER A N     1 
ATOM   537  C CA    . SER A 1 78  ? -4.175  -22.097 21.853  1.00 22.77 ? 78  SER A CA    1 
ATOM   538  C C     . SER A 1 78  ? -5.466  -22.677 22.383  1.00 22.56 ? 78  SER A C     1 
ATOM   539  O O     . SER A 1 78  ? -5.520  -23.823 22.843  1.00 25.72 ? 78  SER A O     1 
ATOM   540  C CB    . SER A 1 78  ? -4.171  -22.105 20.312  1.00 19.20 ? 78  SER A CB    1 
ATOM   541  O OG    . SER A 1 78  ? -4.322  -23.406 19.784  1.00 21.61 ? 78  SER A OG    1 
ATOM   542  H H     . SER A 1 78  ? -3.217  -23.706 22.451  1.00 22.35 ? 78  SER A H     1 
ATOM   543  H HA    . SER A 1 78  ? -4.106  -21.170 22.129  1.00 27.36 ? 78  SER A HA    1 
ATOM   544  H HB2   . SER A 1 78  ? -4.905  -21.556 19.997  1.00 23.08 ? 78  SER A HB2   1 
ATOM   545  H HB3   . SER A 1 78  ? -3.327  -21.741 20.002  1.00 23.08 ? 78  SER A HB3   1 
ATOM   546  H HG    . SER A 1 78  ? -4.616  -23.924 20.377  1.00 25.97 ? 78  SER A HG    1 
ATOM   547  N N     . SER A 1 79  ? -6.482  -21.864 22.338  1.00 21.15 ? 79  SER A N     1 
ATOM   548  C CA    . SER A 1 79  ? -7.794  -22.225 22.815  1.00 24.63 ? 79  SER A CA    1 
ATOM   549  C C     . SER A 1 79  ? -8.679  -22.685 21.666  1.00 26.05 ? 79  SER A C     1 
ATOM   550  O O     . SER A 1 79  ? -8.405  -22.420 20.490  1.00 17.85 ? 79  SER A O     1 
ATOM   551  C CB    . SER A 1 79  ? -8.436  -21.023 23.506  1.00 24.06 ? 79  SER A CB    1 
ATOM   552  O OG    . SER A 1 79  ? -8.736  -20.006 22.565  1.00 33.73 ? 79  SER A OG    1 
ATOM   553  H H     . SER A 1 79  ? -6.441  -21.064 22.025  1.00 25.42 ? 79  SER A H     1 
ATOM   554  H HA    . SER A 1 79  ? -7.726  -22.953 23.452  1.00 29.59 ? 79  SER A HA    1 
ATOM   555  H HB2   . SER A 1 79  ? -9.258  -21.307 23.937  1.00 28.91 ? 79  SER A HB2   1 
ATOM   556  H HB3   . SER A 1 79  ? -7.819  -20.671 24.167  1.00 28.91 ? 79  SER A HB3   1 
ATOM   557  H HG    . SER A 1 79  ? -9.443  -20.195 22.153  1.00 40.52 ? 79  SER A HG    1 
ATOM   558  N N     . PRO A 1 80  ? -9.775  -23.364 21.976  1.00 21.04 ? 80  PRO A N     1 
ATOM   559  C CA    . PRO A 1 80  ? -10.719 -23.722 20.908  1.00 16.32 ? 80  PRO A CA    1 
ATOM   560  C C     . PRO A 1 80  ? -11.220 -22.512 20.120  1.00 12.95 ? 80  PRO A C     1 
ATOM   561  O O     . PRO A 1 80  ? -11.442 -22.610 18.898  1.00 16.09 ? 80  PRO A O     1 
ATOM   562  C CB    . PRO A 1 80  ? -11.862 -24.408 21.675  1.00 22.93 ? 80  PRO A CB    1 
ATOM   563  C CG    . PRO A 1 80  ? -11.236 -24.851 22.986  1.00 20.76 ? 80  PRO A CG    1 
ATOM   564  C CD    . PRO A 1 80  ? -10.186 -23.854 23.309  1.00 19.31 ? 80  PRO A CD    1 
ATOM   565  H HA    . PRO A 1 80  ? -10.312 -24.358 20.298  1.00 19.62 ? 80  PRO A HA    1 
ATOM   566  H HB2   . PRO A 1 80  ? -12.583 -23.777 21.828  1.00 27.56 ? 80  PRO A HB2   1 
ATOM   567  H HB3   . PRO A 1 80  ? -12.190 -25.169 21.171  1.00 27.56 ? 80  PRO A HB3   1 
ATOM   568  H HG2   . PRO A 1 80  ? -11.914 -24.869 23.679  1.00 24.96 ? 80  PRO A HG2   1 
ATOM   569  H HG3   . PRO A 1 80  ? -10.848 -25.733 22.878  1.00 24.96 ? 80  PRO A HG3   1 
ATOM   570  H HD2   . PRO A 1 80  ? -10.547 -23.133 23.848  1.00 23.21 ? 80  PRO A HD2   1 
ATOM   571  H HD3   . PRO A 1 80  ? -9.442  -24.272 23.769  1.00 23.21 ? 80  PRO A HD3   1 
ATOM   572  N N     . ASP A 1 81  ? -11.391 -21.373 20.800  1.00 17.23 ? 81  ASP A N     1 
ATOM   573  C CA    . ASP A 1 81  ? -11.797 -20.144 20.132  1.00 14.41 ? 81  ASP A CA    1 
ATOM   574  C C     . ASP A 1 81  ? -10.829 -19.760 19.016  1.00 15.07 ? 81  ASP A C     1 
ATOM   575  O O     . ASP A 1 81  ? -11.233 -19.105 18.044  1.00 11.07 ? 81  ASP A O     1 
ATOM   576  C CB    . ASP A 1 81  ? -11.870 -18.998 21.140  1.00 19.72 ? 81  ASP A CB    1 
ATOM   577  C CG    . ASP A 1 81  ? -12.951 -19.196 22.189  1.00 31.36 ? 81  ASP A CG    1 
ATOM   578  O OD1   . ASP A 1 81  ? -13.744 -20.153 22.060  1.00 33.52 ? 81  ASP A OD1   1 
ATOM   579  O OD2   . ASP A 1 81  ? -13.008 -18.373 23.135  1.00 42.11 ? 81  ASP A OD2   1 
ATOM   580  H H     . ASP A 1 81  ? -11.278 -21.290 21.649  1.00 20.72 ? 81  ASP A H     1 
ATOM   581  H HA    . ASP A 1 81  ? -12.676 -20.286 19.748  1.00 17.33 ? 81  ASP A HA    1 
ATOM   582  H HB2   . ASP A 1 81  ? -11.018 -18.928 21.599  1.00 23.70 ? 81  ASP A HB2   1 
ATOM   583  H HB3   . ASP A 1 81  ? -12.060 -18.173 20.666  1.00 23.70 ? 81  ASP A HB3   1 
ATOM   584  N N     . ASP A 1 82  ? -9.557  -20.162 19.127  1.00 12.84 ? 82  ASP A N     1 
ATOM   585  C CA    . ASP A 1 82  ? -8.488  -19.641 18.273  1.00 11.80 ? 82  ASP A CA    1 
ATOM   586  C C     . ASP A 1 82  ? -8.342  -20.371 16.938  1.00 8.70  ? 82  ASP A C     1 
ATOM   587  O O     . ASP A 1 82  ? -7.548  -19.932 16.090  1.00 8.14  ? 82  ASP A O     1 
ATOM   588  C CB    . ASP A 1 82  ? -7.137  -19.747 18.982  1.00 13.75 ? 82  ASP A CB    1 
ATOM   589  C CG    . ASP A 1 82  ? -7.004  -18.854 20.218  1.00 17.44 ? 82  ASP A CG    1 
ATOM   590  O OD1   . ASP A 1 82  ? -7.618  -17.773 20.282  1.00 19.06 ? 82  ASP A OD1   1 
ATOM   591  O OD2   . ASP A 1 82  ? -6.218  -19.231 21.121  1.00 19.75 ? 82  ASP A OD2   1 
ATOM   592  H H     . ASP A 1 82  ? -9.286  -20.745 19.699  1.00 15.44 ? 82  ASP A H     1 
ATOM   593  H HA    . ASP A 1 82  ? -8.698  -18.710 18.100  1.00 14.20 ? 82  ASP A HA    1 
ATOM   594  H HB2   . ASP A 1 82  ? -7.007  -20.664 19.268  1.00 16.54 ? 82  ASP A HB2   1 
ATOM   595  H HB3   . ASP A 1 82  ? -6.439  -19.491 18.359  1.00 16.54 ? 82  ASP A HB3   1 
ATOM   596  N N     . GLN A 1 83  ? -9.031  -21.502 16.737  1.00 9.00  ? 83  GLN A N     1 
ATOM   597  C CA    . GLN A 1 83  ? -8.671  -22.468 15.696  1.00 8.25  ? 83  GLN A CA    1 
ATOM   598  C C     . GLN A 1 83  ? -9.270  -22.089 14.344  1.00 7.50  ? 83  GLN A C     1 
ATOM   599  O O     . GLN A 1 83  ? -10.160 -22.752 13.822  1.00 7.19  ? 83  GLN A O     1 
ATOM   600  C CB    . GLN A 1 83  ? -9.142  -23.866 16.084  1.00 10.14 ? 83  GLN A CB    1 
ATOM   601  C CG    . GLN A 1 83  ? -8.734  -24.286 17.469  1.00 19.25 ? 83  GLN A CG    1 
ATOM   602  C CD    . GLN A 1 83  ? -7.267  -24.298 17.593  1.00 14.21 ? 83  GLN A CD    1 
ATOM   603  O OE1   . GLN A 1 83  ? -6.576  -24.863 16.753  1.00 18.74 ? 83  GLN A OE1   1 
ATOM   604  N NE2   . GLN A 1 83  ? -6.756  -23.648 18.621  1.00 17.12 ? 83  GLN A NE2   1 
ATOM   605  H H     . GLN A 1 83  ? -9.720  -21.734 17.197  1.00 10.83 ? 83  GLN A H     1 
ATOM   606  H HA    . GLN A 1 83  ? -7.704  -22.441 15.616  1.00 9.94  ? 83  GLN A HA    1 
ATOM   607  H HB2   . GLN A 1 83  ? -10.111 -23.891 16.041  1.00 12.20 ? 83  GLN A HB2   1 
ATOM   608  H HB3   . GLN A 1 83  ? -8.766  -24.506 15.459  1.00 12.20 ? 83  GLN A HB3   1 
ATOM   609  H HG2   . GLN A 1 83  ? -9.095  -23.661 18.117  1.00 23.14 ? 83  GLN A HG2   1 
ATOM   610  H HG3   . GLN A 1 83  ? -9.067  -25.179 17.649  1.00 23.14 ? 83  GLN A HG3   1 
ATOM   611  H HE21  . GLN A 1 83  ? -7.276  -23.245 19.176  1.00 20.58 ? 83  GLN A HE21  1 
ATOM   612  H HE22  . GLN A 1 83  ? -5.904  -23.626 18.735  1.00 20.58 ? 83  GLN A HE22  1 
ATOM   613  N N     . ILE A 1 84  ? -8.725  -21.029 13.741  1.00 7.08  ? 84  ILE A N     1 
ATOM   614  C CA    . ILE A 1 84  ? -9.286  -20.500 12.489  1.00 6.59  ? 84  ILE A CA    1 
ATOM   615  C C     . ILE A 1 84  ? -8.241  -19.631 11.786  1.00 6.63  ? 84  ILE A C     1 
ATOM   616  O O     . ILE A 1 84  ? -7.542  -18.854 12.425  1.00 7.99  ? 84  ILE A O     1 
ATOM   617  C CB    . ILE A 1 84  ? -10.602 -19.741 12.794  1.00 9.94  ? 84  ILE A CB    1 
ATOM   618  C CG1   . ILE A 1 84  ? -11.201 -19.131 11.541  1.00 9.61  ? 84  ILE A CG1   1 
ATOM   619  C CG2   . ILE A 1 84  ? -10.422 -18.661 13.852  1.00 9.84  ? 84  ILE A CG2   1 
ATOM   620  C CD1   . ILE A 1 84  ? -12.678 -18.696 11.758  1.00 10.67 ? 84  ILE A CD1   1 
ATOM   621  H H     . ILE A 1 84  ? -8.038  -20.601 14.033  1.00 8.53  ? 84  ILE A H     1 
ATOM   622  H HA    . ILE A 1 84  ? -9.474  -21.229 11.877  1.00 7.95  ? 84  ILE A HA    1 
ATOM   623  H HB    . ILE A 1 84  ? -11.213 -20.409 13.143  1.00 11.97 ? 84  ILE A HB    1 
ATOM   624  H HG12  . ILE A 1 84  ? -10.687 -18.347 11.291  1.00 11.57 ? 84  ILE A HG12  1 
ATOM   625  H HG13  . ILE A 1 84  ? -11.179 -19.785 10.825  1.00 11.57 ? 84  ILE A HG13  1 
ATOM   626  H HG21  . ILE A 1 84  ? -11.292 -18.305 14.091  1.00 11.84 ? 84  ILE A HG21  1 
ATOM   627  H HG22  . ILE A 1 84  ? -9.999  -19.052 14.633  1.00 11.84 ? 84  ILE A HG22  1 
ATOM   628  H HG23  . ILE A 1 84  ? -9.863  -17.956 13.491  1.00 11.84 ? 84  ILE A HG23  1 
ATOM   629  H HD11  . ILE A 1 84  ? -13.117 -18.628 10.896  1.00 12.84 ? 84  ILE A HD11  1 
ATOM   630  H HD12  . ILE A 1 84  ? -13.126 -19.360 12.306  1.00 12.84 ? 84  ILE A HD12  1 
ATOM   631  H HD13  . ILE A 1 84  ? -12.692 -17.835 12.205  1.00 12.84 ? 84  ILE A HD13  1 
ATOM   632  N N     . GLY A 1 85  ? -8.145  -19.754 10.465  1.00 6.94  ? 85  GLY A N     1 
ATOM   633  C CA    . GLY A 1 85  ? -7.210  -18.926 9.714   1.00 5.97  ? 85  GLY A CA    1 
ATOM   634  C C     . GLY A 1 85  ? -7.179  -19.313 8.257   1.00 5.13  ? 85  GLY A C     1 
ATOM   635  O O     . GLY A 1 85  ? -8.141  -19.847 7.712   1.00 6.10  ? 85  GLY A O     1 
ATOM   636  H H     . GLY A 1 85  ? -8.603  -20.302 9.987   1.00 8.37  ? 85  GLY A H     1 
ATOM   637  H HA2   . GLY A 1 85  ? -7.474  -17.995 9.781   1.00 7.20  ? 85  GLY A HA2   1 
ATOM   638  H HA3   . GLY A 1 85  ? -6.318  -19.028 10.081  1.00 7.20  ? 85  GLY A HA3   1 
ATOM   639  N N     . TYR A 1 86  ? -6.061  -19.016 7.614   1.00 5.85  ? 86  TYR A N     1 
ATOM   640  C CA    . TYR A 1 86  ? -5.923  -19.262 6.195   1.00 6.06  ? 86  TYR A CA    1 
ATOM   641  C C     . TYR A 1 86  ? -4.526  -19.782 5.896   1.00 7.08  ? 86  TYR A C     1 
ATOM   642  O O     . TYR A 1 86  ? -3.587  -19.534 6.656   1.00 7.03  ? 86  TYR A O     1 
ATOM   643  C CB    . TYR A 1 86  ? -6.198  -17.968 5.382   1.00 6.65  ? 86  TYR A CB    1 
ATOM   644  C CG    . TYR A 1 86  ? -5.272  -16.806 5.700   1.00 6.95  ? 86  TYR A CG    1 
ATOM   645  C CD1   . TYR A 1 86  ? -5.482  -15.948 6.792   1.00 6.18  ? 86  TYR A CD1   1 
ATOM   646  C CD2   . TYR A 1 86  ? -4.169  -16.573 4.901   1.00 8.38  ? 86  TYR A CD2   1 
ATOM   647  C CE1   . TYR A 1 86  ? -4.607  -14.897 7.057   1.00 8.06  ? 86  TYR A CE1   1 
ATOM   648  C CE2   . TYR A 1 86  ? -3.302  -15.528 5.151   1.00 8.01  ? 86  TYR A CE2   1 
ATOM   649  C CZ    . TYR A 1 86  ? -3.511  -14.700 6.217   1.00 6.58  ? 86  TYR A CZ    1 
ATOM   650  O OH    . TYR A 1 86  ? -2.639  -13.669 6.492   1.00 10.55 ? 86  TYR A OH    1 
ATOM   651  H H     . TYR A 1 86  ? -5.366  -18.668 7.983   1.00 7.05  ? 86  TYR A H     1 
ATOM   652  H HA    . TYR A 1 86  ? -6.553  -19.947 5.923   1.00 7.31  ? 86  TYR A HA    1 
ATOM   653  H HB2   . TYR A 1 86  ? -6.098  -18.170 4.438   1.00 8.02  ? 86  TYR A HB2   1 
ATOM   654  H HB3   . TYR A 1 86  ? -7.105  -17.676 5.565   1.00 8.02  ? 86  TYR A HB3   1 
ATOM   655  H HD1   . TYR A 1 86  ? -6.215  -16.085 7.347   1.00 7.45  ? 86  TYR A HD1   1 
ATOM   656  H HD2   . TYR A 1 86  ? -4.006  -17.134 4.177   1.00 10.10 ? 86  TYR A HD2   1 
ATOM   657  H HE1   . TYR A 1 86  ? -4.752  -14.334 7.783   1.00 9.72  ? 86  TYR A HE1   1 
ATOM   658  H HE2   . TYR A 1 86  ? -2.573  -15.387 4.591   1.00 9.65  ? 86  TYR A HE2   1 
ATOM   659  H HH    . TYR A 1 86  ? -2.836  -13.314 7.227   1.00 12.70 ? 86  TYR A HH    1 
ATOM   660  N N     . TYR A 1 87  ? -4.416  -20.509 4.791   1.00 8.15  ? 87  TYR A N     1 
ATOM   661  C CA    . TYR A 1 87  ? -3.126  -20.772 4.172   1.00 7.36  ? 87  TYR A CA    1 
ATOM   662  C C     . TYR A 1 87  ? -2.940  -19.828 2.995   1.00 11.77 ? 87  TYR A C     1 
ATOM   663  O O     . TYR A 1 87  ? -3.879  -19.572 2.235   1.00 9.21  ? 87  TYR A O     1 
ATOM   664  C CB    . TYR A 1 87  ? -2.994  -22.213 3.675   1.00 8.79  ? 87  TYR A CB    1 
ATOM   665  C CG    . TYR A 1 87  ? -2.907  -23.277 4.759   1.00 9.47  ? 87  TYR A CG    1 
ATOM   666  C CD1   . TYR A 1 87  ? -4.042  -23.728 5.416   1.00 8.59  ? 87  TYR A CD1   1 
ATOM   667  C CD2   . TYR A 1 87  ? -1.677  -23.833 5.099   1.00 7.78  ? 87  TYR A CD2   1 
ATOM   668  C CE1   . TYR A 1 87  ? -3.945  -24.742 6.389   1.00 7.44  ? 87  TYR A CE1   1 
ATOM   669  C CE2   . TYR A 1 87  ? -1.573  -24.809 6.056   1.00 8.38  ? 87  TYR A CE2   1 
ATOM   670  C CZ    . TYR A 1 87  ? -2.713  -25.268 6.691   1.00 9.50  ? 87  TYR A CZ    1 
ATOM   671  O OH    . TYR A 1 87  ? -2.599  -26.276 7.661   1.00 9.96  ? 87  TYR A OH    1 
ATOM   672  H H     . TYR A 1 87  ? -5.082  -20.864 4.378   1.00 9.82  ? 87  TYR A H     1 
ATOM   673  H HA    . TYR A 1 87  ? -2.432  -20.629 4.834   1.00 8.87  ? 87  TYR A HA    1 
ATOM   674  H HB2   . TYR A 1 87  ? -3.769  -22.419 3.130   1.00 10.58 ? 87  TYR A HB2   1 
ATOM   675  H HB3   . TYR A 1 87  ? -2.186  -22.278 3.142   1.00 10.58 ? 87  TYR A HB3   1 
ATOM   676  H HD1   . TYR A 1 87  ? -4.871  -23.359 5.214   1.00 10.35 ? 87  TYR A HD1   1 
ATOM   677  H HD2   . TYR A 1 87  ? -0.909  -23.537 4.667   1.00 9.38  ? 87  TYR A HD2   1 
ATOM   678  H HE1   . TYR A 1 87  ? -4.708  -25.053 6.821   1.00 8.97  ? 87  TYR A HE1   1 
ATOM   679  H HE2   . TYR A 1 87  ? -0.741  -25.160 6.277   1.00 10.09 ? 87  TYR A HE2   1 
ATOM   680  H HH    . TYR A 1 87  ? -3.199  -26.852 7.548   1.00 11.99 ? 87  TYR A HH    1 
ATOM   681  N N     . ARG A 1 88  ? -1.715  -19.355 2.827   1.00 7.35  ? 88  ARG A N     1 
ATOM   682  C CA    . ARG A 1 88  ? -1.356  -18.492 1.710   1.00 8.46  ? 88  ARG A CA    1 
ATOM   683  C C     . ARG A 1 88  ? -0.208  -19.104 0.927   1.00 10.80 ? 88  ARG A C     1 
ATOM   684  O O     . ARG A 1 88  ? 0.844   -19.418 1.501   1.00 9.60  ? 88  ARG A O     1 
ATOM   685  C CB    . ARG A 1 88  ? -0.974  -17.117 2.219   1.00 8.86  ? 88  ARG A CB    1 
ATOM   686  C CG    . ARG A 1 88  ? -0.542  -16.164 1.095   1.00 13.24 ? 88  ARG A CG    1 
ATOM   687  C CD    . ARG A 1 88  ? -0.417  -14.786 1.692   1.00 17.80 ? 88  ARG A CD    1 
ATOM   688  N NE    . ARG A 1 88  ? 0.144   -13.828 0.751   1.00 19.71 ? 88  ARG A NE    1 
ATOM   689  C CZ    . ARG A 1 88  ? 1.443   -13.696 0.525   1.00 33.97 ? 88  ARG A CZ    1 
ATOM   690  N NH1   . ARG A 1 88  ? 2.336   -14.406 1.196   1.00 28.56 ? 88  ARG A NH1   1 
ATOM   691  N NH2   . ARG A 1 88  ? 1.855   -12.839 -0.406  1.00 30.83 ? 88  ARG A NH2   1 
ATOM   692  H H     . ARG A 1 88  ? -1.060  -19.523 3.357   1.00 8.86  ? 88  ARG A H     1 
ATOM   693  H HA    . ARG A 1 88  ? -2.108  -18.410 1.103   1.00 10.19 ? 88  ARG A HA    1 
ATOM   694  H HB2   . ARG A 1 88  ? -1.738  -16.724 2.669   1.00 10.67 ? 88  ARG A HB2   1 
ATOM   695  H HB3   . ARG A 1 88  ? -0.232  -17.205 2.839   1.00 10.67 ? 88  ARG A HB3   1 
ATOM   696  H HG2   . ARG A 1 88  ? 0.315   -16.437 0.734   1.00 15.93 ? 88  ARG A HG2   1 
ATOM   697  H HG3   . ARG A 1 88  ? -1.210  -16.151 0.392   1.00 15.93 ? 88  ARG A HG3   1 
ATOM   698  H HD2   . ARG A 1 88  ? -1.297  -14.472 1.955   1.00 21.40 ? 88  ARG A HD2   1 
ATOM   699  H HD3   . ARG A 1 88  ? 0.166   -14.827 2.467   1.00 21.40 ? 88  ARG A HD3   1 
ATOM   700  H HE    . ARG A 1 88  ? -0.397  -13.319 0.318   1.00 23.69 ? 88  ARG A HE    1 
ATOM   701  H HH11  . ARG A 1 88  ? 2.077   -14.967 1.794   1.00 34.31 ? 88  ARG A HH11  1 
ATOM   702  H HH12  . ARG A 1 88  ? 3.175   -14.306 1.035   1.00 34.31 ? 88  ARG A HH12  1 
ATOM   703  H HH21  . ARG A 1 88  ? 1.281   -12.380 -0.853  1.00 37.03 ? 88  ARG A HH21  1 
ATOM   704  H HH22  . ARG A 1 88  ? 2.696   -12.745 -0.562  1.00 37.03 ? 88  ARG A HH22  1 
ATOM   705  N N     . ARG A 1 89  ? -0.394  -19.221 -0.385  1.00 8.44  ? 89  ARG A N     1 
ATOM   706  C CA    . ARG A 1 89  ? 0.632   -19.746 -1.267  1.00 7.85  ? 89  ARG A CA    1 
ATOM   707  C C     . ARG A 1 89  ? 1.730   -18.728 -1.537  1.00 10.07 ? 89  ARG A C     1 
ATOM   708  O O     . ARG A 1 89  ? 1.466   -17.548 -1.795  1.00 14.42 ? 89  ARG A O     1 
ATOM   709  C CB    . ARG A 1 89  ? 0.012   -20.192 -2.596  1.00 9.57  ? 89  ARG A CB    1 
ATOM   710  C CG    . ARG A 1 89  ? 1.021   -20.762 -3.613  1.00 15.11 ? 89  ARG A CG    1 
ATOM   711  C CD    . ARG A 1 89  ? 0.343   -21.167 -4.921  1.00 20.13 ? 89  ARG A CD    1 
ATOM   712  N NE    . ARG A 1 89  ? -0.371  -20.040 -5.502  1.00 20.63 ? 89  ARG A NE    1 
ATOM   713  C CZ    . ARG A 1 89  ? -1.558  -20.109 -6.093  1.00 19.66 ? 89  ARG A CZ    1 
ATOM   714  N NH1   . ARG A 1 89  ? -2.201  -21.255 -6.241  1.00 22.48 ? 89  ARG A NH1   1 
ATOM   715  N NH2   . ARG A 1 89  ? -2.122  -18.989 -6.534  1.00 20.27 ? 89  ARG A NH2   1 
ATOM   716  H H     . ARG A 1 89  ? -1.119  -18.998 -0.791  1.00 10.17 ? 89  ARG A H     1 
ATOM   717  H HA    . ARG A 1 89  ? 1.043   -20.509 -0.833  1.00 9.46  ? 89  ARG A HA    1 
ATOM   718  H HB2   . ARG A 1 89  ? -0.643  -20.884 -2.415  1.00 11.52 ? 89  ARG A HB2   1 
ATOM   719  H HB3   . ARG A 1 89  ? -0.419  -19.427 -3.009  1.00 11.52 ? 89  ARG A HB3   1 
ATOM   720  H HG2   . ARG A 1 89  ? 1.688   -20.087 -3.814  1.00 18.16 ? 89  ARG A HG2   1 
ATOM   721  H HG3   . ARG A 1 89  ? 1.446   -21.547 -3.235  1.00 18.16 ? 89  ARG A HG3   1 
ATOM   722  H HD2   . ARG A 1 89  ? 1.014   -21.467 -5.554  1.00 24.20 ? 89  ARG A HD2   1 
ATOM   723  H HD3   . ARG A 1 89  ? -0.293  -21.880 -4.749  1.00 24.20 ? 89  ARG A HD3   1 
ATOM   724  H HE    . ARG A 1 89  ? 0.006   -19.268 -5.458  1.00 24.79 ? 89  ARG A HE    1 
ATOM   725  H HH11  . ARG A 1 89  ? -1.852  -21.985 -5.951  1.00 27.01 ? 89  ARG A HH11  1 
ATOM   726  H HH12  . ARG A 1 89  ? -2.969  -21.270 -6.629  1.00 27.01 ? 89  ARG A HH12  1 
ATOM   727  H HH21  . ARG A 1 89  ? -1.718  -18.236 -6.434  1.00 24.36 ? 89  ARG A HH21  1 
ATOM   728  H HH22  . ARG A 1 89  ? -2.890  -19.017 -6.919  1.00 24.36 ? 89  ARG A HH22  1 
ATOM   729  N N     . ALA A 1 90  ? 2.973   -19.201 -1.468  1.00 13.01 ? 90  ALA A N     1 
ATOM   730  C CA    . ALA A 1 90  ? 4.155   -18.430 -1.835  1.00 12.15 ? 90  ALA A CA    1 
ATOM   731  C C     . ALA A 1 90  ? 4.991   -19.282 -2.773  1.00 16.08 ? 90  ALA A C     1 
ATOM   732  O O     . ALA A 1 90  ? 5.211   -20.464 -2.500  1.00 19.21 ? 90  ALA A O     1 
ATOM   733  C CB    . ALA A 1 90  ? 4.985   -18.054 -0.608  1.00 16.76 ? 90  ALA A CB    1 
ATOM   734  H H     . ALA A 1 90  ? 3.163   -19.996 -1.201  1.00 15.65 ? 90  ALA A H     1 
ATOM   735  H HA    . ALA A 1 90  ? 3.889   -17.610 -2.281  1.00 14.62 ? 90  ALA A HA    1 
ATOM   736  H HB1   . ALA A 1 90  ? 5.810   -17.636 -0.901  1.00 20.14 ? 90  ALA A HB1   1 
ATOM   737  H HB2   . ALA A 1 90  ? 4.477   -17.435 -0.061  1.00 20.14 ? 90  ALA A HB2   1 
ATOM   738  H HB3   . ALA A 1 90  ? 5.183   -18.857 -0.102  1.00 20.14 ? 90  ALA A HB3   1 
ATOM   739  N N     . THR A 1 91  ? 5.448   -18.715 -3.884  1.00 19.87 ? 91  THR A N     1 
ATOM   740  C CA    . THR A 1 91  ? 6.264   -19.478 -4.822  1.00 20.53 ? 91  THR A CA    1 
ATOM   741  C C     . THR A 1 91  ? 7.603   -18.789 -5.001  1.00 18.67 ? 91  THR A C     1 
ATOM   742  O O     . THR A 1 91  ? 7.659   -17.613 -5.361  1.00 26.85 ? 91  THR A O     1 
ATOM   743  C CB    . THR A 1 91  ? 5.553   -19.659 -6.160  1.00 24.30 ? 91  THR A CB    1 
