data_3RJ8 # _entry.id 3RJ8 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.286 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3RJ8 RCSB RCSB064998 WWPDB D_1000064998 # _pdbx_database_related.db_name PDB _pdbx_database_related.db_id 3RJA _pdbx_database_related.details . _pdbx_database_related.content_type unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3RJ8 _pdbx_database_status.recvd_initial_deposition_date 2011-04-15 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.methods_development_category ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Duskova, J.' 1 'Skalova, T.' 2 'Stepankova, A.' 3 'Koval, T.' 4 'Hasek, J.' 5 'Ostergaard, L.H.' 6 'Fuglsang, C.C.' 7 'Kolenko, P.' 8 'Dohnalek, J.' 9 # loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.journal_id_ASTM _citation.country _citation.journal_id_ISSN _citation.journal_id_CSD _citation.book_publisher _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary 'Crystal structure and kinetic studies of carbohydrate oxidase from Microdochium nivale' 'To be Published' ? ? ? ? ? ? ? 0353 ? ? ? 1 'Crystallization of carbohydrate oxidase from Microdochium nivale.' 'Acta Crystallogr.,Sect.F' 65 638 640 2009 ? DK 1744-3091 ? ? 19478452 10.1107/S1744309109017643 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Duskova, J.' 1 primary 'Skalova, T.' 2 primary 'Kolenko, P.' 3 primary 'Stepankova, A.' 4 primary 'Koval, T.' 5 primary 'Hasek, J.' 6 primary 'Ostergaard, L.H.' 7 primary 'Fuglsang, C.C.' 8 primary 'Dohnalek, J.' 9 1 'Duskova, J.' 10 1 'Dohnalek, J.' 11 1 'Skalova, T.' 12 1 'Ostergaard, L.H.' 13 1 'Fuglsang, C.C.' 14 1 'Kolenko, P.' 15 1 'Stepankova, A.' 16 1 'Hasek, J.' 17 # _cell.entry_id 3RJ8 _cell.length_a 133.710 _cell.length_b 56.960 _cell.length_c 87.050 _cell.angle_alpha 90.00 _cell.angle_beta 95.85 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 3RJ8 _symmetry.space_group_name_H-M 'C 1 2 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 5 _symmetry.space_group_name_Hall ? # 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 'Carbohydrate oxidase' 52466.957 1 1.1.3.4 ? 'mature enzyme' ? 2 non-polymer syn 'FLAVIN-ADENINE DINUCLEOTIDE' 785.550 1 ? ? ? ? 3 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 2 ? ? ? ? 4 non-polymer syn 'ZINC ION' 65.409 3 ? ? ? ? 5 non-polymer syn 'POTASSIUM ION' 39.098 1 ? ? ? ? 6 non-polymer syn 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL 122.143 1 ? ? ? ? 7 water nat water 18.015 357 ? ? ? ? # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code ;GAIEACLSAAGVPIDIPGTADYERDVEPFNIRLPYIPTAIAQTQTTAHIQSAVQCAKKLNLKVSAKSGGHSYASFGFGGE NGHLMVQLDRMIDVISYNDKTGIAHVEPGARLGHLATVLNDKYGRAISHGTCPGVGISGHFAHGGFGFSSHMHGLAVDSV VGVTVVLADGRIVEASATENADLFWGIKGAGSNFGIVAVWKLATFPAPKVLTRFGVTLNWKNKTSALKGIEAVEDYARWV APREVNFRIGDYGAGNPGIEGLYYGTPEQWRAAFQPLLDTLPAGYVVNPTTSLNWIESVLSYSNFDHVDFITPQPVENFY AKSLTLKSIKGDAVKNFVDYYFDVSNKVKDRFWFYQLDVHGGKNSQVTKVTNAETAYPHRDKLWLIQFYDRYDNNQTYPE TSFKFLDGWVNSVTKALPKSDWGMYINYADPRMDRDYATKVYYGENLARLQKLKAKFDPTDRFYYPQAVRPVK ; _entity_poly.pdbx_seq_one_letter_code_can ;GAIEACLSAAGVPIDIPGTADYERDVEPFNIRLPYIPTAIAQTQTTAHIQSAVQCAKKLNLKVSAKSGGHSYASFGFGGE NGHLMVQLDRMIDVISYNDKTGIAHVEPGARLGHLATVLNDKYGRAISHGTCPGVGISGHFAHGGFGFSSHMHGLAVDSV VGVTVVLADGRIVEASATENADLFWGIKGAGSNFGIVAVWKLATFPAPKVLTRFGVTLNWKNKTSALKGIEAVEDYARWV APREVNFRIGDYGAGNPGIEGLYYGTPEQWRAAFQPLLDTLPAGYVVNPTTSLNWIESVLSYSNFDHVDFITPQPVENFY AKSLTLKSIKGDAVKNFVDYYFDVSNKVKDRFWFYQLDVHGGKNSQVTKVTNAETAYPHRDKLWLIQFYDRYDNNQTYPE TSFKFLDGWVNSVTKALPKSDWGMYINYADPRMDRDYATKVYYGENLARLQKLKAKFDPTDRFYYPQAVRPVK ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLY n 1 2 ALA n 1 3 ILE n 1 4 GLU n 1 5 ALA n 1 6 CYS n 1 7 LEU n 1 8 SER n 1 9 ALA n 1 10 ALA n 1 11 GLY n 1 12 VAL n 1 13 PRO n 1 14 ILE n 1 15 ASP n 1 16 ILE n 1 17 PRO n 1 18 GLY n 1 19 THR n 1 20 ALA n 1 21 ASP n 1 22 TYR n 1 23 GLU n 1 24 ARG n 1 25 ASP n 1 26 VAL n 1 27 GLU n 1 28 PRO n 1 29 PHE n 1 30 ASN n 1 31 ILE n 1 32 ARG n 1 33 LEU n 1 34 PRO n 1 35 TYR n 1 36 ILE n 1 37 PRO n 1 38 THR n 1 39 ALA n 1 40 ILE n 1 41 ALA n 1 42 GLN n 1 43 THR n 1 44 GLN n 1 45 THR n 1 46 THR n 1 47 ALA n 1 48 HIS n 1 49 ILE n 1 50 GLN n 1 51 SER n 1 52 ALA n 1 53 VAL n 1 54 GLN n 1 55 CYS n 1 56 ALA n 1 57 LYS n 1 58 LYS n 1 59 LEU n 1 60 ASN n 1 61 LEU n 1 62 LYS n 1 63 VAL n 1 64 SER n 1 65 ALA n 1 66 LYS n 1 67 SER n 1 68 GLY n 1 69 GLY n 1 70 HIS n 1 71 SER n 1 72 TYR n 1 73 ALA n 1 74 SER n 1 75 PHE n 1 76 GLY n 1 77 PHE n 1 78 GLY n 1 79 GLY n 1 80 GLU n 1 81 ASN n 1 82 GLY n 1 83 HIS n 1 84 LEU n 1 85 MET n 1 86 VAL n 1 87 GLN n 1 88 LEU n 1 89 ASP n 1 90 ARG n 1 91 MET n 1 92 ILE n 1 93 ASP n 1 94 VAL n 1 95 ILE n 1 96 SER n 1 97 TYR n 1 98 ASN n 1 99 ASP n 1 100 LYS n 1 101 THR n 1 102 GLY n 1 103 ILE n 1 104 ALA n 1 105 HIS n 1 106 VAL n 1 107 GLU n 1 108 PRO n 1 109 GLY n 1 110 ALA n 1 111 ARG n 1 112 LEU n 1 113 GLY n 1 114 HIS n 1 115 LEU n 1 116 ALA n 1 117 THR n 1 118 VAL n 1 119 LEU n 1 120 ASN n 1 121 ASP n 1 122 LYS n 1 123 TYR n 1 124 GLY n 1 125 ARG n 1 126 ALA n 1 127 ILE n 1 128 SER n 1 129 HIS n 1 130 GLY n 1 131 THR n 1 132 CYS n 1 133 PRO n 1 134 GLY n 1 135 VAL n 1 136 GLY n 1 137 ILE n 1 138 SER n 1 139 GLY n 1 140 HIS n 1 141 PHE n 1 142 ALA n 1 143 HIS n 1 144 GLY n 1 145 GLY n 1 146 PHE n 1 147 GLY n 1 148 PHE n 1 149 SER n 1 150 SER n 1 151 HIS n 1 152 MET n 1 153 HIS n 1 154 GLY n 1 155 LEU n 1 156 ALA n 1 157 VAL n 1 158 ASP n 1 159 SER n 1 160 VAL n 1 161 VAL n 1 162 GLY n 1 163 VAL n 1 164 THR n 1 165 VAL n 1 166 VAL n 1 167 LEU n 1 168 ALA n 1 169 ASP n 1 170 GLY n 1 171 ARG n 1 172 ILE n 1 173 VAL n 1 174 GLU n 1 175 ALA n 1 176 SER n 1 177 ALA n 1 178 THR n 1 179 GLU n 1 180 ASN n 1 181 ALA n 1 182 ASP n 1 183 LEU n 1 184 PHE n 1 185 TRP n 1 186 GLY n 1 187 ILE n 1 188 LYS n 1 189 GLY n 1 190 ALA n 1 191 GLY n 1 192 SER n 1 193 ASN n 1 194 PHE n 1 195 GLY n 1 196 ILE n 1 197 VAL n 1 198 ALA n 1 199 VAL n 1 200 TRP n 1 201 LYS n 1 202 LEU n 1 203 ALA n 1 204 THR n 1 205 PHE n 1 206 PRO n 1 207 ALA n 1 208 PRO n 1 209 LYS n 1 210 VAL n 1 211 LEU n 1 212 THR n 1 213 ARG n 1 214 PHE n 1 215 GLY n 1 216 VAL n 1 217 THR n 1 218 LEU n 1 219 ASN n 1 220 TRP n 1 221 LYS n 1 222 ASN n 1 223 LYS n 1 224 THR n 1 225 SER n 1 226 ALA n 1 227 LEU n 1 228 LYS n 1 229 GLY n 1 230 ILE n 1 231 GLU n 1 232 ALA n 1 233 VAL n 1 234 GLU n 1 235 ASP n 1 236 TYR n 1 237 ALA n 1 238 ARG n 1 239 TRP n 1 240 VAL n 1 241 ALA n 1 242 PRO n 1 243 ARG n 1 244 GLU n 1 245 VAL n 1 246 ASN n 1 247 PHE n 1 248 ARG n 1 249 ILE n 1 250 GLY n 1 251 ASP n 1 252 TYR n 1 253 GLY n 1 254 ALA n 1 255 GLY n 1 256 ASN n 1 257 PRO n 1 258 GLY n 1 259 ILE n 1 260 GLU n 1 261 GLY n 1 262 LEU n 1 263 TYR n 1 264 TYR n 1 265 GLY n 1 266 THR n 1 267 PRO n 1 268 GLU n 1 269 GLN n 1 270 TRP n 1 271 ARG n 1 272 ALA n 1 273 ALA n 1 274 PHE n 1 275 GLN n 1 276 PRO n 1 277 LEU n 1 278 LEU n 1 279 ASP n 1 280 THR n 1 281 LEU n 1 282 PRO n 1 283 ALA n 1 284 GLY n 1 285 TYR n 1 286 VAL n 1 287 VAL n 1 288 ASN n 1 289 PRO n 1 290 THR n 1 291 THR n 1 292 SER n 1 293 LEU n 1 294 ASN n 1 295 TRP n 1 296 ILE n 1 297 GLU n 1 298 SER n 1 299 VAL n 1 300 LEU n 1 301 SER n 1 302 TYR n 1 303 SER n 1 304 ASN n 1 305 PHE n 1 306 ASP n 1 307 HIS n 1 308 VAL n 1 309 ASP n 1 310 PHE n 1 311 ILE n 1 312 THR n 1 313 PRO n 1 314 GLN n 1 315 PRO n 1 316 VAL n 1 317 GLU n 1 318 ASN n 1 319 PHE n 1 320 TYR n 1 321 ALA n 1 322 LYS n 1 323 SER n 1 324 LEU n 1 325 THR n 1 326 LEU n 1 327 LYS n 1 328 SER n 1 329 ILE n 1 330 LYS n 1 331 GLY n 1 332 ASP n 1 333 ALA n 1 334 VAL n 1 335 LYS n 1 336 ASN n 1 337 PHE n 1 338 VAL n 1 339 ASP n 1 340 TYR n 1 341 TYR n 1 342 PHE n 1 343 ASP n 1 344 VAL n 1 345 SER n 1 346 ASN n 1 347 LYS n 1 348 VAL n 1 349 LYS n 1 350 ASP n 1 351 ARG n 1 352 PHE n 1 353 TRP n 1 354 PHE n 1 355 TYR n 1 356 GLN n 1 357 LEU n 1 358 ASP n 1 359 VAL n 1 360 HIS n 1 361 GLY n 1 362 GLY n 1 363 LYS n 1 364 ASN n 1 365 SER n 1 366 GLN n 1 367 VAL n 1 368 THR n 1 369 LYS n 1 370 VAL n 1 371 THR n 1 372 ASN n 1 373 ALA n 1 374 GLU n 1 375 THR n 1 376 ALA n 1 377 TYR n 1 378 PRO n 1 379 HIS n 1 380 ARG n 1 381 ASP n 1 382 LYS n 1 383 LEU n 1 384 TRP n 1 385 LEU n 1 386 ILE n 1 387 GLN n 1 388 PHE n 1 389 TYR n 1 390 ASP n 1 391 ARG n 1 392 TYR n 1 393 ASP n 1 394 ASN n 1 395 ASN n 1 396 GLN n 1 397 THR n 1 398 TYR n 1 399 PRO n 1 400 GLU n 1 401 THR n 1 402 SER n 1 403 PHE n 1 404 LYS n 1 405 PHE n 1 406 LEU n 1 407 ASP n 1 408 GLY n 1 409 TRP n 1 410 VAL n 1 411 ASN n 1 412 SER n 1 413 VAL n 1 414 THR n 1 415 LYS n 1 416 ALA n 1 417 LEU n 1 418 PRO n 1 419 LYS n 1 420 SER n 1 421 ASP n 1 422 TRP n 1 423 GLY n 1 424 MET n 1 425 TYR n 1 426 ILE n 1 427 ASN n 1 428 TYR n 1 429 ALA n 1 430 ASP n 1 431 PRO n 1 432 ARG n 1 433 MET n 1 434 ASP n 1 435 ARG n 1 436 ASP n 1 437 TYR n 1 438 ALA n 1 439 THR n 1 440 LYS n 1 441 VAL n 1 442 TYR n 1 443 TYR n 1 444 GLY n 1 445 GLU n 1 446 ASN n 1 447 LEU n 1 448 ALA n 1 449 ARG n 1 450 LEU n 1 451 GLN n 1 452 LYS n 1 453 LEU n 1 454 LYS n 1 455 ALA n 1 456 LYS n 1 457 PHE n 1 458 ASP n 1 459 PRO n 1 460 THR n 1 461 ASP n 1 462 ARG n 1 463 PHE n 1 464 TYR n 1 465 TYR n 1 466 PRO n 1 467 GLN n 1 468 ALA n 1 469 VAL n 1 470 ARG n 1 471 PRO n 1 472 VAL n 1 473 LYS 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 ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name ? _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene MnCO _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain NN008551 _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 'Microdochium nivale' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 5520 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name 'Aspergillus oryzae' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 5062 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain JaL228 _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 plasmid _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pEJG33 _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name PDB _struct_ref.db_code 3RJ8 _struct_ref.pdbx_db_accession 3RJ8 _struct_ref.entity_id 1 _struct_ref.pdbx_align_begin ? _struct_ref.pdbx_seq_one_letter_code ;GAIEACLSAAGVPIDIPGTADYERDVEPFNIRLPYIPTAIAQTQTTAHIQSAVQCAKKLNLKVSAKSGGHSYASFGFGGE NGHLMVQLDRMIDVISYNDKTGIAHVEPGARLGHLATVLNDKYGRAISHGTCPGVGISGHFAHGGFGFSSHMHGLAVDSV VGVTVVLADGRIVEASATENADLFWGIKGAGSNFGIVAVWKLATFPAPKVLTRFGVTLNWKNKTSALKGIEAVEDYARWV APREVNFRIGDYGAGNPGIEGLYYGTPEQWRAAFQPLLDTLPAGYVVNPTTSLNWIESVLSYSNFDHVDFITPQPVENFY AKSLTLKSIKGDAVKNFVDYYFDVSNKVKDRFWFYQLDVHGGKNSQVTKVTNAETAYPHRDKLWLIQFYDRYDNNQTYPE TSFKFLDGWVNSVTKALPKSDWGMYINYADPRMDRDYATKVYYGENLARLQKLKAKFDPTDRFYYPQAVRPVK ; _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 3RJ8 _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 473 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession 3RJ8 _struct_ref_seq.db_align_beg 1 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 473 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 1 _struct_ref_seq.pdbx_auth_seq_align_end 473 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 FAD non-polymer . 'FLAVIN-ADENINE DINUCLEOTIDE' ? 'C27 H33 N9 O15 P2' 785.550 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 K non-polymer . 'POTASSIUM ION' ? 'K 1' 39.098 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 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 TRS non-polymer . 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL 'TRIS BUFFER' 'C4 H12 N O3 1' 122.143 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 ZN non-polymer . 'ZINC ION' ? 'Zn 2' 65.409 # _exptl.entry_id 3RJ8 _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.15 _exptl_crystal.density_percent_sol 60.91 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.temp 298 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 6.5 _exptl_crystal_grow.pdbx_details '0.01 M zinc sulfate, 0.1 M MES, 12% PEG550 MME, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector 'IMAGE PLATE' _diffrn_detector.type 'MAR555 FLAT PANEL' _diffrn_detector.pdbx_collection_date 2007-11-24 _diffrn_detector.details 'elliptically bent 12 quartz segments' # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator ;Ge(111) triangular bent compressing 7 Fankuchen cut ; _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.8148 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'EMBL/DESY, HAMBURG BEAMLINE X11' _diffrn_source.pdbx_synchrotron_site 'EMBL/DESY, Hamburg' _diffrn_source.pdbx_synchrotron_beamline X11 _diffrn_source.pdbx_wavelength 0.8148 _diffrn_source.pdbx_wavelength_list ? # _reflns.entry_id 3RJ8 _reflns.observed_criterion_sigma_I -3 _reflns.observed_criterion_sigma_F 0 _reflns.d_resolution_low 15 _reflns.d_resolution_high 2.4 _reflns.number_obs 24502 _reflns.number_all 24502 _reflns.percent_possible_obs 95.5 _reflns.pdbx_Rmerge_I_obs 0.098 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 11.7 _reflns.B_iso_Wilson_estimate 32.5 _reflns.pdbx_redundancy 2.9 _reflns.R_free_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.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 2.4 _reflns_shell.d_res_low 2.55 _reflns_shell.percent_possible_all 95.2 _reflns_shell.Rmerge_I_obs 0.362 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs 3.42 _reflns_shell.pdbx_redundancy 2.8 _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all 3807 _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 3RJ8 _refine.ls_number_reflns_obs 24502 _refine.ls_number_reflns_all 24502 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 15.00 _refine.ls_d_res_high 2.40 _refine.ls_percent_reflns_obs 95.50 _refine.ls_R_factor_obs 0.156 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.155 _refine.ls_R_factor_R_free ? _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free ? _refine.ls_number_reflns_R_free ? _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc 0.945 _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean 14.9 _refine.aniso_B[1][1] -0.13 _refine.aniso_B[2][2] -0.13 _refine.aniso_B[3][3] -0.05 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] -1.52 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_details MASK _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.20 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_ls_cross_valid_method ? _refine.details ;STRUCTURE SOLUTION AND REFINEMENT WERE PERFORMED USING FREE R FOR CROSS-VALIDATION THROUGHOUT: FREE R = 0.210 (FREE R = 0.300 FOR THE HIGHEST RESOLUTION SHELL) FROM A RANDOM TEST SET COMPRISING 5% OF REFLECTIONS (1225 TOTAL). FINAL REFINEMENT WAS PERFORMED USING ALL REFLECTIONS. ; _refine.pdbx_starting_model 'PDB ENTRY 1ZR6' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ISOTROPIC _refine.pdbx_stereochemistry_target_values 'CCP4 6.1.3 stereochemistry library' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.103 _refine.overall_SU_B 4.504 _refine.overall_SU_R_Cruickshank_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_overall_phase_error ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_overall_ESU_R 0.281 _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 3713 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 93 _refine_hist.number_atoms_solvent 357 _refine_hist.number_atoms_total 4163 _refine_hist.d_res_high 2.40 _refine_hist.d_res_low 15.00 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_restraint_function _refine_ls_restr.pdbx_refine_id r_bond_refined_d 0.011 0.022 ? 3970 ? 'X-RAY DIFFRACTION' r_bond_other_d ? ? ? ? ? 'X-RAY DIFFRACTION' r_angle_refined_deg 1.320 1.962 ? 5421 ? 'X-RAY DIFFRACTION' r_angle_other_deg ? ? ? ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_1_deg 6.466 5.000 ? 486 ? 'X-RAY DIFFRACTION' r_dihedral_angle_2_deg 32.586 23.736 ? 182 ? 'X-RAY DIFFRACTION' r_dihedral_angle_3_deg 14.857 15.000 ? 601 ? 'X-RAY DIFFRACTION' r_dihedral_angle_4_deg 17.500 15.000 ? 20 ? 'X-RAY DIFFRACTION' r_chiral_restr 0.093 0.200 ? 577 ? 'X-RAY DIFFRACTION' r_gen_planes_refined 0.011 0.021 ? 3069 ? 'X-RAY DIFFRACTION' r_gen_planes_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_nbd_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_nbd_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_nbtor_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_nbtor_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_xyhbond_nbd_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_xyhbond_nbd_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_metal_ion_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_metal_ion_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_vdw_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_vdw_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_hbond_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_hbond_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_metal_ion_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_metal_ion_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_mcbond_it ? ? ? ? ? 'X-RAY DIFFRACTION' r_mcbond_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_mcangle_it ? ? ? ? ? 'X-RAY DIFFRACTION' r_scbond_it ? ? ? ? ? 'X-RAY DIFFRACTION' r_scangle_it ? ? ? ? ? 'X-RAY DIFFRACTION' r_rigid_bond_restr ? ? ? ? ? 'X-RAY DIFFRACTION' r_sphericity_free ? ? ? ? ? 'X-RAY DIFFRACTION' r_sphericity_bonded ? ? ? ? ? 'X-RAY DIFFRACTION' # _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.d_res_high 2.400 _refine_ls_shell.d_res_low 2.461 _refine_ls_shell.number_reflns_R_work 1777 _refine_ls_shell.R_factor_R_work 0.232 _refine_ls_shell.percent_reflns_obs 96.47 _refine_ls_shell.R_factor_R_free ? _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free ? _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.number_reflns_obs 1777 _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' # _struct.entry_id 3RJ8 _struct.title 'Crystal structure of carbohydrate oxidase from Microdochium nivale' _struct.pdbx_descriptor 'Carbohydrate oxidase (E.C.1.1.3.4.)' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3RJ8 _struct_keywords.pdbx_keywords OXIDOREDUCTASE _struct_keywords.text ;FAD binding domain, berberine and berberine-like domain, glucooligosaccharide oxidase, FAD Binding, Carbohydrate/Sugar Binding, extracellular, OXIDOREDUCTASE ; # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 3 ? E N N 4 ? F N N 4 ? G N N 4 ? H N N 5 ? I N N 6 ? J N N 7 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLY A 1 ? ALA A 10 ? GLY A 1 ALA A 10 1 ? 10 HELX_P HELX_P2 2 THR A 19 ? VAL A 26 ? THR A 19 VAL A 26 1 ? 8 HELX_P HELX_P3 3 THR A 45 ? LEU A 59 ? THR A 45 LEU A 59 1 ? 15 HELX_P HELX_P4 4 SER A 74 ? GLY A 78 ? SER A 74 GLY A 78 5 ? 5 HELX_P HELX_P5 5 ARG A 111 ? GLY A 124 ? ARG A 111 GLY A 124 1 ? 14 HELX_P HELX_P6 6 GLY A 136 ? GLY A 144 ? GLY A 136 GLY A 144 1 ? 9 HELX_P HELX_P7 7 SER A 149 ? GLY A 154 ? SER A 149 GLY A 154 1 ? 6 HELX_P HELX_P8 8 LEU A 155 ? ASP A 158 ? LEU A 155 ASP A 158 5 ? 4 HELX_P HELX_P9 9 ASN A 180 ? GLY A 191 ? ASN A 180 GLY A 191 1 ? 12 HELX_P HELX_P10 10 SER A 192 ? PHE A 194 ? SER A 192 PHE A 194 5 ? 3 HELX_P HELX_P11 11 ASN A 222 ? VAL A 240 ? ASN A 222 VAL A 240 1 ? 19 HELX_P HELX_P12 12 THR A 266 ? ASP A 279 ? THR A 266 ASP A 279 1 ? 14 HELX_P HELX_P13 13 ASN A 294 ? TYR A 302 ? ASN A 294 TYR A 302 1 ? 9 HELX_P HELX_P14 14 GLY A 331 ? VAL A 344 ? GLY A 331 VAL A 344 1 ? 14 HELX_P HELX_P15 15 SER A 345 ? VAL A 348 ? SER A 345 VAL A 348 5 ? 4 HELX_P HELX_P16 16 SER A 365 ? VAL A 370 ? SER A 365 VAL A 370 5 ? 6 HELX_P HELX_P17 17 PRO A 399 ? SER A 402 ? PRO A 399 SER A 402 5 ? 4 HELX_P HELX_P18 18 PHE A 403 ? LYS A 415 ? PHE A 403 LYS A 415 1 ? 13 HELX_P HELX_P19 19 ALA A 416 ? LEU A 417 ? ALA A 416 LEU A 417 5 ? 2 HELX_P HELX_P20 20 PRO A 418 ? SER A 420 ? PRO A 418 SER A 420 5 ? 3 HELX_P HELX_P21 21 TYR A 425 ? ALA A 429 ? TYR A 425 ALA A 429 5 ? 5 HELX_P HELX_P22 22 ASP A 434 ? GLY A 444 ? ASP A 434 GLY A 444 1 ? 11 HELX_P HELX_P23 23 ASN A 446 ? ASP A 458 ? ASN A 446 ASP A 458 1 ? 13 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order covale1 covale ? ? C NAG . O4 ? ? ? 1_555 D NAG . C1 ? ? A NAG 502 A NAG 503 1_555 ? ? ? ? ? ? ? 1.441 ? covale2 covale ? ? A ASN 222 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 222 A NAG 502 1_555 ? ? ? ? ? ? ? 1.451 ? metalc1 metalc ? ? A ASP 306 OD1 ? ? ? 1_555 E ZN . ZN ? ? A ASP 306 A ZN 601 1_555 ? ? ? ? ? ? ? 1.889 ? metalc2 metalc ? ? A GLU 231 OE2 ? ? ? 1_555 F ZN . ZN ? ? A GLU 231 A ZN 602 1_555 ? ? ? ? ? ? ? 2.002 ? metalc3 metalc ? ? A HIS 307 ND1 ? ? ? 1_555 E ZN . ZN ? ? A HIS 307 A ZN 601 1_555 ? ? ? ? ? ? ? 2.065 ? metalc4 metalc ? ? A ASP 235 OD2 ? ? ? 1_555 F ZN . ZN ? ? A ASP 235 A ZN 602 1_555 ? ? ? ? ? ? ? 2.073 ? metalc5 metalc ? ? A HIS 114 ND1 ? ? ? 1_555 G ZN . ZN ? ? A HIS 114 A ZN 603 1_555 ? ? ? ? ? ? ? 2.153 ? metalc6 metalc ? ? A ASP 309 OD1 ? ? ? 1_555 G ZN . ZN ? ? A ASP 309 A ZN 603 1_555 ? ? ? ? ? ? ? 2.268 ? metalc7 metalc ? ? A ASP 309 OD2 ? ? ? 1_555 G ZN . ZN ? ? A ASP 309 A ZN 603 1_555 ? ? ? ? ? ? ? 2.385 ? metalc8 metalc ? ? G ZN . ZN ? ? ? 1_555 J HOH . O ? ? A ZN 603 A HOH 910 1_555 ? ? ? ? ? ? ? 2.554 ? metalc9 metalc ? ? A ILE 36 O ? ? ? 1_555 H K . K ? ? A ILE 36 A K 604 1_555 ? ? ? ? ? ? ? 2.853 ? covale3 covale ? ? A HIS 70 ND1 ? ? ? 1_555 B FAD . C8M ? ? A HIS 70 A FAD 501 1_555 ? ? ? ? ? ? ? 1.486 ? covale4 covale ? ? A CYS 132 SG ? ? ? 1_555 B FAD . C6 ? ? A CYS 132 A FAD 501 1_555 ? ? ? ? ? ? ? 1.797 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference covale ? ? metalc ? ? # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 3 ? B ? 5 ? C ? 2 ? D ? 3 ? E ? 8 ? # 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 A 1 2 ? parallel A 2 3 ? parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel B 4 5 ? anti-parallel C 1 2 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel E 4 5 ? anti-parallel E 5 6 ? anti-parallel E 6 7 ? anti-parallel E 7 8 ? 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 A 1 ALA A 39 ? GLN A 42 ? ALA A 39 GLN A 42 A 2 LEU A 84 ? GLN A 87 ? LEU A 84 GLN A 87 A 3 VAL A 63 ? LYS A 66 ? VAL A 63 LYS A 66 B 1 VAL A 94 ? TYR A 97 ? VAL A 94 TYR A 97 B 2 ILE A 103 ? VAL A 106 ? ILE A 103 VAL A 106 B 3 ILE A 196 ? ALA A 203 ? ILE A 196 ALA A 203 B 4 VAL A 160 ? VAL A 166 ? VAL A 160 VAL A 166 B 5 ILE A 172 ? ALA A 175 ? ILE A 172 ALA A 175 C 1 ARG A 125 ? ALA A 126 ? ARG A 125 ALA A 126 C 2 PHE A 205 ? PRO A 206 ? PHE A 205 PRO A 206 D 1 VAL A 286 ? VAL A 287 ? VAL A 286 VAL A 287 D 2 LEU A 211 ? THR A 217 ? LEU A 211 THR A 217 D 3 THR A 291 ? LEU A 293 ? THR A 291 LEU A 293 E 1 VAL A 286 ? VAL A 287 ? VAL A 286 VAL A 287 E 2 LEU A 211 ? THR A 217 ? LEU A 211 THR A 217 E 3 GLY A 258 ? TYR A 263 ? GLY A 258 TYR A 263 E 4 VAL A 245 ? ASP A 251 ? VAL A 245 ASP A 251 E 5 PHE A 352 ? VAL A 359 ? PHE A 352 VAL A 359 E 6 TRP A 384 ? TYR A 392 ? TRP A 384 TYR A 392 E 7 ASN A 318 ? LEU A 326 ? ASN A 318 LEU A 326 E 8 TRP A 422 ? GLY A 423 ? TRP A 422 GLY A 423 # 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 A 1 2 N ALA A 39 ? N ALA A 39 O MET A 85 ? O MET A 85 A 2 3 O VAL A 86 ? O VAL A 86 N SER A 64 ? N SER A 64 B 1 2 N SER A 96 ? N SER A 96 O HIS A 105 ? O HIS A 105 B 2 3 N ALA A 104 ? N ALA A 104 O LEU A 202 ? O LEU A 202 B 3 4 O ALA A 198 ? O ALA A 198 N THR A 164 ? N THR A 164 B 4 5 N VAL A 165 ? N VAL A 165 O VAL A 173 ? O VAL A 173 C 1 2 N ALA A 126 ? N ALA A 126 O PHE A 205 ? O PHE A 205 D 1 2 O VAL A 286 ? O VAL A 286 N THR A 217 ? N THR A 217 D 2 3 N LEU A 211 ? N LEU A 211 O LEU A 293 ? O LEU A 293 E 1 2 O VAL A 286 ? O VAL A 286 N THR A 217 ? N THR A 217 E 2 3 N THR A 212 ? N THR A 212 O TYR A 263 ? O TYR A 263 E 3 4 O GLY A 258 ? O GLY A 258 N GLY A 250 ? N GLY A 250 E 4 5 N ILE A 249 ? N ILE A 249 O LEU A 357 ? O LEU A 357 E 5 6 N ASP A 358 ? N ASP A 358 O LEU A 385 ? O LEU A 385 E 6 7 O ASP A 390 ? O ASP A 390 N TYR A 320 ? N TYR A 320 E 7 8 N THR A 325 ? N THR A 325 O GLY A 423 ? O GLY A 423 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 35 'BINDING SITE FOR RESIDUE FAD A 501' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 502' AC3 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG A 503' AC4 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ZN A 601' AC5 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ZN A 602' AC6 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ZN A 603' AC7 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE K A 604' AC8 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE TRS A 605' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 35 PHE A 29 ? PHE A 29 . ? 1_555 ? 2 AC1 35 ALA A 65 ? ALA A 65 . ? 1_555 ? 3 AC1 35 LYS A 66 ? LYS A 66 . ? 1_555 ? 4 AC1 35 SER A 67 ? SER A 67 . ? 1_555 ? 5 AC1 35 GLY A 68 ? GLY A 68 . ? 1_555 ? 6 AC1 35 GLY A 69 ? GLY A 69 . ? 1_555 ? 7 AC1 35 HIS A 70 ? HIS A 70 . ? 1_555 ? 8 AC1 35 SER A 71 ? SER A 71 . ? 1_555 ? 9 AC1 35 TYR A 72 ? TYR A 72 . ? 1_555 ? 10 AC1 35 LEU A 88 ? LEU A 88 . ? 1_555 ? 11 AC1 35 GLY A 130 ? GLY A 130 . ? 1_555 ? 12 AC1 35 THR A 131 ? THR A 131 . ? 1_555 ? 13 AC1 35 CYS A 132 ? CYS A 132 . ? 1_555 ? 14 AC1 35 VAL A 135 ? VAL A 135 . ? 1_555 ? 15 AC1 35 GLY A 136 ? GLY A 136 . ? 1_555 ? 16 AC1 35 SER A 138 ? SER A 138 . ? 1_555 ? 17 AC1 35 GLY A 139 ? GLY A 139 . ? 1_555 ? 18 AC1 35 HIS A 140 ? HIS A 140 . ? 1_555 ? 19 AC1 35 HIS A 143 ? HIS A 143 . ? 1_555 ? 20 AC1 35 PHE A 146 ? PHE A 146 . ? 1_555 ? 21 AC1 35 GLY A 191 ? GLY A 191 . ? 1_555 ? 22 AC1 35 SER A 192 ? SER A 192 . ? 1_555 ? 23 AC1 35 GLY A 195 ? GLY A 195 . ? 1_555 ? 24 AC1 35 ILE A 196 ? ILE A 196 . ? 1_555 ? 25 AC1 35 VAL A 197 ? VAL A 197 . ? 1_555 ? 26 AC1 35 TYR A 425 ? TYR A 425 . ? 1_555 ? 27 AC1 35 ASN A 427 ? ASN A 427 . ? 1_555 ? 28 AC1 35 TYR A 428 ? TYR A 428 . ? 1_555 ? 29 AC1 35 HOH J . ? HOH A 608 . ? 1_555 ? 30 AC1 35 HOH J . ? HOH A 610 . ? 1_555 ? 31 AC1 35 HOH J . ? HOH A 616 . ? 1_555 ? 32 AC1 35 HOH J . ? HOH A 638 . ? 1_555 ? 33 AC1 35 HOH J . ? HOH A 667 . ? 1_555 ? 34 AC1 35 HOH J . ? HOH A 709 . ? 1_555 ? 35 AC1 35 HOH J . ? HOH A 744 . ? 1_555 ? 36 AC2 4 LYS A 221 ? LYS A 221 . ? 1_555 ? 37 AC2 4 ASN A 222 ? ASN A 222 . ? 1_555 ? 38 AC2 4 NAG D . ? NAG A 503 . ? 1_555 ? 39 AC2 4 HOH J . ? HOH A 746 . ? 1_555 ? 40 AC3 1 NAG C . ? NAG A 502 . ? 1_555 ? 41 AC4 4 ASP A 306 ? ASP A 306 . ? 2_554 ? 42 AC4 4 ASP A 306 ? ASP A 306 . ? 1_555 ? 43 AC4 4 HIS A 307 ? HIS A 307 . ? 2_554 ? 44 AC4 4 HIS A 307 ? HIS A 307 . ? 1_555 ? 45 AC5 4 GLU A 231 ? GLU A 231 . ? 1_555 ? 46 AC5 4 GLU A 231 ? GLU A 231 . ? 2_555 ? 47 AC5 4 ASP A 235 ? ASP A 235 . ? 2_555 ? 48 AC5 4 ASP A 235 ? ASP A 235 . ? 1_555 ? 49 AC6 4 HIS A 114 ? HIS A 114 . ? 1_555 ? 50 AC6 4 ASP A 309 ? ASP A 309 . ? 1_555 ? 51 AC6 4 HOH J . ? HOH A 847 . ? 1_555 ? 52 AC6 4 HOH J . ? HOH A 910 . ? 1_555 ? 53 AC7 5 ILE A 36 ? ILE A 36 . ? 1_555 ? 54 AC7 5 PRO A 37 ? PRO A 37 . ? 1_555 ? 55 AC7 5 GLN A 50 ? GLN A 50 . ? 4_444 ? 56 AC7 5 HOH J . ? HOH A 693 . ? 4_444 ? 57 AC7 5 HOH J . ? HOH A 948 . ? 4_444 ? 58 AC8 4 GLN A 44 ? GLN A 44 . ? 1_555 ? 59 AC8 4 ARG A 90 ? ARG A 90 . ? 1_555 ? 60 AC8 4 ASP A 93 ? ASP A 93 . ? 1_555 ? 61 AC8 4 GLU A 107 ? GLU A 107 . ? 1_555 ? # _database_PDB_matrix.entry_id 3RJ8 _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 3RJ8 _atom_sites.fract_transf_matrix[1][1] 0.007479 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000766 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.017556 _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] 0.011548 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C K N O P S ZN # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . GLY A 1 1 ? -32.950 -0.494 -55.203 1.00 17.68 ? 1 GLY A N 1 ATOM 2 C CA . GLY A 1 1 ? -33.970 -0.613 -54.112 1.00 16.84 ? 1 GLY A CA 1 ATOM 3 C C . GLY A 1 1 ? -34.156 0.740 -53.465 1.00 17.16 ? 1 GLY A C 1 ATOM 4 O O . GLY A 1 1 ? -33.379 1.670 -53.725 1.00 16.56 ? 1 GLY A O 1 ATOM 5 N N . ALA A 1 2 ? -35.166 0.861 -52.606 1.00 17.02 ? 2 ALA A N 1 ATOM 6 C CA . ALA A 1 2 ? -35.497 2.159 -52.016 1.00 16.78 ? 2 ALA A CA 1 ATOM 7 C C . ALA A 1 2 ? -34.296 2.908 -51.382 1.00 17.34 ? 2 ALA A C 1 ATOM 8 O O . ALA A 1 2 ? -34.092 4.094 -51.669 1.00 17.23 ? 2 ALA A O 1 ATOM 9 C CB . ALA A 1 2 ? -36.666 2.021 -51.035 1.00 17.55 ? 2 ALA A CB 1 ATOM 10 N N . ILE A 1 3 ? -33.494 2.207 -50.569 1.00 17.12 ? 3 ILE A N 1 ATOM 11 C CA . ILE A 1 3 ? -32.358 2.806 -49.838 1.00 16.74 ? 3 ILE A CA 1 ATOM 12 C C . ILE A 1 3 ? -31.213 3.223 -50.758 1.00 17.53 ? 3 ILE A C 1 ATOM 13 O O . ILE A 1 3 ? -30.593 4.272 -50.543 1.00 16.89 ? 3 ILE A O 1 ATOM 14 C CB . ILE A 1 3 ? -31.839 1.891 -48.640 1.00 16.41 ? 3 ILE A CB 1 ATOM 15 C CG1 . ILE A 1 3 ? -30.713 2.565 -47.835 1.00 15.84 ? 3 ILE A CG1 1 ATOM 16 C CG2 . ILE A 1 3 ? -31.370 0.513 -49.125 1.00 15.61 ? 3 ILE A CG2 1 ATOM 17 C CD1 . ILE A 1 3 ? -31.123 3.801 -47.058 1.00 15.71 ? 3 ILE A CD1 1 ATOM 18 N N . GLU A 1 4 ? -30.941 2.399 -51.771 1.00 18.84 ? 4 GLU A N 1 ATOM 19 C CA . GLU A 1 4 ? -29.923 2.701 -52.786 1.00 19.97 ? 4 GLU A CA 1 ATOM 20 C C . GLU A 1 4 ? -30.276 3.983 -53.536 1.00 19.85 ? 4 GLU A C 1 ATOM 21 O O . GLU A 1 4 ? -29.480 4.920 -53.588 1.00 19.75 ? 4 GLU A O 1 ATOM 22 C CB . GLU A 1 4 ? -29.773 1.542 -53.778 1.00 20.78 ? 4 GLU A CB 1 ATOM 23 C CG . GLU A 1 4 ? -28.995 0.337 -53.235 1.00 23.34 ? 4 GLU A CG 1 ATOM 24 C CD . GLU A 1 4 ? -29.850 -0.660 -52.452 1.00 23.35 ? 4 GLU A CD 1 ATOM 25 O OE1 . GLU A 1 4 ? -31.077 -0.472 -52.355 1.00 24.80 ? 4 GLU A OE1 1 ATOM 26 O OE2 . GLU A 1 4 ? -29.289 -1.648 -51.932 1.00 24.67 ? 4 GLU A OE2 1 ATOM 27 N N . ALA A 1 5 ? -31.483 4.009 -54.099 1.00 20.46 ? 5 ALA A N 1 ATOM 28 C CA . ALA A 1 5 ? -32.007 5.159 -54.829 1.00 20.30 ? 5 ALA A CA 1 ATOM 29 C C . ALA A 1 5 ? -31.925 6.420 -53.989 1.00 20.77 ? 5 ALA A C 1 ATOM 30 O O . ALA A 1 5 ? -31.409 7.448 -54.449 1.00 21.48 ? 5 ALA A O 1 ATOM 31 C CB . ALA A 1 5 ? -33.418 4.902 -55.236 1.00 19.04 ? 5 ALA A CB 1 ATOM 32 N N . CYS A 1 6 ? -32.412 6.315 -52.750 1.00 21.21 ? 6 CYS A N 1 ATOM 33 C CA . CYS A 1 6 ? -32.382 7.399 -51.768 1.00 20.60 ? 6 CYS A CA 1 ATOM 34 C C . CYS A 1 6 ? -30.982 7.968 -51.500 1.00 20.14 ? 6 CYS A C 1 ATOM 35 O O . CYS A 1 6 ? -30.793 9.186 -51.540 1.00 21.08 ? 6 CYS A O 1 ATOM 36 C CB . CYS A 1 6 ? -33.008 6.930 -50.466 1.00 22.83 ? 6 CYS A CB 1 ATOM 37 S SG . CYS A 1 6 ? -33.440 8.272 -49.373 1.00 29.22 ? 6 CYS A SG 1 ATOM 38 N N . LEU A 1 7 ? -30.015 7.084 -51.239 1.00 19.01 ? 7 LEU A N 1 ATOM 39 C CA . LEU A 1 7 ? -28.609 7.468 -51.060 1.00 16.89 ? 7 LEU A CA 1 ATOM 40 C C . LEU A 1 7 ? -28.018 8.149 -52.289 1.00 16.36 ? 7 LEU A C 1 ATOM 41 O O . LEU A 1 7 ? -27.314 9.158 -52.154 1.00 15.93 ? 7 LEU A O 1 ATOM 42 C CB . LEU A 1 7 ? -27.754 6.257 -50.675 1.00 15.79 ? 7 LEU A CB 1 ATOM 43 C CG . LEU A 1 7 ? -27.870 5.742 -49.231 1.00 16.13 ? 7 LEU A CG 1 ATOM 44 C CD1 . LEU A 1 7 ? -27.192 4.356 -49.080 1.00 14.37 ? 7 LEU A CD1 1 ATOM 45 C CD2 . LEU A 1 7 ? -27.350 6.751 -48.195 1.00 14.71 ? 7 LEU A CD2 1 ATOM 46 N N . SER A 1 8 ? -28.313 7.595 -53.471 1.00 15.97 ? 8 SER A N 1 ATOM 47 C CA . SER A 1 8 ? -27.811 8.106 -54.754 1.00 15.63 ? 8 SER A CA 1 ATOM 48 C C . SER A 1 8 ? -28.308 9.497 -55.059 1.00 14.64 ? 8 SER A C 1 ATOM 49 O O . SER A 1 8 ? -27.552 10.322 -55.534 1.00 14.91 ? 8 SER A O 1 ATOM 50 C CB . SER A 1 8 ? -28.211 7.197 -55.918 1.00 16.08 ? 8 SER A CB 1 ATOM 51 O OG . SER A 1 8 ? -27.605 5.935 -55.798 1.00 18.91 ? 8 SER A OG 1 ATOM 52 N N . ALA A 1 9 ? -29.585 9.740 -54.798 1.00 14.38 ? 9 ALA A N 1 ATOM 53 C CA . ALA A 1 9 ? -30.192 11.035 -55.060 1.00 14.79 ? 9 ALA A CA 1 ATOM 54 C C . ALA A 1 9 ? -29.533 12.101 -54.200 1.00 15.27 ? 9 ALA A C 1 ATOM 55 O O . ALA A 1 9 ? -29.364 13.233 -54.646 1.00 16.30 ? 9 ALA A O 1 ATOM 56 C CB . ALA A 1 9 ? -31.693 10.986 -54.795 1.00 14.19 ? 9 ALA A CB 1 ATOM 57 N N . ALA A 1 10 ? -29.154 11.724 -52.976 1.00 15.41 ? 10 ALA A N 1 ATOM 58 C CA . ALA A 1 10 ? -28.426 12.602 -52.045 1.00 15.13 ? 10 ALA A CA 1 ATOM 59 C C . ALA A 1 10 ? -26.917 12.716 -52.320 1.00 15.61 ? 10 ALA A C 1 ATOM 60 O O . ALA A 1 10 ? -26.208 13.437 -51.599 1.00 16.45 ? 10 ALA A O 1 ATOM 61 C CB . ALA A 1 10 ? -28.668 12.162 -50.607 1.00 14.55 ? 10 ALA A CB 1 ATOM 62 N N . GLY A 1 11 ? -26.428 12.021 -53.351 1.00 14.51 ? 11 GLY A N 1 ATOM 63 C CA . GLY A 1 11 ? -25.005 12.096 -53.728 1.00 13.83 ? 11 GLY A CA 1 ATOM 64 C C . GLY A 1 11 ? -24.093 11.267 -52.832 1.00 13.59 ? 11 GLY A C 1 ATOM 65 O O . GLY A 1 11 ? -22.897 11.516 -52.767 1.00 13.41 ? 11 GLY A O 1 ATOM 66 N N . VAL A 1 12 ? -24.664 10.286 -52.132 1.00 13.23 ? 12 VAL A N 1 ATOM 67 C CA . VAL A 1 12 ? -23.910 9.477 -51.173 1.00 13.04 ? 12 VAL A CA 1 ATOM 68 C C . VAL A 1 12 ? -23.423 8.208 -51.865 1.00 13.08 ? 12 VAL A C 1 ATOM 69 O O . VAL A 1 12 ? -24.262 7.426 -52.332 1.00 13.21 ? 12 VAL A O 1 ATOM 70 C CB . VAL A 1 12 ? -24.768 9.085 -49.954 1.00 13.31 ? 12 VAL A CB 1 ATOM 71 C CG1 . VAL A 1 12 ? -23.955 8.219 -48.992 1.00 13.77 ? 12 VAL A CG1 1 ATOM 72 C CG2 . VAL A 1 12 ? -25.305 10.334 -49.237 1.00 12.74 ? 12 VAL A CG2 1 ATOM 73 N N . PRO A 1 13 ? -22.076 8.008 -51.948 1.00 12.10 ? 13 PRO A N 1 ATOM 74 C CA . PRO A 1 13 ? -21.508 6.799 -52.555 1.00 11.75 ? 13 PRO A CA 1 ATOM 75 C C . PRO A 1 13 ? -21.973 5.551 -51.825 1.00 11.59 ? 13 PRO A C 1 ATOM 76 O O . PRO A 1 13 ? -22.071 5.548 -50.591 1.00 11.49 ? 13 PRO A O 1 ATOM 77 C CB . PRO A 1 13 ? -19.985 6.968 -52.371 1.00 11.37 ? 13 PRO A CB 1 ATOM 78 C CG . PRO A 1 13 ? -19.773 8.404 -52.166 1.00 11.66 ? 13 PRO A CG 1 ATOM 79 C CD . PRO A 1 13 ? -21.021 8.933 -51.489 1.00 11.85 ? 13 PRO A CD 1 ATOM 80 N N . ILE A 1 14 ? -22.264 4.502 -52.581 1.00 11.96 ? 14 ILE A N 1 ATOM 81 C CA . ILE A 1 14 ? -22.760 3.263 -51.998 1.00 13.31 ? 14 ILE A CA 1 ATOM 82 C C . ILE A 1 14 ? -21.925 2.075 -52.456 1.00 13.61 ? 14 ILE A C 1 ATOM 83 O O . ILE A 1 14 ? -21.515 2.011 -53.607 1.00 14.12 ? 14 ILE A O 1 ATOM 84 C CB . ILE A 1 14 ? -24.288 3.046 -52.284 1.00 13.52 ? 14 ILE A CB 1 ATOM 85 C CG1 . ILE A 1 14 ? -24.540 2.707 -53.751 1.00 14.25 ? 14 ILE A CG1 1 ATOM 86 C CG2 . ILE A 1 14 ? -25.084 4.289 -51.915 1.00 13.43 ? 14 ILE A CG2 1 ATOM 87 C CD1 . ILE A 1 14 ? -25.909 3.167 -54.270 1.00 15.38 ? 14 ILE A CD1 1 ATOM 88 N N . ASP A 1 15 ? -21.659 1.136 -51.555 1.00 13.68 ? 15 ASP A N 1 ATOM 89 C CA . ASP A 1 15 ? -20.973 -0.072 -51.968 1.00 14.37 ? 15 ASP A CA 1 ATOM 90 C C . ASP A 1 15 ? -21.913 -0.986 -52.722 1.00 14.72 ? 15 ASP A C 1 ATOM 91 O O . ASP A 1 15 ? -23.049 -1.205 -52.297 1.00 14.79 ? 15 ASP A O 1 ATOM 92 C CB . ASP A 1 15 ? -20.394 -0.805 -50.765 1.00 14.78 ? 15 ASP A CB 1 ATOM 93 C CG . ASP A 1 15 ? -19.137 -0.166 -50.259 1.00 14.66 ? 15 ASP A CG 1 ATOM 94 O OD1 . ASP A 1 15 ? -18.558 0.691 -50.972 1.00 14.44 ? 15 ASP A OD1 1 ATOM 95 O OD2 . ASP A 1 15 ? -18.732 -0.527 -49.138 1.00 15.07 ? 15 ASP A OD2 1 ATOM 96 N N . ILE A 1 16 ? -21.421 -1.506 -53.841 1.00 15.11 ? 16 ILE A N 1 ATOM 97 C CA . ILE A 1 16 ? -22.164 -2.412 -54.711 1.00 15.49 ? 16 ILE A CA 1 ATOM 98 C C . ILE A 1 16 ? -21.729 -3.832 -54.411 1.00 16.18 ? 16 ILE A C 1 ATOM 99 O O . ILE A 1 16 ? -20.550 -4.151 -54.563 1.00 16.55 ? 16 ILE A O 1 ATOM 100 C CB . ILE A 1 16 ? -21.903 -2.106 -56.222 1.00 15.43 ? 16 ILE A CB 1 ATOM 101 C CG1 . ILE A 1 16 ? -22.436 -0.713 -56.612 1.00 15.87 ? 16 ILE A CG1 1 ATOM 102 C CG2 . ILE A 1 16 ? -22.466 -3.209 -57.128 1.00 14.91 ? 16 ILE A CG2 1 ATOM 103 C CD1 . ILE A 1 16 ? -23.821 -0.367 -56.006 1.00 16.49 ? 16 ILE A CD1 1 ATOM 104 N N . PRO A 1 17 ? -22.675 -4.692 -53.981 1.00 16.95 ? 17 PRO A N 1 ATOM 105 C CA . PRO A 1 17 ? -22.342 -6.100 -53.744 1.00 17.53 ? 17 PRO A CA 1 ATOM 106 C C . PRO A 1 17 ? -21.656 -6.662 -54.966 1.00 17.93 ? 17 PRO A C 1 ATOM 107 O O . PRO A 1 17 ? -22.109 -6.408 -56.078 1.00 19.03 ? 17 PRO A O 1 ATOM 108 C CB . PRO A 1 17 ? -23.714 -6.761 -53.559 1.00 16.96 ? 17 PRO A CB 1 ATOM 109 C CG . PRO A 1 17 ? -24.567 -5.672 -53.014 1.00 17.21 ? 17 PRO A CG 1 ATOM 110 C CD . PRO A 1 17 ? -24.100 -4.412 -53.715 1.00 16.59 ? 17 PRO A CD 1 ATOM 111 N N . GLY A 1 18 ? -20.560 -7.388 -54.761 1.00 19.26 ? 18 GLY A N 1 ATOM 112 C CA . GLY A 1 18 ? -19.775 -7.938 -55.864 1.00 19.44 ? 18 GLY A CA 1 ATOM 113 C C . GLY A 1 18 ? -18.521 -7.155 -56.228 1.00 22.16 ? 18 GLY A C 1 ATOM 114 O O . GLY A 1 18 ? -17.682 -7.644 -57.000 1.00 24.58 ? 18 GLY A O 1 ATOM 115 N N . THR A 1 19 ? -18.375 -5.941 -55.692 1.00 20.42 ? 19 THR A N 1 ATOM 116 C CA . THR A 1 19 ? -17.154 -5.155 -55.918 1.00 18.21 ? 19 THR A CA 1 ATOM 117 C C . THR A 1 19 ? -16.108 -5.344 -54.800 1.00 18.59 ? 19 THR A C 1 ATOM 118 O O . THR A 1 19 ? -16.412 -5.861 -53.707 1.00 17.30 ? 19 THR A O 1 ATOM 119 C CB . THR A 1 19 ? -17.467 -3.654 -56.118 1.00 17.60 ? 19 THR A CB 1 ATOM 120 O OG1 . THR A 1 19 ? -18.117 -3.126 -54.952 1.00 16.52 ? 19 THR A OG1 1 ATOM 121 C CG2 . THR A 1 19 ? -18.365 -3.444 -57.342 1.00 16.36 ? 19 THR A CG2 1 ATOM 122 N N . ALA A 1 20 ? -14.877 -4.921 -55.086 1.00 17.86 ? 20 ALA A N 1 ATOM 123 C CA . ALA A 1 20 ? -13.789 -4.977 -54.120 1.00 16.53 ? 20 ALA A CA 1 ATOM 124 C C . ALA A 1 20 ? -14.073 -4.129 -52.872 1.00 16.80 ? 20 ALA A C 1 ATOM 125 O O . ALA A 1 20 ? -13.802 -4.575 -51.746 1.00 17.11 ? 20 ALA A O 1 ATOM 126 C CB . ALA A 1 20 ? -12.491 -4.556 -54.763 1.00 16.31 ? 20 ALA A CB 1 ATOM 127 N N . ASP A 1 21 ? -14.612 -2.925 -53.074 1.00 15.53 ? 21 ASP A N 1 ATOM 128 C CA . ASP A 1 21 ? -14.976 -2.025 -51.967 1.00 15.65 ? 21 ASP A CA 1 ATOM 129 C C . ASP A 1 21 ? -16.018 -2.652 -51.027 1.00 14.45 ? 21 ASP A C 1 ATOM 130 O O . ASP A 1 21 ? -15.874 -2.591 -49.805 1.00 13.77 ? 21 ASP A O 1 ATOM 131 C CB . ASP A 1 21 ? -15.499 -0.678 -52.500 1.00 16.74 ? 21 ASP A CB 1 ATOM 132 C CG . ASP A 1 21 ? -14.424 0.399 -52.565 1.00 18.32 ? 21 ASP A CG 1 ATOM 133 O OD1 . ASP A 1 21 ? -13.445 0.381 -51.791 1.00 20.69 ? 21 ASP A OD1 1 ATOM 134 O OD2 . ASP A 1 21 ? -14.569 1.307 -53.384 1.00 20.14 ? 21 ASP A OD2 1 ATOM 135 N N . TYR A 1 22 ? -17.055 -3.259 -51.605 1.00 13.53 ? 22 TYR A N 1 ATOM 136 C CA . TYR A 1 22 ? -18.066 -3.968 -50.818 1.00 13.48 ? 22 TYR A CA 1 ATOM 137 C C . TYR A 1 22 ? -17.472 -5.125 -50.016 1.00 13.37 ? 22 TYR A C 1 ATOM 138 O O . TYR A 1 22 ? -17.779 -5.269 -48.827 1.00 13.88 ? 22 TYR A O 1 ATOM 139 C CB . TYR A 1 22 ? -19.221 -4.475 -51.692 1.00 12.65 ? 22 TYR A CB 1 ATOM 140 C CG . TYR A 1 22 ? -20.334 -5.101 -50.888 1.00 12.44 ? 22 TYR A CG 1 ATOM 141 C CD1 . TYR A 1 22 ? -21.382 -4.325 -50.386 1.00 12.23 ? 22 TYR A CD1 1 ATOM 142 C CD2 . TYR A 1 22 ? -20.331 -6.467 -50.610 1.00 12.41 ? 22 TYR A CD2 1 ATOM 143 C CE1 . TYR A 1 22 ? -22.406 -4.901 -49.628 1.00 12.36 ? 22 TYR A CE1 1 ATOM 144 C CE2 . TYR A 1 22 ? -21.341 -7.054 -49.857 1.00 12.12 ? 22 TYR A CE2 1 ATOM 145 C CZ . TYR A 1 22 ? -22.375 -6.271 -49.365 1.00 12.57 ? 22 TYR A CZ 1 ATOM 146 O OH . TYR A 1 22 ? -23.379 -6.866 -48.627 1.00 12.42 ? 22 TYR A OH 1 ATOM 147 N N . GLU A 1 23 ? -16.626 -5.927 -50.668 1.00 13.19 ? 23 GLU A N 1 ATOM 148 C CA A GLU A 1 23 ? -16.014 -7.074 -50.015 0.50 13.11 ? 23 GLU A CA 1 ATOM 149 C CA B GLU A 1 23 ? -15.953 -7.072 -50.045 0.50 13.25 ? 23 GLU A CA 1 ATOM 150 C C . GLU A 1 23 ? -15.128 -6.644 -48.833 1.00 13.12 ? 23 GLU A C 1 ATOM 151 O O . GLU A 1 23 ? -15.123 -7.305 -47.791 1.00 12.86 ? 23 GLU A O 1 ATOM 152 C CB A GLU A 1 23 ? -15.230 -7.906 -51.024 0.50 13.22 ? 23 GLU A CB 1 ATOM 153 C CB B GLU A 1 23 ? -15.018 -7.747 -51.046 0.50 13.65 ? 23 GLU A CB 1 ATOM 154 C CG A GLU A 1 23 ? -15.467 -9.401 -50.907 0.50 13.63 ? 23 GLU A CG 1 ATOM 155 C CG B GLU A 1 23 ? -15.625 -8.855 -51.882 0.50 14.21 ? 23 GLU A CG 1 ATOM 156 C CD A GLU A 1 23 ? -16.857 -9.823 -51.372 0.50 13.71 ? 23 GLU A CD 1 ATOM 157 C CD B GLU A 1 23 ? -14.550 -9.770 -52.455 0.50 14.81 ? 23 GLU A CD 1 ATOM 158 O OE1 A GLU A 1 23 ? -17.481 -10.674 -50.687 0.50 13.56 ? 23 GLU A OE1 1 ATOM 159 O OE1 B GLU A 1 23 ? -13.726 -9.290 -53.275 0.50 15.39 ? 23 GLU A OE1 1 ATOM 160 O OE2 A GLU A 1 23 ? -17.315 -9.313 -52.421 0.50 13.30 ? 23 GLU A OE2 1 ATOM 161 O OE2 B GLU A 1 23 ? -14.519 -10.960 -52.070 0.50 14.57 ? 23 GLU A OE2 1 ATOM 162 N N . ARG A 1 24 ? -14.406 -5.537 -48.994 1.00 12.86 ? 24 ARG A N 1 ATOM 163 C CA . ARG A 1 24 ? -13.556 -4.996 -47.953 1.00 12.67 ? 24 ARG A CA 1 ATOM 164 C C . ARG A 1 24 ? -14.383 -4.426 -46.808 1.00 12.34 ? 24 ARG A C 1 ATOM 165 O O . ARG A 1 24 ? -14.150 -4.767 -45.648 1.00 12.24 ? 24 ARG A O 1 ATOM 166 C CB . ARG A 1 24 ? -12.653 -3.910 -48.530 1.00 13.77 ? 24 ARG A CB 1 ATOM 167 C CG . ARG A 1 24 ? -11.815 -3.167 -47.484 1.00 14.75 ? 24 ARG A CG 1 ATOM 168 C CD . ARG A 1 24 ? -11.115 -1.983 -48.108 1.00 15.59 ? 24 ARG A CD 1 ATOM 169 N NE . ARG A 1 24 ? -10.840 -0.949 -47.120 1.00 17.27 ? 24 ARG A NE 1 ATOM 170 C CZ . ARG A 1 24 ? -10.139 0.157 -47.354 1.00 17.26 ? 24 ARG A CZ 1 ATOM 171 N NH1 . ARG A 1 24 ? -9.634 0.380 -48.558 1.00 18.03 ? 24 ARG A NH1 1 ATOM 172 N NH2 . ARG A 1 24 ? -9.946 1.044 -46.380 1.00 16.55 ? 24 ARG A NH2 1 ATOM 173 N N . ASP A 1 25 ? -15.360 -3.581 -47.148 1.00 11.46 ? 25 ASP A N 1 ATOM 174 C CA . ASP A 1 25 ? -16.128 -2.828 -46.152 1.00 10.80 ? 25 ASP A CA 1 ATOM 175 C C . ASP A 1 25 ? -17.087 -3.691 -45.337 1.00 10.49 ? 25 ASP A C 1 ATOM 176 O O . ASP A 1 25 ? -17.425 -3.339 -44.203 1.00 10.26 ? 25 ASP A O 1 ATOM 177 C CB . ASP A 1 25 ? -16.884 -1.644 -46.799 1.00 10.66 ? 25 ASP A CB 1 ATOM 178 C CG . ASP A 1 25 ? -15.945 -0.558 -47.372 1.00 10.61 ? 25 ASP A CG 1 ATOM 179 O OD1 . ASP A 1 25 ? -14.742 -0.526 -47.040 1.00 10.61 ? 25 ASP A OD1 1 ATOM 180 O OD2 . ASP A 1 25 ? -16.419 0.285 -48.161 1.00 10.57 ? 25 ASP A OD2 1 ATOM 181 N N . VAL A 1 26 ? -17.522 -4.815 -45.912 1.00 10.17 ? 26 VAL A N 1 ATOM 182 C CA . VAL A 1 26 ? -18.518 -5.682 -45.276 1.00 9.78 ? 26 VAL A CA 1 ATOM 183 C C . VAL A 1 26 ? -17.854 -6.753 -44.385 1.00 9.89 ? 26 VAL A C 1 ATOM 184 O O . VAL A 1 26 ? -18.520 -7.432 -43.607 1.00 10.39 ? 26 VAL A O 1 ATOM 185 C CB . VAL A 1 26 ? -19.481 -6.324 -46.328 1.00 9.57 ? 26 VAL A CB 1 ATOM 186 C CG1 . VAL A 1 26 ? -18.897 -7.620 -46.929 1.00 9.12 ? 26 VAL A CG1 1 ATOM 187 C CG2 . VAL A 1 26 ? -20.846 -6.578 -45.726 1.00 9.25 ? 26 VAL A CG2 1 ATOM 188 N N . GLU A 1 27 ? -16.543 -6.894 -44.508 1.00 9.63 ? 27 GLU A N 1 ATOM 189 C CA . GLU A 1 27 ? -15.802 -7.834 -43.692 1.00 10.08 ? 27 GLU A CA 1 ATOM 190 C C . GLU A 1 27 ? -15.640 -7.368 -42.227 1.00 9.84 ? 27 GLU A C 1 ATOM 191 O O . GLU A 1 27 ? -15.027 -6.324 -41.966 1.00 9.78 ? 27 GLU A O 1 ATOM 192 C CB . GLU A 1 27 ? -14.436 -8.130 -44.322 1.00 10.52 ? 27 GLU A CB 1 ATOM 193 C CG . GLU A 1 27 ? -13.758 -9.347 -43.720 1.00 10.96 ? 27 GLU A CG 1 ATOM 194 C CD . GLU A 1 27 ? -12.449 -9.695 -44.408 1.00 11.89 ? 27 GLU A CD 1 ATOM 195 O OE1 . GLU A 1 27 ? -11.722 -8.768 -44.868 1.00 12.04 ? 27 GLU A OE1 1 ATOM 196 O OE2 . GLU A 1 27 ? -12.146 -10.914 -44.484 1.00 11.98 ? 27 GLU A OE2 1 ATOM 197 N N . PRO A 1 28 ? -16.183 -8.150 -41.272 1.00 9.46 ? 28 PRO A N 1 ATOM 198 C CA . PRO A 1 28 ? -16.027 -7.809 -39.850 1.00 9.31 ? 28 PRO A CA 1 ATOM 199 C C . PRO A 1 28 ? -14.594 -8.060 -39.399 1.00 9.29 ? 28 PRO A C 1 ATOM 200 O O . PRO A 1 28 ? -13.921 -8.938 -39.975 1.00 9.50 ? 28 PRO A O 1 ATOM 201 C CB . PRO A 1 28 ? -16.961 -8.804 -39.153 1.00 9.27 ? 28 PRO A CB 1 ATOM 202 C CG . PRO A 1 28 ? -16.968 -10.032 -40.093 1.00 9.17 ? 28 PRO A CG 1 ATOM 203 C CD . PRO A 1 28 ? -16.886 -9.440 -41.475 1.00 9.40 ? 28 PRO A CD 1 ATOM 204 N N . PHE A 1 29 ? -14.117 -7.324 -38.389 1.00 8.86 ? 29 PHE A N 1 ATOM 205 C CA . PHE A 1 29 ? -12.824 -7.688 -37.791 1.00 9.04 ? 29 PHE A CA 1 ATOM 206 C C . PHE A 1 29 ? -12.913 -9.082 -37.135 1.00 9.16 ? 29 PHE A C 1 ATOM 207 O O . PHE A 1 29 ? -12.011 -9.906 -37.292 1.00 9.16 ? 29 PHE A O 1 ATOM 208 C CB . PHE A 1 29 ? -12.285 -6.638 -36.807 1.00 8.56 ? 29 PHE A CB 1 ATOM 209 C CG . PHE A 1 29 ? -11.110 -7.128 -35.992 1.00 8.50 ? 29 PHE A CG 1 ATOM 210 C CD1 . PHE A 1 29 ? -9.846 -7.296 -36.585 1.00 8.27 ? 29 PHE A CD1 1 ATOM 211 C CD2 . PHE A 1 29 ? -11.270 -7.469 -34.649 1.00 8.26 ? 29 PHE A CD2 1 ATOM 212 C CE1 . PHE A 1 29 ? -8.765 -7.770 -35.836 1.00 8.23 ? 29 PHE A CE1 1 ATOM 213 C CE2 . PHE A 1 29 ? -10.191 -7.945 -33.896 1.00 8.16 ? 29 PHE A CE2 1 ATOM 214 C CZ . PHE A 1 29 ? -8.937 -8.087 -34.488 1.00 8.25 ? 29 PHE A CZ 1 ATOM 215 N N . ASN A 1 30 ? -14.005 -9.331 -36.417 1.00 9.35 ? 30 ASN A N 1 ATOM 216 C CA . ASN A 1 30 ? -14.283 -10.643 -35.855 1.00 9.62 ? 30 ASN A CA 1 ATOM 217 C C . ASN A 1 30 ? -15.162 -11.457 -36.817 1.00 10.44 ? 30 ASN A C 1 ATOM 218 O O . ASN A 1 30 ? -16.397 -11.276 -36.854 1.00 10.03 ? 30 ASN A O 1 ATOM 219 C CB . ASN A 1 30 ? -14.935 -10.515 -34.474 1.00 9.02 ? 30 ASN A CB 1 ATOM 220 C CG . ASN A 1 30 ? -14.903 -11.817 -33.688 1.00 9.14 ? 30 ASN A CG 1 ATOM 221 O OD1 . ASN A 1 30 ? -14.547 -12.870 -34.230 1.00 9.52 ? 30 ASN A OD1 1 ATOM 222 N ND2 . ASN A 1 30 ? -15.263 -11.756 -32.409 1.00 8.65 ? 30 ASN A ND2 1 ATOM 223 N N . ILE A 1 31 ? -14.532 -12.354 -37.588 1.00 10.94 ? 31 ILE A N 1 ATOM 224 C CA . ILE A 1 31 ? -15.287 -13.118 -38.592 1.00 12.03 ? 31 ILE A CA 1 ATOM 225 C C . ILE A 1 31 ? -16.223 -14.180 -37.985 1.00 12.42 ? 31 ILE A C 1 ATOM 226 O O . ILE A 1 31 ? -17.058 -14.737 -38.685 1.00 12.24 ? 31 ILE A O 1 ATOM 227 C CB . ILE A 1 31 ? -14.416 -13.709 -39.742 1.00 12.80 ? 31 ILE A CB 1 ATOM 228 C CG1 . ILE A 1 31 ? -13.305 -14.632 -39.203 1.00 13.43 ? 31 ILE A CG1 1 ATOM 229 C CG2 . ILE A 1 31 ? -13.897 -12.606 -40.634 1.00 12.20 ? 31 ILE A CG2 1 ATOM 230 C CD1 . ILE A 1 31 ? -12.928 -15.755 -40.182 1.00 14.15 ? 31 ILE A CD1 1 ATOM 231 N N . ARG A 1 32 ? -16.076 -14.441 -36.686 1.00 12.05 ? 32 ARG A N 1 ATOM 232 C CA . ARG A 1 32 ? -17.106 -15.124 -35.921 1.00 11.62 ? 32 ARG A CA 1 ATOM 233 C C . ARG A 1 32 ? -18.462 -14.420 -36.069 1.00 12.25 ? 32 ARG A C 1 ATOM 234 O O . ARG A 1 32 ? -19.494 -15.080 -36.042 1.00 13.23 ? 32 ARG A O 1 ATOM 235 C CB . ARG A 1 32 ? -16.724 -15.177 -34.432 1.00 11.00 ? 32 ARG A CB 1 ATOM 236 C CG . ARG A 1 32 ? -17.624 -16.062 -33.610 1.00 10.30 ? 