ATOM   744  O OG1   . THR A 1 91  ? 4.343   -20.395 -5.933  1.00 27.36 ? 91  THR A OG1   1 
ATOM   745  C CG2   . THR A 1 91  ? 6.436   -20.456 -7.147  1.00 23.01 ? 91  THR A CG2   1 
ATOM   746  H H     . THR A 1 91  ? 5.300   -17.900 -4.114  1.00 23.89 ? 91  THR A H     1 
ATOM   747  H HA    . THR A 1 91  ? 6.434   -20.358 -4.451  1.00 24.67 ? 91  THR A HA    1 
ATOM   748  H HB    . THR A 1 91  ? 5.363   -18.793 -6.552  1.00 29.20 ? 91  THR A HB    1 
ATOM   749  H HG1   . THR A 1 91  ? 3.947   -20.528 -6.662  1.00 32.87 ? 91  THR A HG1   1 
ATOM   750  H HG21  . THR A 1 91  ? 5.978   -20.556 -7.996  1.00 27.65 ? 91  THR A HG21  1 
ATOM   751  H HG22  . THR A 1 91  ? 7.274   -19.990 -7.294  1.00 27.65 ? 91  THR A HG22  1 
ATOM   752  H HG23  . THR A 1 91  ? 6.626   -21.337 -6.786  1.00 27.65 ? 91  THR A HG23  1 
ATOM   753  N N     . ARG A 1 92  ? 8.660   -19.508 -4.693  1.00 19.80 ? 92  ARG A N     1 
ATOM   754  C CA    . ARG A 1 92  ? 10.007  -18.996 -4.816  1.00 23.05 ? 92  ARG A CA    1 
ATOM   755  C C     . ARG A 1 92  ? 10.494  -19.247 -6.235  1.00 18.98 ? 92  ARG A C     1 
ATOM   756  O O     . ARG A 1 92  ? 10.197  -20.280 -6.841  1.00 18.23 ? 92  ARG A O     1 
ATOM   757  C CB    . ARG A 1 92  ? 10.922  -19.675 -3.795  1.00 31.17 ? 92  ARG A CB    1 
ATOM   758  C CG    . ARG A 1 92  ? 12.365  -19.222 -3.860  1.00 41.96 ? 92  ARG A CG    1 
ATOM   759  C CD    . ARG A 1 92  ? 13.248  -20.019 -2.905  1.00 47.66 ? 92  ARG A CD    1 
ATOM   760  N NE    . ARG A 1 92  ? 12.973  -19.686 -1.510  1.00 62.76 ? 92  ARG A NE    1 
ATOM   761  C CZ    . ARG A 1 92  ? 12.569  -20.545 -0.580  1.00 65.46 ? 92  ARG A CZ    1 
ATOM   762  N NH1   . ARG A 1 92  ? 12.370  -21.829 -0.851  1.00 53.68 ? 92  ARG A NH1   1 
ATOM   763  N NH2   . ARG A 1 92  ? 12.370  -20.105 0.660   1.00 59.24 ? 92  ARG A NH2   1 
ATOM   764  H H     . ARG A 1 92  ? 8.623   -20.317 -4.403  1.00 23.79 ? 92  ARG A H     1 
ATOM   765  H HA    . ARG A 1 92  ? 10.037  -18.042 -4.643  1.00 27.70 ? 92  ARG A HA    1 
ATOM   766  H HB2   . ARG A 1 92  ? 10.592  -19.479 -2.904  1.00 37.44 ? 92  ARG A HB2   1 
ATOM   767  H HB3   . ARG A 1 92  ? 10.906  -20.632 -3.952  1.00 37.44 ? 92  ARG A HB3   1 
ATOM   768  H HG2   . ARG A 1 92  ? 12.700  -19.348 -4.761  1.00 50.39 ? 92  ARG A HG2   1 
ATOM   769  H HG3   . ARG A 1 92  ? 12.419  -18.285 -3.614  1.00 50.39 ? 92  ARG A HG3   1 
ATOM   770  H HD2   . ARG A 1 92  ? 13.081  -20.966 -3.030  1.00 57.23 ? 92  ARG A HD2   1 
ATOM   771  H HD3   . ARG A 1 92  ? 14.179  -19.818 -3.087  1.00 57.23 ? 92  ARG A HD3   1 
ATOM   772  H HE    . ARG A 1 92  ? 13.081  -18.867 -1.271  1.00 75.34 ? 92  ARG A HE    1 
ATOM   773  H HH11  . ARG A 1 92  ? 12.503  -22.126 -1.647  1.00 64.46 ? 92  ARG A HH11  1 
ATOM   774  H HH12  . ARG A 1 92  ? 12.108  -22.364 -0.231  1.00 64.46 ? 92  ARG A HH12  1 
ATOM   775  H HH21  . ARG A 1 92  ? 12.503  -19.277 0.849   1.00 71.13 ? 92  ARG A HH21  1 
ATOM   776  H HH22  . ARG A 1 92  ? 12.109  -20.649 1.273   1.00 71.13 ? 92  ARG A HH22  1 
ATOM   777  N N     . ARG A 1 93  ? 11.232  -18.287 -6.765  1.00 20.99 ? 93  ARG A N     1 
ATOM   778  C CA    . ARG A 1 93  ? 11.829  -18.417 -8.080  1.00 22.77 ? 93  ARG A CA    1 
ATOM   779  C C     . ARG A 1 93  ? 13.335  -18.378 -7.928  1.00 20.09 ? 93  ARG A C     1 
ATOM   780  O O     . ARG A 1 93  ? 13.863  -17.679 -7.060  1.00 26.90 ? 93  ARG A O     1 
ATOM   781  C CB    . ARG A 1 93  ? 11.365  -17.317 -9.027  1.00 27.04 ? 93  ARG A CB    1 
ATOM   782  C CG    . ARG A 1 93  ? 9.917   -17.472 -9.429  1.00 30.11 ? 93  ARG A CG    1 
ATOM   783  C CD    . ARG A 1 93  ? 9.482   -16.420 -10.443 1.00 41.07 ? 93  ARG A CD    1 
ATOM   784  N NE    . ARG A 1 93  ? 8.058   -16.539 -10.746 1.00 49.48 ? 93  ARG A NE    1 
ATOM   785  C CZ    . ARG A 1 93  ? 7.256   -15.528 -11.061 1.00 49.52 ? 93  ARG A CZ    1 
ATOM   786  N NH1   . ARG A 1 93  ? 7.683   -14.274 -11.066 1.00 42.80 ? 93  ARG A NH1   1 
ATOM   787  N NH2   . ARG A 1 93  ? 5.989   -15.780 -11.378 1.00 46.37 ? 93  ARG A NH2   1 
ATOM   788  H H     . ARG A 1 93  ? 11.403  -17.540 -6.375  1.00 25.22 ? 93  ARG A H     1 
ATOM   789  H HA    . ARG A 1 93  ? 11.572  -19.263 -8.479  1.00 27.36 ? 93  ARG A HA    1 
ATOM   790  H HB2   . ARG A 1 93  ? 11.466  -16.458 -8.588  1.00 32.49 ? 93  ARG A HB2   1 
ATOM   791  H HB3   . ARG A 1 93  ? 11.905  -17.343 -9.833  1.00 32.49 ? 93  ARG A HB3   1 
ATOM   792  H HG2   . ARG A 1 93  ? 9.789   -18.346 -9.828  1.00 36.17 ? 93  ARG A HG2   1 
ATOM   793  H HG3   . ARG A 1 93  ? 9.357   -17.381 -8.642  1.00 36.17 ? 93  ARG A HG3   1 
ATOM   794  H HD2   . ARG A 1 93  ? 9.646   -15.535 -10.080 1.00 49.32 ? 93  ARG A HD2   1 
ATOM   795  H HD3   . ARG A 1 93  ? 9.982   -16.539 -11.265 1.00 49.32 ? 93  ARG A HD3   1 
ATOM   796  H HE    . ARG A 1 93  ? 7.711   -17.326 -10.719 1.00 59.41 ? 93  ARG A HE    1 
ATOM   797  H HH11  . ARG A 1 93  ? 8.500   -14.098 -10.861 1.00 51.40 ? 93  ARG A HH11  1 
ATOM   798  H HH12  . ARG A 1 93  ? 7.145   -13.637 -11.273 1.00 51.40 ? 93  ARG A HH12  1 
ATOM   799  H HH21  . ARG A 1 93  ? 5.699   -16.590 -11.377 1.00 55.69 ? 93  ARG A HH21  1 
ATOM   800  H HH22  . ARG A 1 93  ? 5.460   -15.134 -11.583 1.00 55.69 ? 93  ARG A HH22  1 
ATOM   801  N N     . ILE A 1 94  ? 14.018  -19.149 -8.756  1.00 18.67 ? 94  ILE A N     1 
ATOM   802  C CA    . ILE A 1 94  ? 15.470  -19.115 -8.776  1.00 20.35 ? 94  ILE A CA    1 
ATOM   803  C C     . ILE A 1 94  ? 15.913  -19.029 -10.227 1.00 22.12 ? 94  ILE A C     1 
ATOM   804  O O     . ILE A 1 94  ? 15.179  -19.375 -11.148 1.00 19.31 ? 94  ILE A O     1 
ATOM   805  C CB    . ILE A 1 94  ? 16.100  -20.324 -8.046  1.00 28.63 ? 94  ILE A CB    1 
ATOM   806  C CG1   . ILE A 1 94  ? 15.492  -21.670 -8.447  1.00 27.70 ? 94  ILE A CG1   1 
ATOM   807  C CG2   . ILE A 1 94  ? 15.844  -20.190 -6.564  1.00 24.83 ? 94  ILE A CG2   1 
ATOM   808  C CD1   . ILE A 1 94  ? 15.526  -22.004 -9.897  1.00 38.28 ? 94  ILE A CD1   1 
ATOM   809  H H     . ILE A 1 94  ? 13.664  -19.699 -9.314  1.00 22.44 ? 94  ILE A H     1 
ATOM   810  H HA    . ILE A 1 94  ? 15.792  -18.321 -8.321  1.00 24.46 ? 94  ILE A HA    1 
ATOM   811  H HB    . ILE A 1 94  ? 17.040  -20.315 -8.288  1.00 34.40 ? 94  ILE A HB    1 
ATOM   812  H HG12  . ILE A 1 94  ? 15.977  -22.371 -7.982  1.00 33.27 ? 94  ILE A HG12  1 
ATOM   813  H HG13  . ILE A 1 94  ? 14.561  -21.674 -8.175  1.00 33.27 ? 94  ILE A HG13  1 
ATOM   814  H HG21  . ILE A 1 94  ? 16.261  -20.934 -6.103  1.00 29.83 ? 94  ILE A HG21  1 
ATOM   815  H HG22  . ILE A 1 94  ? 16.223  -19.353 -6.253  1.00 29.83 ? 94  ILE A HG22  1 
ATOM   816  H HG23  . ILE A 1 94  ? 14.887  -20.198 -6.407  1.00 29.83 ? 94  ILE A HG23  1 
ATOM   817  H HD11  . ILE A 1 94  ? 15.264  -22.930 -10.014 1.00 45.98 ? 94  ILE A HD11  1 
ATOM   818  H HD12  . ILE A 1 94  ? 14.909  -21.423 -10.369 1.00 45.98 ? 94  ILE A HD12  1 
ATOM   819  H HD13  . ILE A 1 94  ? 16.427  -21.870 -10.231 1.00 45.98 ? 94  ILE A HD13  1 
ATOM   820  N N     . ARG A 1 95  ? 17.124  -18.528 -10.407 1.00 22.29 ? 95  ARG A N     1 
ATOM   821  C CA    . ARG A 1 95  ? 17.742  -18.405 -11.716 1.00 23.56 ? 95  ARG A CA    1 
ATOM   822  C C     . ARG A 1 95  ? 18.506  -19.686 -12.006 1.00 27.07 ? 95  ARG A C     1 
ATOM   823  O O     . ARG A 1 95  ? 19.443  -20.031 -11.280 1.00 34.61 ? 95  ARG A O     1 
ATOM   824  C CB    . ARG A 1 95  ? 18.664  -17.184 -11.746 1.00 36.02 ? 95  ARG A CB    1 
ATOM   825  C CG    . ARG A 1 95  ? 19.552  -17.054 -12.980 1.00 41.01 ? 95  ARG A CG    1 
ATOM   826  C CD    . ARG A 1 95  ? 18.986  -16.087 -13.991 1.00 42.83 ? 95  ARG A CD    1 
ATOM   827  N NE    . ARG A 1 95  ? 18.766  -14.751 -13.450 1.00 44.26 ? 95  ARG A NE    1 
ATOM   828  C CZ    . ARG A 1 95  ? 18.063  -13.811 -14.069 1.00 47.72 ? 95  ARG A CZ    1 
ATOM   829  N NH1   . ARG A 1 95  ? 17.474  -14.041 -15.235 1.00 43.09 ? 95  ARG A NH1   1 
ATOM   830  N NH2   . ARG A 1 95  ? 17.951  -12.608 -13.508 1.00 59.15 ? 95  ARG A NH2   1 
ATOM   831  H H     . ARG A 1 95  ? 17.623  -18.244 -9.767  1.00 26.78 ? 95  ARG A H     1 
ATOM   832  H HA    . ARG A 1 95  ? 17.070  -18.288 -12.406 1.00 28.31 ? 95  ARG A HA    1 
ATOM   833  H HB2   . ARG A 1 95  ? 18.113  -16.387 -11.703 1.00 43.26 ? 95  ARG A HB2   1 
ATOM   834  H HB3   . ARG A 1 95  ? 19.249  -17.226 -10.974 1.00 43.26 ? 95  ARG A HB3   1 
ATOM   835  H HG2   . ARG A 1 95  ? 20.426  -16.731 -12.710 1.00 49.25 ? 95  ARG A HG2   1 
ATOM   836  H HG3   . ARG A 1 95  ? 19.636  -17.921 -13.406 1.00 49.25 ? 95  ARG A HG3   1 
ATOM   837  H HD2   . ARG A 1 95  ? 19.606  -16.010 -14.733 1.00 51.44 ? 95  ARG A HD2   1 
ATOM   838  H HD3   . ARG A 1 95  ? 18.133  -16.425 -14.306 1.00 51.44 ? 95  ARG A HD3   1 
ATOM   839  H HE    . ARG A 1 95  ? 19.112  -14.562 -12.686 1.00 53.15 ? 95  ARG A HE    1 
ATOM   840  H HH11  . ARG A 1 95  ? 17.544  -14.814 -15.606 1.00 51.74 ? 95  ARG A HH11  1 
ATOM   841  H HH12  . ARG A 1 95  ? 17.023  -13.419 -15.619 1.00 51.74 ? 95  ARG A HH12  1 
ATOM   842  H HH21  . ARG A 1 95  ? 18.332  -12.448 -12.754 1.00 71.02 ? 95  ARG A HH21  1 
ATOM   843  H HH22  . ARG A 1 95  ? 17.498  -11.991 -13.900 1.00 71.02 ? 95  ARG A HH22  1 
ATOM   844  N N     . GLY A 1 96  ? 18.108  -20.386 -13.057 1.00 23.11 ? 96  GLY A N     1 
ATOM   845  C CA    . GLY A 1 96  ? 18.768  -21.612 -13.451 1.00 30.95 ? 96  GLY A CA    1 
ATOM   846  C C     . GLY A 1 96  ? 20.081  -21.369 -14.173 1.00 28.97 ? 96  GLY A C     1 
ATOM   847  O O     . GLY A 1 96  ? 20.554  -20.242 -14.326 1.00 30.24 ? 96  GLY A O     1 
ATOM   848  H H     . GLY A 1 96  ? 17.448  -20.167 -13.564 1.00 27.77 ? 96  GLY A H     1 
ATOM   849  N N     . GLY A 1 97  ? 20.688  -22.472 -14.615 1.00 40.11 ? 97  GLY A N     1 
ATOM   850  C CA    . GLY A 1 97  ? 21.967  -22.375 -15.298 1.00 45.03 ? 97  GLY A CA    1 
ATOM   851  C C     . GLY A 1 97  ? 21.883  -21.562 -16.572 1.00 49.16 ? 97  GLY A C     1 
ATOM   852  O O     . GLY A 1 97  ? 22.803  -20.805 -16.896 1.00 49.24 ? 97  GLY A O     1 
ATOM   853  N N     . ASP A 1 98  ? 20.774  -21.698 -17.305 1.00 48.08 ? 98  ASP A N     1 
ATOM   854  C CA    . ASP A 1 98  ? 20.533  -20.953 -18.535 1.00 40.17 ? 98  ASP A CA    1 
ATOM   855  C C     . ASP A 1 98  ? 20.326  -19.462 -18.299 1.00 38.27 ? 98  ASP A C     1 
ATOM   856  O O     . ASP A 1 98  ? 20.075  -18.729 -19.267 1.00 36.79 ? 98  ASP A O     1 
ATOM   857  C CB    . ASP A 1 98  ? 19.311  -21.533 -19.246 1.00 35.99 ? 98  ASP A CB    1 
ATOM   858  C CG    . ASP A 1 98  ? 18.065  -21.528 -18.361 1.00 38.99 ? 98  ASP A CG    1 
ATOM   859  O OD1   . ASP A 1 98  ? 18.122  -20.969 -17.242 1.00 38.20 ? 98  ASP A OD1   1 
ATOM   860  O OD2   . ASP A 1 98  ? 17.026  -22.082 -18.782 1.00 39.99 ? 98  ASP A OD2   1 
ATOM   861  N N     . GLY A 1 99  ? 20.420  -18.986 -17.059 1.00 27.26 ? 99  GLY A N     1 
ATOM   862  C CA    . GLY A 1 99  ? 20.110  -17.596 -16.818 1.00 31.44 ? 99  GLY A CA    1 
ATOM   863  C C     . GLY A 1 99  ? 18.636  -17.272 -16.870 1.00 25.82 ? 99  GLY A C     1 
ATOM   864  O O     . GLY A 1 99  ? 18.273  -16.090 -16.809 1.00 28.39 ? 99  GLY A O     1 
ATOM   865  N N     . LYS A 1 100 ? 17.776  -18.285 -16.958 1.00 31.87 ? 100 LYS A N     1 
ATOM   866  C CA    . LYS A 1 100 ? 16.333  -18.092 -16.991 1.00 21.02 ? 100 LYS A CA    1 
ATOM   867  C C     . LYS A 1 100 ? 15.711  -18.496 -15.659 1.00 22.77 ? 100 LYS A C     1 
ATOM   868  O O     . LYS A 1 100 ? 16.247  -19.330 -14.921 1.00 24.64 ? 100 LYS A O     1 
ATOM   869  C CB    . LYS A 1 100 ? 15.694  -18.897 -18.125 1.00 20.78 ? 100 LYS A CB    1 
ATOM   870  C CG    . LYS A 1 100 ? 16.280  -18.559 -19.479 1.00 27.16 ? 100 LYS A CG    1 
ATOM   871  C CD    . LYS A 1 100 ? 15.909  -19.617 -20.491 1.00 31.78 ? 100 LYS A CD    1 
ATOM   872  C CE    . LYS A 1 100 ? 16.654  -19.395 -21.800 1.00 39.64 ? 100 LYS A CE    1 
ATOM   873  N NZ    . LYS A 1 100 ? 17.041  -17.960 -21.912 1.00 33.33 ? 100 LYS A NZ    1 
ATOM   874  H H     . LYS A 1 100 ? 18.013  -19.111 -17.001 1.00 38.28 ? 100 LYS A H     1 
ATOM   875  H HA    . LYS A 1 100 ? 16.142  -17.153 -17.139 1.00 25.26 ? 100 LYS A HA    1 
ATOM   876  N N     . MET A 1 101 ? 14.564  -17.894 -15.372 1.00 18.18 ? 101 MET A N     1 
ATOM   877  C CA    . MET A 1 101 ? 13.897  -18.076 -14.089 1.00 18.49 ? 101 MET A CA    1 
ATOM   878  C C     . MET A 1 101 ? 13.049  -19.343 -14.062 1.00 18.45 ? 101 MET A C     1 
ATOM   879  O O     . MET A 1 101 ? 12.329  -19.654 -15.015 1.00 21.71 ? 101 MET A O     1 
ATOM   880  C CB    . MET A 1 101 ? 13.022  -16.866 -13.790 1.00 20.18 ? 101 MET A CB    1 
ATOM   881  C CG    . MET A 1 101 ? 13.787  -15.554 -13.696 1.00 23.45 ? 101 MET A CG    1 
ATOM   882  S SD    . MET A 1 101 ? 15.170  -15.602 -12.522 1.00 29.62 ? 101 MET A SD    1 
ATOM   883  C CE    . MET A 1 101 ? 14.267  -15.883 -11.017 1.00 27.97 ? 101 MET A CE    1 
ATOM   884  H H     . MET A 1 101 ? 14.146  -17.368 -15.909 1.00 21.85 ? 101 MET A H     1 
ATOM   885  H HA    . MET A 1 101 ? 14.574  -18.157 -13.399 1.00 22.22 ? 101 MET A HA    1 
ATOM   886  H HB2   . MET A 1 101 ? 12.366  -16.774 -14.498 1.00 24.26 ? 101 MET A HB2   1 
ATOM   887  H HB3   . MET A 1 101 ? 12.576  -17.007 -12.941 1.00 24.26 ? 101 MET A HB3   1 
ATOM   888  H HG2   . MET A 1 101 ? 14.148  -15.338 -14.570 1.00 28.18 ? 101 MET A HG2   1 
ATOM   889  H HG3   . MET A 1 101 ? 13.178  -14.856 -13.408 1.00 28.18 ? 101 MET A HG3   1 
ATOM   890  H HE1   . MET A 1 101 ? 14.883  -15.852 -10.268 1.00 33.60 ? 101 MET A HE1   1 
ATOM   891  H HE2   . MET A 1 101 ? 13.593  -15.192 -10.919 1.00 33.60 ? 101 MET A HE2   1 
ATOM   892  H HE3   . MET A 1 101 ? 13.843  -16.754 -11.061 1.00 33.60 ? 101 MET A HE3   1 
ATOM   893  N N     . LYS A 1 102 ? 13.135  -20.074 -12.944 1.00 17.85 ? 102 LYS A N     1 
ATOM   894  C CA    . LYS A 1 102 ? 12.397  -21.315 -12.735 1.00 24.89 ? 102 LYS A CA    1 
ATOM   895  C C     . LYS A 1 102 ? 11.599  -21.189 -11.448 1.00 20.16 ? 102 LYS A C     1 
ATOM   896  O O     . LYS A 1 102 ? 12.115  -20.691 -10.449 1.00 18.19 ? 102 LYS A O     1 
ATOM   897  C CB    . LYS A 1 102 ? 13.313  -22.543 -12.605 1.00 28.69 ? 102 LYS A CB    1 
ATOM   898  C CG    . LYS A 1 102 ? 14.411  -22.691 -13.654 1.00 39.40 ? 102 LYS A CG    1 
ATOM   899  C CD    . LYS A 1 102 ? 13.855  -22.970 -15.050 1.00 48.23 ? 102 LYS A CD    1 
ATOM   900  C CE    . LYS A 1 102 ? 14.987  -23.273 -16.052 1.00 57.27 ? 102 LYS A CE    1 
ATOM   901  N NZ    . LYS A 1 102 ? 14.778  -22.678 -17.429 1.00 32.70 ? 102 LYS A NZ    1 
ATOM   902  H H     . LYS A 1 102 ? 13.632  -19.860 -12.274 1.00 21.46 ? 102 LYS A H     1 
ATOM   903  H HA    . LYS A 1 102 ? 11.810  -21.455 -13.495 1.00 29.91 ? 102 LYS A HA    1 
ATOM   904  H HB2   . LYS A 1 102 ? 13.751  -22.501 -11.740 1.00 34.46 ? 102 LYS A HB2   1 
ATOM   905  H HB3   . LYS A 1 102 ? 12.760  -23.338 -12.658 1.00 34.46 ? 102 LYS A HB3   1 
ATOM   906  H HG2   . LYS A 1 102 ? 14.924  -21.869 -13.694 1.00 47.31 ? 102 LYS A HG2   1 
ATOM   907  H HG3   . LYS A 1 102 ? 14.988  -23.431 -13.407 1.00 47.31 ? 102 LYS A HG3   1 
ATOM   908  H HD2   . LYS A 1 102 ? 13.265  -23.739 -15.015 1.00 57.91 ? 102 LYS A HD2   1 
ATOM   909  H HD3   . LYS A 1 102 ? 13.369  -22.192 -15.365 1.00 57.91 ? 102 LYS A HD3   1 
ATOM   910  H HE2   . LYS A 1 102 ? 15.817  -22.915 -15.701 1.00 68.76 ? 102 LYS A HE2   1 
ATOM   911  H HE3   . LYS A 1 102 ? 15.059  -24.235 -16.157 1.00 68.76 ? 102 LYS A HE3   1 
ATOM   912  H HZ1   . LYS A 1 102 ? 15.433  -22.935 -17.974 1.00 39.28 ? 102 LYS A HZ1   1 
ATOM   913  H HZ2   . LYS A 1 102 ? 14.000  -22.950 -17.763 1.00 39.28 ? 102 LYS A HZ2   1 
ATOM   914  H HZ3   . LYS A 1 102 ? 14.777  -21.789 -17.379 1.00 39.28 ? 102 LYS A HZ3   1 
ATOM   915  N N     . ASP A 1 103 ? 10.353  -21.648 -11.475 1.00 20.40 ? 103 ASP A N     1 
ATOM   916  C CA    . ASP A 1 103 ? 9.532   -21.699 -10.275 1.00 18.33 ? 103 ASP A CA    1 
ATOM   917  C C     . ASP A 1 103 ? 9.881   -22.961 -9.502  1.00 17.28 ? 103 ASP A C     1 
ATOM   918  O O     . ASP A 1 103 ? 9.993   -24.035 -10.093 1.00 20.46 ? 103 ASP A O     1 
ATOM   919  C CB    . ASP A 1 103 ? 8.037   -21.733 -10.608 1.00 18.95 ? 103 ASP A CB    1 
ATOM   920  C CG    . ASP A 1 103 ? 7.450   -20.376 -10.983 1.00 27.59 ? 103 ASP A CG    1 
ATOM   921  O OD1   . ASP A 1 103 ? 8.122   -19.331 -10.871 1.00 28.73 ? 103 ASP A OD1   1 
ATOM   922  O OD2   . ASP A 1 103 ? 6.264   -20.366 -11.382 1.00 39.97 ? 103 ASP A OD2   1 
ATOM   923  H H     . ASP A 1 103 ? 9.958   -21.937 -12.182 1.00 24.52 ? 103 ASP A H     1 
ATOM   924  H HA    . ASP A 1 103 ? 9.704   -20.905 -9.745  1.00 22.04 ? 103 ASP A HA    1 
ATOM   925  H HB2   . ASP A 1 103 ? 7.899   -22.331 -11.359 1.00 22.78 ? 103 ASP A HB2   1 
ATOM   926  H HB3   . ASP A 1 103 ? 7.553   -22.059 -9.832  1.00 22.78 ? 103 ASP A HB3   1 
ATOM   927  N N     . LEU A 1 104 ? 10.055  -22.830 -8.189  1.00 15.54 ? 104 LEU A N     1 
ATOM   928  C CA    . LEU A 1 104 ? 10.177  -23.987 -7.322  1.00 17.21 ? 104 LEU A CA    1 
ATOM   929  C C     . LEU A 1 104 ? 8.788   -24.432 -6.866  1.00 16.75 ? 104 LEU A C     1 
ATOM   930  O O     . LEU A 1 104 ? 7.770   -23.811 -7.176  1.00 19.20 ? 104 LEU A O     1 
ATOM   931  C CB    . LEU A 1 104 ? 11.067  -23.661 -6.129  1.00 16.57 ? 104 LEU A CB    1 
ATOM   932  C CG    . LEU A 1 104 ? 12.502  -23.239 -6.472  1.00 22.34 ? 104 LEU A CG    1 
ATOM   933  C CD1   . LEU A 1 104 ? 13.288  -22.949 -5.214  1.00 29.15 ? 104 LEU A CD1   1 
ATOM   934  C CD2   . LEU A 1 104 ? 13.199  -24.292 -7.300  1.00 26.92 ? 104 LEU A CD2   1 
ATOM   935  H H     . LEU A 1 104 ? 10.105  -22.076 -7.779  1.00 18.68 ? 104 LEU A H     1 
ATOM   936  H HA    . LEU A 1 104 ? 10.589  -24.713 -7.815  1.00 20.68 ? 104 LEU A HA    1 
ATOM   937  H HB2   . LEU A 1 104 ? 10.661  -22.931 -5.637  1.00 19.93 ? 104 LEU A HB2   1 
ATOM   938  H HB3   . LEU A 1 104 ? 11.123  -24.449 -5.567  1.00 19.93 ? 104 LEU A HB3   1 
ATOM   939  H HG    . LEU A 1 104 ? 12.464  -22.427 -7.000  1.00 26.85 ? 104 LEU A HG    1 
ATOM   940  H HD11  . LEU A 1 104 ? 13.951  -23.646 -5.088  1.00 35.02 ? 104 LEU A HD11  1 
ATOM   941  H HD12  . LEU A 1 104 ? 13.726  -22.089 -5.307  1.00 35.02 ? 104 LEU A HD12  1 
ATOM   942  H HD13  . LEU A 1 104 ? 12.679  -22.931 -4.459  1.00 35.02 ? 104 LEU A HD13  1 
ATOM   943  H HD21  . LEU A 1 104 ? 14.157  -24.156 -7.241  1.00 32.34 ? 104 LEU A HD21  1 
ATOM   944  H HD22  . LEU A 1 104 ? 12.967  -25.169 -6.956  1.00 32.34 ? 104 LEU A HD22  1 
ATOM   945  H HD23  . LEU A 1 104 ? 12.909  -24.210 -8.222  1.00 32.34 ? 104 LEU A HD23  1 
ATOM   946  N N     . SER A 1 105 ? 8.745   -25.506 -6.093  1.00 17.13 ? 105 SER A N     1 
ATOM   947  C CA    . SER A 1 105 ? 7.462   -26.014 -5.633  1.00 17.32 ? 105 SER A CA    1 
ATOM   948  C C     . SER A 1 105 ? 6.770   -24.969 -4.763  1.00 13.05 ? 105 SER A C     1 
ATOM   949  O O     . SER A 1 105 ? 7.406   -24.399 -3.858  1.00 14.43 ? 105 SER A O     1 
ATOM   950  C CB    . SER A 1 105 ? 7.658   -27.309 -4.846  1.00 22.94 ? 105 SER A CB    1 