32 ARG A CG 1 ATOM 237 C CD . ARG A 1 32 ? -17.133 -16.282 -32.193 1.00 9.82 ? 32 ARG A CD 1 ATOM 238 N NE . ARG A 1 32 ? -17.512 -15.224 -31.255 1.00 9.45 ? 32 ARG A NE 1 ATOM 239 C CZ . ARG A 1 32 ? -18.748 -14.990 -30.809 1.00 9.69 ? 32 ARG A CZ 1 ATOM 240 N NH1 . ARG A 1 32 ? -18.944 -14.008 -29.937 1.00 9.21 ? 32 ARG A NH1 1 ATOM 241 N NH2 . ARG A 1 32 ? -19.796 -15.716 -31.233 1.00 9.48 ? 32 ARG A NH2 1 ATOM 242 N N . LEU A 1 33 ? -18.479 -13.089 -36.206 1.00 12.08 ? 33 LEU A N 1 ATOM 243 C CA . LEU A 1 33 ? -19.769 -12.397 -36.360 1.00 11.60 ? 33 LEU A CA 1 ATOM 244 C C . LEU A 1 33 ? -19.889 -11.532 -37.633 1.00 11.43 ? 33 LEU A C 1 ATOM 245 O O . LEU A 1 33 ? -19.718 -10.321 -37.575 1.00 10.74 ? 33 LEU A O 1 ATOM 246 C CB . LEU A 1 33 ? -20.125 -11.612 -35.084 1.00 11.12 ? 33 LEU A CB 1 ATOM 247 C CG . LEU A 1 33 ? -20.051 -12.369 -33.738 1.00 11.07 ? 33 LEU A CG 1 ATOM 248 C CD1 . LEU A 1 33 ? -19.910 -11.427 -32.563 1.00 10.52 ? 33 LEU A CD1 1 ATOM 249 C CD2 . LEU A 1 33 ? -21.240 -13.314 -33.524 1.00 10.97 ? 33 LEU A CD2 1 ATOM 250 N N . PRO A 1 34 ? -20.183 -12.165 -38.791 1.00 11.52 ? 34 PRO A N 1 ATOM 251 C CA . PRO A 1 34 ? -20.521 -11.382 -39.978 1.00 11.37 ? 34 PRO A CA 1 ATOM 252 C C . PRO A 1 34 ? -21.979 -10.934 -39.905 1.00 11.18 ? 34 PRO A C 1 ATOM 253 O O . PRO A 1 34 ? -22.834 -11.665 -39.396 1.00 11.00 ? 34 PRO A O 1 ATOM 254 C CB . PRO A 1 34 ? -20.348 -12.391 -41.116 1.00 11.11 ? 34 PRO A CB 1 ATOM 255 C CG . PRO A 1 34 ? -20.782 -13.690 -40.510 1.00 11.10 ? 34 PRO A CG 1 ATOM 256 C CD . PRO A 1 34 ? -20.291 -13.617 -39.055 1.00 11.85 ? 34 PRO A CD 1 ATOM 257 N N . TYR A 1 35 ? -22.259 -9.730 -40.381 1.00 11.26 ? 35 TYR A N 1 ATOM 258 C CA . TYR A 1 35 ? -23.653 -9.308 -40.537 1.00 11.19 ? 35 TYR A CA 1 ATOM 259 C C . TYR A 1 35 ? -23.837 -8.700 -41.907 1.00 10.63 ? 35 TYR A C 1 ATOM 260 O O . TYR A 1 35 ? -22.869 -8.249 -42.526 1.00 10.46 ? 35 TYR A O 1 ATOM 261 C CB . TYR A 1 35 ? -24.096 -8.330 -39.438 1.00 11.35 ? 35 TYR A CB 1 ATOM 262 C CG . TYR A 1 35 ? -24.189 -8.947 -38.070 1.00 11.47 ? 35 TYR A CG 1 ATOM 263 C CD1 . TYR A 1 35 ? -23.315 -8.561 -37.050 1.00 11.95 ? 35 TYR A CD1 1 ATOM 264 C CD2 . TYR A 1 35 ? -25.131 -9.937 -37.794 1.00 11.62 ? 35 TYR A CD2 1 ATOM 265 C CE1 . TYR A 1 35 ? -23.397 -9.132 -35.769 1.00 12.06 ? 35 TYR A CE1 1 ATOM 266 C CE2 . TYR A 1 35 ? -25.221 -10.517 -36.528 1.00 11.92 ? 35 TYR A CE2 1 ATOM 267 C CZ . TYR A 1 35 ? -24.351 -10.107 -35.520 1.00 11.94 ? 35 TYR A CZ 1 ATOM 268 O OH . TYR A 1 35 ? -24.434 -10.681 -34.279 1.00 11.66 ? 35 TYR A OH 1 ATOM 269 N N . ILE A 1 36 ? -25.077 -8.704 -42.377 1.00 10.19 ? 36 ILE A N 1 ATOM 270 C CA . ILE A 1 36 ? -25.380 -8.246 -43.713 1.00 10.38 ? 36 ILE A CA 1 ATOM 271 C C . ILE A 1 36 ? -26.224 -6.967 -43.649 1.00 10.01 ? 36 ILE A C 1 ATOM 272 O O . ILE A 1 36 ? -27.430 -7.034 -43.446 1.00 9.93 ? 36 ILE A O 1 ATOM 273 C CB . ILE A 1 36 ? -26.095 -9.376 -44.516 1.00 10.89 ? 36 ILE A CB 1 ATOM 274 C CG1 . ILE A 1 36 ? -25.348 -10.701 -44.341 1.00 10.94 ? 36 ILE A CG1 1 ATOM 275 C CG2 . ILE A 1 36 ? -26.247 -9.006 -45.989 1.00 10.59 ? 36 ILE A CG2 1 ATOM 276 C CD1 . ILE A 1 36 ? -25.994 -11.857 -45.030 1.00 11.78 ? 36 ILE A CD1 1 ATOM 277 N N . PRO A 1 37 ? -25.592 -5.791 -43.832 1.00 10.06 ? 37 PRO A N 1 ATOM 278 C CA . PRO A 1 37 ? -26.392 -4.563 -43.833 1.00 9.68 ? 37 PRO A CA 1 ATOM 279 C C . PRO A 1 37 ? -27.268 -4.499 -45.077 1.00 9.52 ? 37 PRO A C 1 ATOM 280 O O . PRO A 1 37 ? -27.001 -5.191 -46.071 1.00 9.45 ? 37 PRO A O 1 ATOM 281 C CB . PRO A 1 37 ? -25.332 -3.448 -43.864 1.00 9.50 ? 37 PRO A CB 1 ATOM 282 C CG . PRO A 1 37 ? -24.015 -4.139 -43.601 1.00 9.65 ? 37 PRO A CG 1 ATOM 283 C CD . PRO A 1 37 ? -24.177 -5.510 -44.138 1.00 9.61 ? 37 PRO A CD 1 ATOM 284 N N . THR A 1 38 ? -28.322 -3.699 -45.032 1.00 9.45 ? 38 THR A N 1 ATOM 285 C CA . THR A 1 38 ? -29.157 -3.581 -46.210 1.00 9.73 ? 38 THR A CA 1 ATOM 286 C C . THR A 1 38 ? -28.444 -2.789 -47.335 1.00 9.89 ? 38 THR A C 1 ATOM 287 O O . THR A 1 38 ? -28.711 -2.987 -48.528 1.00 9.56 ? 38 THR A O 1 ATOM 288 C CB . THR A 1 38 ? -30.557 -3.042 -45.873 1.00 9.62 ? 38 THR A CB 1 ATOM 289 O OG1 . THR A 1 38 ? -31.394 -3.200 -47.020 1.00 9.96 ? 38 THR A OG1 1 ATOM 290 C CG2 . THR A 1 38 ? -30.509 -1.575 -45.473 1.00 9.81 ? 38 THR A CG2 1 ATOM 291 N N . ALA A 1 39 ? -27.532 -1.907 -46.921 1.00 9.46 ? 39 ALA A N 1 ATOM 292 C CA . ALA A 1 39 ? -26.724 -1.112 -47.820 1.00 9.50 ? 39 ALA A CA 1 ATOM 293 C C . ALA A 1 39 ? -25.596 -0.513 -47.009 1.00 9.43 ? 39 ALA A C 1 ATOM 294 O O . ALA A 1 39 ? -25.721 -0.366 -45.792 1.00 9.15 ? 39 ALA A O 1 ATOM 295 C CB . ALA A 1 39 ? -27.550 0.001 -48.494 1.00 9.22 ? 39 ALA A CB 1 ATOM 296 N N . ILE A 1 40 ? -24.505 -0.176 -47.701 1.00 9.53 ? 40 ILE A N 1 ATOM 297 C CA . ILE A 1 40 ? -23.340 0.442 -47.107 1.00 9.61 ? 40 ILE A CA 1 ATOM 298 C C . ILE A 1 40 ? -23.072 1.797 -47.766 1.00 10.15 ? 40 ILE A C 1 ATOM 299 O O . ILE A 1 40 ? -22.694 1.875 -48.942 1.00 10.47 ? 40 ILE A O 1 ATOM 300 C CB . ILE A 1 40 ? -22.093 -0.455 -47.243 1.00 9.57 ? 40 ILE A CB 1 ATOM 301 C CG1 . ILE A 1 40 ? -22.357 -1.862 -46.673 1.00 9.22 ? 40 ILE A CG1 1 ATOM 302 C CG2 . ILE A 1 40 ? -20.905 0.187 -46.532 1.00 9.46 ? 40 ILE A CG2 1 ATOM 303 C CD1 . ILE A 1 40 ? -21.222 -2.846 -46.923 1.00 8.82 ? 40 ILE A CD1 1 ATOM 304 N N . ALA A 1 41 ? -23.289 2.865 -47.003 1.00 10.34 ? 41 ALA A N 1 ATOM 305 C CA . ALA A 1 41 ? -22.948 4.217 -47.435 1.00 9.98 ? 41 ALA A CA 1 ATOM 306 C C . ALA A 1 41 ? -21.490 4.498 -47.102 1.00 10.09 ? 41 ALA A C 1 ATOM 307 O O . ALA A 1 41 ? -21.118 4.587 -45.934 1.00 10.52 ? 41 ALA A O 1 ATOM 308 C CB . ALA A 1 41 ? -23.860 5.232 -46.762 1.00 9.49 ? 41 ALA A CB 1 ATOM 309 N N . GLN A 1 42 ? -20.663 4.630 -48.133 1.00 10.43 ? 42 GLN A N 1 ATOM 310 C CA . GLN A 1 42 ? -19.235 4.892 -47.958 1.00 10.06 ? 42 GLN A CA 1 ATOM 311 C C . GLN A 1 42 ? -19.024 6.403 -48.011 1.00 9.95 ? 42 GLN A C 1 ATOM 312 O O . GLN A 1 42 ? -18.798 6.975 -49.075 1.00 10.13 ? 42 GLN A O 1 ATOM 313 C CB . GLN A 1 42 ? -18.443 4.185 -49.055 1.00 10.27 ? 42 GLN A CB 1 ATOM 314 C CG . GLN A 1 42 ? -16.990 3.859 -48.698 1.00 10.51 ? 42 GLN A CG 1 ATOM 315 C CD . GLN A 1 42 ? -16.135 3.603 -49.932 1.00 10.51 ? 42 GLN A CD 1 ATOM 316 O OE1 . GLN A 1 42 ? -15.967 4.491 -50.773 1.00 10.41 ? 42 GLN A OE1 1 ATOM 317 N NE2 . GLN A 1 42 ? -15.585 2.390 -50.044 1.00 10.43 ? 42 GLN A NE2 1 ATOM 318 N N . THR A 1 43 ? -19.118 7.052 -46.854 1.00 9.75 ? 43 THR A N 1 ATOM 319 C CA . THR A 1 43 ? -19.194 8.500 -46.811 1.00 9.22 ? 43 THR A CA 1 ATOM 320 C C . THR A 1 43 ? -17.842 9.190 -46.982 1.00 9.74 ? 43 THR A C 1 ATOM 321 O O . THR A 1 43 ? -16.798 8.691 -46.536 1.00 8.96 ? 43 THR A O 1 ATOM 322 C CB . THR A 1 43 ? -19.865 8.998 -45.519 1.00 9.04 ? 43 THR A CB 1 ATOM 323 O OG1 . THR A 1 43 ? -19.126 8.538 -44.387 1.00 8.49 ? 43 THR A OG1 1 ATOM 324 C CG2 . THR A 1 43 ? -21.336 8.533 -45.417 1.00 8.74 ? 43 THR A CG2 1 ATOM 325 N N . GLN A 1 44 ? -17.893 10.361 -47.624 1.00 10.55 ? 44 GLN A N 1 ATOM 326 C CA . GLN A 1 44 ? -16.734 11.222 -47.830 1.00 10.76 ? 44 GLN A CA 1 ATOM 327 C C . GLN A 1 44 ? -16.805 12.542 -47.024 1.00 11.06 ? 44 GLN A C 1 ATOM 328 O O . GLN A 1 44 ? -15.775 13.162 -46.751 1.00 11.75 ? 44 GLN A O 1 ATOM 329 C CB . GLN A 1 44 ? -16.554 11.508 -49.330 1.00 10.89 ? 44 GLN A CB 1 ATOM 330 C CG . GLN A 1 44 ? -16.194 10.272 -50.181 1.00 11.13 ? 44 GLN A CG 1 ATOM 331 C CD . GLN A 1 44 ? -14.777 9.725 -49.902 1.00 11.81 ? 44 GLN A CD 1 ATOM 332 O OE1 . GLN A 1 44 ? -13.860 10.464 -49.526 1.00 12.38 ? 44 GLN A OE1 1 ATOM 333 N NE2 . GLN A 1 44 ? -14.600 8.432 -50.102 1.00 11.47 ? 44 GLN A NE2 1 ATOM 334 N N . THR A 1 45 ? -18.009 12.964 -46.638 1.00 11.21 ? 45 THR A N 1 ATOM 335 C CA . THR A 1 45 ? -18.208 14.277 -45.999 1.00 11.00 ? 45 THR A CA 1 ATOM 336 C C . THR A 1 45 ? -19.191 14.213 -44.832 1.00 10.58 ? 45 THR A C 1 ATOM 337 O O . THR A 1 45 ? -19.928 13.237 -44.690 1.00 10.62 ? 45 THR A O 1 ATOM 338 C CB . THR A 1 45 ? -18.762 15.323 -47.002 1.00 11.26 ? 45 THR A CB 1 ATOM 339 O OG1 . THR A 1 45 ? -20.050 14.898 -47.479 1.00 11.48 ? 45 THR A OG1 1 ATOM 340 C CG2 . THR A 1 45 ? -17.815 15.517 -48.176 1.00 11.20 ? 45 THR A CG2 1 ATOM 341 N N . THR A 1 46 ? -19.217 15.261 -44.013 1.00 10.28 ? 46 THR A N 1 ATOM 342 C CA . THR A 1 46 ? -20.229 15.376 -42.975 1.00 10.56 ? 46 THR A CA 1 ATOM 343 C C . THR A 1 46 ? -21.642 15.320 -43.581 1.00 10.71 ? 46 THR A C 1 ATOM 344 O O . THR A 1 46 ? -22.520 14.642 -43.036 1.00 10.69 ? 46 THR A O 1 ATOM 345 C CB . THR A 1 46 ? -20.039 16.651 -42.112 1.00 10.52 ? 46 THR A CB 1 ATOM 346 O OG1 . THR A 1 46 ? -18.728 16.637 -41.531 1.00 10.33 ? 46 THR A OG1 1 ATOM 347 C CG2 . THR A 1 46 ? -21.093 16.712 -40.992 1.00 10.20 ? 46 THR A CG2 1 ATOM 348 N N . ALA A 1 47 ? -21.833 16.003 -44.716 1.00 10.95 ? 47 ALA A N 1 ATOM 349 C CA . ALA A 1 47 ? -23.107 16.013 -45.445 1.00 11.16 ? 47 ALA A CA 1 ATOM 350 C C . ALA A 1 47 ? -23.600 14.610 -45.834 1.00 11.58 ? 47 ALA A C 1 ATOM 351 O O . ALA A 1 47 ? -24.789 14.291 -45.647 1.00 11.81 ? 47 ALA A O 1 ATOM 352 C CB . ALA A 1 47 ? -23.025 16.927 -46.673 1.00 11.18 ? 47 ALA A CB 1 ATOM 353 N N . HIS A 1 48 ? -22.693 13.772 -46.349 1.00 11.52 ? 48 HIS A N 1 ATOM 354 C CA . HIS A 1 48 ? -23.032 12.374 -46.655 1.00 11.58 ? 48 HIS A CA 1 ATOM 355 C C . HIS A 1 48 ? -23.566 11.656 -45.423 1.00 11.61 ? 48 HIS A C 1 ATOM 356 O O . HIS A 1 48 ? -24.634 11.045 -45.494 1.00 10.97 ? 48 HIS A O 1 ATOM 357 C CB . HIS A 1 48 ? -21.844 11.585 -47.217 1.00 11.35 ? 48 HIS A CB 1 ATOM 358 C CG . HIS A 1 48 ? -21.397 12.036 -48.568 1.00 11.43 ? 48 HIS A CG 1 ATOM 359 N ND1 . HIS A 1 48 ? -20.121 11.801 -49.040 1.00 11.31 ? 48 HIS A ND1 1 ATOM 360 C CD2 . HIS A 1 48 ? -22.045 12.718 -49.546 1.00 11.56 ? 48 HIS A CD2 1 ATOM 361 C CE1 . HIS A 1 48 ? -20.004 12.318 -50.252 1.00 11.64 ? 48 HIS A CE1 1 ATOM 362 N NE2 . HIS A 1 48 ? -21.156 12.876 -50.585 1.00 11.72 ? 48 HIS A NE2 1 ATOM 363 N N . ILE A 1 49 ? -22.815 11.741 -44.311 1.00 11.52 ? 49 ILE A N 1 ATOM 364 C CA . ILE A 1 49 ? -23.243 11.192 -43.015 1.00 11.15 ? 49 ILE A CA 1 ATOM 365 C C . ILE A 1 49 ? -24.673 11.634 -42.646 1.00 11.39 ? 49 ILE A C 1 ATOM 366 O O . ILE A 1 49 ? -25.505 10.797 -42.268 1.00 10.98 ? 49 ILE A O 1 ATOM 367 C CB . ILE A 1 49 ? -22.249 11.507 -41.858 1.00 10.73 ? 49 ILE A CB 1 ATOM 368 C CG1 . ILE A 1 49 ? -20.855 10.942 -42.169 1.00 10.95 ? 49 ILE A CG1 1 ATOM 369 C CG2 . ILE A 1 49 ? -22.754 10.883 -40.572 1.00 10.61 ? 49 ILE A CG2 1 ATOM 370 C CD1 . ILE A 1 49 ? -19.708 11.399 -41.223 1.00 10.60 ? 49 ILE A CD1 1 ATOM 371 N N . GLN A 1 50 ? -24.952 12.936 -42.779 1.00 11.19 ? 50 GLN A N 1 ATOM 372 C CA . GLN A 1 50 ? -26.290 13.493 -42.512 1.00 11.12 ? 50 GLN A CA 1 ATOM 373 C C . GLN A 1 50 ? -27.355 12.983 -43.495 1.00 10.72 ? 50 GLN A C 1 ATOM 374 O O . GLN A 1 50 ? -28.488 12.692 -43.108 1.00 10.25 ? 50 GLN A O 1 ATOM 375 C CB . GLN A 1 50 ? -26.237 15.028 -42.519 1.00 10.98 ? 50 GLN A CB 1 ATOM 376 C CG . GLN A 1 50 ? -27.581 15.717 -42.738 1.00 10.69 ? 50 GLN A CG 1 ATOM 377 C CD . GLN A 1 50 ? -27.443 17.222 -42.743 1.00 10.97 ? 50 GLN A CD 1 ATOM 378 O OE1 . GLN A 1 50 ? -26.612 17.793 -43.476 1.00 10.82 ? 50 GLN A OE1 1 ATOM 379 N NE2 . GLN A 1 50 ? -28.248 17.885 -41.908 1.00 10.44 ? 50 GLN A NE2 1 ATOM 380 N N . SER A 1 51 ? -26.982 12.874 -44.767 1.00 10.95 ? 51 SER A N 1 ATOM 381 C CA . SER A 1 51 ? -27.886 12.332 -45.770 1.00 10.70 ? 51 SER A CA 1 ATOM 382 C C . SER A 1 51 ? -28.234 10.885 -45.468 1.00 10.88 ? 51 SER A C 1 ATOM 383 O O . SER A 1 51 ? -29.409 10.507 -45.537 1.00 11.19 ? 51 SER A O 1 ATOM 384 C CB . SER A 1 51 ? -27.292 12.465 -47.153 1.00 10.60 ? 51 SER A CB 1 ATOM 385 O OG . SER A 1 51 ? -27.089 13.827 -47.466 1.00 11.27 ? 51 SER A OG 1 ATOM 386 N N . ALA A 1 52 ? -27.223 10.089 -45.120 1.00 10.69 ? 52 ALA A N 1 ATOM 387 C CA . ALA A 1 52 ? -27.416 8.686 -44.750 1.00 10.97 ? 52 ALA A CA 1 ATOM 388 C C . ALA A 1 52 ? -28.432 8.579 -43.621 1.00 11.21 ? 52 ALA A C 1 ATOM 389 O O . ALA A 1 52 ? -29.425 7.843 -43.730 1.00 11.20 ? 52 ALA A O 1 ATOM 390 C CB . ALA A 1 52 ? -26.082 8.029 -44.350 1.00 10.77 ? 52 ALA A CB 1 ATOM 391 N N . VAL A 1 53 ? -28.202 9.334 -42.550 1.00 11.52 ? 53 VAL A N 1 ATOM 392 C CA . VAL A 1 53 ? -29.136 9.363 -41.416 1.00 11.95 ? 53 VAL A CA 1 ATOM 393 C C . VAL A 1 53 ? -30.553 9.761 -41.879 1.00 12.91 ? 53 VAL A C 1 ATOM 394 O O . VAL A 1 53 ? -31.538 9.126 -41.490 1.00 13.00 ? 53 VAL A O 1 ATOM 395 C CB . VAL A 1 53 ? -28.624 10.242 -40.259 1.00 11.32 ? 53 VAL A CB 1 ATOM 396 C CG1 . VAL A 1 53 ? -29.697 10.396 -39.165 1.00 11.31 ? 53 VAL A CG1 1 ATOM 397 C CG2 . VAL A 1 53 ? -27.352 9.645 -39.673 1.00 10.97 ? 53 VAL A CG2 1 ATOM 398 N N . GLN A 1 54 ? -30.644 10.777 -42.737 1.00 14.43 ? 54 GLN A N 1 ATOM 399 C CA . GLN A 1 54 ? -31.927 11.174 -43.347 1.00 15.79 ? 54 GLN A CA 1 ATOM 400 C C . GLN A 1 54 ? -32.636 10.021 -44.057 1.00 16.09 ? 54 GLN A C 1 ATOM 401 O O . GLN A 1 54 ? -33.837 9.831 -43.885 1.00 16.56 ? 54 GLN A O 1 ATOM 402 C CB . GLN A 1 54 ? -31.720 12.306 -44.344 1.00 15.84 ? 54 GLN A CB 1 ATOM 403 C CG . GLN A 1 54 ? -32.257 13.635 -43.898 1.00 17.46 ? 54 GLN A CG 1 ATOM 404 C CD . GLN A 1 54 ? -32.224 14.651 -45.031 1.00 19.20 ? 54 GLN A CD 1 ATOM 405 O OE1 . GLN A 1 54 ? -31.191 14.824 -45.705 1.00 18.97 ? 54 GLN A OE1 1 ATOM 406 N NE2 . GLN A 1 54 ? -33.359 15.319 -45.260 1.00 18.24 ? 54 GLN A NE2 1 ATOM 407 N N . CYS A 1 55 ? -31.888 9.276 -44.869 1.00 16.41 ? 55 CYS A N 1 ATOM 408 C CA . CYS A 1 55 ? -32.423 8.146 -45.602 1.00 16.48 ? 55 CYS A CA 1 ATOM 409 C C . CYS A 1 55 ? -32.934 7.070 -44.666 1.00 15.96 ? 55 CYS A C 1 ATOM 410 O O . CYS A 1 55 ? -33.962 6.453 -44.944 1.00 15.87 ? 55 CYS A O 1 ATOM 411 C CB . CYS A 1 55 ? -31.367 7.569 -46.532 1.00 17.48 ? 55 CYS A CB 1 ATOM 412 S SG . CYS A 1 55 ? -30.991 8.612 -47.944 1.00 22.04 ? 55 CYS A SG 1 ATOM 413 N N . ALA A 1 56 ? -32.215 6.844 -43.565 1.00 15.99 ? 56 ALA A N 1 ATOM 414 C CA . ALA A 1 56 ? -32.638 5.880 -42.552 1.00 16.77 ? 56 ALA A CA 1 ATOM 415 C C . ALA A 1 56 ? -33.998 6.274 -41.994 1.00 16.90 ? 56 ALA A C 1 ATOM 416 O O . ALA A 1 56 ? -34.881 5.426 -41.848 1.00 16.24 ? 56 ALA A O 1 ATOM 417 C CB . ALA A 1 56 ? -31.603 5.755 -41.418 1.00 16.16 ? 56 ALA A CB 1 ATOM 418 N N . LYS A 1 57 ? -34.144 7.566 -41.697 1.00 18.18 ? 57 LYS A N 1 ATOM 419 C CA . LYS A 1 57 ? -35.381 8.131 -41.174 1.00 20.63 ? 57 LYS A CA 1 ATOM 420 C C . LYS A 1 57 ? -36.577 7.926 -42.104 1.00 21.00 ? 57 LYS A C 1 ATOM 421 O O . LYS A 1 57 ? -37.620 7.416 -41.655 1.00 20.66 ? 57 LYS A O 1 ATOM 422 C CB . LYS A 1 57 ? -35.210 9.615 -40.843 1.00 22.00 ? 57 LYS A CB 1 ATOM 423 C CG . LYS A 1 57 ? -36.394 10.218 -40.103 1.00 23.80 ? 57 LYS A CG 1 ATOM 424 C CD . LYS A 1 57 ? -36.015 11.581 -39.510 1.00 26.78 ? 57 LYS A CD 1 ATOM 425 C CE . LYS A 1 57 ? -37.251 12.366 -39.046 1.00 26.94 ? 57 LYS A CE 1 ATOM 426 N NZ . LYS A 1 57 ? -37.992 13.006 -40.177 1.00 25.60 ? 57 LYS A NZ 1 ATOM 427 N N . LYS A 1 58 ? -36.423 8.283 -43.382 1.00 19.26 ? 58 LYS A N 1 ATOM 428 C CA A LYS A 1 58 ? -37.542 8.152 -44.309 0.50 20.82 ? 58 LYS A CA 1 ATOM 429 C CA B LYS A 1 58 ? -37.492 8.155 -44.378 0.50 20.97 ? 58 LYS A CA 1 ATOM 430 C C . LYS A 1 58 ? -37.899 6.701 -44.646 1.00 21.34 ? 58 LYS A C 1 ATOM 431 O O . LYS A 1 58 ? -39.064 6.409 -44.900 1.00 23.41 ? 58 LYS A O 1 ATOM 432 C CB A LYS A 1 58 ? -37.391 9.022 -45.570 0.50 21.50 ? 58 LYS A CB 1 ATOM 433 C CB B LYS A 1 58 ? -37.069 8.842 -45.683 0.50 21.86 ? 58 LYS A CB 1 ATOM 434 C CG A LYS A 1 58 ? -36.102 8.870 -46.364 0.50 21.43 ? 58 LYS A CG 1 ATOM 435 C CG B LYS A 1 58 ? -38.139 8.954 -46.764 0.50 22.07 ? 58 LYS A CG 1 ATOM 436 C CD A LYS A 1 58 ? -36.086 9.872 -47.512 0.50 21.98 ? 58 LYS A CD 1 ATOM 437 C CD B LYS A 1 58 ? -38.017 10.304 -47.469 0.50 22.89 ? 58 LYS A CD 1 ATOM 438 C CE A LYS A 1 58 ? -36.192 11.315 -47.017 0.50 22.27 ? 58 LYS A CE 1 ATOM 439 C CE B LYS A 1 58 ? -38.059 10.163 -48.979 0.50 22.46 ? 58 LYS A CE 1 ATOM 440 N NZ A LYS A 1 58 ? -34.858 11.927 -46.723 0.50 22.18 ? 58 LYS A NZ 1 ATOM 441 N NZ B LYS A 1 58 ? -37.120 11.137 -49.605 0.50 21.88 ? 58 LYS A NZ 1 ATOM 442 N N . LEU A 1 59 ? -36.930 5.787 -44.605 1.00 20.68 ? 59 LEU A N 1 ATOM 443 C CA . LEU A 1 59 ? -37.230 4.389 -44.894 1.00 20.08 ? 59 LEU A CA 1 ATOM 444 C C . LEU A 1 59 ? -37.419 3.532 -43.642 1.00 21.22 ? 59 LEU A C 1 ATOM 445 O O . LEU A 1 59 ? -37.568 2.307 -43.739 1.00 20.23 ? 59 LEU A O 1 ATOM 446 C CB . LEU A 1 59 ? -36.181 3.784 -45.826 1.00 20.90 ? 59 LEU A CB 1 ATOM 447 C CG . LEU A 1 59 ? -36.015 4.452 -47.199 1.00 21.01 ? 59 LEU A CG 1 ATOM 448 C CD1 . LEU A 1 59 ? -34.887 3.808 -47.942 1.00 20.02 ? 59 LEU A CD1 1 ATOM 449 C CD2 . LEU A 1 59 ? -37.311 4.385 -48.029 1.00 20.95 ? 59 LEU A CD2 1 ATOM 450 N N . ASN A 1 60 ? -37.438 4.188 -42.480 1.00 22.01 ? 60 ASN A N 1 ATOM 451 C CA . ASN A 1 60 ? -37.589 3.521 -41.182 1.00 24.09 ? 60 ASN A CA 1 ATOM 452 C C . ASN A 1 60 ? -36.587 2.373 -40.975 1.00 21.12 ? 60 ASN A C 1 ATOM 453 O O . ASN A 1 60 ? -36.962 1.244 -40.674 1.00 19.86 ? 60 ASN A O 1 ATOM 454 C CB . ASN A 1 60 ? -39.036 3.050 -40.958 1.00 29.67 ? 60 ASN A CB 1 ATOM 455 C CG . ASN A 1 60 ? -39.401 2.930 -39.471 1.00 35.80 ? 60 ASN A CG 1 ATOM 456 O OD1 . ASN A 1 60 ? -38.556 3.093 -38.575 1.00 39.85 ? 60 ASN A OD1 1 ATOM 457 N ND2 . ASN A 1 60 ? -40.669 2.637 -39.207 1.00 38.00 ? 60 ASN A ND2 1 ATOM 458 N N . LEU A 1 61 ? -35.309 2.687 -41.154 1.00 18.40 ? 61 LEU A N 1 ATOM 459 C CA . LEU A 1 61 ? -34.254 1.714 -40.976 1.00 16.92 ? 61 LEU A CA 1 ATOM 460 C C . LEU A 1 61 ? -33.476 2.069 -39.710 1.00 15.15 ? 61 LEU A C 1 ATOM 461 O O . LEU A 1 61 ? -33.532 3.203 -39.239 1.00 14.34 ? 61 LEU A O 1 ATOM 462 C CB . LEU A 1 61 ? -33.339 1.682 -42.213 1.00 16.00 ? 61 LEU A CB 1 ATOM 463 C CG . LEU A 1 61 ? -33.988 1.255 -43.541 1.00 16.08 ? 61 LEU A CG 1 ATOM 464 C CD1 . LEU A 1 61 ? -33.236 1.811 -44.743 1.00 15.93 ? 61 LEU A CD1 1 ATOM 465 C CD2 . LEU A 1 61 ? -34.112 -0.264 -43.666 1.00 15.80 ? 61 LEU A CD2 1 ATOM 466 N N . LYS A 1 62 ? -32.782 1.093 -39.144 1.00 13.84 ? 62 LYS A N 1 ATOM 467 C CA . LYS A 1 62 ? -31.806 1.373 -38.095 1.00 13.73 ? 62 LYS A CA 1 ATOM 468 C C . LYS A 1 62 ? -30.502 1.728 -38.778 1.00 12.54 ? 62 LYS A C 1 ATOM 469 O O . LYS A 1 62 ? -30.170 1.158 -39.829 1.00 11.39 ? 62 LYS A O 1 ATOM 470 C CB . LYS A 1 62 ? -31.606 0.154 -37.185 1.00 14.18 ? 62 LYS A CB 1 ATOM 471 C CG . LYS A 1 62 ? -32.854 -0.277 -36.427 1.00 14.43 ? 62 LYS A CG 1 ATOM 472 C CD . LYS A 1 62 ? -33.443 0.854 -35.604 1.00 15.05 ? 62 LYS A CD 1 ATOM 473 C CE . LYS A 1 62 ? -34.567 0.341 -34.720 1.00 16.21 ? 62 LYS A CE 1 ATOM 474 N NZ . LYS A 1 62 ? -35.147 1.453 -33.950 1.00 16.79 ? 62 LYS A NZ 1 ATOM 475 N N . VAL A 1 63 ? -29.768 2.671 -38.198 1.00 11.50 ? 63 VAL A N 1 ATOM 476 C CA . VAL A 1 63 ? -28.487 3.068 -38.788 1.00 10.63 ? 63 VAL A CA 1 ATOM 477 C C . VAL A 1 63 ? -27.314 2.865 -37.805 1.00 10.26 ? 63 VAL A C 1 ATOM 478 O O . VAL A 1 63 ? -27.458 3.104 -36.606 1.00 10.67 ? 63 VAL A O 1 ATOM 479 C CB . VAL A 1 63 ? -28.566 4.484 -39.441 1.00 10.13 ? 63 VAL A CB 1 ATOM 480 C CG1 . VAL A 1 63 ? -29.157 5.474 -38.501 1.00 10.06 ? 63 VAL A CG1 1 ATOM 481 C CG2 . VAL A 1 63 ? -27.207 4.945 -39.923 1.00 10.23 ? 63 VAL A CG2 1 ATOM 482 N N . SER A 1 64 ? -26.181 2.379 -38.318 1.00 9.70 ? 64 SER A N 1 ATOM 483 C CA . SER A 1 64 ? -24.981 2.116 -37.510 1.00 9.18 ? 64 SER A CA 1 ATOM 484 C C . SER A 1 64 ? -23.705 2.600 -38.206 1.00 8.92 ? 64 SER A C 1 ATOM 485 O O . SER A 1 64 ? -23.514 2.361 -39.409 1.00 8.79 ? 64 SER A O 1 ATOM 486 C CB . SER A 1 64 ? -24.859 0.627 -37.226 1.00 9.17 ? 64 SER A CB 1 ATOM 487 O OG . SER A 1 64 ? -25.892 0.194 -36.360 1.00 10.35 ? 64 SER A OG 1 ATOM 488 N N . ALA A 1 65 ? -22.839 3.276 -37.451 1.00 8.45 ? 65 ALA A N 1 ATOM 489 C CA . ALA A 1 65 ? -21.575 3.780 -37.985 1.00 8.27 ? 65 ALA A CA 1 ATOM 490 C C . ALA A 1 65 ? -20.493 2.743 -37.783 1.00 8.15 ? 65 ALA A C 1 ATOM 491 O O . ALA A 1 65 ? -20.409 2.124 -36.713 1.00 8.31 ? 65 ALA A O 1 ATOM 492 C CB . ALA A 1 65 ? -21.174 5.096 -37.303 1.00 8.19 ? 65 ALA A CB 1 ATOM 493 N N . LYS A 1 66 ? -19.671 2.535 -38.801 1.00 7.51 ? 66 LYS A N 1 ATOM 494 C CA . LYS A 1 66 ? -18.504 1.708 -38.606 1.00 7.27 ? 66 LYS A CA 1 ATOM 495 C C . LYS A 1 66 ? -17.293 2.540 -38.956 1.00 7.16 ? 66 LYS A C 1 ATOM 496 O O . LYS A 1 66 ? -17.263 3.163 -40.005 1.00 7.19 ? 66 LYS A O 1 ATOM 497 C CB . LYS A 1 66 ? -18.596 0.420 -39.417 1.00 7.14 ? 66 LYS A CB 1 ATOM 498 C CG . LYS A 1 66 ? -17.351 -0.461 -39.365 1.00 6.95 ? 66 LYS A CG 1 ATOM 499 C CD . LYS A 1 66 ? -17.684 -1.941 -39.627 1.00 6.75 ? 66 LYS A CD 1 ATOM 500 C CE . LYS A 1 66 ? -17.697 -2.296 -41.091 1.00 6.53 ? 66 LYS A CE 1 ATOM 501 N NZ . LYS A 1 66 ? -16.346 -2.188 -41.744 1.00 6.74 ? 66 LYS A NZ 1 ATOM 502 N N . SER A 1 67 ? -16.324 2.575 -38.041 1.00 7.20 ? 67 SER A N 1 ATOM 503 C CA . SER A 1 67 ? -15.143 3.422 -38.156 1.00 7.11 ? 67 SER A CA 1 ATOM 504 C C . SER A 1 67 ? -13.960 2.519 -38.531 1.00 7.12 ? 67 SER A C 1 ATOM 505 O O . SER A 1 67 ? -13.715 2.305 -39.708 1.00 7.29 ? 67 SER A O 1 ATOM 506 C CB . SER A 1 67 ? -14.948 4.201 -36.849 1.00 7.12 ? 67 SER A CB 1 ATOM 507 O OG . SER A 1 67 ? -13.717 4.913 -36.771 1.00 7.12 ? 67 SER A OG 1 ATOM 508 N N . GLY A 1 68 ? -13.273 1.939 -37.553 1.00 6.91 ? 68 GLY A N 1 ATOM 509 C CA . GLY A 1 68 ? -12.235 0.943 -37.840 1.00 7.04 ? 68 GLY A CA 1 ATOM 510 C C . GLY A 1 68 ? -12.745 -0.499 -37.847 1.00 7.25 ? 68 GLY A C 1 ATOM 511 O O . GLY A 1 68 ? -11.999 -1.449 -38.168 1.00 6.93 ? 68 GLY A O 1 ATOM 512 N N . GLY A 1 69 ? -14.018 -0.665 -37.489 1.00 7.21 ? 69 GLY A N 1 ATOM 513 C CA . GLY A 1 69 ? -14.659 -1.969 -37.490 1.00 7.75 ? 69 GLY A CA 1 ATOM 514 C C . GLY A 1 69 ? -14.077 -2.962 -36.498 1.00 8.14 ? 69 GLY A C 1 ATOM 515 O O . GLY A 1 69 ? -14.184 -4.183 -36.701 1.00 8.12 ? 69 GLY A O 1 ATOM 516 N N . HIS A 1 70 ? -13.484 -2.454 -35.420 1.00 8.14 ? 70 HIS A N 1 ATOM 517 C CA . HIS A 1 70 ? -12.837 -3.332 -34.464 1.00 8.76 ? 70 HIS A CA 1 ATOM 518 C C . HIS A 1 70 ? -13.738 -3.883 -33.343 1.00 8.54 ? 70 HIS A C 1 ATOM 519 O O . HIS A 1 70 ? -13.281 -4.693 -32.542 1.00 8.74 ? 70 HIS A O 1 ATOM 520 C CB . HIS A 1 70 ? -11.537 -2.711 -33.922 1.00 9.32 ? 70 HIS A CB 1 ATOM 521 C CG . HIS A 1 70 ? -10.307 -3.191 -34.630 1.00 9.95 ? 70 HIS A CG 1 ATOM 522 N ND1 . HIS A 1 70 ? -9.480 -4.171 -34.115 1.00 10.60 ? 70 HIS A ND1 1 ATOM 523 C CD2 . HIS A 1 70 ? -9.784 -2.850 -35.834 1.00 10.26 ? 70 HIS A CD2 1 ATOM 524 C CE1 . HIS A 1 70 ? -8.489 -4.394 -34.964 1.00 10.42 ? 70 HIS A CE1 1 ATOM 525 N NE2 . HIS A 1 70 ? -8.655 -3.616 -36.019 1.00 10.30 ? 70 HIS A NE2 1 ATOM 526 N N . SER A 1 71 ? -15.003 -3.455 -33.299 1.00 8.23 ? 71 SER A N 1 ATOM 527 C CA . SER A 1 71 ? -15.971 -3.952 -32.307 1.00 7.98 ? 71 SER A CA 1 ATOM 528 C C . SER A 1 71 ? -15.926 -5.468 -32.197 1.00 7.90 ? 71 SER A C 1 ATOM 529 O O . SER A 1 71 ? -16.208 -6.172 -33.164 1.00 8.46 ? 71 SER A O 1 ATOM 530 C CB . SER A 1 71 ? -17.398 -3.516 -32.683 1.00 7.86 ? 71 SER A CB 1 ATOM 531 O OG . SER A 1 71 ? -18.392 -4.154 -31.885 1.00 7.68 ? 71 SER A OG 1 ATOM 532 N N . TYR A 1 72 ? -15.598 -5.974 -31.019 1.00 7.77 ? 72 TYR A N 1 ATOM 533 C CA . TYR A 1 72 ? -15.547 -7.432 -30.793 1.00 7.83 ? 72 TYR A CA 1 ATOM 534 C C . TYR A 1 72 ? -16.880 -8.155 -31.061 1.00 8.02 ? 72 TYR A C 1 ATOM 535 O O . TYR A 1 72 ? -16.892 -9.370 -31.309 1.00 8.07 ? 72 TYR A O 1 ATOM 536 C CB . TYR A 1 72 ? -15.062 -7.752 -29.376 1.00 7.31 ? 72 TYR A CB 1 ATOM 537 C CG . TYR A 1 72 ? -13.631 -7.386 -29.050 1.00 7.20 ? 72 TYR A CG 1 ATOM 538 C CD1 . TYR A 1 72 ? -12.754 -6.851 -30.010 1.00 7.17 ? 72 TYR A CD1 1 ATOM 539 C CD2 . TYR A 1 72 ? -13.133 -7.616 -27.766 1.00 7.09 ? 72 TYR A CD2 1 ATOM 540 C CE1 . TYR A 1 72 ? -11.425 -6.545 -29.675 1.00 6.93 ? 72 TYR A CE1 1 ATOM 541 C CE2 . TYR A 1 72 ? -11.833 -7.336 -27.441 1.00 6.93 ? 72 TYR A CE2 1 ATOM 542 C CZ . TYR A 1 72 ? -10.978 -6.797 -28.383 1.00 6.89 ? 72 TYR A CZ 1 ATOM 543 O OH . TYR A 1 72 ? -9.677 -6.523 -27.993 1.00 6.75 ? 72 TYR A OH 1 ATOM 544 N N . ALA A 1 73 ? -17.983 -7.404 -30.995 1.00 8.23 ? 73 ALA A N 1 ATOM 545 C CA . ALA A 1 73 ? -19.330 -7.904 -31.293 1.00 8.54 ? 73 ALA A CA 1 ATOM 546 C C . ALA A 1 73 ? -19.846 -7.526 -32.710 1.00 8.85 ? 73 ALA A C 1 ATOM 547 O O . ALA A 1 73 ? -21.024 -7.752 -33.028 1.00 8.58 ? 73 ALA A O 1 ATOM 548 C CB . ALA A 1 73 ? -20.316 -7.416 -30.224 1.00 8.49 ? 73 ALA A CB 1 ATOM 549 N N . SER A 1 74 ? -18.965 -6.972 -33.554 1.00 9.05 ? 74 SER A N 1 ATOM 550 C CA . SER A 1 74 ? -19.355 -6.405 -34.861 1.00 9.12 ? 74 SER A CA 1 ATOM 551 C C . SER A 1 74 ? -20.486 -5.369 -34.765 1.00 9.38 ? 74 SER A C 1 ATOM 552 O O . SER A 1 74 ? -21.323 -5.268 -35.673 1.00 10.06 ? 74 SER A O 1 ATOM 553 C CB . SER A 1 74 ? -19.741 -7.505 -35.854 1.00 8.94 ? 74 SER A CB 1 ATOM 554 O OG . SER A 1 74 ? -18.723 -8.477 -35.946 1.00 9.08 ? 74 SER A OG 1 ATOM 555 N N . PHE A 1 75 ? -20.511 -4.604 -33.671 1.00 9.10 ? 75 PHE A N 1 ATOM 556 C CA . PHE A 1 75 ? -21.568 -3.615 -33.446 1.00 8.67 ? 75 PHE A CA 1 ATOM 557 C C . PHE A 1 75 ? -21.597 -2.482 -34.487 1.00 8.39 ? 75 PHE A C 1 ATOM 558 O O . PHE A 1 75 ? -22.654 -1.874 -34.711 1.00 8.10 ? 75 PHE A O 1 ATOM 559 C CB . PHE A 1 75 ? -21.537 -3.076 -32.011 1.00 8.82 ? 75 PHE A CB 1 ATOM 560 C CG . PHE A 1 75 ? -22.137 -4.019 -30.979 1.00 9.04 ? 75 PHE A CG 1 ATOM 561 C CD1 . PHE A 1 75 ? -23.120 -4.946 -31.331 1.00 9.26 ? 75 PHE A CD1 1 ATOM 562 C CD2 . PHE A 1 75 ? -21.728 -3.958 -29.650 1.00 9.17 ? 75 PHE A CD2 1 ATOM 563 C CE1 . PHE A 1 75 ? -23.677 -5.802 -30.371 1.00 9.50 ? 75 PHE A CE1 1 ATOM 564 C CE2 . PHE A 1 75 ? -22.280 -4.810 -28.676 1.00 9.39 ? 75 PHE A CE2 1 ATOM 565 C CZ . PHE A 1 75 ? -23.254 -5.729 -29.037 1.00 9.54 ? 75 PHE A CZ 1 ATOM 566 N N . GLY A 1 76 ? -20.459 -2.218 -35.138 1.00 7.87 ? 76 GLY A N 1 ATOM 567 C CA . GLY A 1 76 ? -20.422 -1.292 -36.284 1.00 7.58 ? 76 GLY A CA 1 ATOM 568 C C . GLY A 1 76 ? -21.459 -1.595 -37.375 1.00 7.47 ? 76 GLY A C 1 ATOM 569 O O . GLY A 1 76 ? -21.907 -0.691 -38.100 1.00 7.36 ? 76 GLY A O 1 ATOM 570 N N . PHE A 1 77 ? -21.825 -2.872 -37.491 1.00 7.43 ? 77 PHE A N 1 ATOM 571 C CA . PHE A 1 77 ? -22.884 -3.348 -38.389 1.00 7.38 ? 77 PHE A CA 1 ATOM 572 C C . PHE A 1 77 ? -24.284 -3.163 -37.815 1.00 7.39 ? 77 PHE A C 1 ATOM 573 O O . PHE A 1 77 ? -25.268 -3.212 -38.540 1.00 7.61 ? 77 PHE A O 1 ATOM 574 C CB . PHE A 1 77 ? -22.691 -4.842 -38.652 1.00 7.20 ? 77 PHE A CB 1 ATOM 575 C CG . PHE A 1 77 ? -21.467 -5.171 -39.459 1.00 7.13 ? 77 PHE A CG 1 ATOM 576 C CD1 . PHE A 1 77 ? -21.568 -5.404 -40.831 1.00 6.90 ? 77 PHE A CD1 1 ATOM 577 C CD2 . PHE A 1 77 ? -20.207 -5.256 -38.846 1.00 6.98 ? 77 PHE A CD2 1 ATOM 578 C CE1 . PHE A 1 77 ? -20.441 -5.709 -41.586 1.00 6.75 ? 77 PHE A CE1 1 ATOM 579 C CE2 . PHE A 1 77 ? -19.080 -5.558 -39.590 1.00 6.72 ? 77 PHE A CE2 1 ATOM 580 C CZ . PHE A 1 77 ? -19.199 -5.791 -40.962 1.00 6.73 ? 77 PHE A CZ 1 ATOM 581 N N . GLY A 1 78 ? -24.382 -2.994 -36.507 1.00 7.67 ? 78 GLY A N 1 ATOM 582 C CA . GLY A 1 78 ? -25.680 -2.975 -35.833 1.00 8.05 ? 78 GLY A CA 1 ATOM 583 C C . GLY A 1 78 ? -25.940 -4.181 -34.947 1.00 8.78 ? 78 GLY A C 1 ATOM 584 O O . GLY A 1 78 ? -26.943 -4.218 -34.250 1.00 9.53 ? 78 GLY A O 1 ATOM 585 N N . GLY A 1 79 ? -25.049 -5.170 -34.976 1.00 9.47 ? 79 GLY A N 1 ATOM 586 C CA . GLY A 1 79 ? -25.137 -6.323 -34.096 1.00 10.51 ? 79 GLY A CA 1 ATOM 587 C C . GLY A 1 79 ? -26.204 -7.296 -34.536 1.00 11.78 ? 79 GLY A C 1 ATOM 588 O O . GLY A 1 79 ? -26.668 -8.119 -33.741 1.00 12.04 ? 79 GLY A O 1 ATOM 589 N N . GLU A 1 80 ? -26.565 -7.201 -35.818 1.00 12.89 ? 80 GLU A N 1 ATOM 590 C CA . GLU A 1 80 ? -27.682 -7.934 -36.445 1.00 13.21 ? 80 GLU A CA 1 ATOM 591 C C . GLU A 1 80 ? -27.718 -7.540 -37.929 1.00 12.78 ? 80 GLU A C 1 ATOM 592 O O . GLU A 1 80 ? -27.102 -6.555 -38.312 1.00 13.05 ? 80 GLU A O 1 ATOM 593 C CB . GLU A 1 80 ? -29.020 -7.585 -35.782 1.00 13.17 ? 80 GLU A CB 1 ATOM 594 C CG . GLU A 1 80 ? -29.405 -6.133 -35.943 1.00 14.24 ? 80 GLU A CG 1 ATOM 595 C CD . GLU A 1 80 ? -30.737 -5.780 -35.314 1.00 15.19 ? 80 GLU A CD 1 ATOM 596 O OE1 . GLU A 1 80 ? -31.359 -6.654 -34.668 1.00 15.84 ? 80 GLU A OE1 1 ATOM 597 O OE2 . GLU A 1 80 ? -31.158 -4.611 -35.466 1.00 15.46 ? 80 GLU A OE2 1 ATOM 598 N N . ASN A 1 81 ? -28.427 -8.310 -38.752 1.00 12.42 ? 81 ASN A N 1 ATOM 599 C CA . ASN A 1 81 ? -28.627 -7.968 -40.162 1.00 12.08 ? 81 ASN A CA 1 ATOM 600 C C . ASN A 1 81 ? -29.639 -6.850 -40.350 1.00 11.88 ? 81 ASN A C 1 ATOM 601 O O . ASN A 1 81 ? -30.544 -6.698 -39.535 1.00 12.05 ? 81 ASN A O 1 ATOM 602 C CB . ASN A 1 81 ? -29.119 -9.187 -40.941 1.00 11.92 ? 81 ASN A CB 1 ATOM 603 C CG . ASN A 1 81 ? -28.140 -10.350 -40.912 1.00 11.88 ? 81 ASN A CG 1 ATOM 604 O OD1 . ASN A 1 81 ? -26.928 -10.154 -40.857 1.00 11.87 ? 81 ASN A OD1 1 ATOM 605 N ND2 . ASN A 1 81 ? -28.670 -11.574 -40.981 1.00 11.41 ? 81 ASN A ND2 1 ATOM 606 N N . GLY A 1 82 ? -29.481 -6.065 -41.419 1.00 12.16 ? 82 GLY A N 1 ATOM 607 C CA . GLY A 1 82 ? -30.560 -5.173 -41.898 1.00 12.25 ? 82 GLY A CA 1 ATOM 608 C C . GLY A 1 82 ? -30.483 -3.672 -41.638 1.00 12.36 ? 82 GLY A C 1 ATOM 609 O O . GLY A 1 82 ? -31.435 -2.930 -41.937 1.00 12.04 ? 82 GLY A O 1 ATOM 610 N N . HIS A 1 83 ? -29.368 -3.219 -41.074 1.00 11.86 ? 83 HIS A N 1 ATOM 611 C CA . HIS A 1 83 ? -29.176 -1.798 -40.816 1.00 11.62 ? 83 HIS A CA 1 ATOM 612 C C . HIS A 1 83 ? -28.621 -1.127 -42.044 1.00 11.58 ? 83 HIS A C 1 ATOM 613 O O . HIS A 1 83 ? -28.015 -1.771 -42.916 1.00 12.21 ? 83 HIS A O 1 ATOM 614 C CB . HIS A 1 83 ? -28.164 -1.586 -39.689 1.00 11.91 ? 83 HIS A CB 1 ATOM 615 C CG . HIS A 1 83 ? -28.682 -1.943 -38.333 1.00 11.86 ? 83 HIS A CG 1 ATOM 616 N ND1 . HIS A 1 83 ? -28.360 -1.222 -37.204 1.00 11.79 ? 83 HIS A ND1 1 ATOM 617 C CD2 . HIS A 1 83 ? -29.498 -2.939 -37.925 1.00 11.84 ? 83 HIS A CD2 1 ATOM 618 C CE1 . HIS A 1 83 ? -28.957 -1.763 -36.158 1.00 11.93 ? 83 HIS A CE1 1 ATOM 619 N NE2 . HIS A 1 83 ? -29.659 -2.801 -36.570 1.00 11.88 ? 83 HIS A NE2 1 ATOM 620 N N . LEU A 1 84 ? -28.809 0.181 -42.097 1.00 10.85 ? 84 LEU A N 1 ATOM 621 C CA . LEU A 1 84 ? -27.992 1.012 -42.944 1.00 10.24 ? 84 LEU A CA 1 ATOM 622 C C . LEU A 1 84 ? -26.627 1.168 -42.236 1.00 9.76 ? 84 LEU A C 1 ATOM 623 O O . LEU A 1 84 ? -26.565 1.608 -41.092 1.00 9.93 ? 84 LEU A O 1 ATOM 624 C CB . LEU A 1 84 ? -28.673 2.368 -43.193 1.00 9.55 ? 84 LEU A CB 1 ATOM 625 C CG . LEU A 1 84 ? -27.857 3.391 -44.003 1.00 9.80 ? 84 LEU A CG 1 ATOM 626 C CD1 . LEU A 1 84 ? -27.381 2.812 -45.344 1.00 9.24 ? 84 LEU A CD1 1 ATOM 627 C CD2 . LEU A 1 84 ? -28.644 4.676 -44.217 1.00 9.50 ? 84 LEU A CD2 1 ATOM 628 N N . MET A 1 85 ? -25.548 0.770 -42.900 1.00 9.45 ? 85 MET A N 1 ATOM 629 C CA . MET A 1 85 ? -24.209 0.917 -42.326 1.00 9.14 ? 85 MET A CA 1 ATOM 630 C C . MET A 1 85 ? -23.513 2.136 -42.916 1.00 8.84 ? 85 MET A C 1 ATOM 631 O O . MET A 1 85 ? -23.274 2.214 -44.120 1.00 8.43 ? 85 MET A O 1 ATOM 632 C CB . MET A 1 85 ? -23.361 -0.340 -42.524 1.00 9.41 ? 85 MET A CB 1 ATOM 633 C CG . MET A 1 85 ? -22.056 -0.352 -41.697 1.00 10.23 ? 85 MET A CG 1 ATOM 634 S SD . MET A 1 85 ? -21.172 -1.935 -41.617 1.00 10.98 ? 85 MET A SD 1 ATOM 635 C CE . MET A 1 85 ? -20.527 -2.057 -43.288 1.00 9.92 ? 85 MET A CE 1 ATOM 636 N N . VAL A 1 86 ? -23.214 3.094 -42.050 1.00 8.78 ? 86 VAL A N 1 ATOM 637 C CA . VAL A 1 86 ? -22.433 4.251 -42.427 1.00 9.02 ? 86 VAL A CA 1 ATOM 638 C C . VAL A 1 86 ? -20.956 3.909 -42.222 1.00 9.16 ? 86 VAL A C 1 ATOM 639 O O . VAL A 1 86 ? -20.431 3.984 -41.099 1.00 9.27 ? 86 VAL A O 1 ATOM 640 C CB . VAL A 1 86 ? -22.837 5.503 -41.623 1.00 9.01 ? 86 VAL A CB 1 ATOM 641 C CG1 . VAL A 1 86 ? -22.048 6.737 -42.103 1.00 9.14 ? 86 VAL A CG1 1 ATOM 642 C CG2 . VAL A 1 86 ? -24.321 5.761 -41.766 1.00 8.79 ? 86 VAL A CG2 1 ATOM 643 N N . GLN A 1 87 ? -20.324 3.506 -43.325 1.00 8.96 ? 87 GLN A N 1 ATOM 644 C CA . GLN A 1 87 ? -18.905 3.153 -43.414 1.00 8.64 ? 87 GLN A CA 1 ATOM 645 C C . GLN A 1 87 ? -18.014 4.403 -43.461 1.00 8.82 ? 87 GLN A C 1 ATOM 646 O O . GLN A 1 87 ? -18.005 5.141 -44.466 1.00 8.77 ? 87 GLN A O 1 ATOM 647 C CB . GLN A 1 87 ? -18.707 2.311 -44.680 1.00 8.29 ? 87 GLN A CB 1 ATOM 648 C CG . GLN A 1 87 ? -17.333 1.743 -44.899 1.00 8.34 ? 87 GLN A CG 1 ATOM 649 C CD . GLN A 1 87 ? -16.804 0.960 -43.712 1.00 8.59 ? 87 GLN A CD 1 ATOM 650 O OE1 . GLN A 1 87 ? -17.525 0.162 -43.097 1.00 8.59 ? 87 GLN A OE1 1 ATOM 651 N NE2 . GLN A 1 87 ? -15.533 1.194 -43.373 1.00 8.42 ? 87 GLN A NE2 1 ATOM 652 N N . LEU A 1 88 ? -17.242 4.626 -42.394 1.00 8.79 ? 88 LEU A N 1 ATOM 653 C CA . LEU A 1 88 ? -16.518 5.903 -42.217 1.00 8.70 ? 88 LEU A CA 1 ATOM 654 C C . LEU A 1 88 ? -15.046 5.891 -42.605 1.00 8.99 ? 88 LEU A C 1 ATOM 655 O O . LEU A 1 88 ? -14.418 6.959 -42.643 1.00 8.71 ? 88 LEU A O 1 ATOM 656 C CB . LEU A 1 88 ? -16.651 6.406 -40.773 1.00 8.62 ? 88 LEU A CB 1 ATOM 657 C CG . LEU A 1 88 ? -18.078 6.574 -40.227 1.00 8.55 ? 88 LEU A CG 1 ATOM 658 C CD1 . LEU A 1 88 ? -18.044 6.769 -38.727 1.00 8.39 ? 88 LEU A CD1 1 ATOM 659 C CD2 . LEU A 1 88 ? -18.784 7.730 -40.914 1.00 8.30 ? 88 LEU A CD2 1 ATOM 660 N N . ASP A 1 89 ? -14.510 4.715 -42.941 1.00 9.20 ? 89 ASP A N 1 ATOM 661 C CA . ASP A 1 89 ? -13.059 4.543 -42.994 1.00 9.91 ? 89 ASP A CA 1 ATOM 662 C C . ASP A 1 89 ? -12.342 5.144 -44.219 1.00 10.44 ? 89 ASP A C 1 ATOM 663 O O . ASP A 1 89 ? -11.142 4.921 -44.390 1.00 10.69 ? 89 ASP A O 1 ATOM 664 C CB . ASP A 1 89 ? -12.649 3.078 -42.734 1.00 9.82 ? 89 ASP A CB 1 ATOM 665 C CG . ASP A 1 89 ? -12.483 2.259 -44.022 1.00 10.17 ? 89 ASP A CG 1 ATOM 666 O OD1 . ASP A 1 89 ? -13.168 2.526 -45.036 1.00 10.37 ? 89 ASP A OD1 1 ATOM 667 O OD2 . ASP A 1 89 ? -11.642 1.338 -44.021 1.00 10.43 ? 89 ASP A OD2 1 ATOM 668 N N . ARG A 1 90 ? -13.054 5.899 -45.052 1.00 11.07 ? 90 ARG A N 1 ATOM 669 C CA . ARG A 1 90 ? -12.385 6.691 -46.105 1.00 12.12 ? 90 ARG A CA 1 ATOM 670 C C . ARG A 1 90 ? -12.158 8.130 -45.663 1.00 11.76 ? 90 ARG A C 1 ATOM 671 O O . ARG A 1 90 ? -11.473 8.899 -46.344 1.00 12.66 ? 90 ARG A O 1 ATOM 672 C CB . ARG A 1 90 ? -13.134 6.648 -47.452 1.00 12.45 ? 90 ARG A CB 1 ATOM 673 C CG . ARG A 1 90 ? -13.477 5.248 -47.952 1.00 13.01 ? 90 ARG A CG 1 ATOM 674 C CD . ARG A 1 90 ? -12.242 4.370 -48.021 1.00 13.98 ? 90 ARG A CD 1 ATOM 675 N NE . ARG A 1 90 ? -12.575 2.949 -47.914 1.00 15.17 ? 90 ARG A NE 1 ATOM 676 C CZ . ARG A 1 90 ? -12.678 2.131 -48.954 1.00 15.46 ? 90 ARG A CZ 1 ATOM 677 N NH1 . ARG A 1 90 ? -12.479 2.595 -50.177 1.00 16.41 ? 90 ARG A NH1 1 ATOM 678 N NH2 . ARG A 1 90 ? -12.978 0.854 -48.776 1.00 15.82 ? 90 ARG A NH2 1 ATOM 679 N N . MET A 1 91 ? -12.724 8.484 -44.517 1.00 11.09 ? 91 MET A N 1 ATOM 680 C CA . MET A 1 91 ? -12.560 9.814 -43.947 1.00 10.52 ? 91 MET A CA 1 ATOM 681 C C . MET A 1 91 ? -11.435 9.795 -42.928 1.00 10.32 ? 91 MET A C 1 ATOM 682 O O . MET A 1 91 ? -11.641 9.518 -41.755 1.00 10.17 ? 91 MET A O 1 ATOM 683 C CB . MET A 1 91 ? -13.874 10.265 -43.322 1.00 9.91 ? 91 MET A CB 1 ATOM 684 C CG . MET A 1 91 ? -14.984 10.261 -44.338 1.00 9.88 ? 91 MET A CG 1 ATOM 685 S SD . MET A 1 91 ? -16.621 10.493 -43.647 1.00 8.92 ? 91 MET A SD 1 ATOM 686 C CE . MET A 1 91 ? -16.585 12.266 -43.330 1.00 8.89 ? 91 MET A CE 1 ATOM 687 N N . ILE A 1 92 ? -10.228 10.086 -43.385 1.00 10.87 ? 92 ILE A N 1 ATOM 688 C CA . ILE A 1 92 ? -9.051 9.756 -42.587 1.00 10.75 ? 92 ILE A CA 1 ATOM 689 C C . ILE A 1 92 ? -8.191 10.940 -42.160 1.00 11.24 ? 92 ILE A C 1 ATOM 690 O O . ILE A 1 92 ? -7.167 10.754 -41.507 1.00 11.49 ? 92 ILE A O 1 ATOM 691 C CB . ILE A 1 92 ? -8.189 8.651 -43.284 1.00 10.69 ? 92 ILE A CB 1 ATOM 692 C CG1 . ILE A 1 92 ? -7.752 9.062 -44.701 1.00 10.38 ? 92 ILE A CG1 1 ATOM 693 C CG2 . ILE A 1 92 ? -8.956 7.345 -43.341 1.00 10.32 ? 92 ILE A CG2 1 ATOM 694 C CD1 . ILE A 1 92 ? -6.423 8.410 -45.171 1.00 9.39 ? 92 ILE A CD1 1 ATOM 695 N N . ASP A 1 93 ? -8.610 12.157 -42.495 1.00 11.71 ? 93 ASP A N 1 ATOM 696 C CA . ASP A 1 93 ? -7.711 13.308 -42.357 1.00 12.47 ? 93 ASP A CA 1 ATOM 697 C C . ASP A 1 93 ? -7.749 14.016 -41.009 1.00 12.54 ? 93 ASP A C 1 ATOM 698 O O . ASP A 1 93 ? -8.796 14.087 -40.344 1.00 11.89 ? 93 ASP A O 1 ATOM 699 C CB . ASP A 1 93 ? -7.960 14.322 -43.477 1.00 13.44 ? 93 ASP A CB 1 ATOM 700 C CG . ASP A 1 93 ? -7.685 13.751 -44.860 1.00 14.01 ? 93 ASP A CG 1 ATOM 701 O OD1 . ASP A 1 93 ? -6.736 12.954 -44.988 1.00 14.17 ? 93 ASP A OD1 1 ATOM 702 O OD2 . ASP A 1 93 ? -8.419 14.097 -45.818 1.00 14.91 ? 93 ASP A OD2 1 ATOM 703 N N . VAL A 1 94 ? -6.582 14.526 -40.614 1.00 13.08 ? 94 VAL A N 1 ATOM 704 C CA . VAL A 1 94 ? -6.493 15.580 -39.614 1.00 13.20 ? 94 VAL A CA 1 ATOM 705 C C . VAL A 1 94 ? -6.914 16.836 -40.373 1.00 13.68 ? 94 VAL A C 1 ATOM 706 O O . VAL A 1 94 ? -6.163 17.356 -41.190 1.00 13.40 ? 94 VAL A O 1 ATOM 707 C CB . VAL A 1 94 ? -5.067 15.722 -39.050 1.00 13.31 ? 94 VAL A CB 1 ATOM 708 C CG1 . VAL A 1 94 ? -5.006 16.829 -38.022 1.00 12.51 ? 94 VAL A CG1 1 ATOM 709 C CG2 . VAL A 1 94 ? -4.601 14.400 -38.429 1.00 13.41 ? 94 VAL A CG2 1 ATOM 710 N N . ILE A 1 95 ? -8.152 17.262 -40.139 1.00 14.52 ? 95 ILE A N 1 ATOM 711 C CA . ILE A 1 95 ? -8.767 18.371 -40.841 1.00 16.05 ? 95 ILE A CA 1 ATOM 712 C C . ILE A 1 95 ? -7.929 19.636 -40.642 1.00 17.48 ? 95 ILE A C 1 ATOM 713 O O . ILE A 1 95 ? -7.656 20.362 -41.591 1.00 18.28 ? 95 ILE A O 1 ATOM 714 C CB . ILE A 1 95 ? -10.242 18.587 -40.352 1.00 16.41 ? 95 ILE A CB 1 ATOM 715 C CG1 . ILE A 1 95 ? -11.148 17.474 -40.871 1.00 15.99 ? 95 ILE A CG1 1 ATOM 716 C CG2 . ILE A 1 95 ? -10.798 19.928 -40.798 1.00 16.47 ? 95 ILE A CG2 1 ATOM 717 C CD1 . ILE A 1 95 ? -12.326 17.165 -39.949 1.00 16.42 ? 95 ILE A CD1 1 ATOM 718 N N . SER A 1 96 ? -7.516 19.874 -39.399 1.00 18.87 ? 96 SER A N 1 ATOM 719 C CA . SER A 1 96 ? -6.770 21.065 -39.018 1.00 18.97 ? 96 SER A CA 1 ATOM 720 C C . SER A 1 96 ? -6.002 20.810 -37.732 1.00 19.79 ? 96 SER A C 1 ATOM 721 O O . SER A 1 96 ? -6.372 19.946 -36.926 1.00 20.16 ? 96 SER A O 1 ATOM 722 C CB . SER A 1 96 ? -7.709 22.267 -38.822 1.00 19.29 ? 96 SER A CB 1 ATOM 723 O OG . SER A 1 96 ? -8.607 22.055 -37.742 1.00 18.19 ? 96 SER A OG 1 ATOM 724 N N . TYR A 1 97 ? -4.921 21.564 -37.556 1.00 19.88 ? 97 TYR A N 1 ATOM 725 C CA . TYR A 1 97 ? -4.215 21.607 -36.293 1.00 18.62 ? 97 TYR A CA 1 ATOM 726 C C . TYR A 1 97 ? -4.000 23.075 -35.925 1.00 18.03 ? 97 TYR A C 1 ATOM 727 O O . TYR A 1 97 ? -3.733 23.904 -36.782 1.00 18.38 ? 97 TYR A O 1 ATOM 728 C CB . TYR A 1 97 ? -2.887 20.840 -36.380 1.00 19.08 ? 97 TYR A CB 1 ATOM 729 C CG . TYR A 1 97 ? -2.057 20.992 -35.131 1.00 18.91 ? 97 TYR A CG 1 ATOM 730 C CD1 . TYR A 1 97 ? -2.396 20.308 -33.972 1.00 18.64 ? 97 TYR A CD1 1 ATOM 731 C CD2 . TYR A 1 97 ? -0.971 21.862 -35.091 1.00 19.04 ? 97 TYR A CD2 1 ATOM 732 C CE1 . TYR A 1 97 ? -1.661 20.452 -32.813 1.00 18.94 ? 97 TYR A CE1 1 ATOM 733 C CE2 . TYR A 1 97 ? -0.225 22.016 -33.926 1.00 19.27 ? 97 TYR A CE2 1 ATOM 734 C CZ . TYR A 1 97 ? -0.579 21.304 -32.792 1.00 19.15 ? 97 TYR A CZ 1 ATOM 735 O OH . TYR A 1 97 ? 0.133 21.440 -31.624 1.00 19.80 ? 97 TYR A OH 1 ATOM 736 N N . ASN A 1 98 ? -4.151 23.397 -34.651 1.00 18.59 ? 98 ASN A N 1 ATOM 737 C CA . ASN A 1 98 ? -3.920 24.752 -34.156 1.00 17.71 ? 98 ASN A CA 1 ATOM 738 C C . ASN A 1 98 ? -2.653 24.741 -33.302 1.00 18.10 ? 98 ASN A C 1 ATOM 739 O O . ASN A 1 98 ? -2.632 24.111 -32.242 1.00 17.51 ? 98 ASN A O 1 ATOM 740 C CB . ASN A 1 98 ? -5.130 25.212 -33.344 1.00 16.71 ? 98 ASN A CB 1 ATOM 741 C CG . ASN A 1 98 ? -5.128 26.708 -33.050 1.00 16.79 ? 98 ASN A CG 1 ATOM 742 O OD1 . ASN A 1 98 ? -4.099 27.311 -32.783 1.00 17.43 ? 98 ASN A OD1 1 ATOM 743 N ND2 . ASN A 1 98 ? -6.308 27.296 -33.055 1.00 17.44 ? 98 ASN A ND2 1 ATOM 744 N N . ASP A 1 99 ? -1.597 25.415 -33.762 1.00 19.49 ? 99 ASP A N 1 ATOM 745 C CA . ASP A 1 99 ? -0.326 25.418 -33.015 1.00 22.40 ? 99 ASP A CA 1 ATOM 746 C C . ASP A 1 99 ? -0.340 26.326 -31.805 1.00 21.95 ? 99 ASP A C 1 ATOM 747 O O . ASP A 1 99 ? 0.604 26.331 -31.038 1.00 21.92 ? 99 ASP A O 1 ATOM 748 C CB . ASP A 1 99 ? 0.922 25.679 -33.897 1.00 23.88 ? 99 ASP A CB 1 ATOM 749 C CG . ASP A 1 99 ? 0.912 27.045 -34.587 0.80 26.12 ? 99 ASP A CG 1 ATOM 750 O OD1 . ASP A 1 99 ? 0.269 28.016 -34.119 0.80 26.29 ? 99 ASP A OD1 1 ATOM 751 O OD2 . ASP A 1 99 ? 1.583 27.142 -35.634 0.80 30.23 ? 99 ASP A OD2 1 ATOM 752 N N . LYS A 1 100 ? -1.414 27.087 -31.620 1.00 23.77 ? 100 LYS A N 1 ATOM 753 C CA . LYS A 1 100 ? -1.526 27.863 -30.387 1.00 24.37 ? 100 LYS A CA 1 ATOM 754 C C . LYS A 1 100 ? -2.085 27.063 -29.210 1.00 22.89 ? 100 LYS A C 1 ATOM 755 O O . LYS A 1 100 ? -1.606 27.188 -28.083 1.00 23.68 ? 100 LYS A O 1 ATOM 756 C CB . LYS A 1 100 ? -2.266 29.190 -30.609 1.00 25.04 ? 100 LYS A CB 1 ATOM 757 C CG . LYS A 1 100 ? -1.409 30.232 -31.334 1.00 27.54 ? 100 LYS A CG 1 ATOM 758 C CD . LYS A 1 100 ? 0.091 29.999 -31.048 1.00 29.58 ? 100 LYS A CD 1 ATOM 759 C CE . LYS A 1 100 ? 0.994 30.965 -31.805 1.00 32.85 ? 100 LYS A CE 1 ATOM 760 N NZ . LYS A 1 100 ? 1.034 32.304 -31.142 1.00 33.35 ? 100 LYS A NZ 1 ATOM 761 N N . THR A 1 101 ? -3.057 26.202 -29.486 1.00 20.89 ? 101 THR A N 1 ATOM 762 C CA . THR A 1 101 ? -3.730 25.449 -28.436 1.00 20.31 ? 101 THR A CA 1 ATOM 763 C C . THR A 1 101 ? -3.288 23.983 -28.396 1.00 19.60 ? 101 THR A C 1 ATOM 764 O O . THR A 1 101 ? -3.359 23.341 -27.354 1.00 19.87 ? 101 THR A O 1 ATOM 765 C CB . THR A 1 101 ? -5.240 25.490 -28.634 1.00 20.16 ? 101 THR A CB 1 ATOM 766 O OG1 . THR A 1 101 ? -5.558 24.889 -29.893 1.00 20.90 ? 101 THR A OG1 1 ATOM 767 C CG2 . THR A 1 101 ? -5.726 26.926 -28.656 1.00 21.36 ? 101 THR A CG2 1 ATOM 768 N N . GLY A 1 102 ? -2.830 23.464 -29.530 1.00 17.89 ? 102 GLY A N 1 ATOM 769 C CA . GLY A 1 102 ? -2.508 22.046 -29.652 1.00 16.75 ? 102 GLY A CA 1 ATOM 770 C C . GLY A 1 102 ? -3.716 21.174 -29.967 1.00 15.99 ? 102 GLY A C 1 ATOM 771 O O . GLY A 1 102 ? -3.651 19.941 -29.831 1.00 15.56 ? 102 GLY A O 1 ATOM 772 N N . ILE A 1 103 ? -4.820 21.809 -30.374 1.00 14.52 ? 103 ILE A N 1 ATOM 773 C CA . ILE A 1 103 ? -6.047 21.090 -30.694 1.00 13.67 ? 103 ILE A CA 1 ATOM 774 C C . ILE A 1 103 ? -6.094 20.705 -32.173 1.00 13.53 ? 103 ILE A C 1 ATOM 775 O O . ILE A 1 103 ? -5.957 21.557 -33.044 1.00 13.03 ? 103 ILE A O 1 ATOM 776 C CB . ILE A 1 103 ? -7.304 21.879 -30.260 1.00 13.34 ? 103 ILE A CB 1 ATOM 777 C CG1 . ILE A 1 103 ? -7.432 21.844 -28.732 1.00 12.83 ? 103 ILE A CG1 1 ATOM 778 C CG2 . ILE A 1 103 ? -8.564 21.299 -30.885 1.00 12.89 ? 103 ILE A CG2 1 ATOM 779 C CD1 . ILE A 1 103 ? -7.975 23.091 -28.149 1.00 12.09 ? 103 ILE A CD1 1 ATOM 780 N N . ALA A 1 104 ? -6.262 19.408 -32.433 1.00 13.87 ? 104 ALA A N 1 ATOM 781 C CA . ALA A 1 104 ? -6.449 18.874 -33.781 1.00 14.28 ? 104 ALA A CA 1 ATOM 782 C C . ALA A 1 104 ? -7.914 18.534 -34.035 1.00 14.54 ? 104 ALA A C 1 ATOM 783 O O . ALA A 1 104 ? -8.596 18.000 -33.150 1.00 14.10 ? 104 ALA A O 1 ATOM 784 C CB . ALA A 1 104 ? -5.591 17.629 -33.982 1.00 14.86 ? 104 ALA A CB 1 ATOM 785 N N . HIS A 1 105 ? -8.395 18.867 -35.233 1.00 14.41 ? 105 HIS A N 1 ATOM 786 C CA . HIS A 1 105 ? -9.694 18.403 -35.703 1.00 14.94 ? 105 HIS A CA 1 ATOM 787 C C . HIS A 1 105 ? -9.434 17.199 -36.607 1.00 15.06 ? 105 HIS A C 1 ATOM 788 O O . HIS A 1 105 ? -8.583 17.266 -37.509 1.00 16.37 ? 105 HIS A O 1 ATOM 789 C CB . HIS A 1 105 ? -10.415 19.500 -36.479 1.00 16.23 ? 105 HIS A CB 1 ATOM 790 C CG . HIS A 1 105 ? -11.001 20.580 -35.621 1.00 17.97 ? 105 HIS A CG 1 ATOM 791 N ND1 . HIS A 1 105 ? -10.408 21.025 -34.455 1.00 19.47 ? 105 HIS A ND1 1 ATOM 792 C CD2 . HIS A 1 105 ? -12.120 21.325 -35.777 1.00 18.38 ? 105 HIS A CD2 1 ATOM 793 C CE1 . HIS A 1 105 ? -11.144 21.984 -33.924 1.00 18.68 ? 105 HIS A CE1 1 ATOM 794 N NE2 . HIS A 1 105 ? -12.188 22.185 -34.708 1.00 19.26 ? 105 HIS A NE2 1 ATOM 795 N N . VAL A 1 106 ? -10.137 16.094 -36.358 1.00 12.85 ? 106 VAL A N 1 ATOM 796 C CA . VAL A 1 106 ? -9.842 14.836 -37.045 1.00 11.66 ? 106 VAL A CA 1 ATOM 797 C C . VAL A 1 106 ? -11.125 14.158 -37.514 1.00 11.24 ? 106 VAL A C 1 ATOM 798 O O . VAL A 1 106 ? -12.107 14.127 -36.779 1.00 11.04 ? 106 VAL A O 1 ATOM 799 C CB . VAL A 1 106 ? -9.074 13.851 -36.124 1.00 11.07 ? 106 VAL A CB 1 ATOM 800 C CG1 . VAL A 1 106 ? -8.674 12.597 -36.892 1.00 10.13 ? 106 VAL A CG1 1 ATOM 801 C CG2 . VAL A 1 106 ? -7.861 14.528 -35.480 1.00 10.73 ? 106 VAL A CG2 1 ATOM 802 N N . GLU A 1 107 ? -11.094 13.618 -38.733 1.00 10.69 ? 107 GLU A N 1 ATOM 803 C CA . GLU A 1 107 ? -12.205 12.869 -39.313 1.00 10.34 ? 107 GLU A CA 1 ATOM 804 C C . GLU A 1 107 ? -12.456 11.524 -38.592 1.00 9.59 ? 107 GLU A C 1 ATOM 805 O O . GLU A 1 107 ? -11.531 10.972 -37.985 1.00 9.89 ? 107 GLU A O 1 ATOM 806 C CB . GLU A 1 107 ? -11.952 12.671 -40.809 1.00 11.22 ? 107 GLU A CB 1 ATOM 807 C CG . GLU A 1 107 ? -12.287 13.911 -41.632 1.00 11.84 ? 107 GLU A CG 1 ATOM 808 C CD . GLU A 1 107 ? -12.092 13.715 -43.127 1.00 12.64 ? 107 GLU A CD 1 ATOM 809 O OE1 . GLU A 1 107 ? -11.157 13.001 -43.549 1.00 12.76 ? 107 GLU A OE1 1 ATOM 810 O OE2 . GLU A 1 107 ? -12.880 14.304 -43.891 1.00 13.95 ? 107 GLU A OE2 1 ATOM 811 N N . PRO A 1 108 ? -13.702 10.996 -38.651 1.00 8.51 ? 108 PRO A N 1 ATOM 812 C CA . PRO A 1 108 ? -14.069 9.862 -37.790 1.00 8.04 ? 108 PRO A CA 1 ATOM 813 C C . PRO A 1 108 ? -13.645 8.455 -38.286 1.00 7.85 ? 108 PRO A C 1 ATOM 814 O O . PRO A 1 108 ? -13.890 7.461 -37.594 1.00 7.84 ? 108 PRO A O 1 ATOM 815 C CB . PRO A 1 108 ? -15.605 9.973 -37.714 1.00 7.76 ? 108 PRO A CB 1 ATOM 816 C CG . PRO A 1 108 ? -16.000 10.551 -39.001 1.00 7.71 ? 108 PRO A CG 1 ATOM 817 C CD . PRO A 1 108 ? -14.853 11.449 -39.465 1.00 8.20 ? 108 PRO A CD 1 ATOM 818 N N . GLY A 1 109 ? -13.019 8.370 -39.457 1.00 7.36 ? 109 GLY A N 1 ATOM 819 C CA . GLY A 1 109 ? -12.557 7.087 -39.978 1.00 7.01 ? 109 GLY A CA 1 ATOM 820 C C . GLY A 1 109 ? -11.049 6.866 -39.879 1.00 6.80 ? 