ATOM   951  O OG    . SER A 1 105 ? 8.165   -28.336 -5.687  1.00 26.90 ? 105 SER A OG    1 
ATOM   952  H H     . SER A 1 105 ? 9.430   -25.952 -5.825  1.00 20.60 ? 105 SER A H     1 
ATOM   953  H HA    . SER A 1 105 ? 6.895   -26.202 -6.398  1.00 20.82 ? 105 SER A HA    1 
ATOM   954  H HB2   . SER A 1 105 ? 8.288   -27.149 -4.126  1.00 27.57 ? 105 SER A HB2   1 
ATOM   955  H HB3   . SER A 1 105 ? 6.804   -27.591 -4.483  1.00 27.57 ? 105 SER A HB3   1 
ATOM   956  H HG    . SER A 1 105 ? 7.993   -29.089 -5.357  1.00 32.32 ? 105 SER A HG    1 
ATOM   957  N N     . PRO A 1 106 ? 5.477   -24.706 -4.975  1.00 13.26 ? 106 PRO A N     1 
ATOM   958  C CA    . PRO A 1 106 ? 4.788   -23.741 -4.116  1.00 12.77 ? 106 PRO A CA    1 
ATOM   959  C C     . PRO A 1 106 ? 4.782   -24.206 -2.665  1.00 13.01 ? 106 PRO A C     1 
ATOM   960  O O     . PRO A 1 106 ? 4.733   -25.405 -2.374  1.00 15.51 ? 106 PRO A O     1 
ATOM   961  C CB    . PRO A 1 106 ? 3.369   -23.692 -4.694  1.00 19.42 ? 106 PRO A CB    1 
ATOM   962  C CG    . PRO A 1 106 ? 3.461   -24.249 -6.035  1.00 18.46 ? 106 PRO A CG    1 
ATOM   963  C CD    . PRO A 1 106 ? 4.605   -25.216 -6.032  1.00 15.41 ? 106 PRO A CD    1 
ATOM   964  H HA    . PRO A 1 106 ? 5.196   -22.864 -4.182  1.00 15.36 ? 106 PRO A HA    1 
ATOM   965  H HB2   . PRO A 1 106 ? 2.774   -24.223 -4.141  1.00 23.35 ? 106 PRO A HB2   1 
ATOM   966  H HB3   . PRO A 1 106 ? 3.062   -22.773 -4.724  1.00 23.35 ? 106 PRO A HB3   1 
ATOM   967  H HG2   . PRO A 1 106 ? 2.632   -24.704 -6.252  1.00 22.19 ? 106 PRO A HG2   1 
ATOM   968  H HG3   . PRO A 1 106 ? 3.622   -23.534 -6.670  1.00 22.19 ? 106 PRO A HG3   1 
ATOM   969  H HD2   . PRO A 1 106 ? 4.299   -26.113 -5.824  1.00 18.53 ? 106 PRO A HD2   1 
ATOM   970  H HD3   . PRO A 1 106 ? 5.062   -25.212 -6.888  1.00 18.53 ? 106 PRO A HD3   1 
ATOM   971  N N     . ARG A 1 107 ? 4.841   -23.238 -1.764  1.00 11.81 ? 107 ARG A N     1 
ATOM   972  C CA    . ARG A 1 107 ? 4.756   -23.470 -0.330  1.00 14.54 ? 107 ARG A CA    1 
ATOM   973  C C     . ARG A 1 107 ? 3.501   -22.799 0.182   1.00 12.39 ? 107 ARG A C     1 
ATOM   974  O O     . ARG A 1 107 ? 3.220   -21.656 -0.165  1.00 15.66 ? 107 ARG A O     1 
ATOM   975  C CB    . ARG A 1 107 ? 5.959   -22.908 0.404   1.00 15.91 ? 107 ARG A CB    1 
ATOM   976  C CG    . ARG A 1 107 ? 7.152   -23.828 0.320   1.00 20.10 ? 107 ARG A CG    1 
ATOM   977  C CD    . ARG A 1 107 ? 8.405   -23.201 0.834   1.00 27.21 ? 107 ARG A CD    1 
ATOM   978  N NE    . ARG A 1 107 ? 9.373   -24.229 1.187   1.00 40.43 ? 107 ARG A NE    1 
ATOM   979  C CZ    . ARG A 1 107 ? 10.591  -23.975 1.640   1.00 49.11 ? 107 ARG A CZ    1 
ATOM   980  N NH1   . ARG A 1 107 ? 11.032  -22.733 1.766   1.00 44.55 ? 107 ARG A NH1   1 
ATOM   981  N NH2   . ARG A 1 107 ? 11.379  -24.989 1.990   1.00 52.72 ? 107 ARG A NH2   1 
ATOM   982  H H     . ARG A 1 107 ? 4.935   -22.407 -1.966  1.00 14.22 ? 107 ARG A H     1 
ATOM   983  H HA    . ARG A 1 107 ? 4.719   -24.422 -0.152  1.00 17.48 ? 107 ARG A HA    1 
ATOM   984  H HB2   . ARG A 1 107 ? 6.205   -22.057 0.009   1.00 19.13 ? 107 ARG A HB2   1 
ATOM   985  H HB3   . ARG A 1 107 ? 5.734   -22.787 1.340   1.00 19.13 ? 107 ARG A HB3   1 
ATOM   986  H HG2   . ARG A 1 107 ? 6.976   -24.622 0.848   1.00 24.16 ? 107 ARG A HG2   1 
ATOM   987  H HG3   . ARG A 1 107 ? 7.298   -24.073 -0.608  1.00 24.16 ? 107 ARG A HG3   1 
ATOM   988  H HD2   . ARG A 1 107 ? 8.791   -22.633 0.148   1.00 32.69 ? 107 ARG A HD2   1 
ATOM   989  H HD3   . ARG A 1 107 ? 8.207   -22.676 1.625   1.00 32.69 ? 107 ARG A HD3   1 
ATOM   990  H HE    . ARG A 1 107 ? 9.140   -25.052 1.095   1.00 48.55 ? 107 ARG A HE    1 
ATOM   991  H HH11  . ARG A 1 107 ? 10.525  -22.073 1.551   1.00 53.49 ? 107 ARG A HH11  1 
ATOM   992  H HH12  . ARG A 1 107 ? 11.826  -22.587 2.062   1.00 53.49 ? 107 ARG A HH12  1 
ATOM   993  H HH21  . ARG A 1 107 ? 11.095  -25.798 1.921   1.00 63.30 ? 107 ARG A HH21  1 
ATOM   994  H HH22  . ARG A 1 107 ? 12.172  -24.836 2.286   1.00 63.30 ? 107 ARG A HH22  1 
ATOM   995  N N     . TRP A 1 108 ? 2.762   -23.481 1.048   1.00 8.42  ? 108 TRP A N     1 
ATOM   996  C CA    . TRP A 1 108 ? 1.560   -22.909 1.629   1.00 9.04  ? 108 TRP A CA    1 
ATOM   997  C C     . TRP A 1 108 ? 1.769   -22.702 3.129   1.00 9.45  ? 108 TRP A C     1 
ATOM   998  O O     . TRP A 1 108 ? 2.071   -23.649 3.846   1.00 10.72 ? 108 TRP A O     1 
ATOM   999  C CB    . TRP A 1 108 ? 0.366   -23.804 1.366   1.00 9.36  ? 108 TRP A CB    1 
ATOM   1000 C CG    . TRP A 1 108 ? -0.010  -23.983 -0.080  1.00 8.88  ? 108 TRP A CG    1 
ATOM   1001 C CD1   . TRP A 1 108 ? 0.603   -24.766 -1.024  1.00 10.89 ? 108 TRP A CD1   1 
ATOM   1002 C CD2   . TRP A 1 108 ? -1.121  -23.377 -0.722  1.00 9.18  ? 108 TRP A CD2   1 
ATOM   1003 N NE1   . TRP A 1 108 ? -0.078  -24.675 -2.218  1.00 10.47 ? 108 TRP A NE1   1 
ATOM   1004 C CE2   . TRP A 1 108 ? -1.146  -23.834 -2.050  1.00 10.24 ? 108 TRP A CE2   1 
ATOM   1005 C CE3   . TRP A 1 108 ? -2.112  -22.495 -0.289  1.00 10.70 ? 108 TRP A CE3   1 
ATOM   1006 C CZ2   . TRP A 1 108 ? -2.121  -23.416 -2.963  1.00 11.20 ? 108 TRP A CZ2   1 
ATOM   1007 C CZ3   . TRP A 1 108 ? -3.075  -22.091 -1.176  1.00 12.18 ? 108 TRP A CZ3   1 
ATOM   1008 C CH2   . TRP A 1 108 ? -3.078  -22.554 -2.501  1.00 11.44 ? 108 TRP A CH2   1 
ATOM   1009 H H     . TRP A 1 108 ? 2.940   -24.280 1.314   1.00 10.14 ? 108 TRP A H     1 
ATOM   1010 H HA    . TRP A 1 108 ? 1.391   -22.040 1.233   1.00 10.88 ? 108 TRP A HA    1 
ATOM   1011 H HB2   . TRP A 1 108 ? 0.561   -24.685 1.724   1.00 11.27 ? 108 TRP A HB2   1 
ATOM   1012 H HB3   . TRP A 1 108 ? -0.404  -23.426 1.819   1.00 11.27 ? 108 TRP A HB3   1 
ATOM   1013 H HD1   . TRP A 1 108 ? 1.363   -25.282 -0.880  1.00 13.10 ? 108 TRP A HD1   1 
ATOM   1014 H HE1   . TRP A 1 108 ? 0.132   -25.079 -2.948  1.00 12.60 ? 108 TRP A HE1   1 
ATOM   1015 H HE3   . TRP A 1 108 ? -2.118  -22.186 0.588   1.00 12.88 ? 108 TRP A HE3   1 
ATOM   1016 H HZ2   . TRP A 1 108 ? -2.119  -23.711 -3.845  1.00 13.48 ? 108 TRP A HZ2   1 
ATOM   1017 H HZ3   . TRP A 1 108 ? -3.737  -21.500 -0.895  1.00 14.66 ? 108 TRP A HZ3   1 
ATOM   1018 H HH2   . TRP A 1 108 ? -3.747  -22.268 -3.080  1.00 13.76 ? 108 TRP A HH2   1 
ATOM   1019 N N     . TYR A 1 109 ? 1.606   -21.474 3.594   1.00 7.92  ? 109 TYR A N     1 
ATOM   1020 C CA    . TYR A 1 109 ? 1.882   -21.083 4.971   1.00 8.26  ? 109 TYR A CA    1 
ATOM   1021 C C     . TYR A 1 109 ? 0.595   -20.750 5.711   1.00 10.86 ? 109 TYR A C     1 
ATOM   1022 O O     . TYR A 1 109 ? -0.271  -20.057 5.171   1.00 9.08  ? 109 TYR A O     1 
ATOM   1023 C CB    . TYR A 1 109 ? 2.793   -19.858 5.004   1.00 11.23 ? 109 TYR A CB    1 
ATOM   1024 C CG    . TYR A 1 109 ? 4.213   -20.110 4.600   1.00 11.92 ? 109 TYR A CG    1 
ATOM   1025 C CD1   . TYR A 1 109 ? 5.159   -20.456 5.537   1.00 11.05 ? 109 TYR A CD1   1 
ATOM   1026 C CD2   . TYR A 1 109 ? 4.615   -19.958 3.275   1.00 10.33 ? 109 TYR A CD2   1 
ATOM   1027 C CE1   . TYR A 1 109 ? 6.498   -20.662 5.179   1.00 11.83 ? 109 TYR A CE1   1 
ATOM   1028 C CE2   . TYR A 1 109 ? 5.935   -20.143 2.908   1.00 13.08 ? 109 TYR A CE2   1 
ATOM   1029 C CZ    . TYR A 1 109 ? 6.866   -20.509 3.864   1.00 14.97 ? 109 TYR A CZ    1 
ATOM   1030 O OH    . TYR A 1 109 ? 8.193   -20.677 3.498   1.00 16.13 ? 109 TYR A OH    1 
ATOM   1031 H H     . TYR A 1 109 ? 1.325   -20.820 3.112   1.00 9.54  ? 109 TYR A H     1 
ATOM   1032 H HA    . TYR A 1 109 ? 2.310   -21.826 5.426   1.00 9.96  ? 109 TYR A HA    1 
ATOM   1033 H HB2   . TYR A 1 109 ? 2.432   -19.192 4.398   1.00 13.52 ? 109 TYR A HB2   1 
ATOM   1034 H HB3   . TYR A 1 109 ? 2.806   -19.511 5.910   1.00 13.52 ? 109 TYR A HB3   1 
ATOM   1035 H HD1   . TYR A 1 109 ? 4.904   -20.555 6.426   1.00 13.30 ? 109 TYR A HD1   1 
ATOM   1036 H HD2   . TYR A 1 109 ? 3.987   -19.729 2.628   1.00 12.43 ? 109 TYR A HD2   1 
ATOM   1037 H HE1   . TYR A 1 109 ? 7.128   -20.899 5.821   1.00 14.23 ? 109 TYR A HE1   1 
ATOM   1038 H HE2   . TYR A 1 109 ? 6.196   -20.022 2.023   1.00 15.73 ? 109 TYR A HE2   1 
ATOM   1039 H HH    . TYR A 1 109 ? 8.696   -20.469 4.138   1.00 19.39 ? 109 TYR A HH    1 
ATOM   1040 N N     . PHE A 1 110 ? 0.473   -21.204 6.966   1.00 7.47  ? 110 PHE A N     1 
ATOM   1041 C CA    . PHE A 1 110 ? -0.720  -20.942 7.750   1.00 7.68  ? 110 PHE A CA    1 
ATOM   1042 C C     . PHE A 1 110 ? -0.597  -19.698 8.618   1.00 7.83  ? 110 PHE A C     1 
ATOM   1043 O O     . PHE A 1 110 ? 0.400   -19.486 9.328   1.00 7.14  ? 110 PHE A O     1 
ATOM   1044 C CB    . PHE A 1 110 ? -1.068  -22.136 8.658   1.00 6.00  ? 110 PHE A CB    1 
ATOM   1045 C CG    . PHE A 1 110 ? -2.248  -21.863 9.571   1.00 4.60  ? 110 PHE A CG    1 
ATOM   1046 C CD1   . PHE A 1 110 ? -3.540  -22.028 9.116   1.00 6.62  ? 110 PHE A CD1   1 
ATOM   1047 C CD2   . PHE A 1 110 ? -2.076  -21.405 10.861  1.00 5.64  ? 110 PHE A CD2   1 
ATOM   1048 C CE1   . PHE A 1 110 ? -4.618  -21.714 9.935   1.00 5.57  ? 110 PHE A CE1   1 
ATOM   1049 C CE2   . PHE A 1 110 ? -3.152  -21.088 11.688  1.00 6.92  ? 110 PHE A CE2   1 
ATOM   1050 C CZ    . PHE A 1 110 ? -4.421  -21.263 11.227  1.00 5.66  ? 110 PHE A CZ    1 
ATOM   1051 H H     . PHE A 1 110 ? 1.071   -21.665 7.377   1.00 9.00  ? 110 PHE A H     1 
ATOM   1052 H HA    . PHE A 1 110 ? -1.439  -20.791 7.117   1.00 9.25  ? 110 PHE A HA    1 
ATOM   1053 H HB2   . PHE A 1 110 ? -1.291  -22.899 8.102   1.00 7.23  ? 110 PHE A HB2   1 
ATOM   1054 H HB3   . PHE A 1 110 ? -0.301  -22.343 9.214   1.00 7.23  ? 110 PHE A HB3   1 
ATOM   1055 H HD1   . PHE A 1 110 ? -3.690  -22.352 8.257   1.00 7.98  ? 110 PHE A HD1   1 
ATOM   1056 H HD2   . PHE A 1 110 ? -1.212  -21.305 11.189  1.00 6.81  ? 110 PHE A HD2   1 
ATOM   1057 H HE1   . PHE A 1 110 ? -5.484  -21.808 9.609   1.00 6.72  ? 110 PHE A HE1   1 
ATOM   1058 H HE2   . PHE A 1 110 ? -3.004  -20.759 12.546  1.00 8.34  ? 110 PHE A HE2   1 
ATOM   1059 H HZ    . PHE A 1 110 ? -5.149  -21.082 11.777  1.00 6.83  ? 110 PHE A HZ    1 
ATOM   1060 N N     . TYR A 1 111 ? -1.657  -18.895 8.604   1.00 7.04  ? 111 TYR A N     1 
ATOM   1061 C CA    . TYR A 1 111 ? -1.789  -17.726 9.439   1.00 7.34  ? 111 TYR A CA    1 
ATOM   1062 C C     . TYR A 1 111 ? -3.131  -17.738 10.159  1.00 5.58  ? 111 TYR A C     1 
ATOM   1063 O O     . TYR A 1 111 ? -4.167  -18.000 9.543   1.00 7.41  ? 111 TYR A O     1 
ATOM   1064 C CB    . TYR A 1 111 ? -1.679  -16.433 8.592   1.00 7.50  ? 111 TYR A CB    1 
ATOM   1065 C CG    . TYR A 1 111 ? -0.361  -16.292 7.867   1.00 5.02  ? 111 TYR A CG    1 
ATOM   1066 C CD1   . TYR A 1 111 ? -0.193  -16.825 6.611   1.00 7.94  ? 111 TYR A CD1   1 
ATOM   1067 C CD2   . TYR A 1 111 ? 0.713   -15.647 8.471   1.00 8.69  ? 111 TYR A CD2   1 
ATOM   1068 C CE1   . TYR A 1 111 ? 1.016   -16.713 5.935   1.00 12.62 ? 111 TYR A CE1   1 
ATOM   1069 C CE2   . TYR A 1 111 ? 1.922   -15.517 7.805   1.00 6.85  ? 111 TYR A CE2   1 
ATOM   1070 C CZ    . TYR A 1 111 ? 2.057   -16.073 6.549   1.00 8.35  ? 111 TYR A CZ    1 
ATOM   1071 O OH    . TYR A 1 111 ? 3.258   -15.960 5.844   1.00 13.56 ? 111 TYR A OH    1 
ATOM   1072 H H     . TYR A 1 111 ? -2.339  -19.019 8.094   1.00 8.49  ? 111 TYR A H     1 
ATOM   1073 H HA    . TYR A 1 111 ? -1.089  -17.734 10.110  1.00 8.84  ? 111 TYR A HA    1 
ATOM   1074 H HB2   . TYR A 1 111 ? -2.384  -16.435 7.926   1.00 9.04  ? 111 TYR A HB2   1 
ATOM   1075 H HB3   . TYR A 1 111 ? -1.778  -15.667 9.178   1.00 9.04  ? 111 TYR A HB3   1 
ATOM   1076 H HD1   . TYR A 1 111 ? -0.902  -17.269 6.206   1.00 9.57  ? 111 TYR A HD1   1 
ATOM   1077 H HD2   . TYR A 1 111 ? 0.619   -15.300 9.329   1.00 10.46 ? 111 TYR A HD2   1 
ATOM   1078 H HE1   . TYR A 1 111 ? 1.115   -17.066 5.080   1.00 15.18 ? 111 TYR A HE1   1 
ATOM   1079 H HE2   . TYR A 1 111 ? 2.631   -15.062 8.199   1.00 8.26  ? 111 TYR A HE2   1 
ATOM   1080 H HH    . TYR A 1 111 ? 3.291   -16.540 5.237   1.00 16.31 ? 111 TYR A HH    1 
ATOM   1081 N N     . TYR A 1 112 ? -3.128  -17.399 11.446  1.00 5.53  ? 112 TYR A N     1 
ATOM   1082 C CA    . TYR A 1 112 ? -4.393  -17.254 12.154  1.00 6.23  ? 112 TYR A CA    1 
ATOM   1083 C C     . TYR A 1 112 ? -5.201  -16.101 11.548  1.00 7.65  ? 112 TYR A C     1 
ATOM   1084 O O     . TYR A 1 112 ? -4.659  -15.139 10.995  1.00 7.84  ? 112 TYR A O     1 
ATOM   1085 C CB    . TYR A 1 112 ? -4.170  -17.042 13.651  1.00 6.54  ? 112 TYR A CB    1 
ATOM   1086 C CG    . TYR A 1 112 ? -3.725  -18.322 14.335  1.00 7.11  ? 112 TYR A CG    1 
ATOM   1087 C CD1   . TYR A 1 112 ? -4.632  -19.286 14.675  1.00 9.98  ? 112 TYR A CD1   1 
ATOM   1088 C CD2   . TYR A 1 112 ? -2.381  -18.558 14.613  1.00 8.58  ? 112 TYR A CD2   1 
ATOM   1089 C CE1   . TYR A 1 112 ? -4.224  -20.476 15.297  1.00 10.02 ? 112 TYR A CE1   1 
ATOM   1090 C CE2   . TYR A 1 112 ? -1.974  -19.723 15.220  1.00 10.45 ? 112 TYR A CE2   1 
ATOM   1091 C CZ    . TYR A 1 112 ? -2.896  -20.670 15.544  1.00 7.80  ? 112 TYR A CZ    1 
ATOM   1092 O OH    . TYR A 1 112 ? -2.462  -21.835 16.148  1.00 9.57  ? 112 TYR A OH    1 
ATOM   1093 H H     . TYR A 1 112 ? -2.424  -17.251 11.919  1.00 6.67  ? 112 TYR A H     1 
ATOM   1094 H HA    . TYR A 1 112 ? -4.911  -18.069 12.066  1.00 7.51  ? 112 TYR A HA    1 
ATOM   1095 H HB2   . TYR A 1 112 ? -3.482  -16.371 13.781  1.00 7.89  ? 112 TYR A HB2   1 
ATOM   1096 H HB3   . TYR A 1 112 ? -5.000  -16.750 14.060  1.00 7.89  ? 112 TYR A HB3   1 
ATOM   1097 H HD1   . TYR A 1 112 ? -5.534  -19.152 14.492  1.00 12.01 ? 112 TYR A HD1   1 
ATOM   1098 H HD2   . TYR A 1 112 ? -1.747  -17.917 14.384  1.00 10.34 ? 112 TYR A HD2   1 
ATOM   1099 H HE1   . TYR A 1 112 ? -4.848  -21.121 15.537  1.00 12.06 ? 112 TYR A HE1   1 
ATOM   1100 H HE2   . TYR A 1 112 ? -1.074  -19.863 15.409  1.00 12.57 ? 112 TYR A HE2   1 
ATOM   1101 H HH    . TYR A 1 112 ? -3.121  -22.289 16.403  1.00 11.52 ? 112 TYR A HH    1 
ATOM   1102 N N     . LEU A 1 113 ? -6.507  -16.208 11.675  1.00 6.20  ? 113 LEU A N     1 
ATOM   1103 C CA    . LEU A 1 113 ? -7.396  -15.161 11.197  1.00 10.49 ? 113 LEU A CA    1 
ATOM   1104 C C     . LEU A 1 113 ? -6.988  -13.810 11.758  1.00 9.23  ? 113 LEU A C     1 
ATOM   1105 O O     . LEU A 1 113 ? -6.739  -13.671 12.957  1.00 7.50  ? 113 LEU A O     1 
ATOM   1106 C CB    . LEU A 1 113 ? -8.810  -15.493 11.637  1.00 9.67  ? 113 LEU A CB    1 
ATOM   1107 C CG    . LEU A 1 113 ? -9.904  -14.475 11.364  1.00 9.59  ? 113 LEU A CG    1 
ATOM   1108 C CD1   . LEU A 1 113 ? -10.126 -14.390 9.888   1.00 10.86 ? 113 LEU A CD1   1 
ATOM   1109 C CD2   . LEU A 1 113 ? -11.137 -14.937 12.110  1.00 10.19 ? 113 LEU A CD2   1 
ATOM   1110 H H     . LEU A 1 113 ? -6.909  -16.878 12.034  1.00 7.48  ? 113 LEU A H     1 
ATOM   1111 H HA    . LEU A 1 113 ? -7.359  -15.109 10.230  1.00 12.63 ? 113 LEU A HA    1 
ATOM   1112 H HB2   . LEU A 1 113 ? -9.073  -16.311 11.187  1.00 11.64 ? 113 LEU A HB2   1 
ATOM   1113 H HB3   . LEU A 1 113 ? -8.793  -15.634 12.597  1.00 11.64 ? 113 LEU A HB3   1 
ATOM   1114 H HG    . LEU A 1 113 ? -9.676  -13.582 11.667  1.00 11.55 ? 113 LEU A HG    1 
ATOM   1115 H HD11  . LEU A 1 113 ? -10.889 -13.816 9.716   1.00 13.08 ? 113 LEU A HD11  1 
ATOM   1116 H HD12  . LEU A 1 113 ? -9.332  -14.019 9.471   1.00 13.08 ? 113 LEU A HD12  1 
ATOM   1117 H HD13  . LEU A 1 113 ? -10.297 -15.279 9.542   1.00 13.08 ? 113 LEU A HD13  1 
ATOM   1118 H HD21  . LEU A 1 113 ? -11.622 -14.161 12.430  1.00 12.27 ? 113 LEU A HD21  1 
ATOM   1119 H HD22  . LEU A 1 113 ? -11.696 -15.451 11.507  1.00 12.27 ? 113 LEU A HD22  1 
ATOM   1120 H HD23  . LEU A 1 113 ? -10.864 -15.489 12.859  1.00 12.27 ? 113 LEU A HD23  1 
ATOM   1121 N N     . GLY A 1 114 ? -6.950  -12.792 10.883  1.00 9.36  ? 114 GLY A N     1 
ATOM   1122 C CA    . GLY A 1 114 ? -6.667  -11.434 11.339  1.00 10.30 ? 114 GLY A CA    1 
ATOM   1123 C C     . GLY A 1 114 ? -5.211  -11.139 11.567  1.00 9.21  ? 114 GLY A C     1 
ATOM   1124 O O     . GLY A 1 114 ? -4.880  -10.101 12.170  1.00 11.90 ? 114 GLY A O     1 
ATOM   1125 H H     . GLY A 1 114 ? -7.083  -12.867 10.037  1.00 11.27 ? 114 GLY A H     1 
ATOM   1126 H HA2   . GLY A 1 114 ? -6.996  -10.808 10.675  1.00 12.40 ? 114 GLY A HA2   1 
ATOM   1127 H HA3   . GLY A 1 114 ? -7.135  -11.283 12.175  1.00 12.40 ? 114 GLY A HA3   1 
ATOM   1128 N N     . THR A 1 115 ? -4.339  -12.046 11.147  1.00 10.46 ? 115 THR A N     1 
ATOM   1129 C CA    . THR A 1 115 ? -2.893  -11.894 11.235  1.00 9.75  ? 115 THR A CA    1 
ATOM   1130 C C     . THR A 1 115 ? -2.298  -12.137 9.865   1.00 7.96  ? 115 THR A C     1 
ATOM   1131 O O     . THR A 1 115 ? -2.951  -12.669 8.960   1.00 9.34  ? 115 THR A O     1 
ATOM   1132 C CB    . THR A 1 115 ? -2.254  -12.893 12.224  1.00 8.88  ? 115 THR A CB    1 
ATOM   1133 O OG1   . THR A 1 115 ? -2.146  -14.158 11.569  1.00 8.54  ? 115 THR A OG1   1 
ATOM   1134 C CG2   . THR A 1 115 ? -3.068  -13.028 13.502  1.00 9.93  ? 115 THR A CG2   1 
ATOM   1135 H H     . THR A 1 115 ? -4.572  -12.793 10.790  1.00 12.59 ? 115 THR A H     1 
ATOM   1136 H HA    . THR A 1 115 ? -2.699  -10.992 11.536  1.00 11.73 ? 115 THR A HA    1 
ATOM   1137 H HB    . THR A 1 115 ? -1.377  -12.577 12.492  1.00 10.70 ? 115 THR A HB    1 
ATOM   1138 H HG1   . THR A 1 115 ? -2.370  -14.774 12.095  1.00 10.29 ? 115 THR A HG1   1 
ATOM   1139 H HG21  . THR A 1 115 ? -2.588  -13.572 14.145  1.00 11.96 ? 115 THR A HG21  1 
ATOM   1140 H HG22  . THR A 1 115 ? -3.229  -12.153 13.887  1.00 11.96 ? 115 THR A HG22  1 
ATOM   1141 H HG23  . THR A 1 115 ? -3.921  -13.449 13.309  1.00 11.96 ? 115 THR A HG23  1 
ATOM   1142 N N     . GLY A 1 116 ? -1.030  -11.744 9.709   1.00 9.32  ? 116 GLY A N     1 
ATOM   1143 C CA    . GLY A 1 116 ? -0.276  -12.094 8.535   1.00 9.30  ? 116 GLY A CA    1 
ATOM   1144 C C     . GLY A 1 116 ? -0.525  -11.198 7.331   1.00 10.26 ? 116 GLY A C     1 
ATOM   1145 O O     . GLY A 1 116 ? -1.128  -10.123 7.462   1.00 11.97 ? 116 GLY A O     1 
ATOM   1146 H H     . GLY A 1 116 ? -0.594  -11.272 10.280  1.00 11.22 ? 116 GLY A H     1 
ATOM   1147 H HA2   . GLY A 1 116 ? 0.670   -12.049 8.747   1.00 11.20 ? 116 GLY A HA2   1 
ATOM   1148 H HA3   . GLY A 1 116 ? -0.500  -13.002 8.279   1.00 11.20 ? 116 GLY A HA3   1 
ATOM   1149 N N     . PRO A 1 117 ? -0.086  -11.658 6.148   1.00 11.96 ? 117 PRO A N     1 
ATOM   1150 C CA    . PRO A 1 117 ? -0.164  -10.823 4.931   1.00 11.14 ? 117 PRO A CA    1 
ATOM   1151 C C     . PRO A 1 117 ? -1.576  -10.463 4.534   1.00 16.11 ? 117 PRO A C     1 
ATOM   1152 O O     . PRO A 1 117 ? -1.787  -9.425  3.890   1.00 16.52 ? 117 PRO A O     1 
ATOM   1153 C CB    . PRO A 1 117 ? 0.496   -11.684 3.847   1.00 15.54 ? 117 PRO A CB    1 
ATOM   1154 C CG    . PRO A 1 117 ? 1.280   -12.696 4.563   1.00 28.08 ? 117 PRO A CG    1 
ATOM   1155 C CD    . PRO A 1 117 ? 0.641   -12.912 5.900   1.00 13.21 ? 117 PRO A CD    1 
ATOM   1156 H HA    . PRO A 1 117 ? 0.358   -10.018 5.070   1.00 13.40 ? 117 PRO A HA    1 
ATOM   1157 H HB2   . PRO A 1 117 ? -0.187  -12.101 3.299   1.00 18.69 ? 117 PRO A HB2   1 
ATOM   1158 H HB3   . PRO A 1 117 ? 1.071   -11.130 3.295   1.00 18.69 ? 117 PRO A HB3   1 
ATOM   1159 H HG2   . PRO A 1 117 ? 1.278   -13.521 4.053   1.00 33.74 ? 117 PRO A HG2   1 
ATOM   1160 H HG3   . PRO A 1 117 ? 2.189   -12.376 4.673   1.00 33.74 ? 117 PRO A HG3   1 
ATOM   1161 H HD2   . PRO A 1 117 ? 0.029   -13.663 5.870   1.00 15.89 ? 117 PRO A HD2   1 
ATOM   1162 H HD3   . PRO A 1 117 ? 1.315   -13.059 6.582   1.00 15.89 ? 117 PRO A HD3   1 
ATOM   1163 N N     . GLU A 1 118 ? -2.564  -11.286 4.873   1.00 12.78 ? 118 GLU A N     1 
ATOM   1164 C CA    . GLU A 1 118 ? -3.969  -10.966 4.621   1.00 11.51 ? 118 GLU A CA    1 
ATOM   1165 C C     . GLU A 1 118 ? -4.744  -10.762 5.923   1.00 9.14  ? 118 GLU A C     1 
ATOM   1166 O O     . GLU A 1 118 ? -5.904  -11.165 6.073   1.00 10.96 ? 118 GLU A O     1 
ATOM   1167 C CB    . GLU A 1 118 ? -4.604  -12.037 3.748   1.00 12.83 ? 118 GLU A CB    1 
ATOM   1168 C CG    . GLU A 1 118 ? -3.997  -12.129 2.337   1.00 12.86 ? 118 GLU A CG    1 
ATOM   1169 C CD    . GLU A 1 118 ? -4.371  -10.964 1.397   1.00 15.94 ? 118 GLU A CD    1 
ATOM   1170 O OE1   . GLU A 1 118 ? -5.036  -9.999  1.833   1.00 17.34 ? 118 GLU A OE1   1 
ATOM   1171 O OE2   . GLU A 1 118 ? -3.973  -11.018 0.210   1.00 22.59 ? 118 GLU A OE2   1 
ATOM   1172 H H     . GLU A 1 118 ? -2.445  -12.047 5.255   1.00 15.37 ? 118 GLU A H     1 
ATOM   1173 H HA    . GLU A 1 118 ? -4.020  -10.127 4.136   1.00 13.85 ? 118 GLU A HA    1 
ATOM   1174 H HB2   . GLU A 1 118 ? -4.488  -12.899 4.177   1.00 15.44 ? 118 GLU A HB2   1 
ATOM   1175 H HB3   . GLU A 1 118 ? -5.549  -11.840 3.651   1.00 15.44 ? 118 GLU A HB3   1 
ATOM   1176 H HG2   . GLU A 1 118 ? -3.030  -12.140 2.418   1.00 15.47 ? 118 GLU A HG2   1 
ATOM   1177 H HG3   . GLU A 1 118 ? -4.305  -12.949 1.922   1.00 15.47 ? 118 GLU A HG3   1 
ATOM   1178 N N     . ALA A 1 119 ? -4.117  -10.080 6.876   1.00 9.48  ? 119 ALA A N     1 
ATOM   1179 C CA    . ALA A 1 119 ? -4.736  -9.822  8.165   1.00 9.79  ? 119 ALA A CA    1 
ATOM   1180 C C     . ALA A 1 119 ? -6.042  -9.053  8.056   1.00 13.27 ? 119 ALA A C     1 
ATOM   1181 O O     . ALA A 1 119 ? -6.852  -9.094  8.993   1.00 13.25 ? 119 ALA A O     1 
ATOM   1182 C CB    . ALA A 1 119 ? -3.778  -9.037  9.059   1.00 12.36 ? 119 ALA A CB    1 
ATOM   1183 H H     . ALA A 1 119 ? -3.325  -9.754  6.800   1.00 11.41 ? 119 ALA A H     1 
ATOM   1184 H HA    . ALA A 1 119 ? -4.925  -10.680 8.578   1.00 11.78 ? 119 ALA A HA    1 
ATOM   1185 H HB1   . ALA A 1 119 ? -4.251  -8.754  9.857   1.00 14.87 ? 119 ALA A HB1   1 
ATOM   1186 H HB2   . ALA A 1 119 ? -3.032  -9.607  9.300   1.00 14.87 ? 119 ALA A HB2   1 
ATOM   1187 H HB3   . ALA A 1 119 ? -3.457  -8.261  8.572   1.00 14.87 ? 119 ALA A HB3   1 
ATOM   1188 N N     . GLY A 1 120 ? -6.241  -8.314  6.959   1.00 12.55 ? 120 GLY A N     1 
ATOM   1189 C CA    . GLY A 1 120 ? -7.446  -7.522  6.805   1.00 13.42 ? 120 GLY A CA    1 
ATOM   1190 C C     . GLY A 1 120 ? -8.657  -8.292  6.326   1.00 12.89 ? 120 GLY A C     1 
ATOM   1191 O O     . GLY A 1 120 ? -9.789  -7.833  6.524   1.00 14.23 ? 120 GLY A O     1 
ATOM   1192 H H     . GLY A 1 120 ? -5.693  -8.260  6.299   1.00 15.09 ? 120 GLY A H     1 
ATOM   1193 H HA2   . GLY A 1 120 ? -7.668  -7.123  7.661   1.00 16.15 ? 120 GLY A HA2   1 
ATOM   1194 H HA3   . GLY A 1 120 ? -7.272  -6.815  6.163   1.00 16.15 ? 120 GLY A HA3   1 
ATOM   1195 N N     . LEU A 1 121 ? -8.449  -9.464  5.714   1.00 11.49 ? 121 LEU A N     1 
ATOM   1196 C CA    . LEU A 1 121 ? -9.552  -10.157 5.067   1.00 12.05 ? 121 LEU A CA    1 
ATOM   1197 C C     . LEU A 1 121 ? -10.456 -10.823 6.097   1.00 15.08 ? 121 LEU A C     1 
ATOM   1198 O O     . LEU A 1 121 ? -9.968  -11.416 7.072   1.00 11.69 ? 121 LEU A O     1 
ATOM   1199 C CB    . LEU A 1 121 ? -9.057  -11.209 4.099   1.00 13.91 ? 121 LEU A CB    1 
ATOM   1200 C CG    . LEU A 1 121 ? -8.332  -10.699 2.862   1.00 14.57 ? 121 LEU A CG    1 
ATOM   1201 C CD1   . LEU A 1 121 ? -7.992  -11.862 1.987   1.00 15.57 ? 121 LEU A CD1   1 
ATOM   1202 C CD2   . LEU A 1 121 ? -9.215  -9.693  2.135   1.00 17.62 ? 121 LEU A CD2   1 
ATOM   1203 H H     . LEU A 1 121 ? -7.690  -9.867  5.664   1.00 13.83 ? 121 LEU A H     1 
ATOM   1204 H HA    . LEU A 1 121 ? -10.069 -9.503  4.571   1.00 14.50 ? 121 LEU A HA    1 
ATOM   1205 H HB2   . LEU A 1 121 ? -8.440  -11.788 4.573   1.00 16.73 ? 121 LEU A HB2   1 
ATOM   1206 H HB3   . LEU A 1 121 ? -9.822  -11.720 3.792   1.00 16.73 ? 121 LEU A HB3   1 
ATOM   1207 H HG    . LEU A 1 121 ? -7.508  -10.247 3.101   1.00 17.52 ? 121 LEU A HG    1 
ATOM   1208 H HD11  . LEU A 1 121 ? -7.554  -11.537 1.185   1.00 18.72 ? 121 LEU A HD11  1 
ATOM   1209 H HD12  . LEU A 1 121 ? -7.398  -12.458 2.470   1.00 18.72 ? 121 LEU A HD12  1 
ATOM   1210 H HD13  . LEU A 1 121 ? -8.809  -12.329 1.751   1.00 18.72 ? 121 LEU A HD13  1 
ATOM   1211 H HD21  . LEU A 1 121 ? -8.937  -9.641  1.207   1.00 21.18 ? 121 LEU A HD21  1 
ATOM   1212 H HD22  . LEU A 1 121 ? -10.138 -9.987  2.187   1.00 21.18 ? 121 LEU A HD22  1 
ATOM   1213 H HD23  . LEU A 1 121 ? -9.120  -8.826  2.558   1.00 21.18 ? 121 LEU A HD23  1 
ATOM   1214 N N     . PRO A 1 122 ? -11.768 -10.772 5.891   1.00 9.78  ? 122 PRO A N     1 
ATOM   1215 C CA    . PRO A 1 122 ? -12.671 -11.548 6.732   1.00 11.16 ? 122 PRO A CA    1 
ATOM   1216 C C     . PRO A 1 122 ? -12.601 -13.011 6.330   1.00 8.58  ? 122 PRO A C     1 
ATOM   1217 O O     . PRO A 1 122 ? -12.300 -13.355 5.186   1.00 10.87 ? 122 PRO A O     1 
ATOM   1218 C CB    . PRO A 1 122 ? -14.044 -10.937 6.430   1.00 10.92 ? 122 PRO A CB    1 
ATOM   1219 C CG    . PRO A 1 122 ? -13.918 -10.482 5.009   1.00 13.79 ? 122 PRO A CG    1 
ATOM   1220 C CD    . PRO A 1 122 ? -12.504 -10.017 4.849   1.00 13.91 ? 122 PRO A CD    1 
ATOM   1221 H HA    . PRO A 1 122 ? -12.491 -11.443 7.679   1.00 13.43 ? 122 PRO A HA    1 
ATOM   1222 H HB2   . PRO A 1 122 ? -14.739 -11.608 6.525   1.00 13.14 ? 122 PRO A HB2   1 
ATOM   1223 H HB3   . PRO A 1 122 ? -14.219 -10.192 7.025   1.00 13.14 ? 122 PRO A HB3   1 
ATOM   1224 H HG2   . PRO A 1 122 ? -14.106 -11.222 4.411   1.00 16.58 ? 122 PRO A HG2   1 
ATOM   1225 H HG3   . PRO A 1 122 ? -14.539 -9.755  4.843   1.00 16.58 ? 122 PRO A HG3   1 
ATOM   1226 H HD2   . PRO A 1 122 ? -12.168 -10.234 3.965   1.00 16.73 ? 122 PRO A HD2   1 
ATOM   1227 H HD3   . PRO A 1 122 ? -12.436 -9.062  5.004   1.00 16.73 ? 122 PRO A HD3   1 
ATOM   1228 N N     . TYR A 1 123 ? -12.862 -13.874 7.305   1.00 10.27 ? 123 TYR A N     1 
ATOM   1229 C CA    . TYR A 1 123 ? -12.904 -15.298 7.041   1.00 11.31 ? 123 TYR A CA    1 
ATOM   1230 C C     . TYR A 1 123 ? -13.783 -15.593 5.828   1.00 12.54 ? 123 TYR A C     1 
ATOM   1231 O O     . TYR A 1 123 ? -14.903 -15.091 5.730   1.00 9.86  ? 123 TYR A O     1 
ATOM   1232 C CB    . TYR A 1 123 ? -13.429 -16.050 8.273   1.00 10.02 ? 123 TYR A CB    1 
ATOM   1233 C CG    . TYR A 1 123 ? -13.342 -17.531 8.066   1.00 12.87 ? 123 TYR A CG    1 
ATOM   1234 C CD1   . TYR A 1 123 ? -12.149 -18.204 8.270   1.00 11.18 ? 123 TYR A CD1   1 
ATOM   1235 C CD2   . TYR A 1 123 ? -14.413 -18.249 7.557   1.00 14.82 ? 123 TYR A CD2   1 
ATOM   1236 C CE1   . TYR A 1 123 ? -12.040 -19.546 8.059   1.00 11.09 ? 123 TYR A CE1   1 
ATOM   1237 C CE2   . TYR A 1 123 ? -14.308 -19.609 7.318   1.00 14.31 ? 123 TYR A CE2   1 
ATOM   1238 C CZ    . TYR A 1 123 ? -13.104 -20.256 7.583   1.00 13.16 ? 123 TYR A CZ    1 
ATOM   1239 O OH    . TYR A 1 123 ? -12.980 -21.604 7.340   1.00 14.22 ? 123 TYR A OH    1 
ATOM   1240 H H     . TYR A 1 123 ? -13.017 -13.658 8.123   1.00 12.36 ? 123 TYR A H     1 
ATOM   1241 H HA    . TYR A 1 123 ? -12.006 -15.613 6.855   1.00 13.61 ? 123 TYR A HA    1 
ATOM   1242 H HB2   . TYR A 1 123 ? -12.895 -15.815 9.048   1.00 12.07 ? 123 TYR A HB2   1 
ATOM   1243 H HB3   . TYR A 1 123 ? -14.357 -15.814 8.425   1.00 12.07 ? 123 TYR A HB3   1 
ATOM   1244 H HD1   . TYR A 1 123 ? -11.404 -17.728 8.559   1.00 13.45 ? 123 TYR A HD1   1 
ATOM   1245 H HD2   . TYR A 1 123 ? -15.212 -17.811 7.374   1.00 17.83 ? 123 TYR A HD2   1 
ATOM   1246 H HE1   . TYR A 1 123 ? -11.237 -19.980 8.241   1.00 13.34 ? 123 TYR A HE1   1 
ATOM   1247 H HE2   . TYR A 1 123 ? -15.034 -20.085 6.984   1.00 17.21 ? 123 TYR A HE2   1 
ATOM   1248 H HH    . TYR A 1 123 ? -12.222 -21.770 7.018   1.00 17.11 ? 123 TYR A HH    1 
ATOM   1249 N N     . GLY A 1 124 ? -13.285 -16.409 4.920   1.00 10.44 ? 124 GLY A N     1 
ATOM   1250 C CA    . GLY A 1 124 ? -14.032 -16.838 3.758   1.00 11.27 ? 124 GLY A CA    1 
ATOM   1251 C C     . GLY A 1 124 ? -13.954 -15.928 2.552   1.00 13.03 ? 124 GLY A C     1 
ATOM   1252 O O     . GLY A 1 124 ? -14.583 -16.237 1.523   1.00 14.26 ? 124 GLY A O     1 
ATOM   1253 H H     . GLY A 1 124 ? -12.491 -16.738 4.956   1.00 12.56 ? 124 GLY A H     1 
ATOM   1254 H HA2   . GLY A 1 124 ? -13.705 -17.710 3.487   1.00 13.56 ? 124 GLY A HA2   1 
ATOM   1255 H HA3   . GLY A 1 124 ? -14.967 -16.915 4.006   1.00 13.56 ? 124 GLY A HA3   1 
ATOM   1256 N N     . ALA A 1 125 ? -13.170 -14.851 2.617   1.00 12.44 ? 125 ALA A N     1 
ATOM   1257 C CA    . ALA A 1 125 ? -12.973 -13.972 1.465   1.00 11.28 ? 125 ALA A CA    1 
ATOM   1258 C C     . ALA A 1 125 ? -12.146 -14.707 0.419   1.00 16.72 ? 125 ALA A C     1 
ATOM   1259 O O     . ALA A 1 125 ? -10.954 -14.964 0.623   1.00 18.29 ? 125 ALA A O     1 
ATOM   1260 C CB    . ALA A 1 125 ? -12.295 -12.672 1.878   1.00 12.29 ? 125 ALA A CB    1 
ATOM   1261 H H     . ALA A 1 125 ? -12.739 -14.607 3.321   1.00 14.96 ? 125 ALA A H     1 
ATOM   1262 H HA    . ALA A 1 125 ? -13.838 -13.746 1.089   1.00 13.58 ? 125 ALA A HA    1 
ATOM   1263 H HB1   . ALA A 1 125 ? -12.124 -12.139 1.086   1.00 14.78 ? 125 ALA A HB1   1 
ATOM   1264 H HB2   . ALA A 1 125 ? -12.880 -12.188 2.482   1.00 14.78 ? 125 ALA A HB2   1 
ATOM   1265 H HB3   . ALA A 1 125 ? -11.459 -12.879 2.324   1.00 14.78 ? 125 ALA A HB3   1 
ATOM   1266 N N     . ASN A 1 126 ? -12.766 -15.058 -0.697  1.00 14.30 ? 126 ASN A N     1 
ATOM   1267 C CA    . ASN A 1 126 ? -12.061 -15.802 -1.735  1.00 12.36 ? 126 ASN A CA    1 
ATOM   1268 C C     . ASN A 1 126 ? -11.023 -14.940 -2.430  1.00 18.37 ? 126 ASN A C     1 
ATOM   1269 O O     . ASN A 1 126 ? -11.301 -13.821 -2.870  1.00 18.31 ? 126 ASN A O     1 
ATOM   1270 C CB    . ASN A 1 126 ? -13.029 -16.350 -2.778  1.00 17.62 ? 126 ASN A CB    1 
ATOM   1271 C CG    . ASN A 1 126 ? -13.785 -17.562 -2.295  1.00 26.71 ? 126 ASN A CG    1 
ATOM   1272 O OD1   . ASN A 1 126 ? -13.992 -17.757 -1.090  1.00 30.92 ? 126 ASN A OD1   1 
ATOM   1273 N ND2   . ASN A 1 126 ? -14.227 -18.384 -3.245  1.00 29.87 ? 126 ASN A ND2   1 
ATOM   1274 H H     . ASN A 1 126 ? -13.588 -14.881 -0.879  1.00 17.19 ? 126 ASN A H     1 
ATOM   1275 H HA    . ASN A 1 126 ? -11.611 -16.545 -1.302  1.00 14.87 ? 126 ASN A HA    1 
ATOM   1276 N N     . LYS A 1 127 ? -9.840  -15.505 -2.604  1.00 12.77 ? 127 LYS A N     1 
ATOM   1277 C CA    . LYS A 1 127 ? -8.731  -14.813 -3.237  1.00 12.63 ? 127 LYS A CA    1 
ATOM   1278 C C     . LYS A 1 127 ? -7.789  -15.878 -3.769  1.00 17.83 ? 127 LYS A C     1 
ATOM   1279 O O     . LYS A 1 127 ? -7.576  -16.895 -3.104  1.00 15.23 ? 127 LYS A O     1 
ATOM   1280 C CB    . LYS A 1 127 ? -8.051  -13.889 -2.216  1.00 16.58 ? 127 LYS A CB    1 
ATOM   1281 C CG    . LYS A 1 127 ? -7.012  -12.953 -2.752  1.00 23.36 ? 127 LYS A CG    1 
ATOM   1282 C CD    . LYS A 1 127 ? -6.887  -11.769 -1.814  1.00 17.52 ? 127 LYS A CD    1 
ATOM   1283 C CE    . LYS A 1 127 ? -5.786  -10.831 -2.256  1.00 24.04 ? 127 LYS A CE    1 
ATOM   1284 N NZ    . LYS A 1 127 ? -5.628  -9.671  -1.344  1.00 23.28 ? 127 LYS A NZ    1 
ATOM   1285 H H     A LYS A 1 127 ? -9.650  -16.307 -2.359  0.50 15.36 ? 127 LYS A H     1 
ATOM   1286 H H     B LYS A 1 127 ? -9.650  -16.307 -2.359  0.50 15.36 ? 127 LYS A H     1 
ATOM   1287 H HA    . LYS A 1 127 ? -9.011  -14.266 -3.987  1.00 15.20 ? 127 LYS A HA    1 
ATOM   1288 H HB2   . LYS A 1 127 ? -8.737  -13.345 -1.799  1.00 19.93 ? 127 LYS A HB2   1 
ATOM   1289 H HB3   . LYS A 1 127 ? -7.617  -14.444 -1.550  1.00 19.93 ? 127 LYS A HB3   1 
ATOM   1290 H HG2   . LYS A 1 127 ? -6.155  -13.405 -2.806  1.00 28.07 ? 127 LYS A HG2   1 
ATOM   1291 H HG3   . LYS A 1 127 ? -7.274  -12.634 -3.630  1.00 28.07 ? 127 LYS A HG3   1 
ATOM   1292 H HD2   . LYS A 1 127 ? -7.723  -11.277 -1.804  1.00 21.06 ? 127 LYS A HD2   1 
ATOM   1293 H HD3   . LYS A 1 127 ? -6.678  -12.086 -0.921  1.00 21.06 ? 127 LYS A HD3   1 
ATOM   1294 H HE2   . LYS A 1 127 ? -4.946  -11.315 -2.276  1.00 28.88 ? 127 LYS A HE2   1 
ATOM   1295 H HE3   . LYS A 1 127 ? -5.994  -10.492 -3.141  1.00 28.88 ? 127 LYS A HE3   1 
ATOM   1296 H HZ1   . LYS A 1 127 ? -5.971  -8.940  -1.719  1.00 27.97 ? 127 LYS A HZ1   1 
ATOM   1297 H HZ2   . LYS A 1 127 ? -6.051  -9.828  -0.577  1.00 27.97 ? 127 LYS A HZ2   1 
ATOM   1298 H HZ3   . LYS A 1 127 ? -4.766  -9.532  -1.175  1.00 27.97 ? 127 LYS A HZ3   1 
ATOM   1299 N N     . ASP A 1 128 ? -7.275  -15.688 -4.988  1.00 18.04 ? 128 ASP A N     1 
ATOM   1300 C CA    . ASP A 1 128 ? -6.330  -16.660 -5.525  1.00 19.78 ? 128 ASP A CA    1 
ATOM   1301 C C     . ASP A 1 128 ? -5.145  -16.790 -4.570  1.00 15.26 ? 128 ASP A C     1 
ATOM   1302 O O     . ASP A 1 128 ? -4.623  -15.791 -4.063  1.00 16.65 ? 128 ASP A O     1 
ATOM   1303 C CB    . ASP A 1 128 ? -5.851  -16.262 -6.929  1.00 25.73 ? 128 ASP A CB    1 
ATOM   1304 C CG    . ASP A 1 128 ? -4.922  -17.322 -7.571  1.00 35.99 ? 128 ASP A CG    1 
ATOM   1305 O OD1   . ASP A 1 128 ? -5.303  -18.513 -7.579  1.00 46.48 ? 128 ASP A OD1   1 
ATOM   1306 O OD2   . ASP A 1 128 ? -3.816  -16.979 -8.054  1.00 44.11 ? 128 ASP A OD2   1 
ATOM   1307 H H     . ASP A 1 128 ? -7.454  -15.025 -5.506  1.00 21.69 ? 128 ASP A H     1 
ATOM   1308 H HA    . ASP A 1 128 ? -6.769  -17.520 -5.614  1.00 23.78 ? 128 ASP A HA    1 
ATOM   1309 H HB2   . ASP A 1 128 ? -6.623  -16.151 -7.507  1.00 30.91 ? 128 ASP A HB2   1 
ATOM   1310 H HB3   . ASP A 1 128 ? -5.359  -15.428 -6.871  1.00 30.91 ? 128 ASP A HB3   1 
ATOM   1311 N N     . GLY A 1 129 ? -4.761  -18.036 -4.302  1.00 17.30 ? 129 GLY A N     1 
ATOM   1312 C CA    . GLY A 1 129 ? -3.665  -18.343 -3.418  1.00 14.07 ? 129 GLY A CA    1 
ATOM   1313 C C     . GLY A 1 129 ? -4.007  -18.369 -1.949  1.00 15.10 ? 129 GLY A C     1 
ATOM   1314 O O     . GLY A 1 129 ? -3.101  -18.546 -1.133  1.00 11.80 ? 129 GLY A O     1 
ATOM   1315 H H     . GLY A 1 129 ? -5.137  -18.735 -4.634  1.00 20.80 ? 129 GLY A H     1 
ATOM   1316 H HA2   . GLY A 1 129 ? -3.313  -19.216 -3.653  1.00 16.93 ? 129 GLY A HA2   1 
ATOM   1317 H HA3   . GLY A 1 129 ? -2.970  -17.678 -3.546  1.00 16.93 ? 129 GLY A HA3   1 
ATOM   1318 N N     . ILE A 1 130 ? -5.271  -18.168 -1.586  1.00 11.66 ? 130 ILE A N     1 
ATOM   1319 C CA    . ILE A 1 130 ? -5.734  -18.207 -0.206  1.00 9.70  ? 130 ILE A CA    1 
ATOM   1320 C C     . ILE A 1 130 ? -6.737  -19.343 -0.073  1.00 12.16 ? 130 ILE A C     1 
ATOM   1321 O O     . ILE A 1 130 ? -7.640  -19.489 -0.907  1.00 12.62 ? 130 ILE A O     1 
ATOM   1322 C CB    . ILE A 1 130 ? -6.383  -16.878 0.233   1.00 9.18  ? 130 ILE A CB    1 
ATOM   1323 C CG1   . ILE A 1 130 ? -5.410  -15.710 0.094   1.00 13.41 ? 130 ILE A CG1   1 
ATOM   1324 C CG2   . ILE A 1 130 ? -6.942  -16.972 1.667   1.00 12.49 ? 130 ILE A CG2   1 
ATOM   1325 C CD1   . ILE A 1 130 ? -4.310  -15.709 1.104   1.00 17.19 ? 130 ILE A CD1   1 
ATOM   1326 H H     . ILE A 1 130 ? -5.902  -18.001 -2.146  1.00 14.03 ? 130 ILE A H     1 
ATOM   1327 H HA    . ILE A 1 130 ? -4.973  -18.381 0.370   1.00 11.68 ? 130 ILE A HA    1 
ATOM   1328 H HB    . ILE A 1 130 ? -7.128  -16.712 -0.365  1.00 11.05 ? 130 ILE A HB    1 
ATOM   1329 H HG12  . ILE A 1 130 ? -5.003  -15.748 -0.785  1.00 16.14 ? 130 ILE A HG12  1 
ATOM   1330 H HG13  . ILE A 1 130 ? -5.904  -14.882 0.196   1.00 16.14 ? 130 ILE A HG13  1 
ATOM   1331 H HG21  . ILE A 1 130 ? -7.127  -16.078 1.993   1.00 15.02 ? 130 ILE A HG21  1 
ATOM   1332 H HG22  . ILE A 1 130 ? -7.759  -17.495 1.653   1.00 15.02 ? 130 ILE A HG22  1 
ATOM   1333 H HG23  . ILE A 1 130 ? -6.284  -17.402 2.235   1.00 15.02 ? 130 ILE A HG23  1 
ATOM   1334 H HD11  . ILE A 1 130 ? -3.617  -15.095 0.816   1.00 20.66 ? 130 ILE A HD11  1 
ATOM   1335 H HD12  . ILE A 1 130 ? -4.668  -15.427 1.961   1.00 20.66 ? 130 ILE A HD12  1 
ATOM   1336 H HD13  . ILE A 1 130 ? -3.947  -16.606 1.177   1.00 20.66 ? 130 ILE A HD13  1 
ATOM   1337 N N     . ILE A 1 131 ? -6.597  -20.143 0.984   1.00 8.39  ? 131 ILE A N     1 
ATOM   1338 C CA    . ILE A 1 131 ? -7.671  -21.048 1.383   1.00 10.57 ? 131 ILE A CA    1 
ATOM   1339 C C     . ILE A 1 131 ? -7.933  -20.870 2.870   1.00 10.84 ? 131 ILE A C     1 
ATOM   1340 O O     . ILE A 1 131 ? -7.020  -20.603 3.653   1.00 11.85 ? 131 ILE A O     1 
ATOM   1341 C CB    . ILE A 1 131 ? -7.386  -22.527 1.066   1.00 13.08 ? 131 ILE A CB    1 
ATOM   1342 C CG1   . ILE A 1 131 ? -6.145  -23.002 1.784   1.00 13.24 ? 131 ILE A CG1   1 
ATOM   1343 C CG2   . ILE A 1 131 ? -7.324  -22.771 -0.447  1.00 14.89 ? 131 ILE A CG2   1 
ATOM   1344 C CD1   . ILE A 1 131 ? -6.216  -24.474 2.109   1.00 19.51 ? 131 ILE A CD1   1 
ATOM   1345 H H     . ILE A 1 131 ? -5.895  -20.179 1.480   1.00 10.11 ? 131 ILE A H     1 
ATOM   1346 H HA    . ILE A 1 131 ? -8.467  -20.797 0.888   1.00 12.72 ? 131 ILE A HA    1 
ATOM   1347 H HB    . ILE A 1 131 ? -8.127  -23.056 1.400   1.00 15.73 ? 131 ILE A HB    1 
ATOM   1348 H HG12  . ILE A 1 131 ? -5.371  -22.852 1.219   1.00 15.93 ? 131 ILE A HG12  1 
ATOM   1349 H HG13  . ILE A 1 131 ? -6.049  -22.511 2.615   1.00 15.93 ? 131 ILE A HG13  1 
ATOM   1350 H HG21  . ILE A 1 131 ? -7.389  -23.724 -0.616  1.00 17.91 ? 131 ILE A HG21  1 
ATOM   1351 H HG22  . ILE A 1 131 ? -8.062  -22.309 -0.873  1.00 17.91 ? 131 ILE A HG22  1 
ATOM   1352 H HG23  . ILE A 1 131 ? -6.481  -22.432 -0.787  1.00 17.91 ? 131 ILE A HG23  1 
ATOM   1353 H HD11  . ILE A 1 131 ? -5.429  -24.723 2.619   1.00 23.46 ? 131 ILE A HD11  1 
ATOM   1354 H HD12  . ILE A 1 131 ? -7.016  -24.644 2.630   1.00 23.46 ? 131 ILE A HD12  1 
ATOM   1355 H HD13  . ILE A 1 131 ? -6.246  -24.979 1.281   1.00 23.46 ? 131 ILE A HD13  1 
ATOM   1356 N N     . TRP A 1 132 ? -9.191  -21.002 3.256   1.00 6.79  ? 132 TRP A N     1 
ATOM   1357 C CA    . TRP A 1 132 ? -9.642  -20.728 4.605   1.00 7.73  ? 132 TRP A CA    1 
ATOM   1358 C C     . TRP A 1 132 ? -9.912  -22.048 5.295   1.00 10.96 ? 132 TRP A C     1 
ATOM   1359 O O     . TRP A 1 132 ? -10.457 -22.974 4.681   1.00 11.73 ? 132 TRP A O     1 
ATOM   1360 C CB    . TRP A 1 132 ? -10.919 -19.871 4.584   1.00 7.75  ? 132 TRP A CB    1 
ATOM   1361 C CG    . TRP A 1 132 ? -10.637 -18.501 4.094   1.00 9.09  ? 132 TRP A CG    1 
ATOM   1362 C CD1   . TRP A 1 132 ? -10.819 -18.024 2.826   1.00 11.03 ? 132 TRP A CD1   1 
ATOM   1363 C CD2   . TRP A 1 132 ? -10.078 -17.434 4.848   1.00 9.20  ? 132 TRP A CD2   1 
ATOM   1364 N NE1   . TRP A 1 132 ? -10.404 -16.714 2.749   1.00 11.70 ? 132 TRP A NE1   1 