109 GLY A C 1 ATOM 821 O O . GLY A 1 109 ? -10.550 5.840 -40.347 1.00 6.52 ? 109 GLY A O 1 ATOM 822 N N . ALA A 1 110 ? -10.326 7.821 -39.276 1.00 6.50 ? 110 ALA A N 1 ATOM 823 C CA . ALA A 1 110 ? -8.888 7.663 -39.025 1.00 6.33 ? 110 ALA A CA 1 ATOM 824 C C . ALA A 1 110 ? -8.601 6.550 -38.025 1.00 6.33 ? 110 ALA A C 1 ATOM 825 O O . ALA A 1 110 ? -9.166 6.507 -36.927 1.00 6.31 ? 110 ALA A O 1 ATOM 826 C CB . ALA A 1 110 ? -8.282 8.954 -38.539 1.00 6.24 ? 110 ALA A CB 1 ATOM 827 N N . ARG A 1 111 ? -7.726 5.632 -38.417 1.00 6.43 ? 111 ARG A N 1 ATOM 828 C CA . ARG A 1 111 ? -7.252 4.594 -37.503 1.00 6.47 ? 111 ARG A CA 1 ATOM 829 C C . ARG A 1 111 ? -6.103 5.120 -36.613 1.00 6.46 ? 111 ARG A C 1 ATOM 830 O O . ARG A 1 111 ? -5.370 6.043 -37.009 1.00 5.95 ? 111 ARG A O 1 ATOM 831 C CB . ARG A 1 111 ? -6.890 3.319 -38.279 1.00 6.32 ? 111 ARG A CB 1 ATOM 832 C CG . ARG A 1 111 ? -8.077 2.824 -39.090 1.00 6.48 ? 111 ARG A CG 1 ATOM 833 C CD . ARG A 1 111 ? -7.724 1.839 -40.170 1.00 6.43 ? 111 ARG A CD 1 ATOM 834 N NE . ARG A 1 111 ? -8.901 1.427 -40.948 1.00 6.48 ? 111 ARG A NE 1 ATOM 835 C CZ . ARG A 1 111 ? -9.679 0.373 -40.665 1.00 6.58 ? 111 ARG A CZ 1 ATOM 836 N NH1 . ARG A 1 111 ? -9.435 -0.396 -39.597 1.00 6.35 ? 111 ARG A NH1 1 ATOM 837 N NH2 . ARG A 1 111 ? -10.713 0.081 -41.455 1.00 6.43 ? 111 ARG A NH2 1 ATOM 838 N N . LEU A 1 112 ? -5.982 4.552 -35.412 1.00 6.77 ? 112 LEU A N 1 ATOM 839 C CA . LEU A 1 112 ? -4.983 4.999 -34.432 1.00 7.49 ? 112 LEU A CA 1 ATOM 840 C C . LEU A 1 112 ? -3.563 5.089 -34.978 1.00 7.77 ? 112 LEU A C 1 ATOM 841 O O . LEU A 1 112 ? -2.865 6.025 -34.669 1.00 7.94 ? 112 LEU A O 1 ATOM 842 C CB . LEU A 1 112 ? -4.987 4.125 -33.166 1.00 7.53 ? 112 LEU A CB 1 ATOM 843 C CG . LEU A 1 112 ? -6.323 3.929 -32.462 1.00 7.52 ? 112 LEU A CG 1 ATOM 844 C CD1 . LEU A 1 112 ? -6.112 3.101 -31.199 1.00 7.63 ? 112 LEU A CD1 1 ATOM 845 C CD2 . LEU A 1 112 ? -6.972 5.274 -32.146 1.00 7.49 ? 112 LEU A CD2 1 ATOM 846 N N . GLY A 1 113 ? -3.134 4.127 -35.782 1.00 8.04 ? 113 GLY A N 1 ATOM 847 C CA . GLY A 1 113 ? -1.806 4.207 -36.381 1.00 8.81 ? 113 GLY A CA 1 ATOM 848 C C . GLY A 1 113 ? -1.653 5.388 -37.330 1.00 9.35 ? 113 GLY A C 1 ATOM 849 O O . GLY A 1 113 ? -0.633 6.089 -37.313 1.00 9.59 ? 113 GLY A O 1 ATOM 850 N N . HIS A 1 114 ? -2.666 5.610 -38.161 1.00 9.55 ? 114 HIS A N 1 ATOM 851 C CA . HIS A 1 114 ? -2.659 6.737 -39.090 1.00 9.79 ? 114 HIS A CA 1 ATOM 852 C C . HIS A 1 114 ? -2.708 8.078 -38.336 1.00 10.24 ? 114 HIS A C 1 ATOM 853 O O . HIS A 1 114 ? -1.952 9.001 -38.663 1.00 10.97 ? 114 HIS A O 1 ATOM 854 C CB . HIS A 1 114 ? -3.789 6.603 -40.131 1.00 9.69 ? 114 HIS A CB 1 ATOM 855 C CG . HIS A 1 114 ? -3.986 7.825 -40.974 1.00 10.12 ? 114 HIS A CG 1 ATOM 856 N ND1 . HIS A 1 114 ? -3.190 8.123 -42.062 1.00 10.37 ? 114 HIS A ND1 1 ATOM 857 C CD2 . HIS A 1 114 ? -4.890 8.829 -40.886 1.00 10.22 ? 114 HIS A CD2 1 ATOM 858 C CE1 . HIS A 1 114 ? -3.596 9.257 -42.606 1.00 10.04 ? 114 HIS A CE1 1 ATOM 859 N NE2 . HIS A 1 114 ? -4.628 9.703 -41.915 1.00 10.45 ? 114 HIS A NE2 1 ATOM 860 N N . LEU A 1 115 ? -3.576 8.177 -37.327 1.00 9.93 ? 115 LEU A N 1 ATOM 861 C CA . LEU A 1 115 ? -3.634 9.365 -36.467 1.00 9.80 ? 115 LEU A CA 1 ATOM 862 C C . LEU A 1 115 ? -2.278 9.698 -35.808 1.00 9.62 ? 115 LEU A C 1 ATOM 863 O O . LEU A 1 115 ? -1.826 10.852 -35.830 1.00 10.36 ? 115 LEU A O 1 ATOM 864 C CB . LEU A 1 115 ? -4.715 9.193 -35.391 1.00 9.80 ? 115 LEU A CB 1 ATOM 865 C CG . LEU A 1 115 ? -4.850 10.321 -34.363 1.00 10.15 ? 115 LEU A CG 1 ATOM 866 C CD1 . LEU A 1 115 ? -5.463 11.597 -34.988 1.00 9.49 ? 115 LEU A CD1 1 ATOM 867 C CD2 . LEU A 1 115 ? -5.656 9.832 -33.157 1.00 9.75 ? 115 LEU A CD2 1 ATOM 868 N N . ALA A 1 116 ? -1.636 8.689 -35.235 1.00 8.77 ? 116 ALA A N 1 ATOM 869 C CA . ALA A 1 116 ? -0.394 8.886 -34.537 1.00 8.75 ? 116 ALA A CA 1 ATOM 870 C C . ALA A 1 116 ? 0.693 9.339 -35.512 1.00 9.05 ? 116 ALA A C 1 ATOM 871 O O . ALA A 1 116 ? 1.476 10.244 -35.196 1.00 8.79 ? 116 ALA A O 1 ATOM 872 C CB . ALA A 1 116 ? 0.013 7.628 -33.826 1.00 8.52 ? 116 ALA A CB 1 ATOM 873 N N . THR A 1 117 ? 0.714 8.717 -36.693 1.00 9.04 ? 117 THR A N 1 ATOM 874 C CA . THR A 1 117 ? 1.659 9.063 -37.744 1.00 9.28 ? 117 THR A CA 1 ATOM 875 C C . THR A 1 117 ? 1.513 10.520 -38.199 1.00 9.91 ? 117 THR A C 1 ATOM 876 O O . THR A 1 117 ? 2.519 11.238 -38.272 1.00 9.84 ? 117 THR A O 1 ATOM 877 C CB . THR A 1 117 ? 1.532 8.132 -38.963 1.00 8.93 ? 117 THR A CB 1 ATOM 878 O OG1 . THR A 1 117 ? 1.749 6.777 -38.556 1.00 8.64 ? 117 THR A OG1 1 ATOM 879 C CG2 . THR A 1 117 ? 2.557 8.505 -40.015 1.00 8.70 ? 117 THR A CG2 1 ATOM 880 N N . VAL A 1 118 ? 0.278 10.954 -38.487 1.00 10.04 ? 118 VAL A N 1 ATOM 881 C CA . VAL A 1 118 ? 0.055 12.330 -38.926 1.00 10.64 ? 118 VAL A CA 1 ATOM 882 C C . VAL A 1 118 ? 0.389 13.342 -37.825 1.00 10.99 ? 118 VAL A C 1 ATOM 883 O O . VAL A 1 118 ? 1.113 14.301 -38.075 1.00 11.18 ? 118 VAL A O 1 ATOM 884 C CB . VAL A 1 118 ? -1.371 12.580 -39.521 1.00 10.80 ? 118 VAL A CB 1 ATOM 885 C CG1 . VAL A 1 118 ? -1.575 14.068 -39.790 1.00 10.42 ? 118 VAL A CG1 1 ATOM 886 C CG2 . VAL A 1 118 ? -1.556 11.811 -40.828 1.00 10.42 ? 118 VAL A CG2 1 ATOM 887 N N . LEU A 1 119 ? -0.109 13.126 -36.612 1.00 11.33 ? 119 LEU A N 1 ATOM 888 C CA . LEU A 1 119 ? 0.167 14.069 -35.532 1.00 12.15 ? 119 LEU A CA 1 ATOM 889 C C . LEU A 1 119 ? 1.656 14.192 -35.197 1.00 13.02 ? 119 LEU A C 1 ATOM 890 O O . LEU A 1 119 ? 2.134 15.276 -34.879 1.00 13.21 ? 119 LEU A O 1 ATOM 891 C CB . LEU A 1 119 ? -0.632 13.725 -34.278 1.00 11.94 ? 119 LEU A CB 1 ATOM 892 C CG . LEU A 1 119 ? -2.147 13.930 -34.330 1.00 11.53 ? 119 LEU A CG 1 ATOM 893 C CD1 . LEU A 1 119 ? -2.734 13.410 -33.036 1.00 11.49 ? 119 LEU A CD1 1 ATOM 894 C CD2 . LEU A 1 119 ? -2.522 15.375 -34.548 1.00 11.03 ? 119 LEU A CD2 1 ATOM 895 N N . ASN A 1 120 ? 2.382 13.080 -35.274 1.00 14.14 ? 120 ASN A N 1 ATOM 896 C CA . ASN A 1 120 ? 3.803 13.080 -35.000 1.00 14.30 ? 120 ASN A CA 1 ATOM 897 C C . ASN A 1 120 ? 4.633 13.631 -36.163 1.00 16.00 ? 120 ASN A C 1 ATOM 898 O O . ASN A 1 120 ? 5.351 14.617 -35.994 1.00 17.28 ? 120 ASN A O 1 ATOM 899 C CB . ASN A 1 120 ? 4.270 11.692 -34.571 1.00 13.56 ? 120 ASN A CB 1 ATOM 900 C CG . ASN A 1 120 ? 5.771 11.602 -34.437 1.00 13.36 ? 120 ASN A CG 1 ATOM 901 O OD1 . ASN A 1 120 ? 6.325 11.807 -33.362 1.00 13.25 ? 120 ASN A OD1 1 ATOM 902 N ND2 . ASN A 1 120 ? 6.437 11.307 -35.534 1.00 13.26 ? 120 ASN A ND2 1 ATOM 903 N N . ASP A 1 121 ? 4.529 13.006 -37.336 1.00 17.35 ? 121 ASP A N 1 ATOM 904 C CA . ASP A 1 121 ? 5.313 13.411 -38.508 1.00 17.41 ? 121 ASP A CA 1 ATOM 905 C C . ASP A 1 121 ? 5.050 14.850 -38.966 1.00 17.36 ? 121 ASP A C 1 ATOM 906 O O . ASP A 1 121 ? 5.972 15.542 -39.392 1.00 16.29 ? 121 ASP A O 1 ATOM 907 C CB . ASP A 1 121 ? 5.095 12.451 -39.683 1.00 18.28 ? 121 ASP A CB 1 ATOM 908 C CG . ASP A 1 121 ? 5.561 11.025 -39.388 1.00 19.76 ? 121 ASP A CG 1 ATOM 909 O OD1 . ASP A 1 121 ? 6.085 10.755 -38.281 1.00 20.72 ? 121 ASP A OD1 1 ATOM 910 O OD2 . ASP A 1 121 ? 5.393 10.162 -40.280 1.00 20.90 ? 121 ASP A OD2 1 ATOM 911 N N . LYS A 1 122 ? 3.804 15.301 -38.885 1.00 16.98 ? 122 LYS A N 1 ATOM 912 C CA . LYS A 1 122 ? 3.456 16.601 -39.454 1.00 16.80 ? 122 LYS A CA 1 ATOM 913 C C . LYS A 1 122 ? 3.484 17.714 -38.403 1.00 15.74 ? 122 LYS A C 1 ATOM 914 O O . LYS A 1 122 ? 3.801 18.856 -38.728 1.00 15.49 ? 122 LYS A O 1 ATOM 915 C CB . LYS A 1 122 ? 2.110 16.521 -40.197 1.00 18.72 ? 122 LYS A CB 1 ATOM 916 C CG . LYS A 1 122 ? 1.740 17.726 -41.051 1.00 20.11 ? 122 LYS A CG 1 ATOM 917 C CD . LYS A 1 122 ? 0.769 17.323 -42.163 1.00 21.96 ? 122 LYS A CD 1 ATOM 918 C CE . LYS A 1 122 ? -0.063 18.510 -42.676 1.00 24.76 ? 122 LYS A CE 1 ATOM 919 N NZ . LYS A 1 122 ? 0.653 19.484 -43.566 1.00 26.45 ? 122 LYS A NZ 1 ATOM 920 N N . TYR A 1 123 ? 3.198 17.384 -37.143 1.00 14.47 ? 123 TYR A N 1 ATOM 921 C CA . TYR A 1 123 ? 3.064 18.425 -36.113 1.00 13.18 ? 123 TYR A CA 1 ATOM 922 C C . TYR A 1 123 ? 3.902 18.285 -34.842 1.00 12.60 ? 123 TYR A C 1 ATOM 923 O O . TYR A 1 123 ? 3.933 19.204 -34.023 1.00 12.40 ? 123 TYR A O 1 ATOM 924 C CB . TYR A 1 123 ? 1.600 18.586 -35.719 1.00 12.95 ? 123 TYR A CB 1 ATOM 925 C CG . TYR A 1 123 ? 0.678 18.844 -36.879 1.00 13.17 ? 123 TYR A CG 1 ATOM 926 C CD1 . TYR A 1 123 ? 0.728 20.056 -37.589 1.00 12.70 ? 123 TYR A CD1 1 ATOM 927 C CD2 . TYR A 1 123 ? -0.275 17.891 -37.254 1.00 13.17 ? 123 TYR A CD2 1 ATOM 928 C CE1 . TYR A 1 123 ? -0.143 20.305 -38.656 1.00 12.59 ? 123 TYR A CE1 1 ATOM 929 C CE2 . TYR A 1 123 ? -1.149 18.130 -38.320 1.00 13.11 ? 123 TYR A CE2 1 ATOM 930 C CZ . TYR A 1 123 ? -1.075 19.334 -39.011 1.00 12.86 ? 123 TYR A CZ 1 ATOM 931 O OH . TYR A 1 123 ? -1.928 19.547 -40.060 1.00 13.34 ? 123 TYR A OH 1 ATOM 932 N N . GLY A 1 124 ? 4.564 17.141 -34.672 1.00 12.07 ? 124 GLY A N 1 ATOM 933 C CA . GLY A 1 124 ? 5.325 16.860 -33.459 1.00 11.55 ? 124 GLY A CA 1 ATOM 934 C C . GLY A 1 124 ? 4.448 16.585 -32.250 1.00 11.75 ? 124 GLY A C 1 ATOM 935 O O . GLY A 1 124 ? 4.882 16.767 -31.110 1.00 12.00 ? 124 GLY A O 1 ATOM 936 N N . ARG A 1 125 ? 3.221 16.117 -32.486 1.00 11.23 ? 125 ARG A N 1 ATOM 937 C CA . ARG A 1 125 ? 2.255 15.942 -31.408 1.00 10.70 ? 125 ARG A CA 1 ATOM 938 C C . ARG A 1 125 ? 1.830 14.494 -31.191 1.00 10.69 ? 125 ARG A C 1 ATOM 939 O O . ARG A 1 125 ? 2.069 13.621 -32.051 1.00 10.28 ? 125 ARG A O 1 ATOM 940 C CB . ARG A 1 125 ? 1.034 16.831 -31.649 1.00 10.94 ? 125 ARG A CB 1 ATOM 941 C CG . ARG A 1 125 ? 1.365 18.301 -31.934 1.00 10.73 ? 125 ARG A CG 1 ATOM 942 C CD . ARG A 1 125 ? 2.058 18.955 -30.768 1.00 10.69 ? 125 ARG A CD 1 ATOM 943 N NE . ARG A 1 125 ? 1.147 19.184 -29.657 1.00 11.13 ? 125 ARG A NE 1 ATOM 944 C CZ . ARG A 1 125 ? 1.333 20.091 -28.695 1.00 11.37 ? 125 ARG A CZ 1 ATOM 945 N NH1 . ARG A 1 125 ? 2.413 20.859 -28.712 1.00 11.46 ? 125 ARG A NH1 1 ATOM 946 N NH2 . ARG A 1 125 ? 0.436 20.230 -27.716 1.00 10.60 ? 125 ARG A NH2 1 ATOM 947 N N . ALA A 1 126 ? 1.200 14.255 -30.036 1.00 10.32 ? 126 ALA A N 1 ATOM 948 C CA . ALA A 1 126 ? 0.819 12.922 -29.593 1.00 10.49 ? 126 ALA A CA 1 ATOM 949 C C . ALA A 1 126 ? -0.493 12.906 -28.813 1.00 10.99 ? 126 ALA A C 1 ATOM 950 O O . ALA A 1 126 ? -0.892 13.909 -28.209 1.00 11.41 ? 126 ALA A O 1 ATOM 951 C CB . ALA A 1 126 ? 1.929 12.309 -28.749 1.00 10.12 ? 126 ALA A CB 1 ATOM 952 N N . ILE A 1 127 ? -1.173 11.760 -28.850 1.00 11.32 ? 127 ILE A N 1 ATOM 953 C CA . ILE A 1 127 ? -2.335 11.504 -27.988 1.00 11.06 ? 127 ILE A CA 1 ATOM 954 C C . ILE A 1 127 ? -2.160 10.135 -27.322 1.00 10.77 ? 127 ILE A C 1 ATOM 955 O O . ILE A 1 127 ? -1.518 9.236 -27.881 1.00 10.28 ? 127 ILE A O 1 ATOM 956 C CB . ILE A 1 127 ? -3.699 11.610 -28.757 1.00 11.08 ? 127 ILE A CB 1 ATOM 957 C CG1 . ILE A 1 127 ? -3.960 13.048 -29.192 1.00 11.27 ? 127 ILE A CG1 1 ATOM 958 C CG2 . ILE A 1 127 ? -4.870 11.166 -27.879 1.00 11.01 ? 127 ILE A CG2 1 ATOM 959 C CD1 . ILE A 1 127 ? -4.978 13.191 -30.288 1.00 11.51 ? 127 ILE A CD1 1 ATOM 960 N N . SER A 1 128 ? -2.703 10.018 -26.113 1.00 10.68 ? 128 SER A N 1 ATOM 961 C CA . SER A 1 128 ? -2.715 8.777 -25.346 1.00 10.86 ? 128 SER A CA 1 ATOM 962 C C . SER A 1 128 ? -3.890 7.916 -25.793 1.00 11.23 ? 128 SER A C 1 ATOM 963 O O . SER A 1 128 ? -5.037 8.189 -25.426 1.00 11.64 ? 128 SER A O 1 ATOM 964 C CB . SER A 1 128 ? -2.831 9.094 -23.853 1.00 10.63 ? 128 SER A CB 1 ATOM 965 O OG . SER A 1 128 ? -2.672 7.946 -23.049 1.00 10.38 ? 128 SER A OG 1 ATOM 966 N N . HIS A 1 129 ? -3.607 6.882 -26.582 1.00 11.13 ? 129 HIS A N 1 ATOM 967 C CA . HIS A 1 129 ? -4.654 5.980 -27.082 1.00 11.32 ? 129 HIS A CA 1 ATOM 968 C C . HIS A 1 129 ? -4.156 4.529 -27.052 1.00 11.37 ? 129 HIS A C 1 ATOM 969 O O . HIS A 1 129 ? -3.113 4.238 -26.457 1.00 10.81 ? 129 HIS A O 1 ATOM 970 C CB . HIS A 1 129 ? -5.141 6.389 -28.494 1.00 11.12 ? 129 HIS A CB 1 ATOM 971 C CG . HIS A 1 129 ? -4.030 6.636 -29.479 1.00 11.33 ? 129 HIS A CG 1 ATOM 972 N ND1 . HIS A 1 129 ? -3.239 5.624 -29.982 1.00 11.65 ? 129 HIS A ND1 1 ATOM 973 C CD2 . HIS A 1 129 ? -3.577 7.779 -30.048 1.00 11.28 ? 129 HIS A CD2 1 ATOM 974 C CE1 . HIS A 1 129 ? -2.342 6.132 -30.810 1.00 11.53 ? 129 HIS A CE1 1 ATOM 975 N NE2 . HIS A 1 129 ? -2.528 7.437 -30.873 1.00 11.68 ? 129 HIS A NE2 1 ATOM 976 N N . GLY A 1 130 ? -4.910 3.637 -27.690 1.00 11.42 ? 130 GLY A N 1 ATOM 977 C CA . GLY A 1 130 ? -4.602 2.219 -27.727 1.00 12.05 ? 130 GLY A CA 1 ATOM 978 C C . GLY A 1 130 ? -3.409 1.836 -28.594 1.00 12.83 ? 130 GLY A C 1 ATOM 979 O O . GLY A 1 130 ? -2.854 2.669 -29.331 1.00 12.02 ? 130 GLY A O 1 ATOM 980 N N . THR A 1 131 ? -3.035 0.559 -28.497 1.00 13.28 ? 131 THR A N 1 ATOM 981 C CA . THR A 1 131 ? -1.834 0.036 -29.122 1.00 14.68 ? 131 THR A CA 1 ATOM 982 C C . THR A 1 131 ? -2.052 -0.423 -30.559 1.00 15.87 ? 131 THR A C 1 ATOM 983 O O . THR A 1 131 ? -1.129 -0.320 -31.382 1.00 16.98 ? 131 THR A O 1 ATOM 984 C CB . THR A 1 131 ? -1.216 -1.152 -28.324 1.00 14.62 ? 131 THR A CB 1 ATOM 985 O OG1 . THR A 1 131 ? -2.179 -2.208 -28.191 1.00 15.95 ? 131 THR A OG1 1 ATOM 986 C CG2 . THR A 1 131 ? -0.776 -0.713 -26.949 1.00 14.44 ? 131 THR A CG2 1 ATOM 987 N N . CYS A 1 132 ? -3.241 -0.946 -30.864 1.00 15.74 ? 132 CYS A N 1 ATOM 988 C CA . CYS A 1 132 ? -3.455 -1.576 -32.166 1.00 16.34 ? 132 CYS A CA 1 ATOM 989 C C . CYS A 1 132 ? -3.641 -0.523 -33.272 1.00 15.90 ? 132 CYS A C 1 ATOM 990 O O . CYS A 1 132 ? -4.510 0.337 -33.169 1.00 17.62 ? 132 CYS A O 1 ATOM 991 C CB . CYS A 1 132 ? -4.623 -2.560 -32.122 1.00 16.82 ? 132 CYS A CB 1 ATOM 992 S SG . CYS A 1 132 ? -4.668 -3.710 -30.681 1.00 16.78 ? 132 CYS A SG 1 ATOM 993 N N . PRO A 1 133 ? -2.807 -0.579 -34.325 1.00 15.39 ? 133 PRO A N 1 ATOM 994 C CA . PRO A 1 133 ? -2.798 0.460 -35.374 1.00 14.50 ? 133 PRO A CA 1 ATOM 995 C C . PRO A 1 133 ? -4.041 0.534 -36.285 1.00 13.00 ? 133 PRO A C 1 ATOM 996 O O . PRO A 1 133 ? -4.285 1.573 -36.900 1.00 12.47 ? 133 PRO A O 1 ATOM 997 C CB . PRO A 1 133 ? -1.544 0.115 -36.201 1.00 14.59 ? 133 PRO A CB 1 ATOM 998 C CG . PRO A 1 133 ? -1.268 -1.304 -35.897 1.00 14.58 ? 133 PRO A CG 1 ATOM 999 C CD . PRO A 1 133 ? -1.679 -1.514 -34.479 1.00 14.94 ? 133 PRO A CD 1 ATOM 1000 N N . GLY A 1 134 ? -4.805 -0.554 -36.368 1.00 12.17 ? 134 GLY A N 1 ATOM 1001 C CA . GLY A 1 134 ? -6.001 -0.610 -37.207 1.00 10.73 ? 134 GLY A CA 1 ATOM 1002 C C . GLY A 1 134 ? -7.287 -0.144 -36.555 1.00 10.19 ? 134 GLY A C 1 ATOM 1003 O O . GLY A 1 134 ? -8.304 0.032 -37.233 1.00 10.96 ? 134 GLY A O 1 ATOM 1004 N N . VAL A 1 135 ? -7.259 0.068 -35.242 1.00 9.10 ? 135 VAL A N 1 ATOM 1005 C CA . VAL A 1 135 ? -8.454 0.496 -34.519 1.00 8.35 ? 135 VAL A CA 1 ATOM 1006 C C . VAL A 1 135 ? -8.969 1.873 -34.973 1.00 8.09 ? 135 VAL A C 1 ATOM 1007 O O . VAL A 1 135 ? -8.187 2.782 -35.198 1.00 7.61 ? 135 VAL A O 1 ATOM 1008 C CB . VAL A 1 135 ? -8.189 0.459 -32.996 1.00 8.20 ? 135 VAL A CB 1 ATOM 1009 C CG1 . VAL A 1 135 ? -9.220 1.261 -32.217 1.00 7.64 ? 135 VAL A CG1 1 ATOM 1010 C CG2 . VAL A 1 135 ? -8.112 -1.000 -32.512 1.00 7.97 ? 135 VAL A CG2 1 ATOM 1011 N N . GLY A 1 136 ? -10.298 2.016 -35.100 1.00 8.23 ? 136 GLY A N 1 ATOM 1012 C CA . GLY A 1 136 ? -10.908 3.300 -35.457 1.00 7.34 ? 136 GLY A CA 1 ATOM 1013 C C . GLY A 1 136 ? -10.855 4.308 -34.331 1.00 7.06 ? 136 GLY A C 1 ATOM 1014 O O . GLY A 1 136 ? -10.993 3.941 -33.164 1.00 7.03 ? 136 GLY A O 1 ATOM 1015 N N . ILE A 1 137 ? -10.652 5.580 -34.683 1.00 6.84 ? 137 ILE A N 1 ATOM 1016 C CA . ILE A 1 137 ? -10.714 6.686 -33.716 1.00 6.72 ? 137 ILE A CA 1 ATOM 1017 C C . ILE A 1 137 ? -12.084 6.764 -32.999 1.00 6.59 ? 137 ILE A C 1 ATOM 1018 O O . ILE A 1 137 ? -12.146 7.065 -31.802 1.00 6.36 ? 137 ILE A O 1 ATOM 1019 C CB . ILE A 1 137 ? -10.378 8.066 -34.382 1.00 6.71 ? 137 ILE A CB 1 ATOM 1020 C CG1 . ILE A 1 137 ? -10.340 9.197 -33.342 1.00 6.72 ? 137 ILE A CG1 1 ATOM 1021 C CG2 . ILE A 1 137 ? -11.382 8.404 -35.490 1.00 6.62 ? 137 ILE A CG2 1 ATOM 1022 C CD1 . ILE A 1 137 ? -9.887 10.556 -33.899 1.00 6.81 ? 137 ILE A CD1 1 ATOM 1023 N N . SER A 1 138 ? -13.161 6.474 -33.731 1.00 6.50 ? 138 SER A N 1 ATOM 1024 C CA . SER A 1 138 ? -14.517 6.776 -33.269 1.00 6.57 ? 138 SER A CA 1 ATOM 1025 C C . SER A 1 138 ? -15.030 5.811 -32.203 1.00 6.75 ? 138 SER A C 1 ATOM 1026 O O . SER A 1 138 ? -15.477 6.246 -31.140 1.00 6.79 ? 138 SER A O 1 ATOM 1027 C CB . SER A 1 138 ? -15.486 6.845 -34.438 1.00 6.47 ? 138 SER A CB 1 ATOM 1028 O OG . SER A 1 138 ? -15.295 8.023 -35.193 1.00 6.48 ? 138 SER A OG 1 ATOM 1029 N N . GLY A 1 139 ? -14.949 4.509 -32.482 1.00 6.83 ? 139 GLY A N 1 ATOM 1030 C CA . GLY A 1 139 ? -15.353 3.489 -31.525 1.00 6.83 ? 139 GLY A CA 1 ATOM 1031 C C . GLY A 1 139 ? -14.477 3.536 -30.288 1.00 7.09 ? 139 GLY A C 1 ATOM 1032 O O . GLY A 1 139 ? -14.966 3.399 -29.151 1.00 7.32 ? 139 GLY A O 1 ATOM 1033 N N . HIS A 1 140 ? -13.184 3.747 -30.522 1.00 6.95 ? 140 HIS A N 1 ATOM 1034 C CA . HIS A 1 140 ? -12.180 3.804 -29.476 1.00 6.98 ? 140 HIS A CA 1 ATOM 1035 C C . HIS A 1 140 ? -12.358 4.993 -28.524 1.00 7.39 ? 140 HIS A C 1 ATOM 1036 O O . HIS A 1 140 ? -12.559 4.791 -27.311 1.00 7.74 ? 140 HIS A O 1 ATOM 1037 C CB . HIS A 1 140 ? -10.803 3.863 -30.115 1.00 6.50 ? 140 HIS A CB 1 ATOM 1038 C CG . HIS A 1 140 ? -9.672 3.651 -29.161 1.00 6.20 ? 140 HIS A CG 1 ATOM 1039 N ND1 . HIS A 1 140 ? -9.366 2.417 -28.631 1.00 6.07 ? 140 HIS A ND1 1 ATOM 1040 C CD2 . HIS A 1 140 ? -8.725 4.503 -28.703 1.00 6.09 ? 140 HIS A CD2 1 ATOM 1041 C CE1 . HIS A 1 140 ? -8.294 2.525 -27.866 1.00 5.98 ? 140 HIS A CE1 1 ATOM 1042 N NE2 . HIS A 1 140 ? -7.890 3.782 -27.889 1.00 5.94 ? 140 HIS A NE2 1 ATOM 1043 N N . PHE A 1 141 ? -12.269 6.215 -29.056 1.00 7.53 ? 141 PHE A N 1 ATOM 1044 C CA . PHE A 1 141 ? -12.417 7.439 -28.224 1.00 7.80 ? 141 PHE A CA 1 ATOM 1045 C C . PHE A 1 141 ? -13.783 7.581 -27.571 1.00 7.64 ? 141 PHE A C 1 ATOM 1046 O O . PHE A 1 141 ? -13.865 8.083 -26.453 1.00 7.93 ? 141 PHE A O 1 ATOM 1047 C CB . PHE A 1 141 ? -12.102 8.731 -28.998 1.00 7.75 ? 141 PHE A CB 1 ATOM 1048 C CG . PHE A 1 141 ? -10.645 8.938 -29.278 1.00 8.06 ? 141 PHE A CG 1 ATOM 1049 C CD1 . PHE A 1 141 ? -10.005 10.101 -28.856 1.00 8.25 ? 141 PHE A CD1 1 ATOM 1050 C CD2 . PHE A 1 141 ? -9.903 7.983 -29.969 1.00 8.16 ? 141 PHE A CD2 1 ATOM 1051 C CE1 . PHE A 1 141 ? -8.646 10.312 -29.125 1.00 8.09 ? 141 PHE A CE1 1 ATOM 1052 C CE2 . PHE A 1 141 ? -8.557 8.190 -30.238 1.00 8.22 ? 141 PHE A CE2 1 ATOM 1053 C CZ . PHE A 1 141 ? -7.927 9.362 -29.811 1.00 8.05 ? 141 PHE A CZ 1 ATOM 1054 N N . ALA A 1 142 ? -14.838 7.141 -28.261 1.00 7.41 ? 142 ALA A N 1 ATOM 1055 C CA . ALA A 1 142 ? -16.216 7.258 -27.764 1.00 7.26 ? 142 ALA A CA 1 ATOM 1056 C C . ALA A 1 142 ? -16.515 6.477 -26.496 1.00 7.38 ? 142 ALA A C 1 ATOM 1057 O O . ALA A 1 142 ? -17.500 6.745 -25.828 1.00 7.53 ? 142 ALA A O 1 ATOM 1058 C CB . ALA A 1 142 ? -17.194 6.841 -28.845 1.00 7.14 ? 142 ALA A CB 1 ATOM 1059 N N . HIS A 1 143 ? -15.704 5.475 -26.192 1.00 7.61 ? 143 HIS A N 1 ATOM 1060 C CA . HIS A 1 143 ? -16.010 4.557 -25.088 1.00 7.77 ? 143 HIS A CA 1 ATOM 1061 C C . HIS A 1 143 ? -14.857 4.447 -24.076 1.00 7.96 ? 143 HIS A C 1 ATOM 1062 O O . HIS A 1 143 ? -14.943 3.679 -23.114 1.00 7.98 ? 143 HIS A O 1 ATOM 1063 C CB . HIS A 1 143 ? -16.403 3.167 -25.632 1.00 7.53 ? 143 HIS A CB 1 ATOM 1064 C CG . HIS A 1 143 ? -17.554 3.189 -26.594 1.00 7.52 ? 143 HIS A CG 1 ATOM 1065 N ND1 . HIS A 1 143 ? -17.384 3.203 -27.965 1.00 7.62 ? 143 HIS A ND1 1 ATOM 1066 C CD2 . HIS A 1 143 ? -18.895 3.202 -26.384 1.00 7.39 ? 143 HIS A CD2 1 ATOM 1067 C CE1 . HIS A 1 143 ? -18.569 3.216 -28.551 1.00 7.42 ? 143 HIS A CE1 1 ATOM 1068 N NE2 . HIS A 1 143 ? -19.500 3.217 -27.615 1.00 7.16 ? 143 HIS A NE2 1 ATOM 1069 N N . GLY A 1 144 ? -13.790 5.221 -24.304 1.00 8.22 ? 144 GLY A N 1 ATOM 1070 C CA . GLY A 1 144 ? -12.647 5.297 -23.391 1.00 8.44 ? 144 GLY A CA 1 ATOM 1071 C C . GLY A 1 144 ? -11.314 5.370 -24.120 1.00 8.87 ? 144 GLY A C 1 ATOM 1072 O O . GLY A 1 144 ? -10.888 6.447 -24.566 1.00 8.69 ? 144 GLY A O 1 ATOM 1073 N N . GLY A 1 145 ? -10.658 4.217 -24.249 1.00 9.12 ? 145 GLY A N 1 ATOM 1074 C CA . GLY A 1 145 ? -9.402 4.109 -24.979 1.00 8.99 ? 145 GLY A CA 1 ATOM 1075 C C . GLY A 1 145 ? -8.237 4.071 -24.025 1.00 9.38 ? 145 GLY A C 1 ATOM 1076 O O . GLY A 1 145 ? -7.858 5.099 -23.468 1.00 9.75 ? 145 GLY A O 1 ATOM 1077 N N . PHE A 1 146 ? -7.676 2.881 -23.826 1.00 9.77 ? 146 PHE A N 1 ATOM 1078 C CA . PHE A 1 146 ? -6.620 2.670 -22.835 1.00 10.07 ? 146 PHE A CA 1 ATOM 1079 C C . PHE A 1 146 ? -5.370 2.108 -23.489 1.00 10.50 ? 146 PHE A C 1 ATOM 1080 O O . PHE A 1 146 ? -5.456 1.184 -24.289 1.00 11.34 ? 146 PHE A O 1 ATOM 1081 C CB . PHE A 1 146 ? -7.078 1.732 -21.699 1.00 9.83 ? 146 PHE A CB 1 ATOM 1082 C CG . PHE A 1 146 ? -6.010 1.481 -20.659 1.00 9.76 ? 146 PHE A CG 1 ATOM 1083 C CD1 . PHE A 1 146 ? -5.930 2.276 -19.515 1.00 9.74 ? 146 PHE A CD1 1 ATOM 1084 C CD2 . PHE A 1 146 ? -5.061 0.463 -20.837 1.00 9.66 ? 146 PHE A CD2 1 ATOM 1085 C CE1 . PHE A 1 146 ? -4.928 2.060 -18.547 1.00 9.37 ? 146 PHE A CE1 1 ATOM 1086 C CE2 . PHE A 1 146 ? -4.053 0.244 -19.894 1.00 9.62 ? 146 PHE A CE2 1 ATOM 1087 C CZ . PHE A 1 146 ? -3.991 1.044 -18.736 1.00 9.49 ? 146 PHE A CZ 1 ATOM 1088 N N . GLY A 1 147 ? -4.212 2.651 -23.130 1.00 10.26 ? 147 GLY A N 1 ATOM 1089 C CA . GLY A 1 147 ? -2.956 2.127 -23.632 1.00 10.63 ? 147 GLY A CA 1 ATOM 1090 C C . GLY A 1 147 ? -1.751 2.359 -22.740 1.00 10.76 ? 147 GLY A C 1 ATOM 1091 O O . GLY A 1 147 ? -1.872 2.596 -21.531 1.00 10.66 ? 147 GLY A O 1 ATOM 1092 N N . PHE A 1 148 ? -0.578 2.315 -23.356 1.00 11.06 ? 148 PHE A N 1 ATOM 1093 C CA . PHE A 1 148 ? 0.677 2.410 -22.624 1.00 11.21 ? 148 PHE A CA 1 ATOM 1094 C C . PHE A 1 148 ? 1.078 3.852 -22.264 1.00 11.44 ? 148 PHE A C 1 ATOM 1095 O O . PHE A 1 148 ? 2.207 4.110 -21.820 1.00 11.22 ? 148 PHE A O 1 ATOM 1096 C CB . PHE A 1 148 ? 1.774 1.672 -23.384 1.00 11.32 ? 148 PHE A CB 1 ATOM 1097 C CG . PHE A 1 148 ? 1.712 0.178 -23.238 1.00 11.78 ? 148 PHE A CG 1 ATOM 1098 C CD1 . PHE A 1 148 ? 1.986 -0.437 -22.007 1.00 12.41 ? 148 PHE A CD1 1 ATOM 1099 C CD2 . PHE A 1 148 ? 1.401 -0.634 -24.325 1.00 11.87 ? 148 PHE A CD2 1 ATOM 1100 C CE1 . PHE A 1 148 ? 1.936 -1.845 -21.866 1.00 11.81 ? 148 PHE A CE1 1 ATOM 1101 C CE2 . PHE A 1 148 ? 1.348 -2.051 -24.185 1.00 11.73 ? 148 PHE A CE2 1 ATOM 1102 C CZ . PHE A 1 148 ? 1.626 -2.642 -22.961 1.00 11.34 ? 148 PHE A CZ 1 ATOM 1103 N N . SER A 1 149 ? 0.145 4.788 -22.430 1.00 11.47 ? 149 SER A N 1 ATOM 1104 C CA . SER A 1 149 ? 0.346 6.142 -21.935 1.00 11.76 ? 149 SER A CA 1 ATOM 1105 C C . SER A 1 149 ? -0.756 6.595 -20.965 1.00 12.12 ? 149 SER A C 1 ATOM 1106 O O . SER A 1 149 ? -0.737 7.724 -20.471 1.00 12.99 ? 149 SER A O 1 ATOM 1107 C CB . SER A 1 149 ? 0.487 7.123 -23.098 1.00 11.43 ? 149 SER A CB 1 ATOM 1108 O OG . SER A 1 149 ? 1.732 6.950 -23.730 1.00 11.70 ? 149 SER A OG 1 ATOM 1109 N N . SER A 1 150 ? -1.708 5.719 -20.671 1.00 12.09 ? 