ATOM   1365 C CE2   . TRP A 1 132 ? -9.958  -16.320 3.980   1.00 11.08 ? 132 TRP A CE2   1 
ATOM   1366 C CE3   . TRP A 1 132 ? -9.697  -17.288 6.186   1.00 9.28  ? 132 TRP A CE3   1 
ATOM   1367 C CZ2   . TRP A 1 132 ? -9.467  -15.102 4.406   1.00 9.42  ? 132 TRP A CZ2   1 
ATOM   1368 C CZ3   . TRP A 1 132 ? -9.214  -16.076 6.605   1.00 9.66  ? 132 TRP A CZ3   1 
ATOM   1369 C CH2   . TRP A 1 132 ? -9.088  -14.994 5.711   1.00 10.32 ? 132 TRP A CH2   1 
ATOM   1370 H H     . TRP A 1 132 ? -9.824  -21.260 2.734   1.00 8.19  ? 132 TRP A H     1 
ATOM   1371 H HA    . TRP A 1 132 ? -8.965  -20.244 5.102   1.00 9.31  ? 132 TRP A HA    1 
ATOM   1372 H HB2   . TRP A 1 132 ? -11.571 -20.280 3.994   1.00 9.33  ? 132 TRP A HB2   1 
ATOM   1373 H HB3   . TRP A 1 132 ? -11.278 -19.808 5.483   1.00 9.33  ? 132 TRP A HB3   1 
ATOM   1374 H HD1   . TRP A 1 132 ? -11.171 -18.513 2.118   1.00 13.27 ? 132 TRP A HD1   1 
ATOM   1375 H HE1   . TRP A 1 132 ? -10.423 -16.224 2.042   1.00 14.08 ? 132 TRP A HE1   1 
ATOM   1376 H HE3   . TRP A 1 132 ? -9.770  -18.000 6.779   1.00 11.17 ? 132 TRP A HE3   1 
ATOM   1377 H HZ2   . TRP A 1 132 ? -9.397  -14.381 3.823   1.00 11.34 ? 132 TRP A HZ2   1 
ATOM   1378 H HZ3   . TRP A 1 132 ? -8.965  -15.965 7.494   1.00 11.63 ? 132 TRP A HZ3   1 
ATOM   1379 H HH2   . TRP A 1 132 ? -8.738  -14.189 6.018   1.00 12.42 ? 132 TRP A HH2   1 
ATOM   1380 N N     . VAL A 1 133 ? -9.541  -22.120 6.566   1.00 7.59  ? 133 VAL A N     1 
ATOM   1381 C CA    . VAL A 1 133 ? -9.773  -23.305 7.384   1.00 6.98  ? 133 VAL A CA    1 
ATOM   1382 C C     . VAL A 1 133 ? -10.283 -22.898 8.754   1.00 8.71  ? 133 VAL A C     1 
ATOM   1383 O O     . VAL A 1 133 ? -9.881  -21.875 9.313   1.00 7.11  ? 133 VAL A O     1 
ATOM   1384 C CB    . VAL A 1 133 ? -8.495  -24.176 7.536   1.00 8.32  ? 133 VAL A CB    1 
ATOM   1385 C CG1   . VAL A 1 133 ? -8.128  -24.810 6.211   1.00 10.06 ? 133 VAL A CG1   1 
ATOM   1386 C CG2   . VAL A 1 133 ? -7.354  -23.381 8.120   1.00 7.07  ? 133 VAL A CG2   1 
ATOM   1387 H H     . VAL A 1 133 ? -9.146  -21.482 6.986   1.00 9.14  ? 133 VAL A H     1 
ATOM   1388 H HA    . VAL A 1 133 ? -10.462 -23.832 6.950   1.00 8.41  ? 133 VAL A HA    1 
ATOM   1389 H HB    . VAL A 1 133 ? -8.677  -24.895 8.162   1.00 10.03 ? 133 VAL A HB    1 
ATOM   1390 H HG11  . VAL A 1 133 ? -7.362  -25.390 6.340   1.00 12.10 ? 133 VAL A HG11  1 
ATOM   1391 H HG12  . VAL A 1 133 ? -8.884  -25.326 5.889   1.00 12.10 ? 133 VAL A HG12  1 
ATOM   1392 H HG13  . VAL A 1 133 ? -7.911  -24.110 5.576   1.00 12.10 ? 133 VAL A HG13  1 
ATOM   1393 H HG21  . VAL A 1 133 ? -6.536  -23.896 8.038   1.00 8.53  ? 133 VAL A HG21  1 
ATOM   1394 H HG22  . VAL A 1 133 ? -7.269  -22.546 7.633   1.00 8.53  ? 133 VAL A HG22  1 
ATOM   1395 H HG23  . VAL A 1 133 ? -7.540  -23.202 9.055   1.00 8.53  ? 133 VAL A HG23  1 
ATOM   1396 N N     . ALA A 1 134 ? -11.161 -23.730 9.320   1.00 8.47  ? 134 ALA A N     1 
ATOM   1397 C CA    . ALA A 1 134 ? -11.661 -23.456 10.660  1.00 7.98  ? 134 ALA A CA    1 
ATOM   1398 C C     . ALA A 1 134 ? -12.080 -24.756 11.324  1.00 9.33  ? 134 ALA A C     1 
ATOM   1399 O O     . ALA A 1 134 ? -12.782 -25.563 10.711  1.00 11.48 ? 134 ALA A O     1 
ATOM   1400 C CB    . ALA A 1 134 ? -12.856 -22.501 10.646  1.00 10.75 ? 134 ALA A CB    1 
ATOM   1401 H H     . ALA A 1 134 ? -11.473 -24.443 8.953   1.00 10.20 ? 134 ALA A H     1 
ATOM   1402 H HA    . ALA A 1 134 ? -10.940 -23.054 11.169  1.00 9.61  ? 134 ALA A HA    1 
ATOM   1403 H HB1   . ALA A 1 134 ? -13.236 -22.458 11.538  1.00 12.94 ? 134 ALA A HB1   1 
ATOM   1404 H HB2   . ALA A 1 134 ? -12.554 -21.621 10.372  1.00 12.94 ? 134 ALA A HB2   1 
ATOM   1405 H HB3   . ALA A 1 134 ? -13.519 -22.832 10.020  1.00 12.94 ? 134 ALA A HB3   1 
ATOM   1406 N N     . THR A 1 135 ? -11.669 -24.919 12.572  1.00 9.10  ? 135 THR A N     1 
ATOM   1407 C CA    . THR A 1 135 ? -12.204 -25.994 13.403  1.00 8.41  ? 135 THR A CA    1 
ATOM   1408 C C     . THR A 1 135 ? -13.568 -25.575 13.930  1.00 12.27 ? 135 THR A C     1 
ATOM   1409 O O     . THR A 1 135 ? -13.753 -24.443 14.376  1.00 12.50 ? 135 THR A O     1 
ATOM   1410 C CB    . THR A 1 135 ? -11.250 -26.284 14.556  1.00 12.18 ? 135 THR A CB    1 
ATOM   1411 O OG1   . THR A 1 135 ? -9.938  -26.573 14.047  1.00 10.38 ? 135 THR A OG1   1 
ATOM   1412 C CG2   . THR A 1 135 ? -11.714 -27.500 15.354  1.00 13.87 ? 135 THR A CG2   1 
ATOM   1413 H H     . THR A 1 135 ? -11.084 -24.425 12.963  1.00 10.96 ? 135 THR A H     1 
ATOM   1414 H HA    . THR A 1 135 ? -12.303 -26.813 12.892  1.00 10.13 ? 135 THR A HA    1 
ATOM   1415 H HB    . THR A 1 135 ? -11.225 -25.506 15.135  1.00 14.65 ? 135 THR A HB    1 
ATOM   1416 H HG1   . THR A 1 135 ? -9.370  -26.505 14.663  1.00 12.49 ? 135 THR A HG1   1 
ATOM   1417 H HG21  . THR A 1 135 ? -10.993 -27.821 15.918  1.00 16.68 ? 135 THR A HG21  1 
ATOM   1418 H HG22  . THR A 1 135 ? -12.468 -27.261 15.914  1.00 16.68 ? 135 THR A HG22  1 
ATOM   1419 H HG23  . THR A 1 135 ? -11.982 -28.210 14.751  1.00 16.68 ? 135 THR A HG23  1 
ATOM   1420 N N     . GLU A 1 136 ? -14.530 -26.496 13.885  1.00 9.42  ? 136 GLU A N     1 
ATOM   1421 C CA    . GLU A 1 136 ? -15.851 -26.196 14.414  1.00 10.41 ? 136 GLU A CA    1 
ATOM   1422 C C     . GLU A 1 136 ? -15.753 -25.755 15.869  1.00 11.35 ? 136 GLU A C     1 
ATOM   1423 O O     . GLU A 1 136 ? -15.057 -26.373 16.676  1.00 12.61 ? 136 GLU A O     1 
ATOM   1424 C CB    . GLU A 1 136 ? -16.774 -27.414 14.289  1.00 14.60 ? 136 GLU A CB    1 
ATOM   1425 C CG    . GLU A 1 136 ? -18.240 -26.976 14.389  1.00 22.22 ? 136 GLU A CG    1 
ATOM   1426 C CD    . GLU A 1 136 ? -19.249 -28.061 14.106  1.00 32.59 ? 136 GLU A CD    1 
ATOM   1427 O OE1   . GLU A 1 136 ? -18.965 -28.928 13.245  1.00 30.40 ? 136 GLU A OE1   1 
ATOM   1428 O OE2   . GLU A 1 136 ? -20.312 -28.057 14.767  1.00 35.24 ? 136 GLU A OE2   1 
ATOM   1429 H H     . GLU A 1 136 ? -14.443 -27.287 13.557  1.00 11.34 ? 136 GLU A H     1 
ATOM   1430 H HA    . GLU A 1 136 ? -16.240 -25.473 13.898  1.00 12.53 ? 136 GLU A HA    1 
ATOM   1431 H HB2   . GLU A 1 136 ? -16.635 -27.842 13.430  1.00 17.56 ? 136 GLU A HB2   1 
ATOM   1432 H HB3   . GLU A 1 136 ? -16.586 -28.040 15.006  1.00 17.56 ? 136 GLU A HB3   1 
ATOM   1433 H HG2   . GLU A 1 136 ? -18.404 -26.654 15.290  1.00 26.70 ? 136 GLU A HG2   1 
ATOM   1434 H HG3   . GLU A 1 136 ? -18.393 -26.263 13.749  1.00 26.70 ? 136 GLU A HG3   1 
ATOM   1435 N N     . GLY A 1 137 ? -16.428 -24.642 16.189  1.00 17.26 ? 137 GLY A N     1 
ATOM   1436 C CA    . GLY A 1 137 ? -16.346 -24.039 17.500  1.00 14.59 ? 137 GLY A CA    1 
ATOM   1437 C C     . GLY A 1 137 ? -15.449 -22.820 17.583  1.00 18.98 ? 137 GLY A C     1 
ATOM   1438 O O     . GLY A 1 137 ? -15.496 -22.098 18.590  1.00 19.20 ? 137 GLY A O     1 
ATOM   1439 H H     . GLY A 1 137 ? -16.945 -24.220 15.647  1.00 20.75 ? 137 GLY A H     1 
ATOM   1440 H HA2   . GLY A 1 137 ? -17.236 -23.770 17.776  1.00 17.55 ? 137 GLY A HA2   1 
ATOM   1441 H HA3   . GLY A 1 137 ? -16.007 -24.698 18.126  1.00 17.55 ? 137 GLY A HA3   1 
ATOM   1442 N N     . ALA A 1 138 ? -14.610 -22.599 16.574  1.00 12.56 ? 138 ALA A N     1 
ATOM   1443 C CA    . ALA A 1 138 ? -13.751 -21.427 16.565  1.00 13.62 ? 138 ALA A CA    1 
ATOM   1444 C C     . ALA A 1 138 ? -14.585 -20.157 16.556  1.00 12.78 ? 138 ALA A C     1 
ATOM   1445 O O     . ALA A 1 138 ? -15.718 -20.126 16.064  1.00 14.26 ? 138 ALA A O     1 
ATOM   1446 C CB    . ALA A 1 138 ? -12.829 -21.449 15.342  1.00 12.90 ? 138 ALA A CB    1 
ATOM   1447 H H     . ALA A 1 138 ? -14.521 -23.111 15.889  1.00 15.11 ? 138 ALA A H     1 
ATOM   1448 H HA    . ALA A 1 138 ? -13.199 -21.428 17.362  1.00 16.39 ? 138 ALA A HA    1 
ATOM   1449 H HB1   . ALA A 1 138 ? -12.222 -20.694 15.391  1.00 15.51 ? 138 ALA A HB1   1 
ATOM   1450 H HB2   . ALA A 1 138 ? -12.326 -22.278 15.341  1.00 15.51 ? 138 ALA A HB2   1 
ATOM   1451 H HB3   . ALA A 1 138 ? -13.368 -21.388 14.538  1.00 15.51 ? 138 ALA A HB3   1 
ATOM   1452 N N     . LEU A 1 139 ? -14.005 -19.100 17.103  1.00 11.80 ? 139 LEU A N     1 
ATOM   1453 C CA    . LEU A 1 139 ? -14.645 -17.792 17.131  1.00 13.41 ? 139 LEU A CA    1 
ATOM   1454 C C     . LEU A 1 139 ? -14.128 -16.972 15.961  1.00 12.24 ? 139 LEU A C     1 
ATOM   1455 O O     . LEU A 1 139 ? -12.921 -16.910 15.722  1.00 11.33 ? 139 LEU A O     1 
ATOM   1456 C CB    . LEU A 1 139 ? -14.388 -17.086 18.456  1.00 14.32 ? 139 LEU A CB    1 
ATOM   1457 C CG    . LEU A 1 139 ? -15.078 -17.816 19.633  1.00 23.37 ? 139 LEU A CG    1 
ATOM   1458 C CD1   . LEU A 1 139 ? -15.046 -17.005 20.928  1.00 34.82 ? 139 LEU A CD1   1 
ATOM   1459 C CD2   . LEU A 1 139 ? -16.540 -18.202 19.307  1.00 33.00 ? 139 LEU A CD2   1 
ATOM   1460 H H     . LEU A 1 139 ? -13.228 -19.114 17.470  1.00 14.19 ? 139 LEU A H     1 
ATOM   1461 H HA    . LEU A 1 139 ? -15.606 -17.886 17.038  1.00 16.13 ? 139 LEU A HA    1 
ATOM   1462 H HB2   . LEU A 1 139 ? -13.434 -17.064 18.626  1.00 17.22 ? 139 LEU A HB2   1 
ATOM   1463 H HB3   . LEU A 1 139 ? -14.738 -16.182 18.409  1.00 17.22 ? 139 LEU A HB3   1 
ATOM   1464 H HG    . LEU A 1 139 ? -14.568 -18.629 19.774  1.00 28.08 ? 139 LEU A HG    1 
ATOM   1465 H HD11  . LEU A 1 139 ? -15.493 -17.508 21.626  1.00 41.83 ? 139 LEU A HD11  1 
ATOM   1466 H HD12  . LEU A 1 139 ? -14.122 -16.843 21.176  1.00 41.83 ? 139 LEU A HD12  1 
ATOM   1467 H HD13  . LEU A 1 139 ? -15.502 -16.161 20.784  1.00 41.83 ? 139 LEU A HD13  1 
ATOM   1468 H HD21  . LEU A 1 139 ? -16.955 -18.568 20.104  1.00 39.64 ? 139 LEU A HD21  1 
ATOM   1469 H HD22  . LEU A 1 139 ? -17.019 -17.410 19.018  1.00 39.64 ? 139 LEU A HD22  1 
ATOM   1470 H HD23  . LEU A 1 139 ? -16.541 -18.866 18.600  1.00 39.64 ? 139 LEU A HD23  1 
ATOM   1471 N N     . ASN A 1 140 ? -15.050 -16.370 15.218  1.00 13.24 ? 140 ASN A N     1 
ATOM   1472 C CA    . ASN A 1 140 ? -14.723 -15.616 14.006  1.00 13.80 ? 140 ASN A CA    1 
ATOM   1473 C C     . ASN A 1 140 ? -14.328 -14.184 14.374  1.00 18.07 ? 140 ASN A C     1 
ATOM   1474 O O     . ASN A 1 140 ? -15.054 -13.215 14.134  1.00 20.45 ? 140 ASN A O     1 
ATOM   1475 C CB    . ASN A 1 140 ? -15.905 -15.651 13.050  1.00 13.25 ? 140 ASN A CB    1 
ATOM   1476 C CG    . ASN A 1 140 ? -15.550 -15.148 11.672  1.00 18.32 ? 140 ASN A CG    1 
ATOM   1477 O OD1   . ASN A 1 140 ? -14.418 -14.730 11.438  1.00 18.60 ? 140 ASN A OD1   1 
ATOM   1478 N ND2   . ASN A 1 140 ? -16.512 -15.171 10.750  1.00 20.65 ? 140 ASN A ND2   1 
ATOM   1479 H H     . ASN A 1 140 ? -15.891 -16.382 15.397  1.00 15.93 ? 140 ASN A H     1 
ATOM   1480 H HA    . ASN A 1 140 ? -13.957 -16.025 13.573  1.00 16.60 ? 140 ASN A HA    1 
ATOM   1481 H HB2   . ASN A 1 140 ? -16.217 -16.565 12.965  1.00 15.94 ? 140 ASN A HB2   1 
ATOM   1482 H HB3   . ASN A 1 140 ? -16.613 -15.089 13.402  1.00 15.94 ? 140 ASN A HB3   1 
ATOM   1483 H HD21  . ASN A 1 140 ? -16.350 -14.893 9.952   1.00 24.82 ? 140 ASN A HD21  1 
ATOM   1484 H HD22  . ASN A 1 140 ? -17.295 -15.465 10.952  1.00 24.82 ? 140 ASN A HD22  1 
ATOM   1485 N N     . THR A 1 141 ? -13.124 -14.061 14.935  1.00 14.06 ? 141 THR A N     1 
ATOM   1486 C CA    . THR A 1 141 ? -12.555 -12.818 15.447  1.00 14.86 ? 141 THR A CA    1 
ATOM   1487 C C     . THR A 1 141 ? -11.051 -12.830 15.200  1.00 13.57 ? 141 THR A C     1 
ATOM   1488 O O     . THR A 1 141 ? -10.454 -13.909 15.139  1.00 12.82 ? 141 THR A O     1 
ATOM   1489 C CB    . THR A 1 141 ? -12.818 -12.655 16.949  1.00 15.61 ? 141 THR A CB    1 
ATOM   1490 O OG1   . THR A 1 141 ? -12.191 -13.734 17.667  1.00 17.62 ? 141 THR A OG1   1 
ATOM   1491 C CG2   . THR A 1 141 ? -14.324 -12.646 17.225  1.00 19.89 ? 141 THR A CG2   1 
ATOM   1492 H H     . THR A 1 141 ? -12.586 -14.725 15.036  1.00 16.91 ? 141 THR A H     1 
ATOM   1493 H HA    . THR A 1 141 ? -12.947 -12.067 14.973  1.00 17.87 ? 141 THR A HA    1 
ATOM   1494 H HB    . THR A 1 141 ? -12.450 -11.814 17.261  1.00 18.78 ? 141 THR A HB    1 
ATOM   1495 H HG1   . THR A 1 141 ? -11.459 -13.478 17.988  1.00 21.18 ? 141 THR A HG1   1 
ATOM   1496 H HG21  . THR A 1 141 ? -14.495 -12.332 18.127  1.00 23.91 ? 141 THR A HG21  1 
ATOM   1497 H HG22  . THR A 1 141 ? -14.773 -12.059 16.597  1.00 23.91 ? 141 THR A HG22  1 
ATOM   1498 H HG23  . THR A 1 141 ? -14.684 -13.542 17.131  1.00 23.91 ? 141 THR A HG23  1 
ATOM   1499 N N     . PRO A 1 142 ? -10.408 -11.670 15.063  1.00 13.97 ? 142 PRO A N     1 
ATOM   1500 C CA    . PRO A 1 142 ? -8.975  -11.673 14.745  1.00 14.74 ? 142 PRO A CA    1 
ATOM   1501 C C     . PRO A 1 142 ? -8.146  -12.168 15.910  1.00 17.47 ? 142 PRO A C     1 
ATOM   1502 O O     . PRO A 1 142 ? -8.473  -11.932 17.074  1.00 16.60 ? 142 PRO A O     1 
ATOM   1503 C CB    . PRO A 1 142 ? -8.678  -10.205 14.424  1.00 17.68 ? 142 PRO A CB    1 
ATOM   1504 C CG    . PRO A 1 142 ? -9.750  -9.444  15.095  1.00 27.66 ? 142 PRO A CG    1 
ATOM   1505 C CD    . PRO A 1 142 ? -10.966 -10.306 15.065  1.00 23.47 ? 142 PRO A CD    1 
ATOM   1506 H HA    . PRO A 1 142 ? -8.794  -12.219 13.964  1.00 17.72 ? 142 PRO A HA    1 
ATOM   1507 H HB2   . PRO A 1 142 ? -7.807  -9.960  14.774  1.00 21.25 ? 142 PRO A HB2   1 
ATOM   1508 H HB3   . PRO A 1 142 ? -8.701  -10.065 13.464  1.00 21.25 ? 142 PRO A HB3   1 
ATOM   1509 H HG2   . PRO A 1 142 ? -9.489  -9.255  16.010  1.00 33.22 ? 142 PRO A HG2   1 
ATOM   1510 H HG3   . PRO A 1 142 ? -9.907  -8.615  14.616  1.00 33.22 ? 142 PRO A HG3   1 
ATOM   1511 H HD2   . PRO A 1 142 ? -11.515 -10.158 15.850  1.00 28.21 ? 142 PRO A HD2   1 
ATOM   1512 H HD3   . PRO A 1 142 ? -11.485 -10.144 14.262  1.00 28.21 ? 142 PRO A HD3   1 
ATOM   1513 N N     . LYS A 1 143 ? -7.060  -12.869 15.591  1.00 13.99 ? 143 LYS A N     1 
ATOM   1514 C CA    . LYS A 1 143 ? -6.239  -13.492 16.631  1.00 13.29 ? 143 LYS A CA    1 
ATOM   1515 C C     . LYS A 1 143 ? -4.981  -12.665 16.915  1.00 18.30 ? 143 LYS A C     1 
ATOM   1516 O O     . LYS A 1 143 ? -3.849  -13.147 16.890  1.00 15.96 ? 143 LYS A O     1 
ATOM   1517 C CB    . LYS A 1 143 ? -5.903  -14.926 16.234  1.00 11.27 ? 143 LYS A CB    1 
ATOM   1518 C CG    . LYS A 1 143 ? -7.136  -15.785 15.854  1.00 9.59  ? 143 LYS A CG    1 
ATOM   1519 C CD    . LYS A 1 143 ? -8.244  -15.781 16.889  1.00 12.00 ? 143 LYS A CD    1 
ATOM   1520 C CE    . LYS A 1 143 ? -9.503  -16.458 16.384  1.00 10.08 ? 143 LYS A CE    1 
ATOM   1521 N NZ    . LYS A 1 143 ? -10.658 -16.189 17.292  1.00 13.58 ? 143 LYS A NZ    1 
ATOM   1522 H H     . LYS A 1 143 ? -6.780  -12.997 14.788  1.00 16.82 ? 143 LYS A H     1 
ATOM   1523 H HA    . LYS A 1 143 ? -6.750  -13.519 17.455  1.00 15.99 ? 143 LYS A HA    1 
ATOM   1524 H HB2   . LYS A 1 143 ? -5.311  -14.905 15.466  1.00 13.56 ? 143 LYS A HB2   1 
ATOM   1525 H HB3   . LYS A 1 143 ? -5.461  -15.360 16.982  1.00 13.56 ? 143 LYS A HB3   1 
ATOM   1526 H HG2   . LYS A 1 143 ? -7.509  -15.444 15.026  1.00 11.55 ? 143 LYS A HG2   1 
ATOM   1527 H HG3   . LYS A 1 143 ? -6.850  -16.704 15.736  1.00 11.55 ? 143 LYS A HG3   1 
ATOM   1528 H HD2   . LYS A 1 143 ? -7.942  -16.255 17.680  1.00 14.44 ? 143 LYS A HD2   1 
ATOM   1529 H HD3   . LYS A 1 143 ? -8.464  -14.864 17.116  1.00 14.44 ? 143 LYS A HD3   1 
ATOM   1530 H HE2   . LYS A 1 143 ? -9.720  -16.119 15.502  1.00 12.13 ? 143 LYS A HE2   1 
ATOM   1531 H HE3   . LYS A 1 143 ? -9.360  -17.417 16.345  1.00 12.13 ? 143 LYS A HE3   1 
ATOM   1532 H HZ1   . LYS A 1 143 ? -11.424 -16.329 16.860  1.00 16.34 ? 143 LYS A HZ1   1 
ATOM   1533 H HZ2   . LYS A 1 143 ? -10.623 -16.728 17.999  1.00 16.34 ? 143 LYS A HZ2   1 
ATOM   1534 H HZ3   . LYS A 1 143 ? -10.635 -15.344 17.572  1.00 16.34 ? 143 LYS A HZ3   1 
ATOM   1535 N N     . ASP A 1 144 ? -5.206  -11.386 17.244  1.00 18.31 ? 144 ASP A N     1 
ATOM   1536 C CA    . ASP A 1 144 ? -4.092  -10.478 17.524  1.00 22.94 ? 144 ASP A CA    1 
ATOM   1537 C C     . ASP A 1 144 ? -3.249  -10.955 18.695  1.00 21.36 ? 144 ASP A C     1 
ATOM   1538 O O     . ASP A 1 144 ? -2.062  -10.619 18.775  1.00 23.95 ? 144 ASP A O     1 
ATOM   1539 C CB    . ASP A 1 144 ? -4.602  -9.071  17.849  1.00 32.15 ? 144 ASP A CB    1 
ATOM   1540 C CG    . ASP A 1 144 ? -5.801  -8.673  17.026  1.00 32.03 ? 144 ASP A CG    1 
ATOM   1541 O OD1   . ASP A 1 144 ? -5.616  -8.326  15.838  1.00 49.48 ? 144 ASP A OD1   1 
ATOM   1542 O OD2   . ASP A 1 144 ? -6.926  -8.705  17.570  1.00 50.65 ? 144 ASP A OD2   1 
ATOM   1543 H H     . ASP A 1 144 ? -5.984  -11.026 17.312  1.00 22.01 ? 144 ASP A H     1 
ATOM   1544 H HA    . ASP A 1 144 ? -3.545  -10.441 16.723  1.00 27.56 ? 144 ASP A HA    1 
ATOM   1545 H HB2   . ASP A 1 144 ? -4.857  -9.038  18.784  1.00 38.61 ? 144 ASP A HB2   1 
ATOM   1546 H HB3   . ASP A 1 144 ? -3.894  -8.432  17.675  1.00 38.61 ? 144 ASP A HB3   1 
ATOM   1547 N N     . HIS A 1 145 ? -3.846  -11.699 19.629  1.00 21.94 ? 145 HIS A N     1 
ATOM   1548 C CA    . HIS A 1 145 ? -3.120  -12.187 20.798  1.00 23.13 ? 145 HIS A CA    1 
ATOM   1549 C C     . HIS A 1 145 ? -2.130  -13.292 20.462  1.00 27.31 ? 145 HIS A C     1 
ATOM   1550 O O     . HIS A 1 145 ? -1.302  -13.642 21.310  1.00 23.48 ? 145 HIS A O     1 
ATOM   1551 C CB    . HIS A 1 145 ? -4.100  -12.673 21.871  1.00 26.15 ? 145 HIS A CB    1 
ATOM   1552 C CG    . HIS A 1 145 ? -5.031  -13.751 21.410  1.00 21.33 ? 145 HIS A CG    1 
ATOM   1553 N ND1   . HIS A 1 145 ? -6.172  -13.488 20.684  1.00 25.89 ? 145 HIS A ND1   1 
ATOM   1554 C CD2   . HIS A 1 145 ? -4.998  -15.090 21.592  1.00 22.12 ? 145 HIS A CD2   1 
ATOM   1555 C CE1   . HIS A 1 145 ? -6.797  -14.623 20.429  1.00 25.13 ? 145 HIS A CE1   1 
ATOM   1556 N NE2   . HIS A 1 145 ? -6.102  -15.611 20.966  1.00 24.93 ? 145 HIS A NE2   1 
ATOM   1557 H H     . HIS A 1 145 ? -4.673  -11.935 19.607  1.00 26.36 ? 145 HIS A H     1 
ATOM   1558 H HA    . HIS A 1 145 ? -2.617  -11.447 21.175  1.00 27.79 ? 145 HIS A HA    1 
ATOM   1559 H HB2   . HIS A 1 145 ? -3.592  -13.023 22.619  1.00 31.41 ? 145 HIS A HB2   1 
ATOM   1560 H HB3   . HIS A 1 145 ? -4.640  -11.921 22.160  1.00 31.41 ? 145 HIS A HB3   1 
ATOM   1561 H HD2   . HIS A 1 145 ? -4.348  -15.569 22.054  1.00 26.58 ? 145 HIS A HD2   1 
ATOM   1562 H HE1   . HIS A 1 145 ? -7.590  -14.713 19.952  1.00 30.19 ? 145 HIS A HE1   1 
ATOM   1563 H HE2   . HIS A 1 145 ? -6.309  -16.445 20.929  1.00 29.96 ? 145 HIS A HE2   1 
ATOM   1564 N N     . ILE A 1 146 ? -2.190  -13.843 19.256  1.00 14.25 ? 146 ILE A N     1 
ATOM   1565 C CA    . ILE A 1 146 ? -1.209  -14.803 18.770  1.00 12.82 ? 146 ILE A CA    1 
ATOM   1566 C C     . ILE A 1 146 ? -0.282  -14.149 17.762  1.00 14.93 ? 146 ILE A C     1 
ATOM   1567 O O     . ILE A 1 146 ? 0.941   -14.329 17.806  1.00 15.00 ? 146 ILE A O     1 
ATOM   1568 C CB    . ILE A 1 146 ? -1.915  -16.027 18.142  1.00 13.15 ? 146 ILE A CB    1 
ATOM   1569 C CG1   . ILE A 1 146 ? -2.812  -16.712 19.182  1.00 19.26 ? 146 ILE A CG1   1 
ATOM   1570 C CG2   . ILE A 1 146 ? -0.897  -17.001 17.526  1.00 13.30 ? 146 ILE A CG2   1 
ATOM   1571 C CD1   . ILE A 1 146 ? -3.707  -17.820 18.598  1.00 15.40 ? 146 ILE A CD1   1 
ATOM   1572 H H     . ILE A 1 146 ? -2.809  -13.670 18.685  1.00 17.13 ? 146 ILE A H     1 
ATOM   1573 H HA    . ILE A 1 146 ? -0.675  -15.116 19.516  1.00 15.42 ? 146 ILE A HA    1 
ATOM   1574 H HB    . ILE A 1 146 ? -2.482  -15.717 17.418  1.00 15.82 ? 146 ILE A HB    1 
ATOM   1575 H HG12  . ILE A 1 146 ? -2.249  -17.114 19.862  1.00 23.15 ? 146 ILE A HG12  1 
ATOM   1576 H HG13  . ILE A 1 146 ? -3.391  -16.045 19.582  1.00 23.15 ? 146 ILE A HG13  1 
ATOM   1577 H HG21  . ILE A 1 146 ? -1.285  -17.889 17.501  1.00 16.00 ? 146 ILE A HG21  1 
ATOM   1578 H HG22  . ILE A 1 146 ? -0.683  -16.708 16.627  1.00 16.00 ? 146 ILE A HG22  1 
ATOM   1579 H HG23  . ILE A 1 146 ? -0.095  -17.006 18.072  1.00 16.00 ? 146 ILE A HG23  1 
ATOM   1580 H HD11  . ILE A 1 146 ? -4.617  -17.686 18.905  1.00 18.52 ? 146 ILE A HD11  1 
ATOM   1581 H HD12  . ILE A 1 146 ? -3.675  -17.774 17.629  1.00 18.52 ? 146 ILE A HD12  1 
ATOM   1582 H HD13  . ILE A 1 146 ? -3.380  -18.682 18.899  1.00 18.52 ? 146 ILE A HD13  1 
ATOM   1583 N N     . GLY A 1 147 ? -0.860  -13.399 16.826  1.00 13.43 ? 147 GLY A N     1 
ATOM   1584 C CA    . GLY A 1 147 ? -0.074  -12.655 15.884  1.00 11.58 ? 147 GLY A CA    1 
ATOM   1585 C C     . GLY A 1 147 ? 0.804   -13.541 15.041  1.00 12.24 ? 147 GLY A C     1 
ATOM   1586 O O     . GLY A 1 147 ? 0.493   -14.709 14.772  1.00 10.01 ? 147 GLY A O     1 
ATOM   1587 H H     . GLY A 1 147 ? -1.710  -13.311 16.724  1.00 16.15 ? 147 GLY A H     1 
ATOM   1588 H HA2   . GLY A 1 147 ? -0.664  -12.159 15.295  1.00 13.93 ? 147 GLY A HA2   1 
ATOM   1589 H HA3   . GLY A 1 147 ? 0.492   -12.029 16.363  1.00 13.93 ? 147 GLY A HA3   1 
ATOM   1590 N N     . THR A 1 148 ? 1.933   -12.973 14.607  1.00 10.60 ? 148 THR A N     1 
ATOM   1591 C CA    . THR A 1 148 ? 2.894   -13.642 13.746  1.00 9.68  ? 148 THR A CA    1 
ATOM   1592 C C     . THR A 1 148 ? 4.279   -13.648 14.399  1.00 8.69  ? 148 THR A C     1 
ATOM   1593 O O     . THR A 1 148 ? 4.490   -13.096 15.492  1.00 12.57 ? 148 THR A O     1 
ATOM   1594 C CB    . THR A 1 148 ? 2.943   -12.978 12.368  1.00 12.13 ? 148 THR A CB    1 
ATOM   1595 O OG1   . THR A 1 148 ? 2.782   -11.571 12.534  1.00 15.34 ? 148 THR A OG1   1 
ATOM   1596 C CG2   . THR A 1 148 ? 1.833   -13.494 11.484  1.00 13.92 ? 148 THR A CG2   1 
ATOM   1597 H H     . THR A 1 148 ? 2.167   -12.170 14.810  1.00 12.75 ? 148 THR A H     1 
ATOM   1598 H HA    . THR A 1 148 ? 2.616   -14.565 13.634  1.00 11.66 ? 148 THR A HA    1 
ATOM   1599 H HB    . THR A 1 148 ? 3.791   -13.177 11.940  1.00 14.60 ? 148 THR A HB    1 
ATOM   1600 H HG1   . THR A 1 148 ? 2.751   -11.195 11.783  1.00 18.44 ? 148 THR A HG1   1 
ATOM   1601 H HG21  . THR A 1 148 ? 1.801   -12.982 10.660  1.00 16.75 ? 148 THR A HG21  1 
ATOM   1602 H HG22  . THR A 1 148 ? 1.987   -14.427 11.268  1.00 16.75 ? 148 THR A HG22  1 
ATOM   1603 H HG23  . THR A 1 148 ? 0.981   -13.412 11.939  1.00 16.75 ? 148 THR A HG23  1 
ATOM   1604 N N     . ARG A 1 149 ? 5.206   -14.270 13.693  1.00 10.78 ? 149 ARG A N     1 
ATOM   1605 C CA    . ARG A 1 149 ? 6.514   -14.664 14.206  1.00 10.29 ? 149 ARG A CA    1 
ATOM   1606 C C     . ARG A 1 149 ? 7.612   -13.754 13.669  1.00 15.15 ? 149 ARG A C     1 
ATOM   1607 O O     . ARG A 1 149 ? 7.628   -13.418 12.484  1.00 12.32 ? 149 ARG A O     1 
ATOM   1608 C CB    . ARG A 1 149 ? 6.794   -16.111 13.793  1.00 10.84 ? 149 ARG A CB    1 
ATOM   1609 C CG    . ARG A 1 149 ? 8.162   -16.640 14.199  1.00 12.33 ? 149 ARG A CG    1 
ATOM   1610 C CD    . ARG A 1 149 ? 8.287   -18.126 13.913  1.00 9.86  ? 149 ARG A CD    1 
ATOM   1611 N NE    . ARG A 1 149 ? 8.255   -18.447 12.494  1.00 8.84  ? 149 ARG A NE    1 
ATOM   1612 C CZ    . ARG A 1 149 ? 9.320   -18.578 11.718  1.00 11.16 ? 149 ARG A CZ    1 
ATOM   1613 N NH1   . ARG A 1 149 ? 10.548  -18.456 12.204  1.00 13.23 ? 149 ARG A NH1   1 
ATOM   1614 N NH2   . ARG A 1 149 ? 9.157   -18.866 10.427  1.00 14.38 ? 149 ARG A NH2   1 
ATOM   1615 H H     . ARG A 1 149 ? 5.099   -14.488 12.868  1.00 12.97 ? 149 ARG A H     1 
ATOM   1616 H HA    . ARG A 1 149 ? 6.529   -14.582 15.172  1.00 12.38 ? 149 ARG A HA    1 
ATOM   1617 H HB2   . ARG A 1 149 ? 6.126   -16.682 14.205  1.00 13.05 ? 149 ARG A HB2   1 
ATOM   1618 H HB3   . ARG A 1 149 ? 6.733   -16.172 12.827  1.00 13.05 ? 149 ARG A HB3   1 
ATOM   1619 H HG2   . ARG A 1 149 ? 8.849   -16.174 13.698  1.00 14.84 ? 149 ARG A HG2   1 
ATOM   1620 H HG3   . ARG A 1 149 ? 8.292   -16.501 15.150  1.00 14.84 ? 149 ARG A HG3   1 
ATOM   1621 H HD2   . ARG A 1 149 ? 9.130   -18.444 14.270  1.00 11.87 ? 149 ARG A HD2   1 
ATOM   1622 H HD3   . ARG A 1 149 ? 7.549   -18.590 14.339  1.00 11.87 ? 149 ARG A HD3   1 
ATOM   1623 H HE    . ARG A 1 149 ? 7.483   -18.562 12.130  1.00 10.65 ? 149 ARG A HE    1 
ATOM   1624 H HH11  . ARG A 1 149 ? 10.665  -18.289 13.039  1.00 15.91 ? 149 ARG A HH11  1 
ATOM   1625 H HH12  . ARG A 1 149 ? 11.228  -18.544 11.684  1.00 15.91 ? 149 ARG A HH12  1 
ATOM   1626 H HH21  . ARG A 1 149 ? 8.366   -18.966 10.106  1.00 17.30 ? 149 ARG A HH21  1 
ATOM   1627 H HH22  . ARG A 1 149 ? 9.843   -18.952 9.916   1.00 17.30 ? 149 ARG A HH22  1 
ATOM   1628 N N     . ASN A 1 150 ? 8.575   -13.423 14.535  1.00 12.42 ? 150 ASN A N     1 
ATOM   1629 C CA    . ASN A 1 150 ? 9.827   -12.793 14.120  1.00 13.02 ? 150 ASN A CA    1 
ATOM   1630 C C     . ASN A 1 150 ? 10.881  -13.882 14.001  1.00 13.95 ? 150 ASN A C     1 
ATOM   1631 O O     . ASN A 1 150 ? 11.313  -14.409 15.034  1.00 13.45 ? 150 ASN A O     1 
ATOM   1632 C CB    . ASN A 1 150 ? 10.254  -11.750 15.144  1.00 13.78 ? 150 ASN A CB    1 
ATOM   1633 C CG    . ASN A 1 150 ? 11.559  -11.068 14.778  1.00 16.51 ? 150 ASN A CG    1 
ATOM   1634 O OD1   . ASN A 1 150 ? 12.336  -11.557 13.952  1.00 16.90 ? 150 ASN A OD1   1 
ATOM   1635 N ND2   . ASN A 1 150 ? 11.788  -9.921  15.385  1.00 24.88 ? 150 ASN A ND2   1 
ATOM   1636 H H     . ASN A 1 150 ? 8.525   -13.556 15.383  1.00 14.94 ? 150 ASN A H     1 
ATOM   1637 H HA    . ASN A 1 150 ? 9.718   -12.356 13.261  1.00 15.66 ? 150 ASN A HA    1 
ATOM   1638 H HB2   . ASN A 1 150 ? 9.567   -11.069 15.207  1.00 16.57 ? 150 ASN A HB2   1 
ATOM   1639 H HB3   . ASN A 1 150 ? 10.373  -12.182 16.005  1.00 16.57 ? 150 ASN A HB3   1 
ATOM   1640 H HD21  . ASN A 1 150 ? 12.510  -9.484  15.221  1.00 29.89 ? 150 ASN A HD21  1 
ATOM   1641 H HD22  . ASN A 1 150 ? 11.215  -9.609  15.946  1.00 29.89 ? 150 ASN A HD22  1 
ATOM   1642 N N     . PRO A 1 151 ? 11.313  -14.279 12.801  1.00 12.84 ? 151 PRO A N     1 
ATOM   1643 C CA    . PRO A 1 151 ? 12.244  -15.410 12.693  1.00 12.35 ? 151 PRO A CA    1 
ATOM   1644 C C     . PRO A 1 151 ? 13.581  -15.181 13.373  1.00 14.64 ? 151 PRO A C     1 
ATOM   1645 O O     . PRO A 1 151 ? 14.292  -16.162 13.622  1.00 16.69 ? 151 PRO A O     1 
ATOM   1646 C CB    . PRO A 1 151 ? 12.421  -15.581 11.180  1.00 18.15 ? 151 PRO A CB    1 
ATOM   1647 C CG    . PRO A 1 151 ? 11.209  -14.981 10.594  1.00 14.97 ? 151 PRO A CG    1 
ATOM   1648 C CD    . PRO A 1 151 ? 10.866  -13.828 11.471  1.00 13.90 ? 151 PRO A CD    1 
ATOM   1649 H HA    . PRO A 1 151 ? 11.830  -16.205 13.065  1.00 14.86 ? 151 PRO A HA    1 
ATOM   1650 H HB2   . PRO A 1 151 ? 13.218  -15.115 10.884  1.00 21.82 ? 151 PRO A HB2   1 
ATOM   1651 H HB3   . PRO A 1 151 ? 12.486  -16.523 10.957  1.00 21.82 ? 151 PRO A HB3   1 
ATOM   1652 H HG2   . PRO A 1 151 ? 11.394  -14.683 9.690   1.00 18.00 ? 151 PRO A HG2   1 
ATOM   1653 H HG3   . PRO A 1 151 ? 10.491  -15.633 10.588  1.00 18.00 ? 151 PRO A HG3   1 
ATOM   1654 H HD2   . PRO A 1 151 ? 11.345  -13.030 11.197  1.00 16.71 ? 151 PRO A HD2   1 
ATOM   1655 H HD3   . PRO A 1 151 ? 9.911   -13.660 11.465  1.00 16.71 ? 151 PRO A HD3   1 
ATOM   1656 N N     . ALA A 1 152 ? 13.957  -13.932 13.632  1.00 16.05 ? 152 ALA A N     1 
ATOM   1657 C CA    . ALA A 1 152 ? 15.212  -13.684 14.331  1.00 26.34 ? 152 ALA A CA    1 
ATOM   1658 C C     . ALA A 1 152 ? 15.123  -14.119 15.784  1.00 24.70 ? 152 ALA A C     1 
ATOM   1659 O O     . ALA A 1 152 ? 16.147  -14.444 16.398  1.00 27.10 ? 152 ALA A O     1 
ATOM   1660 C CB    . ALA A 1 152 ? 15.579  -12.201 14.245  1.00 28.64 ? 152 ALA A CB    1 
ATOM   1661 H H     . ALA A 1 152 ? 13.514  -13.226 13.419  1.00 19.30 ? 152 ALA A H     1 
ATOM   1662 H HA    . ALA A 1 152 ? 15.918  -14.191 13.901  1.00 31.65 ? 152 ALA A HA    1 
ATOM   1663 H HB1   . ALA A 1 152 ? 16.471  -12.076 14.603  1.00 34.41 ? 152 ALA A HB1   1 
ATOM   1664 H HB2   . ALA A 1 152 ? 15.553  -11.923 13.316  1.00 34.41 ? 152 ALA A HB2   1 
ATOM   1665 H HB3   . ALA A 1 152 ? 14.939  -11.688 14.762  1.00 34.41 ? 152 ALA A HB3   1 
ATOM   1666 N N     . ASN A 1 153 ? 13.916  -14.134 16.345  1.00 17.77 ? 153 ASN A N     1 
ATOM   1667 C CA    . ASN A 1 153 ? 13.724  -14.428 17.755  1.00 16.61 ? 153 ASN A CA    1 
ATOM   1668 C C     . ASN A 1 153 ? 13.132  -15.800 18.007  1.00 17.93 ? 153 ASN A C     1 
ATOM   1669 O O     . ASN A 1 153 ? 13.351  -16.348 19.083  1.00 17.45 ? 153 ASN A O     1 
ATOM   1670 C CB    . ASN A 1 153 ? 12.809  -13.389 18.412  1.00 21.87 ? 153 ASN A CB    1 
ATOM   1671 C CG    . ASN A 1 153 ? 13.434  -12.021 18.482  1.00 32.31 ? 153 ASN A CG    1 
ATOM   1672 O OD1   . ASN A 1 153 ? 14.643  -11.886 18.648  1.00 39.01 ? 153 ASN A OD1   1 
ATOM   1673 N ND2   . ASN A 1 153 ? 12.607  -10.993 18.368  1.00 38.28 ? 153 ASN A ND2   1 
ATOM   1674 H H     . ASN A 1 153 ? 13.185  -13.975 15.921  1.00 21.36 ? 153 ASN A H     1 
ATOM   1675 H HA    . ASN A 1 153 ? 14.587  -14.377 18.194  1.00 19.97 ? 153 ASN A HA    1 
ATOM   1676 H HB2   . ASN A 1 153 ? 11.990  -13.318 17.896  1.00 26.29 ? 153 ASN A HB2   1 
ATOM   1677 H HB3   . ASN A 1 153 ? 12.607  -13.673 19.317  1.00 26.29 ? 153 ASN A HB3   1 
ATOM   1678 H HD21  . ASN A 1 153 ? 11.765  -11.129 18.260  1.00 45.97 ? 153 ASN A HD21  1 
ATOM   1679 H HD22  . ASN A 1 153 ? 12.912  -10.190 18.401  1.00 45.97 ? 153 ASN A HD22  1 
ATOM   1680 N N     . ASN A 1 154 ? 12.394  -16.365 17.047  1.00 14.41 ? 154 ASN A N     1 
ATOM   1681 C CA    . ASN A 1 154 ? 11.675  -17.623 17.251  1.00 12.61 ? 154 ASN A CA    1 
ATOM   1682 C C     . ASN A 1 154 ? 11.744  -18.497 16.016  1.00 12.06 ? 154 ASN A C     1 
ATOM   1683 O O     . ASN A 1 154 ? 11.479  -18.035 14.898  1.00 12.11 ? 154 ASN A O     1 
ATOM   1684 C CB    . ASN A 1 154 ? 10.187  -17.397 17.569  1.00 12.87 ? 154 ASN A CB    1 
ATOM   1685 C CG    . ASN A 1 154 ? 9.947   -16.710 18.869  1.00 15.84 ? 154 ASN A CG    1 
ATOM   1686 O OD1   . ASN A 1 154 ? 9.725   -15.513 18.922  1.00 22.79 ? 154 ASN A OD1   1 
ATOM   1687 N ND2   . ASN A 1 154 ? 9.954   -17.474 19.941  1.00 24.97 ? 154 ASN A ND2   1 
ATOM   1688 H H     . ASN A 1 154 ? 12.293  -16.033 16.260  1.00 17.33 ? 154 ASN A H     1 
ATOM   1689 H HA    . ASN A 1 154 ? 12.113  -18.074 17.989  1.00 15.17 ? 154 ASN A HA    1 
ATOM   1690 H HB2   . ASN A 1 154 ? 9.797   -16.850 16.869  1.00 15.48 ? 154 ASN A HB2   1 
ATOM   1691 H HB3   . ASN A 1 154 ? 9.741   -18.258 17.604  1.00 15.48 ? 154 ASN A HB3   1 
ATOM   1692 H HD21  . ASN A 1 154 ? 9.821   -17.128 20.717  1.00 30.00 ? 154 ASN A HD21  1 
ATOM   1693 H HD22  . ASN A 1 154 ? 10.093  -18.319 19.865  1.00 30.00 ? 154 ASN A HD22  1 
ATOM   1694 N N     . ALA A 1 155 ? 12.046  -19.772 16.221  1.00 12.68 ? 155 ALA A N     1 
ATOM   1695 C CA    . ALA A 1 155 ? 11.960  -20.749 15.152  1.00 11.76 ? 155 ALA A CA    1 
ATOM   1696 C C     . ALA A 1 155 ? 10.502  -21.098 14.857  1.00 11.51 ? 155 ALA A C     1 
ATOM   1697 O O     . ALA A 1 155 ? 9.630   -21.012 15.731  1.00 13.18 ? 155 ALA A O     1 
ATOM   1698 C CB    . ALA A 1 155 ? 12.709  -22.017 15.536  1.00 16.70 ? 155 ALA A CB    1 
ATOM   1699 H H     . ALA A 1 155 ? 12.306  -20.097 16.974  1.00 15.25 ? 155 ALA A H     1 
ATOM   1700 H HA    . ALA A 1 155 ? 12.360  -20.380 14.349  1.00 14.16 ? 155 ALA A HA    1 
ATOM   1701 H HB1   . ALA A 1 155 ? 12.603  -22.672 14.828  1.00 20.08 ? 155 ALA A HB1   1 
ATOM   1702 H HB2   . ALA A 1 155 ? 13.648  -21.805 15.653  1.00 20.08 ? 155 ALA A HB2   1 
ATOM   1703 H HB3   . ALA A 1 155 ? 12.342  -22.362 16.364  1.00 20.08 ? 155 ALA A HB3   1 
ATOM   1704 N N     . ALA A 1 156 ? 10.259  -21.527 13.627  1.00 14.78 ? 156 ALA A N     1 
ATOM   1705 C CA    . ALA A 1 156 ? 8.948   -22.046 13.269  1.00 12.87 ? 156 ALA A CA    1 
ATOM   1706 C C     . ALA A 1 156 ? 8.683   -23.365 13.980  1.00 15.99 ? 156 ALA A C     1 
ATOM   1707 O O     . ALA A 1 156 ? 9.602   -24.154 14.230  1.00 16.16 ? 156 ALA A O     1 
ATOM   1708 C CB    . ALA A 1 156 ? 8.837   -22.266 11.765  1.00 13.26 ? 156 ALA A CB    1 
ATOM   1709 H H     . ALA A 1 156 ? 10.832  -21.529 12.985  1.00 17.78 ? 156 ALA A H     1 
ATOM   1710 H HA    . ALA A 1 156 ? 8.275   -21.399 13.533  1.00 15.48 ? 156 ALA A HA    1 
ATOM   1711 H HB1   . ALA A 1 156 ? 8.015   -22.744 11.576  1.00 15.95 ? 156 ALA A HB1   1 
ATOM   1712 H HB2   . ALA A 1 156 ? 8.829   -21.404 11.320  1.00 15.95 ? 156 ALA A HB2   1 
ATOM   1713 H HB3   . ALA A 1 156 ? 9.599   -22.786 11.465  1.00 15.95 ? 156 ALA A HB3   1 
ATOM   1714 N N     . ILE A 1 157 ? 7.410   -23.571 14.318  1.00 13.46 ? 157 ILE A N     1 
ATOM   1715 C CA    . ILE A 1 157 ? 6.854   -24.856 14.737  1.00 14.75 ? 157 ILE A CA    1 
ATOM   1716 C C     . ILE A 1 157 ? 6.636   -25.753 13.523  1.00 11.48 ? 157 ILE A C     1 
ATOM   1717 O O     . ILE A 1 157 ? 6.043   -25.334 12.521  1.00 11.77 ? 157 ILE A O     1 
ATOM   1718 C CB    . ILE A 1 157 ? 5.512   -24.629 15.465  1.00 13.54 ? 157 ILE A CB    1 
ATOM   1719 C CG1   . ILE A 1 157 ? 5.688   -23.703 16.663  1.00 23.01 ? 157 ILE A CG1   1 
ATOM   1720 C CG2   . ILE A 1 157 ? 4.869   -25.954 15.822  1.00 17.78 ? 157 ILE A CG2   1 
ATOM   1721 C CD1   . ILE A 1 157 ? 6.687   -24.201 17.659  1.00 25.23 ? 157 ILE A CD1   1 
ATOM   1722 H H     . ILE A 1 157 ? 6.816   -22.949 14.311  1.00 16.19 ? 157 ILE A H     1 
ATOM   1723 H HA    . ILE A 1 157 ? 7.488   -25.292 15.328  1.00 17.74 ? 157 ILE A HA    1 
ATOM   1724 H HB    . ILE A 1 157 ? 4.903   -24.176 14.862  1.00 16.29 ? 157 ILE A HB    1 
ATOM   1725 H HG12  . ILE A 1 157 ? 5.989   -22.836 16.348  1.00 27.65 ? 157 ILE A HG12  1 
ATOM   1726 H HG13  . ILE A 1 157 ? 4.835   -23.613 17.117  1.00 27.65 ? 157 ILE A HG13  1 
ATOM   1727 H HG21  . ILE A 1 157 ? 4.087   -25.787 16.372  1.00 21.37 ? 157 ILE A HG21  1 
ATOM   1728 H HG22  . ILE A 1 157 ? 4.609   -26.409 15.006  1.00 21.37 ? 157 ILE A HG22  1 
ATOM   1729 H HG23  . ILE A 1 157 ? 5.509   -26.494 16.312  1.00 21.37 ? 157 ILE A HG23  1 
ATOM   1730 H HD11  . ILE A 1 157 ? 6.729   -23.579 18.402  1.00 30.31 ? 157 ILE A HD11  1 
ATOM   1731 H HD12  . ILE A 1 157 ? 6.409   -25.075 17.974  1.00 30.31 ? 157 ILE A HD12  1 
ATOM   1732 H HD13  . ILE A 1 157 ? 7.555   -24.264 17.230  1.00 30.31 ? 157 ILE A HD13  1 
ATOM   1733 N N     . VAL A 1 158 ? 7.033   -27.028 13.625  1.00 12.78 ? 158 VAL A N     1 
ATOM   1734 C CA    . VAL A 1 158 ? 6.738   -27.947 12.536  1.00 12.20 ? 158 VAL A CA    1 
ATOM   1735 C C     . VAL A 1 158 ? 5.228   -28.056 12.395  1.00 14.62 ? 158 VAL A C     1 
ATOM   1736 O O     . VAL A 1 158 ? 4.516   -28.324 13.369  1.00 15.60 ? 158 VAL A O     1 
ATOM   1737 C CB    . VAL A 1 158 ? 7.357   -29.329 12.791  1.00 18.23 ? 158 VAL A CB    1 
ATOM   1738 C CG1   . VAL A 1 158 ? 6.890   -30.290 11.738  1.00 17.50 ? 158 VAL A CG1   1 
ATOM   1739 C CG2   . VAL A 1 158 ? 8.871   -29.239 12.802  1.00 25.73 ? 158 VAL A CG2   1 
ATOM   1740 H H     . VAL A 1 158 ? 7.458   -27.367 14.291  1.00 15.37 ? 158 VAL A H     1 
ATOM   1741 H HA    . VAL A 1 158 ? 7.123   -27.595 11.718  1.00 14.68 ? 158 VAL A HA    1 
ATOM   1742 H HB    . VAL A 1 158 ? 7.074   -29.657 13.659  1.00 21.91 ? 158 VAL A HB    1 
ATOM   1743 H HG11  . VAL A 1 158 ? 7.516   -31.029 11.686  1.00 21.04 ? 158 VAL A HG11  1 
ATOM   1744 H HG12  . VAL A 1 158 ? 6.010   -30.618 11.978  1.00 21.04 ? 158 VAL A HG12  1 
ATOM   1745 H HG13  . VAL A 1 158 ? 6.850   -29.829 10.885  1.00 21.04 ? 158 VAL A HG13  1 
ATOM   1746 H HG21  . VAL A 1 158 ? 9.241   -30.133 12.735  1.00 30.92 ? 158 VAL A HG21  1 
ATOM   1747 H HG22  . VAL A 1 158 ? 9.161   -28.703 12.048  1.00 30.92 ? 158 VAL A HG22  1 
ATOM   1748 H HG23  . VAL A 1 158 ? 9.156   -28.824 13.631  1.00 30.92 ? 158 VAL A HG23  1 
ATOM   1749 N N     . LEU A 1 159 ? 4.727   -27.837 11.188  1.00 14.81 ? 159 LEU A N     1 
ATOM   1750 C CA    . LEU A 1 159 ? 3.288   -27.907 10.985  1.00 11.41 ? 159 LEU A CA    1 
ATOM   1751 C C     . LEU A 1 159 ? 2.819   -29.359 11.071  1.00 11.78 ? 159 LEU A C     1 
ATOM   1752 O O     . LEU A 1 159 ? 3.207   -30.203 10.253  1.00 13.41 ? 159 LEU A O     1 
ATOM   1753 C CB    . LEU A 1 159 ? 2.926   -27.294 9.648   1.00 8.99  ? 159 LEU A CB    1 
ATOM   1754 C CG    . LEU A 1 159 ? 1.430   -26.963 9.493   1.00 9.98  ? 159 LEU A CG    1 
ATOM   1755 C CD1   . LEU A 1 159 ? 1.178   -25.901 8.467   1.00 15.81 ? 159 LEU A CD1   1 
ATOM   1756 C CD2   . LEU A 1 159 ? 0.576   -28.194 9.222   1.00 17.23 ? 159 LEU A CD2   1 
ATOM   1757 H H     . LEU A 1 159 ? 5.188   -27.651 10.486  1.00 17.81 ? 159 LEU A H     1 
ATOM   1758 H HA    . LEU A 1 159 ? 2.835   -27.405 11.680  1.00 13.73 ? 159 LEU A HA    1 
ATOM   1759 H HB2   . LEU A 1 159 ? 3.424   -26.469 9.540   1.00 10.82 ? 159 LEU A HB2   1 
ATOM   1760 H HB3   . LEU A 1 159 ? 3.164   -27.920 8.945   1.00 10.82 ? 159 LEU A HB3   1 
ATOM   1761 H HG    . LEU A 1 159 ? 1.145   -26.606 10.349  1.00 12.02 ? 159 LEU A HG    1 
ATOM   1762 H HD11  . LEU A 1 159 ? 0.241   -25.654 8.491   1.00 19.02 ? 159 LEU A HD11  1 
ATOM   1763 H HD12  . LEU A 1 159 ? 1.729   -25.129 8.670   1.00 19.02 ? 159 LEU A HD12  1 
ATOM   1764 H HD13  . LEU A 1 159 ? 1.406   -26.248 7.590   1.00 19.02 ? 159 LEU A HD13  1 
ATOM   1765 H HD21  . LEU A 1 159 ? -0.203  -27.931 8.707   1.00 20.71 ? 159 LEU A HD21  1 
ATOM   1766 H HD22  . LEU A 1 159 ? 1.101   -28.839 8.722   1.00 20.71 ? 159 LEU A HD22  1 
ATOM   1767 H HD23  . LEU A 1 159 ? 0.299   -28.578 10.068  1.00 20.71 ? 159 LEU A HD23  1 
ATOM   1768 N N     . GLN A 1 160 ? 1.957   -29.635 12.055  1.00 10.44 ? 160 GLN A N     1 
ATOM   1769 C CA    . GLN A 1 160 ? 1.393   -30.954 12.304  1.00 11.29 ? 160 GLN A CA    1 
ATOM   1770 C C     . GLN A 1 160 ? -0.110  -30.846 12.135  1.00 8.91  ? 160 GLN A C     1 
ATOM   1771 O O     . GLN A 1 160 ? -0.701  -29.856 12.572  1.00 12.28 ? 160 GLN A O     1 
ATOM   1772 C CB    . GLN A 1 160 ? 1.691   -31.422 13.732  1.00 16.53 ? 160 GLN A CB    1 
ATOM   1773 C CG    . GLN A 1 160 ? 3.169   -31.579 14.053  1.00 22.35 ? 160 GLN A CG    1 
ATOM   1774 C CD    . GLN A 1 160 ? 3.457   -31.551 15.541  1.00 38.63 ? 160 GLN A CD    1 
ATOM   1775 O OE1   . GLN A 1 160 ? 2.711   -30.960 16.336  1.00 28.44 ? 160 GLN A OE1   1 
ATOM   1776 N NE2   . GLN A 1 160 ? 4.566   -32.173 15.927  1.00 35.45 ? 160 GLN A NE2   1 
ATOM   1777 H H     . GLN A 1 160 ? 1.674   -29.044 12.613  1.00 12.56 ? 160 GLN A H     1 
ATOM   1778 H HA    . GLN A 1 160 ? 1.763   -31.604 11.685  1.00 13.59 ? 160 GLN A HA    1 
ATOM   1779 H HB2   . GLN A 1 160 ? 1.324   -30.773 14.352  1.00 19.88 ? 160 GLN A HB2   1 