150 SER A N 1 ATOM 1110 C CA . SER A 1 150 ? -2.890 6.154 -19.929 1.00 11.52 ? 150 SER A CA 1 ATOM 1111 C C . SER A 1 150 ? -2.587 6.498 -18.480 1.00 11.40 ? 150 SER A C 1 ATOM 1112 O O . SER A 1 150 ? -3.174 7.440 -17.929 1.00 10.60 ? 150 SER A O 1 ATOM 1113 C CB . SER A 1 150 ? -4.027 5.152 -20.048 1.00 11.37 ? 150 SER A CB 1 ATOM 1114 O OG . SER A 1 150 ? -4.429 5.030 -21.392 1.00 11.69 ? 150 SER A OG 1 ATOM 1115 N N . HIS A 1 151 ? -1.662 5.753 -17.871 1.00 11.30 ? 151 HIS A N 1 ATOM 1116 C CA . HIS A 1 151 ? -1.211 6.085 -16.517 1.00 11.39 ? 151 HIS A CA 1 ATOM 1117 C C . HIS A 1 151 ? -0.598 7.499 -16.475 1.00 11.19 ? 151 HIS A C 1 ATOM 1118 O O . HIS A 1 151 ? -0.891 8.284 -15.584 1.00 10.96 ? 151 HIS A O 1 ATOM 1119 C CB . HIS A 1 151 ? -0.223 5.039 -16.013 1.00 11.08 ? 151 HIS A CB 1 ATOM 1120 C CG . HIS A 1 151 ? -0.120 4.977 -14.525 1.00 11.24 ? 151 HIS A CG 1 ATOM 1121 N ND1 . HIS A 1 151 ? 0.773 5.747 -13.807 1.00 11.21 ? 151 HIS A ND1 1 ATOM 1122 C CD2 . HIS A 1 151 ? -0.789 4.225 -13.617 1.00 11.29 ? 151 HIS A CD2 1 ATOM 1123 C CE1 . HIS A 1 151 ? 0.653 5.467 -12.521 1.00 11.43 ? 151 HIS A CE1 1 ATOM 1124 N NE2 . HIS A 1 151 ? -0.294 4.554 -12.377 1.00 11.62 ? 151 HIS A NE2 1 ATOM 1125 N N . MET A 1 152 ? 0.230 7.808 -17.467 1.00 11.71 ? 152 MET A N 1 ATOM 1126 C CA . MET A 1 152 ? 0.853 9.120 -17.611 1.00 12.26 ? 152 MET A CA 1 ATOM 1127 C C . MET A 1 152 ? -0.106 10.231 -18.060 1.00 11.42 ? 152 MET A C 1 ATOM 1128 O O . MET A 1 152 ? -0.049 11.336 -17.540 1.00 11.36 ? 152 MET A O 1 ATOM 1129 C CB . MET A 1 152 ? 2.024 9.024 -18.607 1.00 13.53 ? 152 MET A CB 1 ATOM 1130 C CG . MET A 1 152 ? 2.819 10.303 -18.800 1.00 14.87 ? 152 MET A CG 1 ATOM 1131 S SD . MET A 1 152 ? 3.662 10.872 -17.296 1.00 17.76 ? 152 MET A SD 1 ATOM 1132 C CE . MET A 1 152 ? 4.512 12.324 -17.939 1.00 16.26 ? 152 MET A CE 1 ATOM 1133 N N . HIS A 1 153 ? -0.969 9.938 -19.031 1.00 10.66 ? 153 HIS A N 1 ATOM 1134 C CA . HIS A 1 153 ? -1.686 10.986 -19.766 1.00 9.84 ? 153 HIS A CA 1 ATOM 1135 C C . HIS A 1 153 ? -3.191 10.751 -19.907 1.00 9.35 ? 153 HIS A C 1 ATOM 1136 O O . HIS A 1 153 ? -3.876 11.521 -20.563 1.00 9.54 ? 153 HIS A O 1 ATOM 1137 C CB . HIS A 1 153 ? -1.061 11.182 -21.153 1.00 9.43 ? 153 HIS A CB 1 ATOM 1138 C CG . HIS A 1 153 ? 0.187 12.008 -21.151 1.00 9.84 ? 153 HIS A CG 1 ATOM 1139 N ND1 . HIS A 1 153 ? 0.204 13.335 -20.771 1.00 10.00 ? 153 HIS A ND1 1 ATOM 1140 C CD2 . HIS A 1 153 ? 1.460 11.702 -21.502 1.00 9.77 ? 153 HIS A CD2 1 ATOM 1141 C CE1 . HIS A 1 153 ? 1.436 13.805 -20.876 1.00 10.11 ? 153 HIS A CE1 1 ATOM 1142 N NE2 . HIS A 1 153 ? 2.217 12.832 -21.312 1.00 9.86 ? 153 HIS A NE2 1 ATOM 1143 N N . GLY A 1 154 ? -3.708 9.688 -19.316 1.00 8.86 ? 154 GLY A N 1 ATOM 1144 C CA . GLY A 1 154 ? -5.150 9.444 -19.349 1.00 8.90 ? 154 GLY A CA 1 ATOM 1145 C C . GLY A 1 154 ? -5.659 8.668 -20.554 1.00 8.65 ? 154 GLY A C 1 ATOM 1146 O O . GLY A 1 154 ? -4.881 8.206 -21.401 1.00 8.17 ? 154 GLY A O 1 ATOM 1147 N N . LEU A 1 155 ? -6.980 8.535 -20.625 1.00 8.81 ? 155 LEU A N 1 ATOM 1148 C CA . LEU A 1 155 ? -7.635 7.796 -21.716 1.00 8.94 ? 155 LEU A CA 1 ATOM 1149 C C . LEU A 1 155 ? -7.696 8.629 -22.986 1.00 9.09 ? 155 LEU A C 1 ATOM 1150 O O . LEU A 1 155 ? -7.664 9.873 -22.928 1.00 9.27 ? 155 LEU A O 1 ATOM 1151 C CB . LEU A 1 155 ? -9.056 7.378 -21.309 1.00 8.88 ? 155 LEU A CB 1 ATOM 1152 C CG . LEU A 1 155 ? -9.263 6.603 -20.005 1.00 8.92 ? 155 LEU A CG 1 ATOM 1153 C CD1 . LEU A 1 155 ? -10.757 6.499 -19.741 1.00 9.36 ? 155 LEU A CD1 1 ATOM 1154 C CD2 . LEU A 1 155 ? -8.631 5.214 -20.050 1.00 8.92 ? 155 LEU A CD2 1 ATOM 1155 N N . ALA A 1 156 ? -7.777 7.943 -24.131 1.00 9.08 ? 156 ALA A N 1 ATOM 1156 C CA . ALA A 1 156 ? -8.029 8.594 -25.421 1.00 8.88 ? 156 ALA A CA 1 ATOM 1157 C C . ALA A 1 156 ? -9.192 9.591 -25.292 1.00 9.04 ? 156 ALA A C 1 ATOM 1158 O O . ALA A 1 156 ? -9.084 10.723 -25.756 1.00 9.41 ? 156 ALA A O 1 ATOM 1159 C CB . ALA A 1 156 ? -8.319 7.543 -26.509 1.00 8.66 ? 156 ALA A CB 1 ATOM 1160 N N . VAL A 1 157 ? -10.271 9.172 -24.621 1.00 8.68 ? 157 VAL A N 1 ATOM 1161 C CA . VAL A 1 157 ? -11.461 10.003 -24.396 1.00 8.68 ? 157 VAL A CA 1 ATOM 1162 C C . VAL A 1 157 ? -11.120 11.321 -23.669 1.00 9.19 ? 157 VAL A C 1 ATOM 1163 O O . VAL A 1 157 ? -11.756 12.369 -23.896 1.00 8.72 ? 157 VAL A O 1 ATOM 1164 C CB . VAL A 1 157 ? -12.563 9.205 -23.628 1.00 8.34 ? 157 VAL A CB 1 ATOM 1165 C CG1 . VAL A 1 157 ? -12.191 9.008 -22.160 1.00 7.79 ? 157 VAL A CG1 1 ATOM 1166 C CG2 . VAL A 1 157 ? -13.944 9.857 -23.775 1.00 8.11 ? 157 VAL A CG2 1 ATOM 1167 N N . ASP A 1 158 ? -10.101 11.263 -22.810 1.00 9.79 ? 158 ASP A N 1 ATOM 1168 C CA . ASP A 1 158 ? -9.700 12.422 -22.023 1.00 9.96 ? 158 ASP A CA 1 ATOM 1169 C C . ASP A 1 158 ? -9.006 13.492 -22.877 1.00 9.85 ? 158 ASP A C 1 ATOM 1170 O O . ASP A 1 158 ? -8.697 14.557 -22.380 1.00 10.31 ? 158 ASP A O 1 ATOM 1171 C CB . ASP A 1 158 ? -8.834 11.988 -20.836 1.00 9.98 ? 158 ASP A CB 1 ATOM 1172 C CG . ASP A 1 158 ? -9.616 11.160 -19.815 1.00 10.65 ? 158 ASP A CG 1 ATOM 1173 O OD1 . ASP A 1 158 ? -10.824 11.407 -19.621 1.00 10.64 ? 158 ASP A OD1 1 ATOM 1174 O OD2 . ASP A 1 158 ? -9.021 10.263 -19.184 1.00 11.24 ? 158 ASP A OD2 1 ATOM 1175 N N . SER A 1 159 ? -8.771 13.219 -24.156 1.00 9.59 ? 159 SER A N 1 ATOM 1176 C CA . SER A 1 159 ? -8.209 14.234 -25.056 1.00 9.74 ? 159 SER A CA 1 ATOM 1177 C C . SER A 1 159 ? -9.316 15.052 -25.751 1.00 9.55 ? 159 SER A C 1 ATOM 1178 O O . SER A 1 159 ? -9.064 16.123 -26.316 1.00 9.12 ? 159 SER A O 1 ATOM 1179 C CB . SER A 1 159 ? -7.262 13.593 -26.096 1.00 9.63 ? 159 SER A CB 1 ATOM 1180 O OG . SER A 1 159 ? -7.983 12.844 -27.071 1.00 9.52 ? 159 SER A OG 1 ATOM 1181 N N . VAL A 1 160 ? -10.536 14.530 -25.696 1.00 9.57 ? 160 VAL A N 1 ATOM 1182 C CA . VAL A 1 160 ? -11.682 15.124 -26.370 1.00 9.85 ? 160 VAL A CA 1 ATOM 1183 C C . VAL A 1 160 ? -12.119 16.439 -25.704 1.00 10.32 ? 160 VAL A C 1 ATOM 1184 O O . VAL A 1 160 ? -12.544 16.464 -24.540 1.00 11.18 ? 160 VAL A O 1 ATOM 1185 C CB . VAL A 1 160 ? -12.852 14.106 -26.473 1.00 9.58 ? 160 VAL A CB 1 ATOM 1186 C CG1 . VAL A 1 160 ? -14.090 14.750 -27.059 1.00 9.13 ? 160 VAL A CG1 1 ATOM 1187 C CG2 . VAL A 1 160 ? -12.422 12.853 -27.283 1.00 9.03 ? 160 VAL A CG2 1 ATOM 1188 N N . VAL A 1 161 ? -11.994 17.525 -26.467 1.00 10.32 ? 161 VAL A N 1 ATOM 1189 C CA . VAL A 1 161 ? -12.416 18.873 -26.053 1.00 10.06 ? 161 VAL A CA 1 ATOM 1190 C C . VAL A 1 161 ? -13.637 19.361 -26.846 1.00 10.36 ? 161 VAL A C 1 ATOM 1191 O O . VAL A 1 161 ? -14.261 20.358 -26.473 1.00 11.60 ? 161 VAL A O 1 ATOM 1192 C CB . VAL A 1 161 ? -11.251 19.925 -26.175 1.00 9.82 ? 161 VAL A CB 1 ATOM 1193 C CG1 . VAL A 1 161 ? -10.150 19.659 -25.136 1.00 9.12 ? 161 VAL A CG1 1 ATOM 1194 C CG2 . VAL A 1 161 ? -10.671 19.984 -27.599 1.00 9.12 ? 161 VAL A CG2 1 ATOM 1195 N N . GLY A 1 162 ? -13.982 18.660 -27.927 1.00 9.96 ? 162 GLY A N 1 ATOM 1196 C CA . GLY A 1 162 ? -15.144 19.021 -28.758 1.00 9.70 ? 162 GLY A CA 1 ATOM 1197 C C . GLY A 1 162 ? -15.528 17.961 -29.785 1.00 9.51 ? 162 GLY A C 1 ATOM 1198 O O . GLY A 1 162 ? -14.689 17.149 -30.194 1.00 9.44 ? 162 GLY A O 1 ATOM 1199 N N . VAL A 1 163 ? -16.804 17.942 -30.170 1.00 8.90 ? 163 VAL A N 1 ATOM 1200 C CA . VAL A 1 163 ? -17.279 17.068 -31.244 1.00 9.06 ? 163 VAL A CA 1 ATOM 1201 C C . VAL A 1 163 ? -18.296 17.791 -32.127 1.00 9.37 ? 163 VAL A C 1 ATOM 1202 O O . VAL A 1 163 ? -19.067 18.617 -31.634 1.00 9.41 ? 163 VAL A O 1 ATOM 1203 C CB . VAL A 1 163 ? -17.887 15.703 -30.746 1.00 8.85 ? 163 VAL A CB 1 ATOM 1204 C CG1 . VAL A 1 163 ? -16.801 14.762 -30.216 1.00 8.53 ? 163 VAL A CG1 1 ATOM 1205 C CG2 . VAL A 1 163 ? -19.000 15.917 -29.695 1.00 9.01 ? 163 VAL A CG2 1 ATOM 1206 N N . THR A 1 164 ? -18.267 17.488 -33.426 1.00 9.40 ? 164 THR A N 1 ATOM 1207 C CA . THR A 1 164 ? -19.353 17.814 -34.345 1.00 9.78 ? 164 THR A CA 1 ATOM 1208 C C . THR A 1 164 ? -20.144 16.516 -34.493 1.00 10.00 ? 164 THR A C 1 ATOM 1209 O O . THR A 1 164 ? -19.559 15.467 -34.835 1.00 9.97 ? 164 THR A O 1 ATOM 1210 C CB . THR A 1 164 ? -18.810 18.264 -35.738 1.00 10.13 ? 164 THR A CB 1 ATOM 1211 O OG1 . THR A 1 164 ? -17.848 19.325 -35.578 1.00 10.31 ? 164 THR A OG1 1 ATOM 1212 C CG2 . THR A 1 164 ? -19.939 18.719 -36.658 1.00 9.52 ? 164 THR A CG2 1 ATOM 1213 N N . VAL A 1 165 ? -21.455 16.568 -34.226 1.00 9.99 ? 165 VAL A N 1 ATOM 1214 C CA . VAL A 1 165 ? -22.278 15.350 -34.187 1.00 10.02 ? 165 VAL A CA 1 ATOM 1215 C C . VAL A 1 165 ? -23.483 15.410 -35.119 1.00 10.27 ? 165 VAL A C 1 ATOM 1216 O O . VAL A 1 165 ? -24.169 16.433 -35.184 1.00 10.90 ? 165 VAL A O 1 ATOM 1217 C CB . VAL A 1 165 ? -22.803 15.052 -32.748 1.00 10.13 ? 165 VAL A CB 1 ATOM 1218 C CG1 . VAL A 1 165 ? -23.429 13.665 -32.673 1.00 9.52 ? 165 VAL A CG1 1 ATOM 1219 C CG2 . VAL A 1 165 ? -21.700 15.187 -31.730 1.00 10.07 ? 165 VAL A CG2 1 ATOM 1220 N N . VAL A 1 166 ? -23.758 14.304 -35.813 1.00 10.07 ? 166 VAL A N 1 ATOM 1221 C CA . VAL A 1 166 ? -25.004 14.145 -36.568 1.00 9.60 ? 166 VAL A CA 1 ATOM 1222 C C . VAL A 1 166 ? -26.021 13.399 -35.683 1.00 10.00 ? 166 VAL A C 1 ATOM 1223 O O . VAL A 1 166 ? -25.768 12.274 -35.258 1.00 9.86 ? 166 VAL A O 1 ATOM 1224 C CB . VAL A 1 166 ? -24.772 13.387 -37.910 1.00 9.31 ? 166 VAL A CB 1 ATOM 1225 C CG1 . VAL A 1 166 ? -26.080 13.166 -38.651 1.00 8.69 ? 166 VAL A CG1 1 ATOM 1226 C CG2 . VAL A 1 166 ? -23.750 14.127 -38.803 1.00 9.05 ? 166 VAL A CG2 1 ATOM 1227 N N . LEU A 1 167 ? -27.164 14.027 -35.404 1.00 10.24 ? 167 LEU A N 1 ATOM 1228 C CA . LEU A 1 167 ? -28.158 13.433 -34.497 1.00 10.57 ? 167 LEU A CA 1 ATOM 1229 C C . LEU A 1 167 ? -29.163 12.533 -35.237 1.00 10.78 ? 167 LEU A C 1 ATOM 1230 O O . LEU A 1 167 ? -29.267 12.597 -36.456 1.00 10.69 ? 167 LEU A O 1 ATOM 1231 C CB . LEU A 1 167 ? -28.875 14.524 -33.694 1.00 10.02 ? 167 LEU A CB 1 ATOM 1232 C CG . LEU A 1 167 ? -28.014 15.563 -32.967 1.00 10.23 ? 167 LEU A CG 1 ATOM 1233 C CD1 . LEU A 1 167 ? -28.859 16.661 -32.327 1.00 9.55 ? 167 LEU A CD1 1 ATOM 1234 C CD2 . LEU A 1 167 ? -27.039 14.933 -31.937 1.00 10.22 ? 167 LEU A CD2 1 ATOM 1235 N N . ALA A 1 168 ? -29.891 11.701 -34.490 1.00 11.24 ? 168 ALA A N 1 ATOM 1236 C CA . ALA A 1 168 ? -30.907 10.792 -35.047 1.00 12.07 ? 168 ALA A CA 1 ATOM 1237 C C . ALA A 1 168 ? -31.885 11.444 -36.033 1.00 12.74 ? 168 ALA A C 1 ATOM 1238 O O . ALA A 1 168 ? -32.460 10.771 -36.879 1.00 11.79 ? 168 ALA A O 1 ATOM 1239 C CB . ALA A 1 168 ? -31.677 10.098 -33.915 1.00 11.48 ? 168 ALA A CB 1 ATOM 1240 N N . ASP A 1 169 ? -32.066 12.757 -35.912 1.00 15.22 ? 169 ASP A N 1 ATOM 1241 C CA . ASP A 1 169 ? -32.962 13.503 -36.792 1.00 16.51 ? 169 ASP A CA 1 ATOM 1242 C C . ASP A 1 169 ? -32.206 14.143 -37.957 1.00 15.95 ? 169 ASP A C 1 ATOM 1243 O O . ASP A 1 169 ? -32.796 14.773 -38.821 1.00 17.11 ? 169 ASP A O 1 ATOM 1244 C CB . ASP A 1 169 ? -33.738 14.556 -35.991 1.00 19.05 ? 169 ASP A CB 1 ATOM 1245 C CG . ASP A 1 169 ? -32.827 15.628 -35.368 1.00 20.56 ? 169 ASP A CG 1 ATOM 1246 O OD1 . ASP A 1 169 ? -31.604 15.630 -35.616 1.00 22.37 ? 169 ASP A OD1 1 ATOM 1247 O OD2 . ASP A 1 169 ? -33.345 16.484 -34.631 1.00 21.41 ? 169 ASP A OD2 1 ATOM 1248 N N . GLY A 1 170 ? -30.890 13.982 -37.974 1.00 16.24 ? 170 GLY A N 1 ATOM 1249 C CA . GLY A 1 170 ? -30.077 14.443 -39.102 1.00 14.90 ? 170 GLY A CA 1 ATOM 1250 C C . GLY A 1 170 ? -29.552 15.856 -38.977 1.00 13.95 ? 170 GLY A C 1 ATOM 1251 O O . GLY A 1 170 ? -28.915 16.361 -39.900 1.00 13.31 ? 170 GLY A O 1 ATOM 1252 N N . ARG A 1 171 ? -29.828 16.495 -37.840 1.00 13.65 ? 171 ARG A N 1 ATOM 1253 C CA . ARG A 1 171 ? -29.250 17.802 -37.528 1.00 13.25 ? 171 ARG A CA 1 ATOM 1254 C C . ARG A 1 171 ? -27.792 17.644 -37.150 1.00 12.93 ? 171 ARG A C 1 ATOM 1255 O O . ARG A 1 171 ? -27.402 16.654 -36.524 1.00 12.81 ? 171 ARG A O 1 ATOM 1256 C CB . ARG A 1 171 ? -30.006 18.491 -36.388 1.00 13.14 ? 171 ARG A CB 1 ATOM 1257 C CG . ARG A 1 171 ? -31.436 18.923 -36.742 1.00 13.25 ? 171 ARG A CG 1 ATOM 1258 C CD . ARG A 1 171 ? -32.068 19.810 -35.656 1.00 12.87 ? 171 ARG A CD 1 ATOM 1259 N NE . ARG A 1 171 ? -32.314 19.107 -34.392 1.00 12.75 ? 171 ARG A NE 1 ATOM 1260 C CZ . ARG A 1 171 ? -31.712 19.394 -33.230 1.00 12.92 ? 171 ARG A CZ 1 ATOM 1261 N NH1 . ARG A 1 171 ? -30.828 20.381 -33.144 1.00 11.96 ? 171 ARG A NH1 1 ATOM 1262 N NH2 . ARG A 1 171 ? -32.006 18.694 -32.137 1.00 13.15 ? 171 ARG A NH2 1 ATOM 1263 N N . ILE A 1 172 ? -26.991 18.625 -37.544 1.00 13.35 ? 172 ILE A N 1 ATOM 1264 C CA . ILE A 1 172 ? -25.587 18.687 -37.168 1.00 12.97 ? 172 ILE A CA 1 ATOM 1265 C C . ILE A 1 172 ? -25.439 19.699 -36.038 1.00 13.45 ? 172 ILE A C 1 ATOM 1266 O O . ILE A 1 172 ? -25.895 20.834 -36.152 1.00 13.60 ? 172 ILE A O 1 ATOM 1267 C CB . ILE A 1 172 ? -24.707 19.062 -38.360 1.00 12.84 ? 172 ILE A CB 1 ATOM 1268 C CG1 . ILE A 1 172 ? -25.002 18.128 -39.546 1.00 13.28 ? 172 ILE A CG1 1 ATOM 1269 C CG2 . ILE A 1 172 ? -23.219 19.068 -37.958 1.00 12.51 ? 172 ILE A CG2 1 ATOM 1270 C CD1 . ILE A 1 172 ? -24.367 18.556 -40.874 1.00 13.41 ? 172 ILE A CD1 1 ATOM 1271 N N . VAL A 1 173 ? -24.820 19.264 -34.942 1.00 13.80 ? 173 VAL A N 1 ATOM 1272 C CA . VAL A 1 173 ? -24.615 20.105 -33.757 1.00 14.06 ? 173 VAL A CA 1 ATOM 1273 C C . VAL A 1 173 ? -23.191 19.984 -33.218 1.00 14.30 ? 173 VAL A C 1 ATOM 1274 O O . VAL A 1 173 ? -22.537 18.960 -33.403 1.00 14.28 ? 173 VAL A O 1 ATOM 1275 C CB . VAL A 1 173 ? -25.643 19.807 -32.597 1.00 13.19 ? 173 VAL A CB 1 ATOM 1276 C CG1 . VAL A 1 173 ? -27.088 19.813 -33.114 1.00 12.50 ? 173 VAL A CG1 1 ATOM 1277 C CG2 . VAL A 1 173 ? -25.315 18.512 -31.874 1.00 12.59 ? 173 VAL A CG2 1 ATOM 1278 N N . GLU A 1 174 ? -22.725 21.051 -32.574 1.00 15.45 ? 174 GLU A N 1 ATOM 1279 C CA . GLU A 1 174 ? -21.476 21.047 -31.831 1.00 16.66 ? 174 GLU A CA 1 ATOM 1280 C C . GLU A 1 174 ? -21.709 20.697 -30.354 1.00 16.50 ? 174 GLU A C 1 ATOM 1281 O O . GLU A 1 174 ? -22.721 21.095 -29.758 1.00 15.92 ? 174 GLU A O 1 ATOM 1282 C CB . GLU A 1 174 ? -20.779 22.404 -31.952 1.00 18.57 ? 174 GLU A CB 1 ATOM 1283 C CG . GLU A 1 174 ? -20.676 22.963 -33.384 1.00 21.31 ? 174 GLU A CG 1 ATOM 1284 C CD . GLU A 1 174 ? -19.772 22.135 -34.307 1.00 24.60 ? 174 GLU A CD 1 ATOM 1285 O OE1 . GLU A 1 174 ? -18.901 21.375 -33.803 1.00 24.81 ? 174 GLU A OE1 1 ATOM 1286 O OE2 . GLU A 1 174 ? -19.944 22.252 -35.548 1.00 26.38 ? 174 GLU A OE2 1 ATOM 1287 N N . ALA A 1 175 ? -20.780 19.931 -29.784 1.00 16.31 ? 175 ALA A N 1 ATOM 1288 C CA . ALA A 1 175 ? -20.788 19.634 -28.350 1.00 16.65 ? 175 ALA A CA 1 ATOM 1289 C C . ALA A 1 175 ? -19.394 19.802 -27.745 1.00 17.24 ? 175 ALA A C 1 ATOM 1290 O O . ALA A 1 175 ? -18.387 19.434 -28.351 1.00 17.00 ? 175 ALA A O 1 ATOM 1291 C CB . ALA A 1 175 ? -21.349 18.243 -28.060 1.00 15.08 ? 175 ALA A CB 1 ATOM 1292 N N . SER A 1 176 ? -19.372 20.395 -26.553 1.00 17.42 ? 176 SER A N 1 ATOM 1293 C CA . SER A 1 176 ? -18.168 20.664 -25.782 1.00 17.53 ? 176 SER A CA 1 ATOM 1294 C C . SER A 1 176 ? -18.622 20.957 -24.349 1.00 18.46 ? 176 SER A C 1 ATOM 1295 O O . SER A 1 176 ? -19.805 20.768 -24.019 1.00 16.89 ? 176 SER A O 1 ATOM 1296 C CB . SER A 1 176 ? -17.390 21.850 -26.365 1.00 16.22 ? 176 SER A CB 1 ATOM 1297 O OG . SER A 1 176 ? -18.040 23.072 -26.099 1.00 16.04 ? 176 SER A OG 1 ATOM 1298 N N . ALA A 1 177 ? -17.691 21.422 -23.514 1.00 19.73 ? 177 ALA A N 1 ATOM 1299 C CA . ALA A 1 177 ? -18.000 21.805 -22.137 1.00 22.60 ? 177 ALA A CA 1 ATOM 1300 C C . ALA A 1 177 ? -18.968 23.002 -22.049 1.00 25.28 ? 177 ALA A C 1 ATOM 1301 O O . ALA A 1 177 ? -19.750 23.095 -21.101 1.00 27.46 ? 177 ALA A O 1 ATOM 1302 C CB . ALA A 1 177 ? -16.724 22.084 -21.367 1.00 21.31 ? 177 ALA A CB 1 ATOM 1303 N N . THR A 1 178 ? -18.931 23.883 -23.054 1.00 27.13 ? 178 THR A N 1 ATOM 1304 C CA . THR A 1 178 ? -19.701 25.135 -23.060 1.00 27.68 ? 178 THR A CA 1 ATOM 1305 C C . THR A 1 178 ? -20.817 25.163 -24.122 1.00 29.67 ? 178 THR A C 1 ATOM 1306 O O . THR A 1 178 ? -21.401 26.220 -24.394 1.00 28.57 ? 178 THR A O 1 ATOM 1307 C CB . THR A 1 178 ? -18.783 26.359 -23.303 1.00 27.49 ? 178 THR A CB 1 ATOM 1308 O OG1 . THR A 1 178 ? -18.497 26.469 -24.703 1.00 27.83 ? 178 THR A OG1 1 ATOM 1309 C CG2 . THR A 1 178 ? -17.482 26.239 -22.528 1.00 26.20 ? 178 THR A CG2 1 ATOM 1310 N N . GLU A 1 179 ? -21.098 24.013 -24.732 1.00 28.57 ? 179 GLU A N 1 ATOM 1311 C CA . GLU A 1 179 ? -22.154 23.907 -25.734 1.00 27.09 ? 179 GLU A CA 1 ATOM 1312 C C . GLU A 1 179 ? -22.637 22.459 -25.811 1.00 26.29 ? 179 GLU A C 1 ATOM 1313 O O . GLU A 1 179 ? -21.852 21.545 -26.068 1.00 29.15 ? 179 GLU A O 1 ATOM 1314 C CB . GLU A 1 179 ? -21.655 24.396 -27.098 1.00 27.64 ? 179 GLU A CB 1 ATOM 1315 C CG . GLU A 1 179 ? -22.761 24.635 -28.111 1.00 29.85 ? 179 GLU A CG 1 ATOM 1316 C CD . GLU A 1 179 ? -22.242 25.033 -29.486 1.00 33.97 ? 179 GLU A CD 1 ATOM 1317 O OE1 . GLU A 1 179 ? -21.006 25.216 -29.628 1.00 37.67 ? 179 GLU A OE1 1 ATOM 1318 O OE2 . GLU A 1 179 ? -23.073 25.161 -30.426 1.00 32.56 ? 179 GLU A OE2 1 ATOM 1319 N N . ASN A 1 180 ? -23.928 22.260 -25.575 1.00 23.66 ? 180 ASN A N 1 ATOM 1320 C CA . ASN A 1 180 ? -24.521 20.922 -25.452 1.00 21.11 ? 180 ASN A CA 1 ATOM 1321 C C . ASN A 1 180 ? -23.739 19.999 -24.513 1.00 19.32 ? 180 ASN A C 1 ATOM 1322 O O . ASN A 1 180 ? -23.509 18.822 -24.833 1.00 19.47 ? 180 ASN A O 1 ATOM 1323 C CB . ASN A 1 180 ? -24.701 20.281 -26.829 1.00 20.95 ? 180 ASN A CB 1 ATOM 1324 C CG . ASN A 1 180 ? -25.786 20.949 -27.641 1.00 20.02 ? 180 ASN A CG 1 ATOM 1325 O OD1 . ASN A 1 180 ? -26.890 21.166 -27.156 1.00 19.40 ? 180 ASN A OD1 1 ATOM 1326 N ND2 . ASN A 1 180 ? -25.479 21.267 -28.884 1.00 18.78 ? 180 ASN A ND2 1 ATOM 1327 N N . ALA A 1 181 ? -23.345 20.540 -23.357 1.00 16.71 ? 181 ALA A N 1 ATOM 1328 C CA . ALA A 1 181 ? -22.543 19.806 -22.364 1.00 16.52 ? 181 ALA A CA 1 ATOM 1329 C C . ALA A 1 181 ? -23.116 18.447 -21.916 1.00 15.88 ? 181 ALA A C 1 ATOM 1330 O O . ALA A 1 181 ? -22.344 17.539 -21.592 1.00 16.78 ? 181 ALA A O 1 ATOM 1331 C CB . ALA A 1 181 ? -22.217 20.685 -21.160 1.00 15.29 ? 181 ALA A CB 1 ATOM 1332 N N . ASP A 1 182 ? -24.445 18.309 -21.905 1.00 14.45 ? 182 ASP A N 1 ATOM 1333 C CA . ASP A 1 182 ? -25.078 17.022 -21.600 1.00 13.85 ? 182 ASP A CA 1 ATOM 1334 C C . ASP A 1 182 ? -24.726 15.957 -22.657 1.00 13.25 ? 182 ASP A C 1 ATOM 1335 O O . ASP A 1 182 ? -24.384 14.825 -22.304 1.00 12.29 ? 182 ASP A O 1 ATOM 1336 C CB . ASP A 1 182 ? -26.606 17.157 -21.436 1.00 13.58 ? 182 ASP A CB 1 ATOM 1337 C CG . ASP A 1 182 ? -27.274 17.900 -22.608 1.00 14.27 ? 182 ASP A CG 1 ATOM 1338 O OD1 . ASP A 1 182 ? -26.572 18.578 -23.402 1.00 13.64 ? 182 ASP A OD1 1 ATOM 1339 O OD2 . ASP A 1 182 ? -28.520 17.812 -22.721 1.00 13.93 ? 182 ASP A OD2 1 ATOM 1340 N N . LEU A 1 183 ? -24.814 16.334 -23.938 1.00 12.16 ? 183 LEU A N 1 ATOM 1341 C CA . LEU A 1 183 ? -24.491 15.437 -25.052 1.00 11.57 ? 183 LEU A CA 1 ATOM 1342 C C . LEU A 1 183 ? -22.986 15.107 -25.039 1.00 11.38 ? 183 LEU A C 1 ATOM 1343 O O . LEU A 1 183 ? -22.582 13.937 -25.178 1.00 11.46 ? 183 LEU A O 1 ATOM 1344 C CB . LEU A 1 183 ? -24.935 16.056 -26.387 1.00 11.38 ? 183 LEU A CB 1 ATOM 1345 C CG . LEU A 1 183 ? -24.646 15.397 -27.751 1.00 11.56 ? 183 LEU A CG 1 ATOM 1346 C CD1 . LEU A 1 183 ? -25.255 14.002 -27.851 1.00 11.59 ? 183 LEU A CD1 1 ATOM 1347 C CD2 . LEU A 1 183 ? -25.135 16.257 -28.906 1.00 11.00 ? 183 LEU A CD2 1 ATOM 1348 N N . PHE A 1 184 ? -22.171 16.143 -24.849 1.00 10.70 ? 184 PHE A N 1 ATOM 1349 C CA . PHE A 1 184 ? -20.727 15.993 -24.690 1.00 10.13 ? 184 PHE A CA 1 ATOM 1350 C C . PHE A 1 184 ? -20.362 14.956 -23.613 1.00 9.76 ? 184 PHE A C 1 ATOM 1351 O O . PHE A 1 184 ? -19.459 14.148 -23.812 1.00 9.58 ? 184 PHE A O 1 ATOM 1352 C CB . PHE A 1 184 ? -20.105 17.349 -24.350 1.00 9.94 ? 184 PHE A CB 1 ATOM 1353 C CG . PHE A 1 184 ? -18.608 17.406 -24.536 1.00 9.51 ? 184 PHE A CG 1 ATOM 1354 C CD1 . PHE A 1 184 ? -18.031 17.075 -25.756 1.00 9.55 ? 184 PHE A CD1 1 ATOM 1355 C CD2 . PHE A 1 184 ? -17.783 17.817 -23.491 1.00 9.42 ? 184 PHE A CD2 1 ATOM 1356 C CE1 . PHE A 1 184 ? -16.635 17.142 -25.944 1.00 9.50 ? 184 PHE A CE1 1 ATOM 1357 C CE2 . PHE A 1 184 ? -16.397 17.899 -23.659 1.00 9.55 ? 184 PHE A CE2 1 ATOM 1358 C CZ . PHE A 1 184 ? -15.820 17.562 -24.895 1.00 9.56 ? 184 PHE A CZ 1 ATOM 1359 N N . TRP A 1 185 ? -21.073 14.994 -22.485 1.00 9.63 ? 185 TRP A N 1 ATOM 1360 C CA . TRP A 1 185 ? -20.836 14.078 -21.355 1.00 9.38 ? 185 TRP A CA 1 ATOM 1361 C C . TRP A 1 185 ? -21.085 12.628 -21.777 1.00 9.21 ? 185 TRP A C 1 ATOM 1362 O O . TRP A 1 185 ? -20.290 11.737 -21.473 1.00 8.66 ? 185 TRP A O 1 ATOM 1363 C CB . TRP A 1 185 ? -21.703 14.480 -20.161 1.00 9.10 ? 185 TRP A CB 1 ATOM 1364 C CG . TRP A 1 185 ? -21.603 13.584 -18.962 1.00 9.10 ? 185 TRP A CG 1 ATOM 1365 C CD1 . TRP A 1 185 ? -20.758 13.728 -17.883 1.00 9.02 ? 185 TRP A CD1 1 ATOM 1366 C CD2 . TRP A 1 185 ? -22.396 12.419 -18.696 1.00 8.96 ? 185 TRP A CD2 1 ATOM 1367 N NE1 . TRP A 1 185 ? -20.973 12.711 -16.971 1.00 8.91 ? 185 TRP A NE1 1 ATOM 1368 C CE2 . TRP A 1 185 ? -21.961 11.889 -17.450 1.00 9.25 ? 185 TRP A CE2 1 ATOM 1369 C CE3 . TRP A 1 185 ? -23.416 11.763 -19.394 1.00 8.91 ? 185 TRP A CE3 1 ATOM 1370 C CZ2 . TRP A 1 185 ? -22.535 10.729 -16.877 1.00 9.58 ? 185 TRP A CZ2 1 ATOM 1371 C CZ3 . TRP A 1 185 ? -23.988 10.615 -18.834 1.00 9.32 ? 185 TRP A CZ3 1 ATOM 1372 C CH2 . TRP A 1 185 ? -23.548 10.111 -17.578 1.00 9.56 ? 185 TRP A CH2 1 ATOM 1373 N N . GLY A 1 186 ? -22.169 12.422 -22.521 1.00 9.40 ? 186 GLY A N 1 ATOM 1374 C CA . GLY A 1 186 ? -22.531 11.113 -23.053 1.00 9.92 ? 186 GLY A CA 1 ATOM 1375 C C . GLY A 1 186 ? -21.599 10.584 -24.132 1.00 10.25 ? 186 GLY A C 1 ATOM 1376 O O . GLY A 1 186 ? -21.308 9.390 -24.163 1.00 10.55 ? 186 GLY A O 1 ATOM 1377 N N . ILE A 1 187 ? -21.126 11.470 -25.014 1.00 10.45 ? 187 ILE A N 1 ATOM 1378 C CA . ILE A 1 187 ? -20.218 11.079 -26.091 1.00 9.83 ? 187 ILE A CA 1 ATOM 1379 C C . ILE A 1 187 ? -18.873 10.620 -25.521 1.00 9.83 ? 187 ILE A C 1 ATOM 1380 O O . ILE A 1 187 ? -18.222 9.720 -26.064 1.00 10.00 ? 187 ILE A O 1 ATOM 1381 C CB . ILE A 1 187 ? -20.094 12.198 -27.169 1.00 9.97 ? 187 ILE A CB 1 ATOM 1382 C CG1 . ILE A 1 187 ? -21.171 11.980 -28.232 1.00 10.19 ? 187 ILE A CG1 1 ATOM 1383 C CG2 . ILE A 1 187 ? -18.712 12.202 -27.867 1.00 9.87 ? 187 ILE A CG2 1 ATOM 1384 C CD1 . ILE A 1 187 ? -21.657 13.223 -28.868 1.00 10.17 ? 187 ILE A CD1 1 ATOM 1385 N N . LYS A 1 188 ? -18.474 11.229 -24.411 1.00 9.03 ? 188 LYS A N 1 ATOM 1386 C CA . LYS A 1 188 ? -17.197 10.916 -23.790 1.00 8.46 ? 188 LYS A CA 1 ATOM 1387 C C . LYS A 1 188 ? -17.302 9.687 -22.882 1.00 8.18 ? 188 LYS A C 1 ATOM 1388 O O . LYS A 1 188 ? -17.161 9.788 -21.655 1.00 7.96 ? 188 LYS A O 1 ATOM 1389 C CB . LYS A 1 188 ? -16.664 12.143 -23.047 1.00 8.33 ? 188 LYS A CB 1 ATOM 1390 C CG . LYS A 1 188 ? -16.150 13.237 -24.001 1.00 8.22 ? 188 LYS A CG 1 ATOM 1391 C CD . LYS A 1 188 ? -15.554 14.439 -23.273 1.00 8.25 ? 188 LYS A CD 1 ATOM 1392 C CE . LYS A 1 188 ? -14.273 14.104 -22.518 1.00 8.22 ? 188 LYS A CE 1 ATOM 1393 N NZ . LYS A 1 188 ? -13.629 15.303 -21.898 1.00 8.26 ? 188 LYS A NZ 1 ATOM 1394 N N . GLY A 1 189 ? -17.576 8.532 -23.498 1.00 7.80 ? 189 GLY A N 1 ATOM 1395 C CA . GLY A 1 189 ? -17.695 7.271 -22.768 1.00 7.82 ? 189 GLY A CA 1 ATOM 1396 C C . GLY A 1 189 ? -18.785 6.313 -23.223 1.00 7.97 ? 189 GLY A C 1 ATOM 1397 O O . GLY A 1 189 ? -18.638 5.101 -23.069 1.00 7.37 ? 189 GLY A O 1 ATOM 1398 N N . ALA A 1 190 ? -19.882 6.852 -23.767 1.00 8.19 ? 190 ALA A N 1 ATOM 1399 C CA . ALA A 1 190 ? -20.972 6.031 -24.294 1.00 8.54 ? 190 ALA A CA 1 ATOM 1400 C C . ALA A 1 190 ? -21.435 6.492 -25.690 1.00 8.63 ? 190 ALA A C 1 ATOM 1401 O O . ALA A 1 190 ? -22.588 6.301 -26.079 1.00 8.29 ? 190 ALA A O 1 ATOM 1402 C CB . ALA A 1 190 ? -22.137 6.024 -23.308 1.00 8.80 ? 190 ALA A CB 1 ATOM 1403 N N . GLY A 1 191 ? -20.504 7.059 -26.448 1.00 9.25 ? 191 GLY A N 1 ATOM 1404 C CA . GLY A 1 191 ? -20.811 7.834 -27.671 1.00 9.92 ? 191 GLY A CA 1 ATOM 1405 C C . GLY A 1 191 ? -21.524 7.154 -28.834 1.00 10.19 ? 191 GLY A C 1 ATOM 1406 O O . GLY A 1 191 ? -22.106 7.830 -29.709 1.00 10.69 ? 191 GLY A O 1 ATOM 1407 N N . SER A 1 192 ? -21.474 5.825 -28.859 1.00 9.70 ? 192 SER A N 1 ATOM 1408 C CA . SER A 1 192 ? -22.203 5.060 -29.845 1.00 9.52 ? 192 SER A CA 1 ATOM 1409 C C . SER A 1 192 ? -23.716 5.264 -29.668 1.00 9.49 ? 192 SER A C 1 ATOM 1410 O O . SER A 1 192 ? -24.506 4.971 -30.571 1.00 9.19 ? 192 SER A O 1 ATOM 1411 C CB . SER A 1 192 ? -21.832 3.576 -29.751 1.00 9.17 ? 192 SER A CB 1 ATOM 1412 O OG . SER A 1 192 ? -22.131 3.052 -28.475 1.00 8.78 ? 192 SER A OG 1 ATOM 1413 N N . ASN A 1 193 ? -24.105 5.796 -28.515 1.00 9.68 ? 193 ASN A N 1 ATOM 1414 C CA . ASN A 1 193 ? -25.521 5.920 -28.177 1.00 10.12 ? 193 ASN A CA 1 ATOM 1415 C C . ASN A 1 193 ? -26.259 7.146 -28.710 1.00 9.71 ? 193 ASN A C 1 ATOM 1416 O O . ASN A 1 193 ? -27.484 7.102 -28.828 1.00 9.62 ? 193 ASN A O 1 ATOM 1417 C CB . ASN A 1 193 ? -25.726 5.776 -26.660 1.00 10.63 ? 193 ASN A CB 1 ATOM 1418 C CG . ASN A 1 193 ? -25.582 4.328 -26.197 1.00 11.11 ? 193 ASN A CG 1 ATOM 1419 O OD1 . ASN A 1 193 ? -26.439 3.487 -26.483 1.00 11.50 ? 193 ASN A OD1 1 ATOM 1420 N ND2 . ASN A 1 193 ? -24.491 4.031 -25.491 1.00 11.07 ? 193 ASN A ND2 1 ATOM 1421 N N . PHE A 1 194 ? -25.533 8.217 -29.054 1.00 9.26 ? 194 PHE A N 1 ATOM 1422 C CA . PHE A 1 194 ? -26.186 9.528 -29.198 1.00 9.05 ? 194 PHE A CA 1 ATOM 1423 C C . PHE A 1 194 ? -26.046 10.223 -30.541 1.00 9.26 ? 194 PHE A C 1 ATOM 1424 O O . PHE A 1 194 ? -26.482 11.341 -30.706 1.00 9.75 ? 194 PHE A O 1 ATOM 1425 C CB . PHE A 1 194 ? -25.768 10.467 -28.067 1.00 8.48 ? 194 PHE A CB 1 ATOM 1426 C CG . PHE A 1 194 ? -25.769 9.818 -26.723 1.00 8.28 ? 194 PHE A CG 1 ATOM 1427 C CD1 . PHE A 1 194 ? -26.970 9.509 -26.086 1.00 8.30 ? 194 PHE A CD1 1 ATOM 1428 C CD2 . PHE A 1 194 ? -24.570 9.496 -26.098 1.00 8.20 ? 194 PHE A CD2 1 ATOM 1429 C CE1 . PHE A 1 194 ? -26.976 8.879 -24.831 1.00 8.32 ? 194 PHE A CE1 1 ATOM 1430 C CE2 . PHE A 1 194 ? -24.558 8.870 -24.858 1.00 8.32 ? 194 PHE A CE2 1 ATOM 1431 C CZ . PHE A 1 194 ? -25.775 8.564 -24.213 1.00 8.19 ? 194 PHE A CZ 1 ATOM 1432 N N . GLY A 1 195 ? -25.452 9.564 -31.515 1.00 9.71 ? 195 GLY A N 1 ATOM 1433 C CA . GLY A 1 195 ? -25.305 10.182 -32.816 1.00 9.61 ? 195 GLY A CA 1 ATOM 1434 C C . GLY A 1 195 ? -24.077 9.659 -33.495 1.00 9.73 ? 195 GLY A C 1 ATOM 1435 O O . GLY A 1 195 ? -23.403 8.784 -32.965 1.00 11.11 ? 195 GLY A O 1 ATOM 1436 N N . ILE A 1 196 ? -23.794 10.168 -34.682 1.00 9.35 ? 196 ILE A N 1 ATOM 1437 C CA . ILE A 1 196 ? -22.567 9.803 -35.357 1.00 8.99 ? 196 ILE A CA 1 ATOM 1438 C C . ILE A 1 196 ? -21.654 11.013 -35.288 1.00 8.95 ? 196 ILE A C 1 ATOM 1439 O O . ILE A 1 196 ? -22.004 12.091 -35.779 1.00 8.86 ? 196 ILE A O 1 ATOM 1440 C CB . ILE A 1 196 ? -22.815 9.358 -36.806 1.00 8.70 ? 196 ILE A CB 1 ATOM 1441 C CG1 . ILE A 1 196 ? -23.892 8.256 -36.829 1.00 8.75 ? 196 ILE A CG1 1 ATOM 1442 C CG2 . ILE A 1 196 ? -21.495 8.953 -37.483 1.00 8.15 ? 196 ILE A CG2 1 ATOM 1443 C CD1 . ILE A 1 196 ? -24.079 7.536 -38.180 1.00 8.49 ? 196 ILE A CD1 1 ATOM 1444 N N . VAL A 1 197 ? -20.504 10.831 -34.643 1.00 8.81 ? 197 VAL A N 1 ATOM 1445 C CA . VAL A 1 197 ? -19.509 11.876 -34.548 1.00 8.72 ? 197 VAL A CA 1 ATOM 1446 C C . VAL A 1 197 ? -18.914 12.031 -35.932 1.00 9.00 ? 197 VAL A C 1 ATOM 1447 O O . VAL A 1 197 ? -18.495 11.046 -36.531 1.00 9.55 ? 197 VAL A O 1 ATOM 1448 C CB . VAL A 1 197 ? -18.423 11.543 -33.492 1.00 8.65 ? 197 VAL A CB 1 ATOM 1449 C CG1 . VAL A 1 197 ? -17.236 12.528 -33.575 1.00 8.46 ? 197 VAL A CG1 1 ATOM 1450 C CG2 . VAL A 1 197 ? -19.034 11.529 -32.087 1.00 8.40 ? 197 VAL A CG2 1 ATOM 1451 N N . ALA A 1 198 ? -18.908 13.271 -36.430 1.00 8.96 ? 198 ALA A N 1 ATOM 1452 C CA . ALA A 1 198 ? -18.370 13.632 -37.745 1.00 8.40 ? 198 ALA A CA 1 ATOM 1453 C C . ALA A 1 198 ? -16.976 14.277 -37.666 1.00 8.40 ? 198 ALA A C 1 ATOM 1454 O O . ALA A 1 198 ? -16.198 14.201 -38.614 1.00 8.34 ? 198 ALA A O 1 ATOM 1455 C CB . ALA A 1 198 ? -19.336 14.568 -38.446 1.00 8.53 ? 198 ALA A CB 1 ATOM 1456 N N . VAL A 1 199 ? -16.668 14.931 -36.547 1.00 8.26 ? 199 VAL A N 1 ATOM 1457 C CA . VAL A 1 199 ? -15.347 15.521 -36.329 1.00 8.17 ? 199 VAL A CA 1 ATOM 1458 C C . VAL A 1 199 ? -14.974 15.353 -34.864 1.00 8.59 ? 199 VAL A C 1 ATOM 1459 O O . VAL A 1 199 ? -15.745 15.736 -33.975 1.00 8.54 ? 199 VAL A O 1 ATOM 1460 C CB . VAL A 1 199 ? -15.304 17.062 -36.682 1.00 8.14 ? 199 VAL A CB 1 ATOM 1461 C CG1 . VAL A 1 199 ? -13.875 17.644 -36.504 1.00 7.60 ? 199 VAL A CG1 1 ATOM 1462 C CG2 . VAL A 1 199 ? -15.866 17.353 -38.094 1.00 7.67 ? 199 VAL A CG2 1 ATOM 1463 N N . TRP A 1 200 ? -13.799 14.788 -34.595 1.00 9.01 ? 200 TRP A N 1 ATOM 1464 C CA . TRP A 1 200 ? -13.275 14.792 -33.225 1.00 9.28 ? 200 TRP A CA 1 ATOM 1465 C C . TRP A 1 200 ? -12.355 15.996 -33.047 1.00 9.89 ? 200 TRP A C 1 ATOM 1466 O O . TRP A 1 200 ? -11.577 16.319 -33.934 1.00 10.28 ? 200 TRP A O 1 ATOM 1467 C CB . TRP A 1 200 ? -12.533 13.501 -32.904 1.00 8.72 ? 200 TRP A CB 1 ATOM 1468 C CG . TRP A 1 200 ? -13.394 12.275 -32.932 1.00 8.72 ? 200 TRP A CG 1 ATOM 1469 C CD1 . TRP A 1 200 ? -13.654 11.461 -34.022 1.00 8.47 ? 200 TRP A CD1 1 ATOM 1470 C CD2 . TRP A 1 200 ? -14.117 11.707 -31.827 1.00 8.45 ? 200 TRP A CD2 1 ATOM 1471 N NE1 . TRP A 1 200 ? -14.482 10.425 -33.645 1.00 8.23 ? 200 TRP A NE1 1 ATOM 1472 C CE2 . TRP A 1 200 ? -14.783 10.552 -32.311 1.00 8.32 ? 200 TRP A CE2 1 ATOM 1473 C CE3 . TRP A 1 200 ? -14.269 12.064 -30.476 1.00 8.48 ? 200 TRP A CE3 1 ATOM 1474 C CZ2 . TRP A 1 200 ? -15.595 9.752 -31.488 1.00 8.38 ? 200 TRP A CZ2 1 ATOM 1475 C CZ3 . TRP A 1 200 ? -15.075 11.263 -29.653 1.00 8.35 ? 200 TRP A CZ3 1 ATOM 1476 C CH2 . TRP A 1 200 ? -15.726 10.117 -30.168 1.00 8.33 ? 200 TRP A CH2 1 ATOM 1477 N N . LYS A 1 201 ? -12.467 16.670 -31.908 1.00 10.94 ? 201 LYS A N 1 ATOM 1478 C CA . LYS A 1 201 ? -11.622 17.823 -31.599 1.00 11.57 ? 201 LYS A CA 1 ATOM 1479 C C . LYS A 1 201 ? -10.797 17.463 -30.385 1.00 11.28 ? 201 LYS A C 1 ATOM 1480 O O . LYS A 1 201 ? -11.339 17.243 -29.296 1.00 10.83 ? 201 LYS A O 1 ATOM 1481 C CB . LYS A 1 201 ? -12.474 19.073 -31.382 1.00 12.77 ? 201 LYS A CB 1 ATOM 1482 C CG . LYS A 1 201 ? -13.315 19.413 -32.604 1.00 13.86 ? 201 LYS A CG 1 ATOM 1483 C CD . LYS A 1 201 ? -14.372 20.436 -32.290 1.00 15.77 ? 201 LYS A CD 1 ATOM 1484 C CE . LYS A 1 201 ? -15.298 20.667 -33.493 1.00 17.34 ? 201 LYS A CE 1 ATOM 1485 N NZ . LYS A 1 201 ? -16.382 21.644 -33.159 1.00 17.67 ? 201 LYS A NZ 1 ATOM 1486 N N . LEU A 1 202 ? -9.483 17.359 -30.594 1.00 11.12 ? 202 LEU A N 1 ATOM 1487 C CA . LEU A 1 202 ? -8.604 16.679 -29.650 1.00 10.88 ? 202 LEU A CA 1 ATOM 1488 C C . LEU A 1 202 ? -7.431 17.527 -29.196 1.00 11.34 ? 202 LEU A C 1 ATOM 1489 O O . LEU A 1 202 ? -6.717 18.117 -30.015 1.00 11.27 ? 202 LEU A O 1 ATOM 1490 C CB . LEU A 1 202 ? -8.070 15.374 -30.258 1.00 10.65 ? 202 LEU A CB 1 ATOM 1491 C CG . LEU A 1 202 ? -9.061 14.382 -30.890 1.00 11.01 ? 202 LEU A CG 1 ATOM 1492 C CD1 . LEU A 1 202 ? -8.338 13.177 -31.534 1.00 10.64 ? 202 LEU A CD1 1 ATOM 1493 C CD2 . LEU A 1 202 ? -10.127 13.936 -29.884 1.00 10.28 ? 202 LEU A CD2 1 ATOM 1494 N N . ALA A 1 203 ? -7.227 17.563 -27.879 1.00 11.20 ? 203 ALA A N 1 ATOM 1495 C CA . ALA A 1 203 ? -6.045 18.162 -27.297 1.00 10.99 ? 203 ALA A CA 1 ATOM 1496 C C . ALA A 1 203 ? -4.869 17.192 -27.429 1.00 11.46 ? 203 ALA A C 1 ATOM 1497 O O . ALA A 1 203 ? -5.012 15.994 -27.204 1.00 12.55 ? 203 ALA A O 1 ATOM 1498 C CB . ALA A 1 203 ? -6.299 18.493 -25.850 1.00 10.93 ? 203 ALA A CB 1 ATOM 1499 N N . THR A 1 204 ? -3.710 17.707 -27.806 1.00 11.46 ? 204 THR A N 1 ATOM 1500 C CA . THR A 1 204 ? -2.517 16.882 -27.948 1.00 11.76 ? 204 THR A CA 1 ATOM 1501 C C . THR A 1 204 ? -1.474 17.323 -26.920 1.00 11.74 ? 204 THR A C 1 ATOM 1502 O O . THR A 1 204 ? -1.629 18.364 -26.291 1.00 12.35 ? 204 THR A O 1 ATOM 1503 C CB . THR A 1 204 ? -1.930 16.967 -29.390 1.00 11.58 ? 204 THR A CB 1 ATOM 1504 O OG1 . THR A 1 204 ? -1.434 18.292 -29.635 1.00 11.11 ? 204 THR A OG1 1 ATOM 1505 C CG2 . THR A 1 204 ? -2.995 16.606 -30.451 1.00 10.97 ? 204 THR A CG2 1 ATOM 1506 N N . PHE A 1 205 ? -0.437 16.518 -26.723 1.00 11.48 ? 205 PHE A N 1 ATOM 1507 C CA . PHE A 1 205 ? 0.757 16.973 -25.989 1.00 11.62 ? 205 PHE A CA 1 ATOM 1508 C C . PHE A 1 205 ? 1.967 16.844 -26.901 1.00 11.82 ? 205 PHE A C 1 ATOM 1509 O O . PHE A 1 205 ? 1.908 16.105 -27.890 1.00 12.20 ? 205 PHE A O 1 ATOM 1510 C CB . PHE A 1 205 ? 0.965 16.195 -24.685 1.00 10.86 ? 205 PHE A CB 1 ATOM 1511 C CG . PHE A 1 205 ? 0.864 14.705 -24.838 1.00 10.71 ? 205 PHE A CG 1 ATOM 1512 C CD1 . PHE A 1 205 ? 2.003 13.939 -25.056 1.00 10.28 ? 205 PHE A CD1 1 ATOM 1513 C CD2 . PHE A 1 205 ? -0.380 14.066 -24.744 1.00 10.56 ? 205 PHE A CD2 1 ATOM 1514 C CE1 . PHE A 1 205 ? 1.913 12.568 -25.189 1.00 10.51 ? 205 PHE A CE1 1 ATOM 1515 C CE2 . PHE A 1 205 ? -0.488 12.692 -24.881 1.00 10.59 ? 205 PHE A CE2 1 ATOM 1516 C CZ . PHE A 1 205 ? 0.659 11.934 -25.105 1.00 10.69 ? 205 PHE A CZ 1 ATOM 1517 N N . PRO A 1 206 ? 3.064 17.571 -26.600 1.00 12.42 ? 206 PRO A N 1 ATOM 1518 C CA . PRO A 1 206 ? 4.267 17.374 -27.440 1.00 12.14 ? 206 PRO A CA 1 ATOM 1519 C C . PRO A 1 206 ? 4.674 15.900 -27.465 1.00 12.72 ? 206 PRO A C 1 ATOM 1520 O O . PRO A 1 206 ? 4.612 15.234 -26.430 1.00 12.90 ? 206 PRO A O 1 ATOM 1521 C CB . PRO A 1 206 ? 5.331 18.224 -26.737 1.00 11.51 ? 206 PRO A CB 1 ATOM 1522 C CG . PRO A 1 206 ? 4.576 19.248 -25.981 1.00 11.52 ? 206 PRO A CG 1 ATOM 1523 C CD . PRO A 1 206 ? 3.254 18.637 -25.593 1.00 11.85 ? 206 PRO A CD 1 ATOM 1524 N N . ALA A 1 207 ? 5.047 15.385 -28.634 1.00 14.00 ? 207 ALA A N 1 ATOM 1525 C CA . ALA A 1 207 ? 5.485 13.989 -28.762 1.00 15.39 ? 207 ALA A CA 1 ATOM 1526 C C . ALA A 1 207 ? 6.716 13.750 -27.889 1.00 16.67 ? 207 ALA A C 1 ATOM 1527 O O . ALA A 1 207 ? 7.718 14.447 -28.042 1.00 17.61 ? 207 ALA A O 1 ATOM 1528 C CB . ALA A 1 207 ? 5.785 13.640 -30.208 1.00 15.01 ? 207 ALA A CB 1 ATOM 1529 N N . PRO A 1 208 ? 6.631 12.783 -26.954 1.00 17.48 ? 208 PRO A N 1 ATOM 1530 C CA . PRO A 1 208 ? 7.706 12.506 -26.006 1.00 18.72 ? 208 PRO A CA 1 ATOM 1531 C C . PRO A 1 208 ? 9.014 12.127 -26.695 1.00 20.92 ? 208 PRO A C 1 ATOM 1532 O O . PRO A 1 208 ? 9.001 11.442 -27.720 1.00 23.23 ? 208 PRO A O 1 ATOM 1533 C CB . PRO A 1 208 ? 7.155 11.322 -25.203 1.00 18.02 ? 208 PRO A CB 1 ATOM 1534 C CG . PRO A 1 208 ? 5.698 11.512 -25.245 1.00 17.57 ? 208 PRO A CG 1 ATOM 1535 C CD . PRO A 1 208 ? 5.411 12.022 -26.620 1.00 17.34 ? 208 PRO A CD 1 ATOM 1536 N N . LYS A 1 209 ? 10.134 12.568 -26.136 1.00 21.96 ? 209 LYS A N 1 ATOM 1537 C CA . LYS A 1 209 ? 11.429 12.322 -26.758 1.00 21.56 ? 209 LYS A CA 1 ATOM 1538 C C . LYS A 1 209 ? 12.162 11.186 -26.059 1.00 21.65 ? 209 LYS A C 1 ATOM 1539 O O . LYS A 1 209 ? 13.004 10.516 -26.668 1.00 22.84 ? 209 LYS A O 1 ATOM 1540 C CB . LYS A 1 209 ? 12.283 13.593 -26.739 1.00 23.19 ? 209 LYS A CB 1 ATOM 1541 C CG . LYS A 1 209 ? 11.802 14.713 -27.659 1.00 24.14 ? 209 LYS A CG 1 ATOM 1542 C CD . LYS A 1 209 ? 12.920 15.739 -27.893 1.00 26.54 ? 209 LYS A CD 1 ATOM 1543 C CE . LYS A 1 209 ? 12.546 16.811 -28.924 1.00 27.25 ? 209 LYS A CE 1 ATOM 1544 N NZ . LYS A 1 209 ? 12.258 16.218 -30.262 1.00 27.91 ? 209 LYS A NZ 1 ATOM 1545 N N . VAL A 1 210 ? 11.840 10.980 -24.781 1.00 19.69 ? 210 VAL A N 1 ATOM 1546 C CA . VAL A 1 210 ? 12.549 10.018 -23.938 1.00 17.79 ? 210 VAL A CA 1 ATOM 1547 C C . VAL A 1 210 ? 11.575 9.012 -23.320 1.00 16.89 ? 210 VAL A C 1 ATOM 1548 O O . VAL A 1 210 ? 10.828 9.324 -22.381 1.00 15.99 ? 210 VAL A O 1 ATOM 1549 C CB . VAL A 1 210 ? 13.432 10.736 -22.845 1.00 18.01 ? 210 VAL A CB 1 ATOM 1550 C CG1 . VAL A 1 210 ? 14.125 9.729 -21.943 1.00 16.93 ? 210 VAL A CG1 1 ATOM 1551 C CG2 . VAL A 1 210 ? 14.490 11.636 -23.504 1.00 17.26 ? 210 VAL A CG2 1 ATOM 1552 N N . LEU A 1 211 ? 11.586 7.806 -23.876 1.00 15.59 ? 211 LEU A N 1 ATOM 1553 C CA . LEU A 1 211 ? 10.727 6.721 -23.424 1.00 14.59 ? 211 LEU A CA 1 ATOM 1554 C C . LEU A 1 211 ? 11.529 5.446 -23.346 1.00 14.47 ? 211 LEU A C 1 ATOM 1555 O O . LEU A 1 211 ? 12.419 5.197 -24.166 1.00 14.53 ? 211 LEU A O 1 ATOM 1556 C CB . LEU A 1 211 ? 9.552 6.501 -24.382 1.00 13.76 ? 211 LEU A CB 1 ATOM 1557 C CG . LEU A 1 211 ? 8.546 7.627 -24.608 1.00 13.59 ? 211 LEU A CG 1 ATOM 1558 C CD1 . LEU A 1 211 ? 7.625 7.242 -25.728 1.00 13.48 ? 211 LEU A CD1 1 ATOM 1559 C CD2 . LEU A 1 211 ? 7.743 7.951 -23.335 1.00 13.37 ? 211 LEU A CD2 1 ATOM 1560 N N . THR A 1 212 ? 11.194 4.630 -22.361 1.00 14.45 ? 212 THR A N 1 ATOM 1561 C CA . THR A 1 212 ? 11.849 3.358 -22.171 1.00 14.35 ? 212 THR A CA 1 ATOM 1562 C C . THR A 1 212 ? 10.795 2.266 -22.089 1.00 14.58 ? 212 THR A C 1 ATOM 1563 O O . THR A 1 212 ? 9.904 2.312 -21.229 1.00 15.00 ? 212 THR A O 1 ATOM 1564 C CB . THR A 1 212 ? 12.709 3.374 -20.884 1.00 14.25 ? 212 THR A CB 1 ATOM 1565 O OG1 . THR A 1 212 ? 13.638 4.467 -20.955 1.00 13.77 ? 212 THR A OG1 1 ATOM 1566 C CG2 . THR A 1 212 ? 13.471 2.074 -20.734 1.00 13.90 ? 212 THR A CG2 1 ATOM 1567 N N . ARG A 1 213 ? 10.876 1.307 -23.006 1.00 14.15 ? 213 ARG A N 1 ATOM 1568 C CA . ARG A 1 213 ? 10.070 0.097 -22.898 1.00 14.17 ? 213 ARG A CA 1 ATOM 1569 C C . ARG A 1 213 ? 10.802 -0.843 -21.965 1.00 13.59 ? 213 ARG A C 1 ATOM 1570 O O . ARG A 1 213 ? 12.020 -0.976 -22.045 1.00 13.58 ? 213 ARG A O 1 ATOM 1571 C CB . ARG A 1 213 ? 9.853 -0.573 -24.255 1.00 14.45 ? 213 ARG A CB 1 ATOM 1572 C CG . ARG A 1 213 ? 9.289 -1.965 -24.150 1.00 14.69 ? 213 ARG A CG 1 ATOM 1573 C CD . ARG A 1 213 ? 9.009 -2.552 -25.513 1.00 15.79 ? 213 ARG A CD 1 ATOM 1574 N NE . ARG A 1 213 ? 8.299 -3.824 -25.401 1.00 15.57 ? 213 ARG A NE 1 ATOM 1575 C CZ . ARG A 1 213 ? 7.528 -4.335 -26.352 1.00 15.57 ? 213 ARG A CZ 1 ATOM 1576 N NH1 . ARG A 1 213 ? 7.357 -3.673 -27.487 1.00 16.57 ? 213 ARG A NH1 1 ATOM 1577 N NH2 . ARG A 1 213 ? 6.915 -5.495 -26.168 1.00 14.96 ? 213 ARG A NH2 1 ATOM 1578 N N . PHE A 1 214 ? 10.051 -1.469 -21.070 1.00 12.94 ? 214 PHE A N 1 ATOM 1579 C CA . PHE A 1 214 ? 10.608 -2.422 -20.127 1.00 12.49 ? 214 PHE A CA 1 ATOM 1580 C C . PHE A 1 214 ? 9.753 -3.669 -20.092 1.00 12.74 ? 214 PHE A C 1 ATOM 1581 O O . PHE A 1 214 ? 8.562 -3.617 -20.425 1.00 12.88 ? 214 PHE A O 1 ATOM 1582 C CB . PHE A 1 214 ? 10.735 -1.804 -18.719 1.00 11.56 ? 214 PHE A CB 1 ATOM 1583 C CG . PHE A 1 214 ? 9.437 -1.330 -18.129 1.00 10.77 ? 214 PHE A CG 1 ATOM 1584 C CD1 . PHE A 1 214 ? 8.658 -2.178 -17.348 1.00 10.73 ? 214 PHE A CD1 1 ATOM 1585 C CD2 . PHE A 1 214 ? 8.994 -0.034 -18.339 1.00 10.33 ? 214 PHE A CD2 1 ATOM 1586 C CE1 . PHE A 1 214 ? 7.465 -1.729 -16.783 1.00 10.33 ? 214 PHE A CE1 1 ATOM 1587 C CE2 . PHE A 1 214 ? 7.794 0.407 -17.779 1.00 10.09 ? 214 PHE A CE2 1 ATOM 1588 C CZ . PHE A 1 214 ? 7.042 -0.441 -16.997 1.00 9.88 ? 214 PHE A CZ 1 ATOM 1589 N N . GLY A 1 215 ? 10.369 -4.777 -19.686 1.00 13.20 ? 215 GLY A N 1 ATOM 1590 C CA . GLY A 1 215 ? 9.664 -6.036 -19.452 1.00 14.33 ? 215 GLY A CA 1 ATOM 1591 C C . GLY A 1 215 ? 10.344 -6.917 -18.416 1.00 15.47 ? 215 GLY A C 1 ATOM 1592 O O . GLY A 1 215 ? 11.574 -6.907 -18.277 1.00 17.53 ? 215 GLY A O 1 ATOM 1593 N N . VAL A 1 216 ? 9.538 -7.679 -17.684 1.00 15.14 ? 216 VAL A N 1 ATOM 1594 C CA . VAL A 1 216 ? 10.026 -8.647 -16.696 1.00 14.20 ? 216 VAL A CA 1 ATOM 1595 C C . VAL A 1 216 ? 9.323 -9.981 -16.931 1.00 14.00 ? 216 VAL A C 1 ATOM 1596 O O . VAL A 1 216 ? 8.095 -10.054 -16.904 1.00 13.66 ? 216 VAL A O 1 ATOM 1597 C CB . VAL A 1 216 ? 9.761 -8.185 -15.206 1.00 14.00 ? 216 VAL A CB 1 ATOM 1598 C CG1 . VAL A 1 216 ? 10.405 -9.134 -14.207 1.00 12.95 ? 216 VAL A CG1 1 ATOM 1599 C CG2 . VAL A 1 216 ? 10.249 -6.754 -14.961 1.00 13.99 ? 216 VAL A CG2 1 ATOM 1600 N N . THR A 1 217 ? 10.104 -11.032 -17.172 1.00 14.04 ? 217 THR A N 1 ATOM 1601 C CA . THR A 1 217 ? 9.574 -12.392 -17.235 1.00 13.19 ? 217 THR A CA 1 ATOM 1602 C C . THR A 1 217 ? 9.381 -12.865 -15.796 1.00 13.68 ? 217 THR A C 1 ATOM 1603 O O . THR A 1 217 ? 10.335 -12.953 -15.013 1.00 14.16 ? 217 THR A O 1 ATOM 1604 C CB . THR A 1 217 ? 10.524 -13.291 -18.048 1.00 12.89 ? 217 THR A CB 1 ATOM 1605 O OG1 . THR A 1 217 ? 10.578 -12.788 -19.394 1.00 12.84 ? 217 THR A OG1 1 ATOM 1606 C CG2 . THR A 1 217 ? 10.086 -14.769 -18.043 1.00 11.69 ? 217 THR A CG2 1 ATOM 1607 N N . LEU A 1 218 ? 8.133 -13.128 -15.442 1.00 14.25 ? 218 LEU A N 1 ATOM 1608 C CA . LEU A 1 218 ? 7.753 -13.314 -14.041 1.00 14.35 ? 218 LEU A CA 1 ATOM 1609 C C . LEU A 1 218 ? 8.140 -14.682 -13.478 1.00 15.35 ? 218 LEU A C 1 ATOM 1610 O O . LEU A 1 218 ? 8.538 -14.791 -12.317 1.00 14.46 ? 218 LEU A O 1 ATOM 1611 C CB . LEU A 1 218 ? 6.265 -13.032 -13.863 1.00 13.36 ? 218 LEU A CB 1 ATOM 1612 C CG . LEU A 1 218 ? 5.920 -11.555 -14.080 1.00 13.27 ? 218 LEU A CG 1 ATOM 1613 C CD1 . LEU A 1 218 ? 4.433 -11.385 -14.249 1.00 13.09 ? 218 LEU A CD1 1 ATOM 1614 C CD2 . LEU A 1 218 ? 6.433 -10.687 -12.921 1.00 13.28 ? 218 LEU A CD2 1 ATOM 1615 N N . ASN A 1 219 ? 8.034 -15.712 -14.322 1.00 16.74 ? 219 ASN A N 1 ATOM 1616 C CA . ASN A 1 219 ? 8.387 -17.092 -13.968 1.00 17.65 ? 219 ASN A CA 1 ATOM 1617 C C . ASN A 1 219 ? 7.607 -17.674 -12.797 1.00 18.50 ? 219 ASN A C 1 ATOM 1618 O O . ASN A 1 219 ? 8.141 -18.482 -12.045 1.00 18.79 ? 219 ASN A O 1 ATOM 1619 C CB . ASN A 1 219 ? 9.904 -17.248 -13.764 1.00 17.05 ? 219 ASN A CB 1 ATOM 1620 C CG . ASN A 1 219 ? 10.668 -17.159 -15.066 1.00 16.86 ? 219 ASN A CG 1 ATOM 1621 O OD1 . ASN A 1 219 ? 10.247 -17.723 -16.072 1.00 18.32 ? 219 ASN A OD1 1 ATOM 1622 N ND2 . ASN A 1 219 ? 11.777 -16.435 -15.064 1.00 15.74 ? 219 ASN A ND2 1 ATOM 1623 N N . TRP A 1 220 ? 6.341 -17.274 -12.670 1.00 19.51 ? 220 TRP A N 1 ATOM 1624 C CA . TRP A 1 220 ? 5.423 -17.867 -11.700 1.00 20.89 ? 220 TRP A CA 1 ATOM 1625 C C . TRP A 1 220 ? 5.053 -19.265 -12.186 1.00 22.99 ? 220 TRP A C 1 ATOM 1626 O O . TRP A 1 220 ? 4.254 -19.400 -13.116 1.00 25.22 ? 220 TRP A O 1 ATOM 1627 C CB . TRP A 1 220 ? 4.157 -17.016 -11.531 1.00 19.90 ? 220 TRP A CB 1 ATOM 1628 C CG . TRP A 1 220 ? 4.408 -15.573 -11.163 1.00 20.50 ? 220 TRP A CG 1 ATOM 1629 C CD1 . TRP A 1 220 ? 5.526 -15.058 -10.557 1.00 20.25 ? 220 TRP A CD1 1 ATOM 1630 C CD2 . TRP A 1 220 ? 3.504 -14.466 -11.338 1.00 20.83 ? 220 TRP A CD2 1 ATOM 1631 N NE1 . TRP A 1 220 ? 5.385 -13.703 -10.367 1.00 20.82 ? 220 TRP A NE1 1 ATOM 1632 C CE2 . TRP A 1 220 ? 4.156 -13.310 -10.832 1.00 21.05 ? 220 TRP A CE2 1 ATOM 1633 C CE3 . TRP A 1 220 ? 2.214 -14.334 -11.881 1.00 19.95 ? 220 TRP A CE3 1 ATOM 1634 C CZ2 . TRP A 1 220 ? 3.561 -12.035 -10.858 1.00 20.03 ? 220 TRP A CZ2 1 ATOM 1635 C CZ3 . TRP A 1 220 ? 1.625 -13.067 -11.906 1.00 19.48 ? 220 TRP A CZ3 1 ATOM 1636 C CH2 . TRP A 1 220 ? 2.299 -11.936 -11.393 1.00 19.44 ? 220 TRP A CH2 1 ATOM 1637 N N . LYS A 1 221 ? 5.637 -20.291 -11.562 1.00 23.02 ? 221 LYS A N 1 ATOM 1638 C CA A LYS A 1 221 ? 5.407 -21.649 -12.048 0.50 24.15 ? 221 LYS A CA 1 ATOM 1639 C CA B LYS A 1 221 ? 5.498 -21.701 -11.957 0.50 23.45 ? 221 LYS A CA 1 ATOM 1640 C C . LYS A 1 221 ? 4.323 -22.389 -11.252 1.00 24.34 ? 221 LYS A C 1 ATOM 1641 O O . LYS A 1 221 ? 3.982 -23.529 -11.560 1.00 25.57 ? 221 LYS A O 1 ATOM 1642 C CB A LYS A 1 221 ? 6.723 -22.435 -12.113 0.50 24.87 ? 221 LYS A CB 1 ATOM 1643 C CB B LYS A 1 221 ? 6.770 -22.501 -11.599 0.50 22.87 ? 221 LYS A CB 1 ATOM 1644 C CG A LYS A 1 221 ? 7.394 -22.444 -13.498 0.50 25.23 ? 221 LYS A CG 1 ATOM 1645 C CG B LYS A 1 221 ? 8.122 -21.818 -11.819 0.50 21.57 ? 221 LYS A CG 1 ATOM 1646 C CD A LYS A 1 221 ? 7.157 -21.162 -14.303 0.50 24.53 ? 221 LYS A CD 1 ATOM 1647 C CD B LYS A 1 221 ? 8.650 -22.017 -13.231 0.50 21.05 ? 221 LYS A CD 1 ATOM 1648 C CE A LYS A 1 221 ? 7.754 -21.270 -15.705 0.50 24.80 ? 221 LYS A CE 1 ATOM 1649 C CE B LYS A 1 221 ? 10.116 -21.618 -13.331 0.50 20.18 ? 221 LYS A CE 1 ATOM 1650 N NZ A LYS A 1 221 ? 7.190 -20.271 -16.652 0.50 24.29 ? 221 LYS A NZ 1 ATOM 1651 N NZ B LYS A 1 221 ? 10.526 -21.352 -14.734 0.50 19.71 ? 221 LYS A NZ 1 ATOM 1652 N N . ASN A 1 222 ? 3.747 -21.725 -10.258 1.00 23.79 ? 222 ASN A N 1 ATOM 1653 C CA . ASN A 1 222 ? 2.704 -22.345 -9.433 1.00 23.54 ? 222 ASN A CA 1 ATOM 1654 C C . ASN A 1 222 ? 1.726 -21.318 -8.838 1.00 21.93 ? 222 ASN A C 1 ATOM 1655 O O . ASN A 1 222 ? 1.931 -20.106 -8.959 1.00 20.82 ? 222 ASN A O 1 ATOM 1656 C CB . ASN A 1 222 ? 3.319 -23.257 -8.343 1.00 24.41 ? 222 ASN A CB 1 ATOM 1657 C CG . ASN A 1 222 ? 4.336 -22.530 -7.464 1.00 25.40 ? 222 ASN A CG 1 ATOM 1658 O OD1 . ASN A 1 222 ? 4.041 -21.456 -6.941 1.00 27.61 ? 222 ASN A OD1 1 ATOM 1659 N ND2 . ASN A 1 222 ? 5.539 -23.118 -7.299 1.00 25.64 ? 222 ASN A ND2 1 ATOM 1660 N N . LYS A 1 223 ? 0.667 -21.818 -8.208 1.00 21.24 ? 223 LYS A N 1 ATOM 1661 C CA . LYS A 1 223 ? -0.395 -20.981 -7.654 1.00 19.45 ? 223 LYS A CA 1 ATOM 1662 C C . LYS A 1 223 ? 0.110 -19.994 -6.612 1.00 20.02 ? 223 LYS A C 1 ATOM 1663 O O . LYS A 1 223 ? -0.301 -18.817 -6.625 1.00 20.20 ? 223 LYS A O 1 ATOM 1664 C CB . LYS A 1 223 ? -1.510 -21.844 -7.061 1.00 18.89 ? 223 LYS A CB 1 ATOM 1665 C CG . LYS A 1 223 ? -2.294 -22.659 -8.097 1.00 18.84 ? 223 LYS A CG 1 ATOM 1666 C CD . LYS A 1 223 ? -3.522 -23.300 -7.467 1.00 18.19 ? 223 LYS A CD 1 ATOM 1667 C CE . LYS A 1 223 ? -4.034 -24.467 -8.279 1.00 17.60 ? 223 LYS A CE 1 ATOM 1668 N NZ . LYS A 1 223 ? -5.428 -24.808 -7.872 1.00 18.31 ? 223 LYS A NZ 1 ATOM 1669 N N . THR A 1 224 ? 1.003 -20.470 -5.732 1.00 18.95 ? 224 THR A N 1 ATOM 1670 C CA . THR A 1 224 ? 1.605 -19.639 -4.678 1.00 19.02 ? 224 THR A CA 1 ATOM 1671 C C . THR A 1 224 ? 2.315 -18.421 -5.252 1.00 17.56 ? 224 THR A C 1 ATOM 1672 O O . THR A 1 224 ? 2.051 -17.296 -4.835 1.00 17.58 ? 224 THR A O 1 ATOM 1673 C CB . THR A 1 224 ? 2.592 -20.442 -3.754 1.00 20.55 ? 224 THR A CB 1 ATOM 1674 O OG1 . THR A 1 224 ? 1.976 -21.666 -3.347 1.00 22.85 ? 224 THR A OG1 1 ATOM 1675 C CG2 . THR A 1 224 ? 2.943 -19.651 -2.492 1.00 19.65 ? 