ATOM   1780 H HB3   . GLN A 1 160 ? 1.269   -32.285 13.867  1.00 19.88 ? 160 GLN A HB3   1 
ATOM   1781 H HG2   . GLN A 1 160 ? 3.479   -32.430 13.705  1.00 26.86 ? 160 GLN A HG2   1 
ATOM   1782 H HG3   . GLN A 1 160 ? 3.661   -30.852 13.640  1.00 26.86 ? 160 GLN A HG3   1 
ATOM   1783 H HE21  . GLN A 1 160 ? 5.069   -32.557 15.344  1.00 42.57 ? 160 GLN A HE21  1 
ATOM   1784 H HE22  . GLN A 1 160 ? 4.782   -32.191 16.759  1.00 42.57 ? 160 GLN A HE22  1 
ATOM   1785 N N     . LEU A 1 161 ? -0.716  -31.868 11.541  1.00 9.19  ? 161 LEU A N     1 
ATOM   1786 C CA    . LEU A 1 161 ? -2.161  -31.956 11.405  1.00 8.83  ? 161 LEU A CA    1 
ATOM   1787 C C     . LEU A 1 161 ? -2.687  -33.152 12.187  1.00 10.96 ? 161 LEU A C     1 
ATOM   1788 O O     . LEU A 1 161 ? -1.962  -34.141 12.359  1.00 12.22 ? 161 LEU A O     1 
ATOM   1789 C CB    . LEU A 1 161 ? -2.569  -32.088 9.937   1.00 8.27  ? 161 LEU A CB    1 
ATOM   1790 C CG    . LEU A 1 161 ? -2.251  -30.828 9.137   1.00 14.15 ? 161 LEU A CG    1 
ATOM   1791 C CD1   . LEU A 1 161 ? -2.244  -31.108 7.665   1.00 16.84 ? 161 LEU A CD1   1 
ATOM   1792 C CD2   . LEU A 1 161 ? -3.246  -29.707 9.462   1.00 11.37 ? 161 LEU A CD2   1 
ATOM   1793 H H     . LEU A 1 161 ? -0.300  -32.539 11.201  1.00 11.07 ? 161 LEU A H     1 
ATOM   1794 H HA    . LEU A 1 161 ? -2.573  -31.153 11.760  1.00 10.63 ? 161 LEU A HA    1 
ATOM   1795 H HB2   . LEU A 1 161 ? -2.087  -32.830 9.539   1.00 9.96  ? 161 LEU A HB2   1 
ATOM   1796 H HB3   . LEU A 1 161 ? -3.524  -32.247 9.886   1.00 9.96  ? 161 LEU A HB3   1 
ATOM   1797 H HG    . LEU A 1 161 ? -1.363  -30.526 9.386   1.00 17.02 ? 161 LEU A HG    1 
ATOM   1798 H HD11  . LEU A 1 161 ? -1.958  -30.310 7.193   1.00 20.25 ? 161 LEU A HD11  1 
ATOM   1799 H HD12  . LEU A 1 161 ? -1.629  -31.837 7.486   1.00 20.25 ? 161 LEU A HD12  1 
ATOM   1800 H HD13  . LEU A 1 161 ? -3.139  -31.355 7.386   1.00 20.25 ? 161 LEU A HD13  1 
ATOM   1801 H HD21  . LEU A 1 161 ? -3.288  -29.094 8.711   1.00 13.68 ? 161 LEU A HD21  1 
ATOM   1802 H HD22  . LEU A 1 161 ? -4.120  -30.097 9.620   1.00 13.68 ? 161 LEU A HD22  1 
ATOM   1803 H HD23  . LEU A 1 161 ? -2.945  -29.238 10.256  1.00 13.68 ? 161 LEU A HD23  1 
ATOM   1804 N N     . PRO A 1 162 ? -3.929  -33.079 12.673  1.00 8.73  ? 162 PRO A N     1 
ATOM   1805 C CA    . PRO A 1 162 ? -4.516  -34.209 13.397  1.00 10.78 ? 162 PRO A CA    1 
ATOM   1806 C C     . PRO A 1 162 ? -4.452  -35.471 12.567  1.00 11.37 ? 162 PRO A C     1 
ATOM   1807 O O     . PRO A 1 162 ? -4.694  -35.456 11.362  1.00 12.13 ? 162 PRO A O     1 
ATOM   1808 C CB    . PRO A 1 162 ? -5.965  -33.768 13.617  1.00 15.19 ? 162 PRO A CB    1 
ATOM   1809 C CG    . PRO A 1 162 ? -5.924  -32.344 13.615  1.00 15.25 ? 162 PRO A CG    1 
ATOM   1810 C CD    . PRO A 1 162 ? -4.836  -31.924 12.658  1.00 9.00  ? 162 PRO A CD    1 
ATOM   1811 H HA    . PRO A 1 162 ? -4.074  -34.343 14.250  1.00 12.97 ? 162 PRO A HA    1 
ATOM   1812 H HB2   . PRO A 1 162 ? -6.524  -34.101 12.898  1.00 18.27 ? 162 PRO A HB2   1 
ATOM   1813 H HB3   . PRO A 1 162 ? -6.286  -34.104 14.469  1.00 18.27 ? 162 PRO A HB3   1 
ATOM   1814 H HG2   . PRO A 1 162 ? -6.782  -31.999 13.322  1.00 18.34 ? 162 PRO A HG2   1 
ATOM   1815 H HG3   . PRO A 1 162 ? -5.727  -32.027 14.510  1.00 18.34 ? 162 PRO A HG3   1 
ATOM   1816 H HD2   . PRO A 1 162 ? -5.194  -31.775 11.769  1.00 10.84 ? 162 PRO A HD2   1 
ATOM   1817 H HD3   . PRO A 1 162 ? -4.386  -31.124 12.973  1.00 10.84 ? 162 PRO A HD3   1 
ATOM   1818 N N     . GLN A 1 163 ? -4.180  -36.590 13.234  1.00 15.14 ? 163 GLN A N     1 
ATOM   1819 C CA    . GLN A 1 163 ? -4.199  -37.865 12.540  1.00 13.30 ? 163 GLN A CA    1 
ATOM   1820 C C     . GLN A 1 163 ? -5.556  -38.073 11.903  1.00 13.07 ? 163 GLN A C     1 
ATOM   1821 O O     . GLN A 1 163 ? -6.593  -37.898 12.555  1.00 15.89 ? 163 GLN A O     1 
ATOM   1822 C CB    . GLN A 1 163 ? -3.893  -39.013 13.503  1.00 19.81 ? 163 GLN A CB    1 
ATOM   1823 C CG    . GLN A 1 163 ? -2.658  -38.770 14.360  1.00 41.71 ? 163 GLN A CG    1 
ATOM   1824 C CD    . GLN A 1 163 ? -1.777  -39.994 14.515  1.00 57.95 ? 163 GLN A CD    1 
ATOM   1825 O OE1   . GLN A 1 163 ? -2.260  -41.102 14.769  1.00 53.63 ? 163 GLN A OE1   1 
ATOM   1826 N NE2   . GLN A 1 163 ? -0.467  -39.798 14.356  1.00 48.18 ? 163 GLN A NE2   1 
ATOM   1827 H H     . GLN A 1 163 ? -3.986  -36.633 14.071  1.00 18.21 ? 163 GLN A H     1 
ATOM   1828 H HA    . GLN A 1 163 ? -3.515  -37.868 11.853  1.00 16.00 ? 163 GLN A HA    1 
ATOM   1829 H HB2   . GLN A 1 163 ? -4.649  -39.133 14.098  1.00 23.81 ? 163 GLN A HB2   1 
ATOM   1830 H HB3   . GLN A 1 163 ? -3.744  -39.822 12.989  1.00 23.81 ? 163 GLN A HB3   1 
ATOM   1831 H HG2   . GLN A 1 163 ? -2.125  -38.071 13.950  1.00 50.09 ? 163 GLN A HG2   1 
ATOM   1832 H HG3   . GLN A 1 163 ? -2.941  -38.494 15.246  1.00 50.09 ? 163 GLN A HG3   1 
ATOM   1833 H HE21  . GLN A 1 163 ? -0.169  -39.011 14.176  1.00 57.85 ? 163 GLN A HE21  1 
ATOM   1834 H HE22  . GLN A 1 163 ? 0.079   -40.457 14.433  1.00 57.85 ? 163 GLN A HE22  1 
ATOM   1835 N N     . GLY A 1 164 ? -5.549  -38.463 10.638  1.00 13.74 ? 164 GLY A N     1 
ATOM   1836 C CA    . GLY A 1 164 ? -6.766  -38.642 9.893   1.00 13.63 ? 164 GLY A CA    1 
ATOM   1837 C C     . GLY A 1 164 ? -7.111  -37.507 8.967   1.00 12.50 ? 164 GLY A C     1 
ATOM   1838 O O     . GLY A 1 164 ? -8.090  -37.615 8.231   1.00 14.74 ? 164 GLY A O     1 
ATOM   1839 H H     . GLY A 1 164 ? -4.836  -38.631 10.188  1.00 16.53 ? 164 GLY A H     1 
ATOM   1840 H HA2   . GLY A 1 164 ? -6.687  -39.447 9.358   1.00 16.39 ? 164 GLY A HA2   1 
ATOM   1841 H HA3   . GLY A 1 164 ? -7.500  -38.748 10.518  1.00 16.39 ? 164 GLY A HA3   1 
ATOM   1842 N N     . THR A 1 165 ? -6.351  -36.413 9.006   1.00 10.83 ? 165 THR A N     1 
ATOM   1843 C CA    . THR A 1 165 ? -6.617  -35.278 8.132   1.00 10.10 ? 165 THR A CA    1 
ATOM   1844 C C     . THR A 1 165 ? -6.421  -35.680 6.678   1.00 10.92 ? 165 THR A C     1 
ATOM   1845 O O     . THR A 1 165 ? -5.462  -36.380 6.340   1.00 15.90 ? 165 THR A O     1 
ATOM   1846 C CB    . THR A 1 165 ? -5.702  -34.101 8.504   1.00 7.40  ? 165 THR A CB    1 
ATOM   1847 O OG1   . THR A 1 165 ? -5.980  -33.653 9.828   1.00 10.90 ? 165 THR A OG1   1 
ATOM   1848 C CG2   . THR A 1 165 ? -5.886  -32.903 7.558   1.00 11.17 ? 165 THR A CG2   1 
ATOM   1849 H H     . THR A 1 165 ? -5.678  -36.305 9.530   1.00 13.03 ? 165 THR A H     1 
ATOM   1850 H HA    . THR A 1 165 ? -7.535  -34.983 8.240   1.00 12.16 ? 165 THR A HA    1 
ATOM   1851 H HB    . THR A 1 165 ? -4.787  -34.416 8.435   1.00 8.91  ? 165 THR A HB    1 
ATOM   1852 H HG1   . THR A 1 165 ? -5.262  -33.485 10.231  1.00 13.11 ? 165 THR A HG1   1 
ATOM   1853 H HG21  . THR A 1 165 ? -5.431  -32.124 7.917   1.00 13.45 ? 165 THR A HG21  1 
ATOM   1854 H HG22  . THR A 1 165 ? -5.515  -33.109 6.686   1.00 13.45 ? 165 THR A HG22  1 
ATOM   1855 H HG23  . THR A 1 165 ? -6.829  -32.699 7.459   1.00 13.45 ? 165 THR A HG23  1 
ATOM   1856 N N     . THR A 1 166 ? -7.348  -35.240 5.831   1.00 11.96 ? 166 THR A N     1 
ATOM   1857 C CA    . THR A 1 166 ? -7.295  -35.444 4.391   1.00 11.66 ? 166 THR A CA    1 
ATOM   1858 C C     . THR A 1 166 ? -6.364  -34.412 3.780   1.00 14.25 ? 166 THR A C     1 
ATOM   1859 O O     . THR A 1 166 ? -6.483  -33.222 4.075   1.00 15.88 ? 166 THR A O     1 
ATOM   1860 C CB    . THR A 1 166 ? -8.686  -35.274 3.780   1.00 17.04 ? 166 THR A CB    1 
ATOM   1861 O OG1   . THR A 1 166 ? -9.635  -36.099 4.474   1.00 23.47 ? 166 THR A OG1   1 
ATOM   1862 C CG2   . THR A 1 166 ? -8.681  -35.631 2.294   1.00 25.21 ? 166 THR A CG2   1 
ATOM   1863 H H     . THR A 1 166 ? -8.045  -34.801 6.077   1.00 14.39 ? 166 THR A H     1 
ATOM   1864 H HA    . THR A 1 166 ? -6.973  -36.338 4.200   1.00 14.03 ? 166 THR A HA    1 
ATOM   1865 H HB    . THR A 1 166 ? -8.955  -34.346 3.863   1.00 20.48 ? 166 THR A HB    1 
ATOM   1866 H HG1   . THR A 1 166 ? -10.416 -35.842 4.304   1.00 28.20 ? 166 THR A HG1   1 
ATOM   1867 H HG21  . THR A 1 166 ? -9.566  -35.913 2.017   1.00 30.29 ? 166 THR A HG21  1 
ATOM   1868 H HG22  . THR A 1 166 ? -8.418  -34.859 1.769   1.00 30.29 ? 166 THR A HG22  1 
ATOM   1869 H HG23  . THR A 1 166 ? -8.054  -36.352 2.129   1.00 30.29 ? 166 THR A HG23  1 
ATOM   1870 N N     . LEU A 1 167 ? -5.440  -34.866 2.935   1.00 15.49 ? 167 LEU A N     1 
ATOM   1871 C CA    . LEU A 1 167 ? -4.608  -33.966 2.144   1.00 15.06 ? 167 LEU A CA    1 
ATOM   1872 C C     . LEU A 1 167 ? -4.796  -34.262 0.662   1.00 15.53 ? 167 LEU A C     1 
ATOM   1873 O O     . LEU A 1 167 ? -5.033  -35.412 0.280   1.00 17.55 ? 167 LEU A O     1 
ATOM   1874 C CB    . LEU A 1 167 ? -3.118  -34.101 2.477   1.00 16.67 ? 167 LEU A CB    1 
ATOM   1875 C CG    . LEU A 1 167 ? -2.631  -33.425 3.757   1.00 19.93 ? 167 LEU A CG    1 
ATOM   1876 C CD1   . LEU A 1 167 ? -1.237  -33.886 4.153   1.00 23.92 ? 167 LEU A CD1   1 
ATOM   1877 C CD2   . LEU A 1 167 ? -2.659  -31.915 3.597   1.00 20.90 ? 167 LEU A CD2   1 
ATOM   1878 H H     . LEU A 1 167 ? -5.276  -35.699 2.802   1.00 18.63 ? 167 LEU A H     1 
ATOM   1879 H HA    . LEU A 1 167 ? -4.872  -33.052 2.336   1.00 18.11 ? 167 LEU A HA    1 
ATOM   1880 H HB2   . LEU A 1 167 ? -2.915  -35.046 2.560   1.00 20.04 ? 167 LEU A HB2   1 
ATOM   1881 H HB3   . LEU A 1 167 ? -2.612  -33.716 1.744   1.00 20.04 ? 167 LEU A HB3   1 
ATOM   1882 H HG    . LEU A 1 167 ? -3.230  -33.680 4.476   1.00 23.95 ? 167 LEU A HG    1 
ATOM   1883 H HD11  . LEU A 1 167 ? -0.943  -33.376 4.924   1.00 28.74 ? 167 LEU A HD11  1 
ATOM   1884 H HD12  . LEU A 1 167 ? -1.266  -34.830 4.371   1.00 28.74 ? 167 LEU A HD12  1 
ATOM   1885 H HD13  . LEU A 1 167 ? -0.632  -33.737 3.409   1.00 28.74 ? 167 LEU A HD13  1 
ATOM   1886 H HD21  . LEU A 1 167 ? -2.185  -31.510 4.340   1.00 25.12 ? 167 LEU A HD21  1 
ATOM   1887 H HD22  . LEU A 1 167 ? -2.228  -31.678 2.761   1.00 25.12 ? 167 LEU A HD22  1 
ATOM   1888 H HD23  . LEU A 1 167 ? -3.582  -31.615 3.590   1.00 25.12 ? 167 LEU A HD23  1 
ATOM   1889 N N     . PRO A 1 168 ? -4.695  -33.250 -0.201  1.00 16.41 ? 168 PRO A N     1 
ATOM   1890 C CA    . PRO A 1 168 ? -4.729  -33.514 -1.644  1.00 16.52 ? 168 PRO A CA    1 
ATOM   1891 C C     . PRO A 1 168 ? -3.500  -34.300 -2.059  1.00 17.79 ? 168 PRO A C     1 
ATOM   1892 O O     . PRO A 1 168 ? -2.496  -34.335 -1.356  1.00 16.50 ? 168 PRO A O     1 
ATOM   1893 C CB    . PRO A 1 168 ? -4.718  -32.116 -2.276  1.00 19.51 ? 168 PRO A CB    1 
ATOM   1894 C CG    . PRO A 1 168 ? -5.045  -31.164 -1.154  1.00 18.43 ? 168 PRO A CG    1 
ATOM   1895 C CD    . PRO A 1 168 ? -4.577  -31.818 0.099   1.00 15.21 ? 168 PRO A CD    1 
ATOM   1896 H HA    . PRO A 1 168 ? -5.542  -33.976 -1.901  1.00 19.86 ? 168 PRO A HA    1 
ATOM   1897 H HB2   . PRO A 1 168 ? -3.840  -31.929 -2.643  1.00 23.45 ? 168 PRO A HB2   1 
ATOM   1898 H HB3   . PRO A 1 168 ? -5.388  -32.067 -2.976  1.00 23.45 ? 168 PRO A HB3   1 
ATOM   1899 H HG2   . PRO A 1 168 ? -4.581  -30.324 -1.295  1.00 22.15 ? 168 PRO A HG2   1 
ATOM   1900 H HG3   . PRO A 1 168 ? -6.003  -31.014 -1.124  1.00 22.15 ? 168 PRO A HG3   1 
ATOM   1901 H HD2   . PRO A 1 168 ? -3.656  -31.580 0.289   1.00 18.29 ? 168 PRO A HD2   1 
ATOM   1902 H HD3   . PRO A 1 168 ? -5.144  -31.575 0.848   1.00 18.29 ? 168 PRO A HD3   1 
ATOM   1903 N N     . LYS A 1 169 ? -3.577  -34.913 -3.236  1.00 19.81 ? 169 LYS A N     1 
ATOM   1904 C CA    . LYS A 1 169 ? -2.398  -35.563 -3.783  1.00 22.63 ? 169 LYS A CA    1 
ATOM   1905 C C     . LYS A 1 169 ? -1.293  -34.528 -3.953  1.00 21.64 ? 169 LYS A C     1 
ATOM   1906 O O     . LYS A 1 169 ? -1.555  -33.382 -4.331  1.00 21.54 ? 169 LYS A O     1 
ATOM   1907 C CB    . LYS A 1 169 ? -2.720  -36.229 -5.121  1.00 28.85 ? 169 LYS A CB    1 
ATOM   1908 C CG    . LYS A 1 169 ? -1.621  -37.136 -5.628  1.00 37.63 ? 169 LYS A CG    1 
ATOM   1909 H H     . LYS A 1 169 ? -4.283  -34.963 -3.725  1.00 23.81 ? 169 LYS A H     1 
ATOM   1910 H HA    . LYS A 1 169 ? -2.092  -36.262 -3.183  1.00 27.19 ? 169 LYS A HA    1 
ATOM   1911 H HB2   . LYS A 1 169 ? -3.523  -36.763 -5.019  1.00 34.66 ? 169 LYS A HB2   1 
ATOM   1912 H HB3   . LYS A 1 169 ? -2.864  -35.538 -5.787  1.00 34.66 ? 169 LYS A HB3   1 
ATOM   1913 H HG2   . LYS A 1 169 ? -1.938  -37.608 -6.415  1.00 45.20 ? 169 LYS A HG2   1 
ATOM   1914 H HG3   . LYS A 1 169 ? -0.848  -36.595 -5.852  1.00 45.20 ? 169 LYS A HG3   1 
ATOM   1915 N N     . GLY A 1 170 ? -0.062  -34.930 -3.651  1.00 19.27 ? 170 GLY A N     1 
ATOM   1916 C CA    . GLY A 1 170 ? 1.084   -34.056 -3.738  1.00 21.75 ? 170 GLY A CA    1 
ATOM   1917 C C     . GLY A 1 170 ? 1.485   -33.406 -2.434  1.00 20.05 ? 170 GLY A C     1 
ATOM   1918 O O     . GLY A 1 170 ? 2.513   -32.717 -2.397  1.00 16.50 ? 170 GLY A O     1 
ATOM   1919 H H     . GLY A 1 170 ? 0.132   -35.725 -3.387  1.00 23.16 ? 170 GLY A H     1 
ATOM   1920 H HA2   . GLY A 1 170 ? 1.842   -34.568 -4.059  1.00 26.13 ? 170 GLY A HA2   1 
ATOM   1921 H HA3   . GLY A 1 170 ? 0.888   -33.349 -4.373  1.00 26.13 ? 170 GLY A HA3   1 
ATOM   1922 N N     . PHE A 1 171 ? 0.714   -33.607 -1.363  1.00 16.84 ? 171 PHE A N     1 
ATOM   1923 C CA    . PHE A 1 171 ? 1.023   -33.071 -0.051  1.00 16.00 ? 171 PHE A CA    1 
ATOM   1924 C C     . PHE A 1 171 ? 1.220   -34.224 0.917   1.00 19.14 ? 171 PHE A C     1 
ATOM   1925 O O     . PHE A 1 171 ? 0.497   -35.228 0.852   1.00 19.51 ? 171 PHE A O     1 
ATOM   1926 C CB    . PHE A 1 171 ? -0.094  -32.179 0.480   1.00 15.21 ? 171 PHE A CB    1 
ATOM   1927 C CG    . PHE A 1 171 ? -0.266  -30.894 -0.278  1.00 12.02 ? 171 PHE A CG    1 
ATOM   1928 C CD1   . PHE A 1 171 ? 0.421   -29.759 0.103   1.00 12.42 ? 171 PHE A CD1   1 
ATOM   1929 C CD2   . PHE A 1 171 ? -1.126  -30.835 -1.365  1.00 14.30 ? 171 PHE A CD2   1 
ATOM   1930 C CE1   . PHE A 1 171 ? 0.253   -28.584 -0.573  1.00 12.40 ? 171 PHE A CE1   1 
ATOM   1931 C CE2   . PHE A 1 171 ? -1.302  -29.663 -2.052  1.00 15.56 ? 171 PHE A CE2   1 
ATOM   1932 C CZ    . PHE A 1 171 ? -0.619  -28.536 -1.656  1.00 12.44 ? 171 PHE A CZ    1 
ATOM   1933 H H     . PHE A 1 171 ? -0.014  -34.066 -1.379  1.00 20.24 ? 171 PHE A H     1 
ATOM   1934 H HA    . PHE A 1 171 ? 1.834   -32.542 -0.108  1.00 19.24 ? 171 PHE A HA    1 
ATOM   1935 H HB2   . PHE A 1 171 ? -0.931  -32.665 0.427   1.00 18.29 ? 171 PHE A HB2   1 
ATOM   1936 H HB3   . PHE A 1 171 ? 0.101   -31.952 1.403   1.00 18.29 ? 171 PHE A HB3   1 
ATOM   1937 H HD1   . PHE A 1 171 ? 1.003   -29.794 0.827   1.00 14.94 ? 171 PHE A HD1   1 
ATOM   1938 H HD2   . PHE A 1 171 ? -1.588  -31.598 -1.629  1.00 17.20 ? 171 PHE A HD2   1 
ATOM   1939 H HE1   . PHE A 1 171 ? 0.719   -27.823 -0.312  1.00 14.92 ? 171 PHE A HE1   1 
ATOM   1940 H HE2   . PHE A 1 171 ? -1.879  -29.630 -2.780  1.00 18.70 ? 171 PHE A HE2   1 
ATOM   1941 H HZ    . PHE A 1 171 ? -0.741  -27.737 -2.116  1.00 14.96 ? 171 PHE A HZ    1 
ATOM   1942 N N     . TYR A 1 172 ? 2.184   -34.055 1.818   1.00 22.31 ? 172 TYR A N     1 
ATOM   1943 C CA    . TYR A 1 172 ? 2.514   -35.047 2.833   1.00 28.26 ? 172 TYR A CA    1 
ATOM   1944 C C     . TYR A 1 172 ? 2.651   -34.357 4.185   1.00 33.43 ? 172 TYR A C     1 
ATOM   1945 O O     . TYR A 1 172 ? 3.192   -33.251 4.274   1.00 31.81 ? 172 TYR A O     1 
ATOM   1946 C CB    . TYR A 1 172 ? 3.813   -35.781 2.451   1.00 24.60 ? 172 TYR A CB    1 
ATOM   1947 C CG    . TYR A 1 172 ? 3.774   -36.320 1.035   1.00 35.65 ? 172 TYR A CG    1 
ATOM   1948 C CD1   . TYR A 1 172 ? 4.155   -35.527 -0.053  1.00 28.98 ? 172 TYR A CD1   1 
ATOM   1949 C CD2   . TYR A 1 172 ? 3.332   -37.614 0.780   1.00 39.87 ? 172 TYR A CD2   1 
ATOM   1950 C CE1   . TYR A 1 172 ? 4.104   -36.015 -1.345  1.00 33.36 ? 172 TYR A CE1   1 
ATOM   1951 C CE2   . TYR A 1 172 ? 3.281   -38.112 -0.514  1.00 47.93 ? 172 TYR A CE2   1 
ATOM   1952 C CZ    . TYR A 1 172 ? 3.664   -37.308 -1.571  1.00 44.22 ? 172 TYR A CZ    1 
ATOM   1953 O OH    . TYR A 1 172 ? 3.610   -37.814 -2.853  1.00 41.94 ? 172 TYR A OH    1 
ATOM   1954 H H     . TYR A 1 172 ? 2.675   -33.350 1.862   1.00 26.80 ? 172 TYR A H     1 
ATOM   1955 H HA    . TYR A 1 172 ? 1.807   -35.706 2.917   1.00 33.95 ? 172 TYR A HA    1 
ATOM   1956 H HB2   . TYR A 1 172 ? 4.559   -35.164 2.518   1.00 29.56 ? 172 TYR A HB2   1 
ATOM   1957 H HB3   . TYR A 1 172 ? 3.946   -36.529 3.055   1.00 29.56 ? 172 TYR A HB3   1 
ATOM   1958 H HD1   . TYR A 1 172 ? 4.447   -34.657 0.096   1.00 34.81 ? 172 TYR A HD1   1 
ATOM   1959 H HD2   . TYR A 1 172 ? 3.066   -38.155 1.489   1.00 47.88 ? 172 TYR A HD2   1 
ATOM   1960 H HE1   . TYR A 1 172 ? 4.363   -35.478 -2.059  1.00 40.07 ? 172 TYR A HE1   1 
ATOM   1961 H HE2   . TYR A 1 172 ? 2.990   -38.982 -0.670  1.00 57.55 ? 172 TYR A HE2   1 
ATOM   1962 H HH    . TYR A 1 172 ? 3.928   -37.258 -3.395  1.00 50.36 ? 172 TYR A HH    1 
ATOM   1963 N N     . ALA A 1 173 ? 2.147   -35.003 5.235   1.00 43.51 ? 173 ALA A N     1 
ATOM   1964 C CA    . ALA A 1 173 ? 2.310   -34.490 6.600   1.00 39.72 ? 173 ALA A CA    1 
ATOM   1965 C C     . ALA A 1 173 ? 2.252   -35.634 7.599   1.00 36.89 ? 173 ALA A C     1 
ATOM   1966 O O     . ALA A 1 173 ? 1.296   -36.402 7.599   1.00 45.33 ? 173 ALA A O     1 
ATOM   1967 C CB    . ALA A 1 173 ? 1.236   -33.447 6.929   1.00 42.28 ? 173 ALA A CB    1 
ATOM   1968 H H     . ALA A 1 173 ? 1.707   -35.740 5.186   1.00 52.25 ? 173 ALA A H     1 
ATOM   1969 H HA    . ALA A 1 173 ? 3.172   -34.051 6.669   1.00 47.71 ? 173 ALA A HA    1 
ATOM   1970 H HB1   . ALA A 1 173 ? 1.292   -32.723 6.286   1.00 50.78 ? 173 ALA A HB1   1 
ATOM   1971 H HB2   . ALA A 1 173 ? 0.363   -33.867 6.879   1.00 50.78 ? 173 ALA A HB2   1 
ATOM   1972 H HB3   . ALA A 1 173 ? 1.390   -33.108 7.824   1.00 50.78 ? 173 ALA A HB3   1 
ATOM   1973 P P     . DT  B 2 1   ? 8.502   -13.335 -1.020  1.00 85.11 ? -1  DT  B P     1 
ATOM   1974 O OP1   . DT  B 2 1   ? 7.141   -13.899 -0.940  1.00 52.06 ? -1  DT  B OP1   1 
ATOM   1975 O OP2   . DT  B 2 1   ? 8.693   -11.913 -1.408  1.00 80.72 ? -1  DT  B OP2   1 
ATOM   1976 O "O5'" . DT  B 2 1   ? 9.300   -13.554 0.337   1.00 63.33 ? -1  DT  B "O5'" 1 
ATOM   1977 C "C5'" . DT  B 2 1   ? 10.641  -13.052 0.469   1.00 62.09 ? -1  DT  B "C5'" 1 
ATOM   1978 C "C4'" . DT  B 2 1   ? 11.034  -12.940 1.924   1.00 67.47 ? -1  DT  B "C4'" 1 
ATOM   1979 O "O4'" . DT  B 2 1   ? 10.245  -11.910 2.567   1.00 71.75 ? -1  DT  B "O4'" 1 
ATOM   1980 C "C3'" . DT  B 2 1   ? 10.833  -14.203 2.757   1.00 48.14 ? -1  DT  B "C3'" 1 
ATOM   1981 O "O3'" . DT  B 2 1   ? 12.087  -14.869 2.890   1.00 43.11 ? -1  DT  B "O3'" 1 
ATOM   1982 C "C2'" . DT  B 2 1   ? 10.459  -13.662 4.120   1.00 51.75 ? -1  DT  B "C2'" 1 
ATOM   1983 C "C1'" . DT  B 2 1   ? 9.706   -12.386 3.793   1.00 55.93 ? -1  DT  B "C1'" 1 
ATOM   1984 N N1    . DT  B 2 1   ? 8.267   -12.581 3.595   1.00 52.10 ? -1  DT  B N1    1 
ATOM   1985 C C2    . DT  B 2 1   ? 7.537   -13.261 4.542   1.00 48.07 ? -1  DT  B C2    1 
ATOM   1986 O O2    . DT  B 2 1   ? 8.016   -13.697 5.579   1.00 35.54 ? -1  DT  B O2    1 
ATOM   1987 N N3    . DT  B 2 1   ? 6.212   -13.412 4.233   1.00 51.96 ? -1  DT  B N3    1 
ATOM   1988 C C4    . DT  B 2 1   ? 5.551   -12.945 3.115   1.00 54.76 ? -1  DT  B C4    1 
ATOM   1989 O O4    . DT  B 2 1   ? 4.349   -13.147 2.988   1.00 58.25 ? -1  DT  B O4    1 
ATOM   1990 C C5    . DT  B 2 1   ? 6.378   -12.255 2.158   1.00 55.50 ? -1  DT  B C5    1 
ATOM   1991 C C7    . DT  B 2 1   ? 5.752   -11.722 0.909   1.00 55.66 ? -1  DT  B C7    1 
ATOM   1992 C C6    . DT  B 2 1   ? 7.676   -12.103 2.445   1.00 65.39 ? -1  DT  B C6    1 
ATOM   1993 P P     . DT  B 2 2   ? 12.204  -16.457 2.807   1.00 41.82 ? 0   DT  B P     1 
ATOM   1994 O OP1   . DT  B 2 2   ? 13.642  -16.781 2.679   1.00 60.32 ? 0   DT  B OP1   1 
ATOM   1995 O OP2   . DT  B 2 2   ? 11.305  -16.964 1.752   1.00 44.66 ? 0   DT  B OP2   1 
ATOM   1996 O "O5'" . DT  B 2 2   ? 11.706  -16.969 4.245   1.00 31.07 ? 0   DT  B "O5'" 1 
ATOM   1997 C "C5'" . DT  B 2 2   ? 11.991  -16.195 5.434   1.00 18.62 ? 0   DT  B "C5'" 1 
ATOM   1998 C "C4'" . DT  B 2 2   ? 11.281  -16.801 6.636   1.00 18.84 ? 0   DT  B "C4'" 1 
ATOM   1999 O "O4'" . DT  B 2 2   ? 9.871   -16.471 6.565   1.00 19.36 ? 0   DT  B "O4'" 1 
ATOM   2000 C "C3'" . DT  B 2 2   ? 11.341  -18.328 6.719   1.00 18.00 ? 0   DT  B "C3'" 1 
ATOM   2001 O "O3'" . DT  B 2 2   ? 11.353  -18.721 8.088   1.00 17.85 ? 0   DT  B "O3'" 1 
ATOM   2002 C "C2'" . DT  B 2 2   ? 10.037  -18.770 6.022   1.00 15.60 ? 0   DT  B "C2'" 1 
ATOM   2003 C "C1'" . DT  B 2 2   ? 9.087   -17.672 6.459   1.00 13.26 ? 0   DT  B "C1'" 1 
ATOM   2004 N N1    . DT  B 2 2   ? 7.989   -17.395 5.501   1.00 11.51 ? 0   DT  B N1    1 
ATOM   2005 C C2    . DT  B 2 2   ? 6.686   -17.339 5.955   1.00 11.45 ? 0   DT  B C2    1 
ATOM   2006 O O2    . DT  B 2 2   ? 6.380   -17.502 7.119   1.00 11.29 ? 0   DT  B O2    1 
ATOM   2007 N N3    . DT  B 2 2   ? 5.768   -17.039 5.001   1.00 11.46 ? 0   DT  B N3    1 
ATOM   2008 C C4    . DT  B 2 2   ? 6.000   -16.833 3.650   1.00 15.90 ? 0   DT  B C4    1 
ATOM   2009 O O4    . DT  B 2 2   ? 5.107   -16.570 2.862   1.00 15.62 ? 0   DT  B O4    1 
ATOM   2010 C C5    . DT  B 2 2   ? 7.363   -16.914 3.237   1.00 16.27 ? 0   DT  B C5    1 
ATOM   2011 C C7    . DT  B 2 2   ? 7.717   -16.691 1.794   1.00 18.29 ? 0   DT  B C7    1 
ATOM   2012 C C6    . DT  B 2 2   ? 8.287   -17.190 4.164   1.00 13.83 ? 0   DT  B C6    1 
ATOM   2013 P P     . DT  B 2 3   ? 12.750  -19.114 8.804   1.00 20.60 ? 1   DT  B P     1 
ATOM   2014 O OP1   . DT  B 2 3   ? 12.438  -19.385 10.231  1.00 19.71 ? 1   DT  B OP1   1 
ATOM   2015 O OP2   . DT  B 2 3   ? 13.750  -18.043 8.547   1.00 22.88 ? 1   DT  B OP2   1 
ATOM   2016 O "O5'" . DT  B 2 3   ? 13.185  -20.457 8.062   1.00 23.82 ? 1   DT  B "O5'" 1 
HETATM 2017 O O     . HOH C 3 .   ? 11.786  -19.118 2.432   1.00 47.17 ? 501 HOH A O     1 
HETATM 2018 O O     . HOH C 3 .   ? 9.886   -8.617  16.988  1.00 35.42 ? 502 HOH A O     1 
HETATM 2019 O O     . HOH C 3 .   ? -14.892 -22.368 20.853  1.00 37.79 ? 503 HOH A O     1 
HETATM 2020 O O     . HOH C 3 .   ? 4.548   -31.633 5.324   1.00 35.39 ? 504 HOH A O     1 
HETATM 2021 O O     . HOH C 3 .   ? 12.094  -21.890 3.727   1.00 44.84 ? 505 HOH A O     1 
HETATM 2022 O O     . HOH C 3 .   ? -7.184  -6.806  14.813  1.00 35.85 ? 506 HOH A O     1 
HETATM 2023 O O     . HOH C 3 .   ? 10.976  -23.145 -2.326  1.00 34.27 ? 507 HOH A O     1 
HETATM 2024 O O     . HOH C 3 .   ? 7.217   -28.570 3.338   1.00 30.34 ? 508 HOH A O     1 
HETATM 2025 O O     . HOH C 3 .   ? -8.593  -8.204  10.496  1.00 32.51 ? 509 HOH A O     1 
HETATM 2026 O O     . HOH C 3 .   ? -7.093  -36.484 -0.661  1.00 35.74 ? 510 HOH A O     1 
HETATM 2027 O O     . HOH C 3 .   ? -6.716  -29.342 -4.678  1.00 28.63 ? 511 HOH A O     1 
HETATM 2028 O O     . HOH C 3 .   ? -22.316 -29.286 13.889  1.00 47.80 ? 512 HOH A O     1 
HETATM 2029 O O     . HOH C 3 .   ? 11.600  -27.270 0.929   1.00 52.03 ? 513 HOH A O     1 
HETATM 2030 O O     . HOH C 3 .   ? 18.948  -13.309 -11.282 1.00 49.43 ? 514 HOH A O     1 
HETATM 2031 O O     . HOH C 3 .   ? 9.268   -20.936 18.244  1.00 29.67 ? 515 HOH A O     1 
HETATM 2032 O O     . HOH C 3 .   ? 8.527   -13.859 17.402  1.00 17.18 ? 516 HOH A O     1 
HETATM 2033 O O     . HOH C 3 .   ? 9.819   -22.288 4.622   1.00 25.11 ? 517 HOH A O     1 
HETATM 2034 O O     . HOH C 3 .   ? 1.138   -26.209 25.440  1.00 27.67 ? 518 HOH A O     1 
HETATM 2035 O O     . HOH C 3 .   ? -8.200  -39.828 13.101  1.00 17.87 ? 519 HOH A O     1 
HETATM 2036 O O     . HOH C 3 .   ? -9.853  -16.541 19.899  1.00 17.11 ? 520 HOH A O     1 
HETATM 2037 O O     . HOH C 3 .   ? 12.677  -25.579 4.143   1.00 46.76 ? 521 HOH A O     1 
HETATM 2038 O O     . HOH C 3 .   ? -14.913 -23.284 6.921   1.00 29.99 ? 522 HOH A O     1 
HETATM 2039 O O     . HOH C 3 .   ? -2.976  -24.024 -9.453  1.00 29.06 ? 523 HOH A O     1 
HETATM 2040 O O     . HOH C 3 .   ? -9.940  -18.343 -1.392  1.00 18.59 ? 524 HOH A O     1 
HETATM 2041 O O     . HOH C 3 .   ? -2.310  -12.757 -0.823  1.00 23.13 ? 525 HOH A O     1 
HETATM 2042 O O     . HOH C 3 .   ? -7.834  -25.002 -3.354  1.00 20.00 ? 526 HOH A O     1 
HETATM 2043 O O     . HOH C 3 .   ? 12.535  -20.801 -17.374 1.00 17.97 ? 527 HOH A O     1 
HETATM 2044 O O     . HOH C 3 .   ? -1.307  -39.974 11.868  1.00 47.84 ? 528 HOH A O     1 
HETATM 2045 O O     . HOH C 3 .   ? 29.569  -9.546  13.625  1.00 33.08 ? 529 HOH A O     1 
HETATM 2046 O O     . HOH C 3 .   ? -5.414  -27.187 16.318  1.00 31.17 ? 530 HOH A O     1 
HETATM 2047 O O     . HOH C 3 .   ? -14.772 -24.936 9.092   1.00 24.89 ? 531 HOH A O     1 
HETATM 2048 O O     . HOH C 3 .   ? -1.168  -26.317 -9.085  1.00 30.32 ? 532 HOH A O     1 
HETATM 2049 O O     . HOH C 3 .   ? -13.627 -12.784 9.827   1.00 13.19 ? 533 HOH A O     1 
HETATM 2050 O O     . HOH C 3 .   ? -4.890  -21.412 -7.563  1.00 35.95 ? 534 HOH A O     1 
HETATM 2051 O O     . HOH C 3 .   ? 6.275   -28.551 7.026   1.00 25.85 ? 535 HOH A O     1 
HETATM 2052 O O     . HOH C 3 .   ? 3.947   -28.456 -7.524  1.00 29.73 ? 536 HOH A O     1 
HETATM 2053 O O     . HOH C 3 .   ? -17.607 -12.514 13.816  1.00 28.12 ? 537 HOH A O     1 
HETATM 2054 O O     . HOH C 3 .   ? -0.473  -16.153 -2.982  1.00 22.58 ? 538 HOH A O     1 
HETATM 2055 O O     . HOH C 3 .   ? 6.104   -12.649 17.576  1.00 35.45 ? 539 HOH A O     1 
HETATM 2056 O O     . HOH C 3 .   ? -0.884  -23.990 -6.379  1.00 20.24 ? 540 HOH A O     1 
HETATM 2057 O O     . HOH C 3 .   ? 4.432   -18.448 -11.004 1.00 34.02 ? 541 HOH A O     1 
HETATM 2058 O O     . HOH C 3 .   ? 2.135   -15.156 20.063  1.00 26.98 ? 542 HOH A O     1 
HETATM 2059 O O     . HOH C 3 .   ? -8.054  -27.173 15.871  1.00 21.84 ? 543 HOH A O     1 
HETATM 2060 O O     . HOH C 3 .   ? 25.659  0.668   11.535  1.00 18.60 ? 544 HOH A O     1 
HETATM 2061 O O     . HOH C 3 .   ? -4.057  -24.008 16.034  1.00 13.13 ? 545 HOH A O     1 
HETATM 2062 O O     . HOH C 3 .   ? 16.133  -2.777  14.158  1.00 24.33 ? 546 HOH A O     1 
HETATM 2063 O O     . HOH C 3 .   ? -14.251 -28.936 17.023  1.00 12.64 ? 547 HOH A O     1 
HETATM 2064 O O     . HOH C 3 .   ? 4.824   -30.566 8.102   1.00 24.08 ? 548 HOH A O     1 
HETATM 2065 O O     . HOH C 3 .   ? 1.682   -27.766 14.273  1.00 13.55 ? 549 HOH A O     1 
HETATM 2066 O O     . HOH C 3 .   ? -7.550  -31.990 1.812   1.00 15.40 ? 550 HOH A O     1 
HETATM 2067 O O     . HOH C 3 .   ? 2.836   -22.470 7.865   1.00 10.36 ? 551 HOH A O     1 
HETATM 2068 O O     . HOH C 3 .   ? 18.646  -14.240 15.305  1.00 35.00 ? 552 HOH A O     1 
HETATM 2069 O O     . HOH C 3 .   ? -16.369 -13.802 3.812   1.00 12.48 ? 553 HOH A O     1 
HETATM 2070 O O     . HOH C 3 .   ? 5.137   -29.420 15.801  1.00 28.46 ? 554 HOH A O     1 
HETATM 2071 O O     . HOH C 3 .   ? 3.811   -31.738 1.507   1.00 21.58 ? 555 HOH A O     1 
HETATM 2072 O O     . HOH C 3 .   ? -6.278  -7.851  12.880  1.00 30.33 ? 556 HOH A O     1 
HETATM 2073 O O     . HOH C 3 .   ? -0.544  -16.152 12.562  1.00 7.92  ? 557 HOH A O     1 
HETATM 2074 O O     . HOH C 3 .   ? -4.309  -24.777 25.386  1.00 42.70 ? 558 HOH A O     1 
HETATM 2075 O O     . HOH C 3 .   ? -6.996  -10.900 20.252  1.00 35.98 ? 559 HOH A O     1 
HETATM 2076 O O     . HOH C 3 .   ? -11.789 -26.047 7.550   1.00 13.45 ? 560 HOH A O     1 
HETATM 2077 O O     . HOH C 3 .   ? 8.239   -21.874 -3.149  1.00 25.76 ? 561 HOH A O     1 
HETATM 2078 O O     . HOH C 3 .   ? 0.641   -22.616 28.060  1.00 23.11 ? 562 HOH A O     1 
HETATM 2079 O O     . HOH C 3 .   ? 13.467  -10.145 11.868  1.00 21.61 ? 563 HOH A O     1 
HETATM 2080 O O     . HOH C 3 .   ? -11.379 -23.815 2.213   1.00 27.93 ? 564 HOH A O     1 
HETATM 2081 O O     . HOH C 3 .   ? 10.544  -25.656 16.357  1.00 27.92 ? 565 HOH A O     1 
HETATM 2082 O O     . HOH C 3 .   ? -9.887  -10.422 9.669   1.00 25.72 ? 566 HOH A O     1 
HETATM 2083 O O     . HOH C 3 .   ? 2.772   -21.234 -8.079  1.00 26.34 ? 567 HOH A O     1 
HETATM 2084 O O     . HOH C 3 .   ? -10.186 -10.558 18.797  1.00 36.42 ? 568 HOH A O     1 
HETATM 2085 O O     . HOH C 3 .   ? -0.249  -31.103 -5.276  1.00 19.48 ? 569 HOH A O     1 
HETATM 2086 O O     . HOH C 3 .   ? -6.079  -34.945 -4.475  1.00 32.51 ? 570 HOH A O     1 
HETATM 2087 O O     . HOH C 3 .   ? 9.741   -25.196 -2.549  1.00 28.40 ? 571 HOH A O     1 
HETATM 2088 O O     . HOH C 3 .   ? -16.052 -19.705 23.570  1.00 40.37 ? 572 HOH A O     1 
HETATM 2089 O O     . HOH C 3 .   ? 1.016   -18.411 11.833  1.00 8.75  ? 573 HOH A O     1 
HETATM 2090 O O     . HOH C 3 .   ? -7.218  -29.560 12.377  1.00 12.02 ? 574 HOH A O     1 
HETATM 2091 O O     . HOH C 3 .   ? -17.037 -17.583 1.670   1.00 30.30 ? 575 HOH A O     1 
HETATM 2092 O O     . HOH C 3 .   ? 7.377   -20.189 8.597   1.00 13.23 ? 576 HOH A O     1 
HETATM 2093 O O     . HOH C 3 .   ? 13.928  -18.776 12.671  1.00 23.28 ? 577 HOH A O     1 
HETATM 2094 O O     . HOH C 3 .   ? -3.370  -9.424  14.557  1.00 41.37 ? 578 HOH A O     1 
HETATM 2095 O O     . HOH C 3 .   ? 9.396   -19.804 1.111   1.00 32.47 ? 579 HOH A O     1 
HETATM 2096 O O     . HOH C 3 .   ? 11.821  -25.093 12.777  1.00 30.01 ? 580 HOH A O     1 
HETATM 2097 O O     . HOH C 3 .   ? 0.304   -10.394 11.901  1.00 18.24 ? 581 HOH A O     1 
HETATM 2098 O O     . HOH C 3 .   ? 9.667   -18.521 -13.083 1.00 28.88 ? 582 HOH A O     1 
HETATM 2099 O O     . HOH C 3 .   ? 5.852   -24.227 -9.200  1.00 29.03 ? 583 HOH A O     1 
HETATM 2100 O O     . HOH C 3 .   ? -6.085  -20.436 -4.969  1.00 33.26 ? 584 HOH A O     1 
HETATM 2101 O O     . HOH C 3 .   ? -17.803 -16.575 15.803  1.00 23.51 ? 585 HOH A O     1 
HETATM 2102 O O     . HOH C 3 .   ? 18.030  -6.706  9.754   1.00 28.34 ? 586 HOH A O     1 
HETATM 2103 O O     . HOH C 3 .   ? -7.593  -31.220 10.216  1.00 12.52 ? 587 HOH A O     1 
HETATM 2104 O O     . HOH C 3 .   ? -0.332  -17.050 -5.513  1.00 30.26 ? 588 HOH A O     1 
HETATM 2105 O O     . HOH C 3 .   ? -12.071 -36.114 3.033   1.00 34.30 ? 589 HOH A O     1 
HETATM 2106 O O     . HOH C 3 .   ? 0.988   -34.005 10.800  1.00 21.44 ? 590 HOH A O     1 
HETATM 2107 O O     . HOH C 3 .   ? -12.363 -25.146 18.036  1.00 25.46 ? 591 HOH A O     1 
HETATM 2108 O O     . HOH C 3 .   ? -0.545  -9.260  16.804  1.00 28.87 ? 592 HOH A O     1 
HETATM 2109 O O     . HOH C 3 .   ? -11.683 -13.005 20.366  1.00 38.54 ? 593 HOH A O     1 
HETATM 2110 O O     . HOH C 3 .   ? 9.812   -11.482 18.620  1.00 34.77 ? 594 HOH A O     1 
HETATM 2111 O O     . HOH C 3 .   ? -5.619  -27.379 -8.177  1.00 30.43 ? 595 HOH A O     1 
HETATM 2112 O O     . HOH C 3 .   ? -9.375  -28.019 11.641  1.00 10.51 ? 596 HOH A O     1 
HETATM 2113 O O     . HOH C 3 .   ? -3.957  -36.635 16.090  1.00 26.54 ? 597 HOH A O     1 
HETATM 2114 O O     . HOH C 3 .   ? 0.487   -37.738 -3.824  1.00 35.93 ? 598 HOH A O     1 
HETATM 2115 O O     . HOH C 3 .   ? -4.289  -27.469 -10.928 1.00 45.85 ? 599 HOH A O     1 
HETATM 2116 O O     . HOH C 3 .   ? -2.692  -14.897 -2.123  1.00 25.81 ? 600 HOH A O     1 
HETATM 2117 O O     . HOH C 3 .   ? 18.269  -16.841 -8.373  1.00 38.27 ? 601 HOH A O     1 
HETATM 2118 O O     . HOH C 3 .   ? 7.428   -6.687  10.232  1.00 27.03 ? 602 HOH A O     1 
HETATM 2119 O O     . HOH C 3 .   ? -5.692  -28.498 15.183  1.00 24.15 ? 603 HOH A O     1 
HETATM 2120 O O     . HOH C 3 .   ? -7.497  -12.620 8.017   1.00 9.95  ? 604 HOH A O     1 
HETATM 2121 O O     . HOH C 3 .   ? -21.000 -30.874 12.489  1.00 35.75 ? 605 HOH A O     1 
HETATM 2122 O O     . HOH C 3 .   ? -7.553  -13.234 -6.538  1.00 30.31 ? 606 HOH A O     1 
HETATM 2123 O O     . HOH C 3 .   ? -3.384  -7.617  1.459   1.00 39.67 ? 607 HOH A O     1 
HETATM 2124 O O     . HOH C 3 .   ? -18.130 -21.344 19.615  1.00 36.39 ? 608 HOH A O     1 
HETATM 2125 O O     . HOH C 3 .   ? -10.297 -25.809 0.796   1.00 25.64 ? 609 HOH A O     1 
HETATM 2126 O O     . HOH C 3 .   ? -7.146  -20.883 -3.439  1.00 35.55 ? 610 HOH A O     1 
HETATM 2127 O O     . HOH C 3 .   ? -11.126 -21.475 1.095   1.00 18.62 ? 611 HOH A O     1 
HETATM 2128 O O     . HOH C 3 .   ? 8.139   -27.851 16.244  1.00 27.37 ? 612 HOH A O     1 
HETATM 2129 O O     . HOH C 3 .   ? -5.448  -26.480 20.830  1.00 33.01 ? 613 HOH A O     1 
HETATM 2130 O O     . HOH C 3 .   ? -4.582  -27.116 18.131  1.00 21.39 ? 614 HOH A O     1 
HETATM 2131 O O     . HOH C 3 .   ? -17.956 -22.996 14.233  1.00 31.73 ? 615 HOH A O     1 
HETATM 2132 O O     . HOH C 3 .   ? 2.354   -10.202 15.618  1.00 25.03 ? 616 HOH A O     1 
HETATM 2133 O O     . HOH C 3 .   ? 2.360   -18.188 -5.633  1.00 32.21 ? 617 HOH A O     1 
HETATM 2134 O O     . HOH C 3 .   ? -2.970  -20.827 26.186  1.00 46.13 ? 618 HOH A O     1 
HETATM 2135 O O     . HOH C 3 .   ? -0.491  -35.528 14.572  1.00 25.82 ? 619 HOH A O     1 
HETATM 2136 O O     . HOH C 3 .   ? 8.896   -24.427 5.643   1.00 27.46 ? 620 HOH A O     1 
HETATM 2137 O O     . HOH C 3 .   ? -19.344 -15.573 11.699  1.00 29.84 ? 621 HOH A O     1 
HETATM 2138 O O     . HOH C 3 .   ? 5.395   -30.235 3.456   1.00 18.95 ? 622 HOH A O     1 
HETATM 2139 O O     . HOH C 3 .   ? -11.940 -25.636 4.852   1.00 20.76 ? 623 HOH A O     1 
HETATM 2140 O O     . HOH C 3 .   ? -8.507  -32.883 -0.186  1.00 35.71 ? 624 HOH A O     1 
HETATM 2141 O O     . HOH C 3 .   ? 12.990  -12.937 8.182   1.00 31.26 ? 625 HOH A O     1 
HETATM 2142 O O     . HOH C 3 .   ? -4.986  -40.908 16.113  1.00 35.03 ? 626 HOH A O     1 
HETATM 2143 O O     . HOH C 3 .   ? -9.612  -25.005 2.515   1.00 25.18 ? 627 HOH A O     1 
HETATM 2144 O O     . HOH C 3 .   ? 7.641   -32.417 15.687  1.00 44.26 ? 628 HOH A O     1 
HETATM 2145 O O     . HOH C 3 .   ? 6.963   -32.247 2.224   1.00 29.80 ? 629 HOH A O     1 
HETATM 2146 O O     . HOH C 3 .   ? -15.897 -25.612 10.613  1.00 34.42 ? 630 HOH A O     1 
HETATM 2147 O O     . HOH C 3 .   ? 5.323   -15.642 -3.365  1.00 35.06 ? 631 HOH A O     1 
HETATM 2148 O O     . HOH C 3 .   ? -16.326 -30.107 2.924   1.00 33.82 ? 632 HOH A O     1 
HETATM 2149 O O     . HOH C 3 .   ? -5.555  -37.993 2.686   1.00 28.31 ? 633 HOH A O     1 
HETATM 2150 O O     . HOH C 3 .   ? -13.749 -14.779 20.190  1.00 37.27 ? 634 HOH A O     1 
HETATM 2151 O O     . HOH C 3 .   ? 7.967   -20.101 -1.000  1.00 34.02 ? 635 HOH A O     1 
HETATM 2152 O O     . HOH C 3 .   ? -3.921  -6.767  5.474   1.00 35.57 ? 636 HOH A O     1 
HETATM 2153 O O     . HOH C 3 .   ? 19.637  -15.610 -19.736 1.00 43.48 ? 637 HOH A O     1 
HETATM 2154 O O     . HOH C 3 .   ? 1.730   -38.031 4.330   1.00 39.07 ? 638 HOH A O     1 
HETATM 2155 O O     . HOH C 3 .   ? -0.515  -9.333  0.742   1.00 43.15 ? 639 HOH A O     1 
HETATM 2156 O O     . HOH C 3 .   ? -11.659 -20.323 -0.921  1.00 43.95 ? 640 HOH A O     1 
HETATM 2157 O O     . HOH C 3 .   ? 8.371   -16.997 -2.016  1.00 29.85 ? 641 HOH A O     1 
HETATM 2158 O O     . HOH C 3 .   ? -10.733 -14.903 -6.248  1.00 31.16 ? 642 HOH A O     1 
HETATM 2159 O O     . HOH C 3 .   ? 14.300  -12.167 10.487  1.00 33.16 ? 643 HOH A O     1 
HETATM 2160 O O     . HOH C 3 .   ? -20.057 -31.436 10.863  1.00 36.00 ? 644 HOH A O     1 
HETATM 2161 O O     . HOH C 3 .   ? 9.219   -22.876 6.417   1.00 34.15 ? 645 HOH A O     1 
HETATM 2162 O O     . HOH C 3 .   ? 9.929   -30.927 0.855   1.00 37.42 ? 646 HOH A O     1 
HETATM 2163 O O     . HOH C 3 .   ? -16.149 -11.741 9.353   1.00 19.05 ? 647 HOH A O     1 
HETATM 2164 O O     . HOH C 3 .   ? -5.261  -19.416 -11.235 1.00 49.20 ? 648 HOH A O     1 
HETATM 2165 O O     . HOH C 3 .   ? -11.026 -15.161 22.007  1.00 34.31 ? 649 HOH A O     1 
HETATM 2166 O O     . HOH C 3 .   ? -5.789  -21.713 26.253  1.00 41.02 ? 650 HOH A O     1 
HETATM 2167 O O     . HOH C 3 .   ? -12.039 -11.181 11.447  1.00 33.30 ? 651 HOH A O     1 
HETATM 2168 O O     . HOH C 3 .   ? 9.068   -29.115 6.787   1.00 36.10 ? 652 HOH A O     1 
HETATM 2169 O O     . HOH C 3 .   ? -18.354 -11.400 10.834  1.00 31.13 ? 653 HOH A O     1 
HETATM 2170 O O     . HOH C 3 .   ? -8.311  -26.729 -5.622  1.00 35.02 ? 654 HOH A O     1 
HETATM 2171 O O     . HOH C 3 .   ? -14.353 -24.647 4.354   1.00 40.29 ? 655 HOH A O     1 
HETATM 2172 O O     . HOH C 3 .   ? 13.674  -27.843 -0.232  1.00 47.19 ? 656 HOH A O     1 
HETATM 2173 O O     . HOH C 3 .   ? -1.006  -9.867  14.312  1.00 25.21 ? 657 HOH A O     1 
HETATM 2174 O O     . HOH C 3 .   ? 1.907   -35.054 14.189  1.00 49.91 ? 658 HOH A O     1 
HETATM 2175 O O     . HOH C 3 .   ? -15.424 -24.416 22.209  1.00 43.70 ? 659 HOH A O     1 
HETATM 2176 O O     . HOH C 3 .   ? -9.013  -28.919 17.580  1.00 26.24 ? 660 HOH A O     1 
HETATM 2177 O O     . HOH C 3 .   ? -6.722  -15.630 -10.998 1.00 43.12 ? 661 HOH A O     1 
HETATM 2178 O O     . HOH C 3 .   ? 3.980   -26.588 -9.686  1.00 40.96 ? 662 HOH A O     1 
HETATM 2179 O O     . HOH C 3 .   ? -19.242 -14.577 14.650  1.00 26.46 ? 663 HOH A O     1 
HETATM 2180 O O     . HOH C 3 .   ? -10.281 -24.545 -1.982  1.00 25.89 ? 664 HOH A O     1 
HETATM 2181 O O     . HOH C 3 .   ? 2.745   -39.946 5.067   1.00 47.05 ? 665 HOH A O     1 
HETATM 2182 O O     . HOH C 3 .   ? 12.294  -25.943 10.729  1.00 35.49 ? 666 HOH A O     1 
HETATM 2183 O O     . HOH C 3 .   ? 15.187  -9.374  7.659   1.00 37.10 ? 667 HOH A O     1 
HETATM 2184 O O     . HOH C 3 .   ? 6.743   -33.205 8.694   1.00 37.26 ? 668 HOH A O     1 
HETATM 2185 O O     . HOH D 3 .   ? 11.032  -16.509 -0.607  1.00 44.28 ? 101 HOH B O     1 
HETATM 2186 O O     . HOH D 3 .   ? 4.678   -13.890 6.104   1.00 22.87 ? 102 HOH B O     1 
HETATM 2187 O O     . HOH D 3 .   ? 5.091   -14.617 0.578   1.00 32.92 ? 103 HOH B O     1 
HETATM 2188 O O     . HOH D 3 .   ? 12.452  -21.648 11.746  1.00 20.77 ? 104 HOH B O     1 
HETATM 2189 O O     . HOH D 3 .   ? 2.356   -17.000 2.436   1.00 15.62 ? 105 HOH B O     1 
HETATM 2190 O O     . HOH D 3 .   ? 14.298  -15.128 8.084   1.00 28.79 ? 106 HOH B O     1 
HETATM 2191 O O     . HOH D 3 .   ? 13.190  -9.802  1.073   1.00 46.54 ? 107 HOH B O     1 
HETATM 2192 O O     . HOH D 3 .   ? 9.296   -22.065 8.119   1.00 26.08 ? 108 HOH B O     1 
HETATM 2193 O O     . HOH D 3 .   ? 12.708  -10.774 -2.800  1.00 40.45 ? 109 HOH B O     1 
# 