224 THR A CG2 1 ATOM 1676 N N . SER A 1 225 ? 3.212 -18.654 -6.205 1.00 17.06 ? 225 SER A N 1 ATOM 1677 C CA . SER A 1 225 ? 3.927 -17.583 -6.889 1.00 16.90 ? 225 SER A CA 1 ATOM 1678 C C . SER A 1 225 ? 2.982 -16.544 -7.493 1.00 16.71 ? 225 SER A C 1 ATOM 1679 O O . SER A 1 225 ? 3.153 -15.358 -7.258 1.00 16.97 ? 225 SER A O 1 ATOM 1680 C CB . SER A 1 225 ? 4.829 -18.151 -7.980 1.00 16.67 ? 225 SER A CB 1 ATOM 1681 O OG . SER A 1 225 ? 5.953 -18.775 -7.414 1.00 17.60 ? 225 SER A OG 1 ATOM 1682 N N . ALA A 1 226 ? 1.985 -16.997 -8.254 1.00 16.55 ? 226 ALA A N 1 ATOM 1683 C CA . ALA A 1 226 ? 1.034 -16.089 -8.902 1.00 16.68 ? 226 ALA A CA 1 ATOM 1684 C C . ALA A 1 226 ? 0.168 -15.298 -7.904 1.00 17.62 ? 226 ALA A C 1 ATOM 1685 O O . ALA A 1 226 ? -0.094 -14.110 -8.121 1.00 16.23 ? 226 ALA A O 1 ATOM 1686 C CB . ALA A 1 226 ? 0.170 -16.841 -9.899 1.00 15.89 ? 226 ALA A CB 1 ATOM 1687 N N . LEU A 1 227 ? -0.259 -15.949 -6.815 1.00 18.85 ? 227 LEU A N 1 ATOM 1688 C CA . LEU A 1 227 ? -1.005 -15.260 -5.755 1.00 20.77 ? 227 LEU A CA 1 ATOM 1689 C C . LEU A 1 227 ? -0.167 -14.142 -5.134 1.00 22.10 ? 227 LEU A C 1 ATOM 1690 O O . LEU A 1 227 ? -0.627 -12.989 -5.018 1.00 21.91 ? 227 LEU A O 1 ATOM 1691 C CB . LEU A 1 227 ? -1.437 -16.230 -4.660 1.00 21.78 ? 227 LEU A CB 1 ATOM 1692 C CG . LEU A 1 227 ? -2.674 -17.091 -4.879 1.00 22.57 ? 227 LEU A CG 1 ATOM 1693 C CD1 . LEU A 1 227 ? -2.640 -18.305 -3.927 1.00 21.95 ? 227 LEU A CD1 1 ATOM 1694 C CD2 . LEU A 1 227 ? -3.924 -16.245 -4.685 1.00 21.85 ? 227 LEU A CD2 1 ATOM 1695 N N . LYS A 1 228 ? 1.064 -14.488 -4.755 1.00 20.58 ? 228 LYS A N 1 ATOM 1696 C CA . LYS A 1 228 ? 1.975 -13.544 -4.129 1.00 19.58 ? 228 LYS A CA 1 ATOM 1697 C C . LYS A 1 228 ? 2.341 -12.409 -5.067 1.00 18.68 ? 228 LYS A C 1 ATOM 1698 O O . LYS A 1 228 ? 2.435 -11.246 -4.638 1.00 18.04 ? 228 LYS A O 1 ATOM 1699 C CB . LYS A 1 228 ? 3.217 -14.270 -3.617 1.00 22.21 ? 228 LYS A CB 1 ATOM 1700 C CG . LYS A 1 228 ? 2.874 -15.302 -2.537 1.00 24.27 ? 228 LYS A CG 1 ATOM 1701 C CD . LYS A 1 228 ? 4.050 -15.706 -1.637 1.00 27.52 ? 228 LYS A CD 1 ATOM 1702 C CE . LYS A 1 228 ? 3.534 -16.562 -0.450 1.00 29.26 ? 228 LYS A CE 1 ATOM 1703 N NZ . LYS A 1 228 ? 4.607 -17.175 0.395 1.00 29.58 ? 228 LYS A NZ 1 ATOM 1704 N N . GLY A 1 229 ? 2.505 -12.748 -6.349 1.00 17.40 ? 229 GLY A N 1 ATOM 1705 C CA . GLY A 1 229 ? 2.912 -11.801 -7.383 1.00 16.26 ? 229 GLY A CA 1 ATOM 1706 C C . GLY A 1 229 ? 1.861 -10.783 -7.786 1.00 15.82 ? 229 GLY A C 1 ATOM 1707 O O . GLY A 1 229 ? 2.155 -9.595 -7.925 1.00 15.74 ? 229 GLY A O 1 ATOM 1708 N N . ILE A 1 230 ? 0.632 -11.246 -7.988 1.00 15.66 ? 230 ILE A N 1 ATOM 1709 C CA . ILE A 1 230 ? -0.462 -10.364 -8.356 1.00 15.52 ? 230 ILE A CA 1 ATOM 1710 C C . ILE A 1 230 ? -0.739 -9.403 -7.199 1.00 16.33 ? 230 ILE A C 1 ATOM 1711 O O . ILE A 1 230 ? -1.002 -8.224 -7.436 1.00 17.79 ? 230 ILE A O 1 ATOM 1712 C CB . ILE A 1 230 ? -1.714 -11.161 -8.791 1.00 15.50 ? 230 ILE A CB 1 ATOM 1713 C CG1 . ILE A 1 230 ? -1.443 -11.869 -10.121 1.00 14.41 ? 230 ILE A CG1 1 ATOM 1714 C CG2 . ILE A 1 230 ? -2.955 -10.248 -8.891 1.00 15.84 ? 230 ILE A CG2 1 ATOM 1715 C CD1 . ILE A 1 230 ? -2.371 -13.020 -10.409 1.00 14.05 ? 230 ILE A CD1 1 ATOM 1716 N N . GLU A 1 231 ? -0.644 -9.909 -5.962 1.00 15.89 ? 231 GLU A N 1 ATOM 1717 C CA . GLU A 1 231 ? -0.722 -9.102 -4.736 1.00 15.61 ? 231 GLU A CA 1 ATOM 1718 C C . GLU A 1 231 ? 0.327 -7.966 -4.725 1.00 15.39 ? 231 GLU A C 1 ATOM 1719 O O . GLU A 1 231 ? -0.001 -6.795 -4.518 1.00 14.51 ? 231 GLU A O 1 ATOM 1720 C CB . GLU A 1 231 ? -0.538 -10.011 -3.508 1.00 16.21 ? 231 GLU A CB 1 ATOM 1721 C CG . GLU A 1 231 ? -0.264 -9.293 -2.156 1.00 17.10 ? 231 GLU A CG 1 ATOM 1722 C CD . GLU A 1 231 ? -1.550 -8.790 -1.493 1.00 18.45 ? 231 GLU A CD 1 ATOM 1723 O OE1 . GLU A 1 231 ? -2.637 -9.328 -1.823 1.00 19.67 ? 231 GLU A OE1 1 ATOM 1724 O OE2 . GLU A 1 231 ? -1.476 -7.862 -0.649 1.00 17.73 ? 231 GLU A OE2 1 ATOM 1725 N N . ALA A 1 232 ? 1.584 -8.335 -4.961 1.00 15.31 ? 232 ALA A N 1 ATOM 1726 C CA . ALA A 1 232 ? 2.698 -7.392 -4.978 1.00 14.54 ? 232 ALA A CA 1 ATOM 1727 C C . ALA A 1 232 ? 2.499 -6.290 -6.022 1.00 14.83 ? 232 ALA A C 1 ATOM 1728 O O . ALA A 1 232 ? 2.827 -5.122 -5.778 1.00 15.31 ? 232 ALA A O 1 ATOM 1729 C CB . ALA A 1 232 ? 4.008 -8.132 -5.208 1.00 13.88 ? 232 ALA A CB 1 ATOM 1730 N N . VAL A 1 233 ? 1.953 -6.662 -7.177 1.00 14.55 ? 233 VAL A N 1 ATOM 1731 C CA . VAL A 1 233 ? 1.730 -5.710 -8.263 1.00 14.03 ? 233 VAL A CA 1 ATOM 1732 C C . VAL A 1 233 ? 0.565 -4.772 -7.960 1.00 13.95 ? 233 VAL A C 1 ATOM 1733 O O . VAL A 1 233 ? 0.642 -3.584 -8.283 1.00 13.89 ? 233 VAL A O 1 ATOM 1734 C CB . VAL A 1 233 ? 1.546 -6.421 -9.629 1.00 14.69 ? 233 VAL A CB 1 ATOM 1735 C CG1 . VAL A 1 233 ? 0.986 -5.461 -10.687 1.00 14.24 ? 233 VAL A CG1 1 ATOM 1736 C CG2 . VAL A 1 233 ? 2.877 -7.037 -10.095 1.00 13.74 ? 233 VAL A CG2 1 ATOM 1737 N N . GLU A 1 234 ? -0.497 -5.289 -7.334 1.00 13.61 ? 234 GLU A N 1 ATOM 1738 C CA . GLU A 1 234 ? -1.603 -4.432 -6.909 1.00 13.70 ? 234 GLU A CA 1 ATOM 1739 C C . GLU A 1 234 ? -1.167 -3.363 -5.885 1.00 14.21 ? 234 GLU A C 1 ATOM 1740 O O . GLU A 1 234 ? -1.513 -2.173 -6.038 1.00 14.52 ? 234 GLU A O 1 ATOM 1741 C CB . GLU A 1 234 ? -2.779 -5.238 -6.365 1.00 13.82 ? 234 GLU A CB 1 ATOM 1742 C CG . GLU A 1 234 ? -3.771 -4.355 -5.616 1.00 14.28 ? 234 GLU A CG 1 ATOM 1743 C CD . GLU A 1 234 ? -5.224 -4.789 -5.707 1.00 15.16 ? 234 GLU A CD 1 ATOM 1744 O OE1 . GLU A 1 234 ? -5.593 -5.654 -6.537 1.00 14.64 ? 234 GLU A OE1 1 ATOM 1745 O OE2 . GLU A 1 234 ? -6.018 -4.233 -4.922 1.00 17.15 ? 234 GLU A OE2 1 ATOM 1746 N N . ASP A 1 235 ? -0.422 -3.790 -4.856 1.00 13.51 ? 235 ASP A N 1 ATOM 1747 C CA . ASP A 1 235 ? 0.062 -2.890 -3.806 1.00 13.19 ? 235 ASP A CA 1 ATOM 1748 C C . ASP A 1 235 ? 0.848 -1.751 -4.444 1.00 12.69 ? 235 ASP A C 1 ATOM 1749 O O . ASP A 1 235 ? 0.630 -0.571 -4.142 1.00 12.37 ? 235 ASP A O 1 ATOM 1750 C CB . ASP A 1 235 ? 0.984 -3.624 -2.813 1.00 12.87 ? 235 ASP A CB 1 ATOM 1751 C CG . ASP A 1 235 ? 0.250 -4.611 -1.931 1.00 13.63 ? 235 ASP A CG 1 ATOM 1752 O OD1 . ASP A 1 235 ? -0.965 -4.431 -1.646 1.00 13.27 ? 235 ASP A OD1 1 ATOM 1753 O OD2 . ASP A 1 235 ? 0.915 -5.581 -1.492 1.00 14.17 ? 235 ASP A OD2 1 ATOM 1754 N N . TYR A 1 236 ? 1.775 -2.127 -5.319 1.00 11.68 ? 236 TYR A N 1 ATOM 1755 C CA . TYR A 1 236 ? 2.596 -1.156 -6.004 1.00 12.20 ? 236 TYR A CA 1 ATOM 1756 C C . TYR A 1 236 ? 1.723 -0.213 -6.843 1.00 12.42 ? 236 TYR A C 1 ATOM 1757 O O . TYR A 1 236 ? 1.894 1.002 -6.778 1.00 12.44 ? 236 TYR A O 1 ATOM 1758 C CB . TYR A 1 236 ? 3.640 -1.864 -6.863 1.00 11.62 ? 236 TYR A CB 1 ATOM 1759 C CG . TYR A 1 236 ? 4.478 -0.940 -7.710 1.00 11.30 ? 236 TYR A CG 1 ATOM 1760 C CD1 . TYR A 1 236 ? 5.622 -0.319 -7.184 1.00 11.62 ? 236 TYR A CD1 1 ATOM 1761 C CD2 . TYR A 1 236 ? 4.147 -0.696 -9.041 1.00 10.73 ? 236 TYR A CD2 1 ATOM 1762 C CE1 . TYR A 1 236 ? 6.418 0.539 -7.980 1.00 11.31 ? 236 TYR A CE1 1 ATOM 1763 C CE2 . TYR A 1 236 ? 4.926 0.139 -9.834 1.00 11.13 ? 236 TYR A CE2 1 ATOM 1764 C CZ . TYR A 1 236 ? 6.061 0.758 -9.303 1.00 11.11 ? 236 TYR A CZ 1 ATOM 1765 O OH . TYR A 1 236 ? 6.824 1.583 -10.094 1.00 10.59 ? 236 TYR A OH 1 ATOM 1766 N N . ALA A 1 237 ? 0.795 -0.787 -7.611 1.00 12.78 ? 237 ALA A N 1 ATOM 1767 C CA . ALA A 1 237 ? -0.141 -0.023 -8.434 1.00 13.82 ? 237 ALA A CA 1 ATOM 1768 C C . ALA A 1 237 ? -1.000 0.915 -7.591 1.00 14.50 ? 237 ALA A C 1 ATOM 1769 O O . ALA A 1 237 ? -1.207 2.067 -7.968 1.00 14.78 ? 237 ALA A O 1 ATOM 1770 C CB . ALA A 1 237 ? -1.037 -0.961 -9.277 1.00 12.72 ? 237 ALA A CB 1 ATOM 1771 N N . ARG A 1 238 ? -1.491 0.427 -6.455 1.00 15.40 ? 238 ARG A N 1 ATOM 1772 C CA . ARG A 1 238 ? -2.410 1.220 -5.635 1.00 16.79 ? 238 ARG A CA 1 ATOM 1773 C C . ARG A 1 238 ? -1.741 2.396 -4.966 1.00 16.37 ? 238 ARG A C 1 ATOM 1774 O O . ARG A 1 238 ? -2.319 3.482 -4.903 1.00 16.11 ? 238 ARG A O 1 ATOM 1775 C CB . ARG A 1 238 ? -3.118 0.374 -4.570 1.00 17.45 ? 238 ARG A CB 1 ATOM 1776 C CG . ARG A 1 238 ? -4.238 1.136 -3.887 1.00 18.69 ? 238 ARG A CG 1 ATOM 1777 C CD . ARG A 1 238 ? -5.048 0.272 -2.915 1.00 20.99 ? 238 ARG A CD 1 ATOM 1778 N NE . ARG A 1 238 ? -5.775 -0.822 -3.569 1.00 22.43 ? 238 ARG A NE 1 ATOM 1779 C CZ . ARG A 1 238 ? -6.856 -0.675 -4.336 1.00 21.40 ? 238 ARG A CZ 1 ATOM 1780 N NH1 . ARG A 1 238 ? -7.374 0.523 -4.564 1.00 20.82 ? 238 ARG A NH1 1 ATOM 1781 N NH2 . ARG A 1 238 ? -7.422 -1.742 -4.877 1.00 22.66 ? 238 ARG A NH2 1 ATOM 1782 N N . TRP A 1 239 ? -0.514 2.184 -4.496 1.00 15.66 ? 239 TRP A N 1 ATOM 1783 C CA . TRP A 1 239 ? 0.083 3.115 -3.553 1.00 15.97 ? 239 TRP A CA 1 ATOM 1784 C C . TRP A 1 239 ? 1.390 3.789 -3.956 1.00 16.80 ? 239 TRP A C 1 ATOM 1785 O O . TRP A 1 239 ? 1.704 4.874 -3.448 1.00 17.23 ? 239 TRP A O 1 ATOM 1786 C CB . TRP A 1 239 ? 0.249 2.420 -2.198 1.00 15.04 ? 239 TRP A CB 1 ATOM 1787 C CG . TRP A 1 239 ? -1.058 2.214 -1.485 1.00 14.67 ? 239 TRP A CG 1 ATOM 1788 C CD1 . TRP A 1 239 ? -1.976 3.179 -1.161 1.00 14.35 ? 239 TRP A CD1 1 ATOM 1789 C CD2 . TRP A 1 239 ? -1.585 0.976 -0.990 1.00 14.58 ? 239 TRP A CD2 1 ATOM 1790 N NE1 . TRP A 1 239 ? -3.042 2.612 -0.500 1.00 14.14 ? 239 TRP A NE1 1 ATOM 1791 C CE2 . TRP A 1 239 ? -2.826 1.264 -0.379 1.00 14.28 ? 239 TRP A CE2 1 ATOM 1792 C CE3 . TRP A 1 239 ? -1.135 -0.354 -1.014 1.00 14.66 ? 239 TRP A CE3 1 ATOM 1793 C CZ2 . TRP A 1 239 ? -3.619 0.270 0.226 1.00 14.75 ? 239 TRP A CZ2 1 ATOM 1794 C CZ3 . TRP A 1 239 ? -1.924 -1.345 -0.413 1.00 15.62 ? 239 TRP A CZ3 1 ATOM 1795 C CH2 . TRP A 1 239 ? -3.160 -1.023 0.195 1.00 14.90 ? 239 TRP A CH2 1 ATOM 1796 N N . VAL A 1 240 ? 2.146 3.160 -4.854 1.00 17.00 ? 240 VAL A N 1 ATOM 1797 C CA . VAL A 1 240 ? 3.527 3.569 -5.099 1.00 16.74 ? 240 VAL A CA 1 ATOM 1798 C C . VAL A 1 240 ? 3.733 4.042 -6.525 1.00 17.11 ? 240 VAL A C 1 ATOM 1799 O O . VAL A 1 240 ? 4.280 5.126 -6.732 1.00 18.43 ? 240 VAL A O 1 ATOM 1800 C CB . VAL A 1 240 ? 4.541 2.423 -4.812 1.00 16.60 ? 240 VAL A CB 1 ATOM 1801 C CG1 . VAL A 1 240 ? 5.993 2.942 -4.853 1.00 15.42 ? 240 VAL A CG1 1 ATOM 1802 C CG2 . VAL A 1 240 ? 4.237 1.741 -3.484 1.00 16.32 ? 240 VAL A CG2 1 ATOM 1803 N N . ALA A 1 241 ? 3.315 3.219 -7.492 1.00 16.40 ? 241 ALA A N 1 ATOM 1804 C CA . ALA A 1 241 ? 3.553 3.447 -8.929 1.00 15.46 ? 241 ALA A CA 1 ATOM 1805 C C . ALA A 1 241 ? 3.497 4.932 -9.292 1.00 15.19 ? 241 ALA A C 1 ATOM 1806 O O . ALA A 1 241 ? 2.430 5.542 -9.183 1.00 15.56 ? 241 ALA A O 1 ATOM 1807 C CB . ALA A 1 241 ? 2.547 2.656 -9.769 1.00 14.33 ? 241 ALA A CB 1 ATOM 1808 N N . PRO A 1 242 ? 4.645 5.526 -9.696 1.00 14.36 ? 242 PRO A N 1 ATOM 1809 C CA . PRO A 1 242 ? 4.638 6.939 -10.104 1.00 13.92 ? 242 PRO A CA 1 ATOM 1810 C C . PRO A 1 242 ? 3.835 7.147 -11.384 1.00 13.67 ? 242 PRO A C 1 ATOM 1811 O O . PRO A 1 242 ? 3.635 6.189 -12.149 1.00 13.40 ? 242 PRO A O 1 ATOM 1812 C CB . PRO A 1 242 ? 6.115 7.253 -10.388 1.00 13.12 ? 242 PRO A CB 1 ATOM 1813 C CG . PRO A 1 242 ? 6.888 6.156 -9.810 1.00 13.40 ? 242 PRO A CG 1 ATOM 1814 C CD . PRO A 1 242 ? 6.002 4.953 -9.710 1.00 14.08 ? 242 PRO A CD 1 ATOM 1815 N N . ARG A 1 243 ? 3.408 8.393 -11.606 1.00 12.79 ? 243 ARG A N 1 ATOM 1816 C CA . ARG A 1 243 ? 2.712 8.808 -12.818 1.00 12.90 ? 243 ARG A CA 1 ATOM 1817 C C . ARG A 1 243 ? 3.360 8.279 -14.118 1.00 12.33 ? 243 ARG A C 1 ATOM 1818 O O . ARG A 1 243 ? 2.665 7.791 -15.020 1.00 11.24 ? 243 ARG A O 1 ATOM 1819 C CB . ARG A 1 243 ? 2.603 10.336 -12.848 1.00 13.13 ? 243 ARG A CB 1 ATOM 1820 C CG . ARG A 1 243 ? 1.659 10.847 -13.907 1.00 13.82 ? 243 ARG A CG 1 ATOM 1821 C CD . ARG A 1 243 ? 1.648 12.350 -13.986 1.00 14.71 ? 243 ARG A CD 1 ATOM 1822 N NE . ARG A 1 243 ? 1.094 12.778 -15.264 1.00 16.31 ? 243 ARG A NE 1 ATOM 1823 C CZ . ARG A 1 243 ? 0.942 14.042 -15.650 1.00 17.11 ? 243 ARG A CZ 1 ATOM 1824 N NH1 . ARG A 1 243 ? 1.307 15.041 -14.856 1.00 17.62 ? 243 ARG A NH1 1 ATOM 1825 N NH2 . ARG A 1 243 ? 0.426 14.307 -16.843 1.00 16.96 ? 243 ARG A NH2 1 ATOM 1826 N N . GLU A 1 244 ? 4.689 8.359 -14.177 1.00 12.44 ? 244 GLU A N 1 ATOM 1827 C CA . GLU A 1 244 ? 5.474 8.057 -15.390 1.00 12.82 ? 244 GLU A CA 1 ATOM 1828 C C . GLU A 1 244 ? 5.474 6.582 -15.840 1.00 12.15 ? 244 GLU A C 1 ATOM 1829 O O . GLU A 1 244 ? 5.925 6.279 -16.949 1.00 12.03 ? 244 GLU A O 1 ATOM 1830 C CB . GLU A 1 244 ? 6.932 8.531 -15.222 1.00 13.53 ? 244 GLU A CB 1 ATOM 1831 C CG . GLU A 1 244 ? 7.146 10.043 -15.246 1.00 14.17 ? 244 GLU A CG 1 ATOM 1832 C CD . GLU A 1 244 ? 6.678 10.729 -13.979 1.00 14.99 ? 244 GLU A CD 1 ATOM 1833 O OE1 . GLU A 1 244 ? 6.479 10.049 -12.943 1.00 14.88 ? 244 GLU A OE1 1 ATOM 1834 O OE2 . GLU A 1 244 ? 6.488 11.962 -14.025 1.00 16.47 ? 244 GLU A OE2 1 ATOM 1835 N N . VAL A 1 245 ? 5.001 5.670 -14.994 1.00 11.53 ? 245 VAL A N 1 ATOM 1836 C CA . VAL A 1 245 ? 5.036 4.249 -15.353 1.00 11.36 ? 245 VAL A CA 1 ATOM 1837 C C . VAL A 1 245 ? 3.673 3.734 -15.820 1.00 10.74 ? 245 VAL A C 1 ATOM 1838 O O . VAL A 1 245 ? 2.666 3.936 -15.157 1.00 10.64 ? 245 VAL A O 1 ATOM 1839 C CB . VAL A 1 245 ? 5.669 3.360 -14.238 1.00 11.53 ? 245 VAL A CB 1 ATOM 1840 C CG1 . VAL A 1 245 ? 4.779 3.285 -13.007 1.00 12.15 ? 245 VAL A CG1 1 ATOM 1841 C CG2 . VAL A 1 245 ? 5.945 1.969 -14.757 1.00 11.66 ? 245 VAL A CG2 1 ATOM 1842 N N . ASN A 1 246 ? 3.657 3.096 -16.986 1.00 10.49 ? 246 ASN A N 1 ATOM 1843 C CA . ASN A 1 246 ? 2.449 2.475 -17.511 1.00 10.25 ? 246 ASN A CA 1 ATOM 1844 C C . ASN A 1 246 ? 2.738 1.012 -17.787 1.00 10.32 ? 246 ASN A C 1 ATOM 1845 O O . ASN A 1 246 ? 3.674 0.691 -18.523 1.00 10.88 ? 246 ASN A O 1 ATOM 1846 C CB . ASN A 1 246 ? 2.000 3.149 -18.808 1.00 10.20 ? 246 ASN A CB 1 ATOM 1847 C CG . ASN A 1 246 ? 2.142 4.661 -18.778 1.00 10.24 ? 246 ASN A CG 1 ATOM 1848 O OD1 . ASN A 1 246 ? 1.140 5.377 -18.696 1.00 10.35 ? 246 ASN A OD1 1 ATOM 1849 N ND2 . ASN A 1 246 ? 3.384 5.157 -18.857 1.00 9.74 ? 246 ASN A ND2 1 ATOM 1850 N N . PHE A 1 247 ? 1.953 0.112 -17.212 1.00 9.88 ? 247 PHE A N 1 ATOM 1851 C CA . PHE A 1 247 ? 2.257 -1.299 -17.386 1.00 9.61 ? 247 PHE A CA 1 ATOM 1852 C C . PHE A 1 247 ? 1.092 -2.253 -17.151 1.00 10.05 ? 247 PHE A C 1 ATOM 1853 O O . PHE A 1 247 ? 0.035 -1.878 -16.619 1.00 9.93 ? 247 PHE A O 1 ATOM 1854 C CB . PHE A 1 247 ? 3.470 -1.697 -16.524 1.00 9.23 ? 247 PHE A CB 1 ATOM 1855 C CG . PHE A 1 247 ? 3.163 -1.876 -15.035 1.00 8.72 ? 247 PHE A CG 1 ATOM 1856 C CD1 . PHE A 1 247 ? 3.122 -3.157 -14.473 1.00 8.44 ? 247 PHE A CD1 1 ATOM 1857 C CD2 . PHE A 1 247 ? 2.952 -0.770 -14.206 1.00 8.18 ? 247 PHE A CD2 1 ATOM 1858 C CE1 . PHE A 1 247 ? 2.867 -3.332 -13.104 1.00 8.30 ? 247 PHE A CE1 1 ATOM 1859 C CE2 . PHE A 1 247 ? 2.700 -0.930 -12.848 1.00 8.20 ? 247 PHE A CE2 1 ATOM 1860 C CZ . PHE A 1 247 ? 2.653 -2.208 -12.291 1.00 8.26 ? 247 PHE A CZ 1 ATOM 1861 N N . ARG A 1 248 ? 1.324 -3.496 -17.558 1.00 10.59 ? 248 ARG A N 1 ATOM 1862 C CA . ARG A 1 248 ? 0.406 -4.594 -17.331 1.00 11.23 ? 248 ARG A CA 1 ATOM 1863 C C . ARG A 1 248 ? 1.135 -5.917 -17.090 1.00 11.39 ? 248 ARG A C 1 ATOM 1864 O O . ARG A 1 248 ? 2.318 -6.054 -17.407 1.00 11.05 ? 248 ARG A O 1 ATOM 1865 C CB . ARG A 1 248 ? -0.482 -4.752 -18.551 1.00 11.77 ? 248 ARG A CB 1 ATOM 1866 C CG . ARG A 1 248 ? 0.247 -5.251 -19.774 1.00 12.47 ? 248 ARG A CG 1 ATOM 1867 C CD . ARG A 1 248 ? -0.512 -4.828 -20.974 1.00 13.40 ? 248 ARG A CD 1 ATOM 1868 N NE . ARG A 1 248 ? -0.114 -5.542 -22.170 1.00 13.67 ? 248 ARG A NE 1 ATOM 1869 C CZ . ARG A 1 248 ? -0.568 -5.233 -23.376 1.00 14.17 ? 248 ARG A CZ 1 ATOM 1870 N NH1 . ARG A 1 248 ? -1.434 -4.232 -23.516 1.00 14.35 ? 248 ARG A NH1 1 ATOM 1871 N NH2 . ARG A 1 248 ? -0.160 -5.920 -24.433 1.00 14.52 ? 248 ARG A NH2 1 ATOM 1872 N N . ILE A 1 249 ? 0.401 -6.874 -16.528 1.00 11.78 ? 249 ILE A N 1 ATOM 1873 C CA . ILE A 1 249 ? 0.774 -8.275 -16.504 1.00 11.94 ? 249 ILE A CA 1 ATOM 1874 C C . ILE A 1 249 ? 0.011 -8.902 -17.659 1.00 13.22 ? 249 ILE A C 1 ATOM 1875 O O . ILE A 1 249 ? -1.189 -8.660 -17.836 1.00 14.09 ? 249 ILE A O 1 ATOM 1876 C CB . ILE A 1 249 ? 0.308 -8.999 -15.193 1.00 12.01 ? 249 ILE A CB 1 ATOM 1877 C CG1 . ILE A 1 249 ? 0.798 -8.267 -13.942 1.00 11.69 ? 249 ILE A CG1 1 ATOM 1878 C CG2 . ILE A 1 249 ? 0.741 -10.499 -15.196 1.00 11.32 ? 249 ILE A CG2 1 ATOM 1879 C CD1 . ILE A 1 249 ? 0.074 -8.690 -12.661 1.00 11.66 ? 249 ILE A CD1 1 ATOM 1880 N N . GLY A 1 250 ? 0.690 -9.722 -18.442 1.00 13.88 ? 250 GLY A N 1 ATOM 1881 C CA . GLY A 1 250 ? 0.040 -10.407 -19.549 1.00 13.87 ? 250 GLY A CA 1 ATOM 1882 C C . GLY A 1 250 ? 0.626 -11.786 -19.696 1.00 13.76 ? 250 GLY A C 1 ATOM 1883 O O . GLY A 1 250 ? 1.770 -12.016 -19.322 1.00 14.57 ? 250 GLY A O 1 ATOM 1884 N N . ASP A 1 251 ? -0.172 -12.712 -20.205 1.00 14.22 ? 251 ASP A N 1 ATOM 1885 C CA . ASP A 1 251 ? 0.287 -14.066 -20.455 1.00 14.40 ? 251 ASP A CA 1 ATOM 1886 C C . ASP A 1 251 ? -0.234 -14.513 -21.807 1.00 14.64 ? 251 ASP A C 1 ATOM 1887 O O . ASP A 1 251 ? -1.431 -14.680 -21.991 1.00 14.42 ? 251 ASP A O 1 ATOM 1888 C CB . ASP A 1 251 ? -0.166 -15.025 -19.357 1.00 13.54 ? 251 ASP A CB 1 ATOM 1889 C CG . ASP A 1 251 ? 0.498 -16.410 -19.464 1.00 13.05 ? 251 ASP A CG 1 ATOM 1890 O OD1 . ASP A 1 251 ? 1.290 -16.640 -20.401 1.00 12.17 ? 251 ASP A OD1 1 ATOM 1891 O OD2 . ASP A 1 251 ? 0.214 -17.271 -18.599 1.00 12.85 ? 251 ASP A OD2 1 ATOM 1892 N N . TYR A 1 252 ? 0.693 -14.693 -22.741 1.00 15.46 ? 252 TYR A N 1 ATOM 1893 C CA . TYR A 1 252 ? 0.392 -15.090 -24.110 1.00 15.99 ? 252 TYR A CA 1 ATOM 1894 C C . TYR A 1 252 ? 0.920 -16.483 -24.383 1.00 16.55 ? 252 TYR A C 1 ATOM 1895 O O . TYR A 1 252 ? 0.922 -16.927 -25.528 1.00 18.44 ? 252 TYR A O 1 ATOM 1896 C CB . TYR A 1 252 ? 1.004 -14.069 -25.090 1.00 15.11 ? 252 TYR A CB 1 ATOM 1897 C CG . TYR A 1 252 ? 0.665 -12.660 -24.695 1.00 15.01 ? 252 TYR A CG 1 ATOM 1898 C CD1 . TYR A 1 252 ? -0.611 -12.131 -24.953 1.00 15.34 ? 252 TYR A CD1 1 ATOM 1899 C CD2 . TYR A 1 252 ? 1.582 -11.863 -24.022 1.00 14.74 ? 252 TYR A CD2 1 ATOM 1900 C CE1 . TYR A 1 252 ? -0.953 -10.844 -24.560 1.00 14.25 ? 252 TYR A CE1 1 ATOM 1901 C CE2 . TYR A 1 252 ? 1.250 -10.563 -23.636 1.00 14.69 ? 252 TYR A CE2 1 ATOM 1902 C CZ . TYR A 1 252 ? -0.027 -10.068 -23.905 1.00 14.37 ? 252 TYR A CZ 1 ATOM 1903 O OH . TYR A 1 252 ? -0.374 -8.793 -23.512 1.00 14.51 ? 252 TYR A OH 1 ATOM 1904 N N . GLY A 1 253 ? 1.376 -17.166 -23.333 1.00 17.19 ? 253 GLY A N 1 ATOM 1905 C CA . GLY A 1 253 ? 1.972 -18.492 -23.474 1.00 17.37 ? 253 GLY A CA 1 ATOM 1906 C C . GLY A 1 253 ? 1.439 -19.567 -22.540 1.00 17.67 ? 253 GLY A C 1 ATOM 1907 O O . GLY A 1 253 ? 2.161 -20.488 -22.183 1.00 17.36 ? 253 GLY A O 1 ATOM 1908 N N . ALA A 1 254 ? 0.173 -19.469 -22.146 1.00 18.98 ? 254 ALA A N 1 ATOM 1909 C CA . ALA A 1 254 ? -0.419 -20.470 -21.252 1.00 19.98 ? 254 ALA A CA 1 ATOM 1910 C C . ALA A 1 254 ? 0.546 -20.862 -20.105 1.00 20.82 ? 254 ALA A C 1 ATOM 1911 O O . ALA A 1 254 ? 0.985 -22.016 -20.014 1.00 21.94 ? 254 ALA A O 1 ATOM 1912 C CB . ALA A 1 254 ? -0.860 -21.715 -22.065 1.00 18.27 ? 254 ALA A CB 1 ATOM 1913 N N . GLY A 1 255 ? 0.894 -19.892 -19.258 1.00 20.34 ? 255 GLY A N 1 ATOM 1914 C CA . GLY A 1 255 ? 1.820 -20.119 -18.139 1.00 19.28 ? 255 GLY A CA 1 ATOM 1915 C C . GLY A 1 255 ? 3.195 -19.457 -18.231 1.00 19.04 ? 255 GLY A C 1 ATOM 1916 O O . GLY A 1 255 ? 4.108 -19.833 -17.506 1.00 20.70 ? 255 GLY A O 1 ATOM 1917 N N . ASN A 1 256 ? 3.352 -18.480 -19.116 1.00 17.44 ? 256 ASN A N 1 ATOM 1918 C CA . ASN A 1 256 ? 4.567 -17.673 -19.164 1.00 16.93 ? 256 ASN A CA 1 ATOM 1919 C C . ASN A 1 256 ? 4.241 -16.169 -18.950 1.00 15.56 ? 256 ASN A C 1 ATOM 1920 O O . ASN A 1 256 ? 4.464 -15.344 -19.837 1.00 14.28 ? 256 ASN A O 1 ATOM 1921 C CB . ASN A 1 256 ? 5.322 -17.950 -20.480 1.00 18.20 ? 256 ASN A CB 1 ATOM 1922 C CG . ASN A 1 256 ? 6.701 -17.255 -20.559 1.00 20.04 ? 256 ASN A CG 1 ATOM 1923 O OD1 . ASN A 1 256 ? 7.478 -17.227 -19.593 1.00 21.06 ? 256 ASN A OD1 1 ATOM 1924 N ND2 . ASN A 1 256 ? 7.006 -16.704 -21.735 1.00 20.02 ? 256 ASN A ND2 1 ATOM 1925 N N . PRO A 1 257 ? 3.691 -15.811 -17.767 1.00 14.93 ? 257 PRO A N 1 ATOM 1926 C CA . PRO A 1 257 ? 3.299 -14.409 -17.560 1.00 14.70 ? 257 PRO A CA 1 ATOM 1927 C C . PRO A 1 257 ? 4.472 -13.432 -17.487 1.00 14.39 ? 257 PRO A C 1 ATOM 1928 O O . PRO A 1 257 ? 5.558 -13.772 -16.993 1.00 15.49 ? 257 PRO A O 1 ATOM 1929 C CB . PRO A 1 257 ? 2.538 -14.435 -16.236 1.00 14.90 ? 257 PRO A CB 1 ATOM 1930 C CG . PRO A 1 257 ? 3.040 -15.674 -15.532 1.00 16.06 ? 257 PRO A CG 1 ATOM 1931 C CD . PRO A 1 257 ? 3.350 -16.661 -16.610 1.00 15.31 ? 257 PRO A CD 1 ATOM 1932 N N . GLY A 1 258 ? 4.254 -12.232 -17.999 1.00 13.12 ? 258 GLY A N 1 ATOM 1933 C CA . GLY A 1 258 ? 5.253 -11.184 -17.910 1.00 13.49 ? 258 GLY A CA 1 ATOM 1934 C C . GLY A 1 258 ? 4.627 -9.841 -17.591 1.00 13.59 ? 258 GLY A C 1 ATOM 1935 O O . GLY A 1 258 ? 3.415 -9.661 -17.734 1.00 13.25 ? 258 GLY A O 1 ATOM 1936 N N . ILE A 1 259 ? 5.452 -8.916 -17.117 1.00 13.69 ? 259 ILE A N 1 ATOM 1937 C CA . ILE A 1 259 ? 5.074 -7.526 -17.072 1.00 14.25 ? 259 ILE A CA 1 ATOM 1938 C C . ILE A 1 259 ? 5.616 -6.875 -18.342 1.00 15.00 ? 259 ILE A C 1 ATOM 1939 O O . ILE A 1 259 ? 6.769 -7.105 -18.720 1.00 15.96 ? 259 ILE A O 1 ATOM 1940 C CB . ILE A 1 259 ? 5.620 -6.815 -15.820 1.00 14.26 ? 259 ILE A CB 1 ATOM 1941 C CG1 . ILE A 1 259 ? 4.766 -7.172 -14.592 1.00 13.95 ? 259 ILE A CG1 1 ATOM 1942 C CG2 . ILE A 1 259 ? 5.655 -5.282 -16.032 1.00 13.79 ? 259 ILE A CG2 1 ATOM 1943 C CD1 . ILE A 1 259 ? 5.456 -6.979 -13.249 1.00 12.76 ? 259 ILE A CD1 1 ATOM 1944 N N . GLU A 1 260 ? 4.782 -6.097 -19.019 1.00 14.76 ? 260 GLU A N 1 ATOM 1945 C CA . GLU A 1 260 ? 5.275 -5.246 -20.103 1.00 15.39 ? 260 GLU A CA 1 ATOM 1946 C C . GLU A 1 260 ? 4.842 -3.813 -19.850 1.00 13.72 ? 260 GLU A C 1 ATOM 1947 O O . GLU A 1 260 ? 3.792 -3.575 -19.271 1.00 13.28 ? 260 GLU A O 1 ATOM 1948 C CB . GLU A 1 260 ? 4.852 -5.752 -21.492 1.00 16.54 ? 260 GLU A CB 1 ATOM 1949 C CG . GLU A 1 260 ? 3.751 -6.788 -21.458 1.00 19.62 ? 260 GLU A CG 1 ATOM 1950 C CD . GLU A 1 260 ? 3.324 -7.260 -22.831 1.00 22.15 ? 260 GLU A CD 1 ATOM 1951 O OE1 . GLU A 1 260 ? 4.198 -7.377 -23.736 1.00 24.52 ? 260 GLU A OE1 1 ATOM 1952 O OE2 . GLU A 1 260 ? 2.110 -7.528 -22.989 1.00 21.07 ? 260 GLU A OE2 1 ATOM 1953 N N . GLY A 1 261 ? 5.671 -2.860 -20.249 1.00 13.35 ? 261 GLY A N 1 ATOM 1954 C CA . GLY A 1 261 ? 5.404 -1.478 -19.895 1.00 12.49 ? 261 GLY A CA 1 ATOM 1955 C C . GLY A 1 261 ? 6.135 -0.429 -20.684 1.00 12.17 ? 261 GLY A C 1 ATOM 1956 O O . GLY A 1 261 ? 7.033 -0.719 -21.488 1.00 11.57 ? 261 GLY A O 1 ATOM 1957 N N . LEU A 1 262 ? 5.717 0.804 -20.440 1.00 12.56 ? 262 LEU A N 1 ATOM 1958 C CA . LEU A 1 262 ? 6.296 1.984 -21.042 1.00 12.86 ? 262 LEU A CA 1 ATOM 1959 C C . LEU A 1 262 ? 6.507 2.982 -19.914 1.00 13.44 ? 262 LEU A C 1 ATOM 1960 O O . LEU A 1 262 ? 5.570 3.291 -19.147 1.00 13.06 ? 262 LEU A O 1 ATOM 1961 C CB . LEU A 1 262 ? 5.364 2.572 -22.110 1.00 13.13 ? 262 LEU A CB 1 ATOM 1962 C CG . LEU A 1 262 ? 5.866 3.788 -22.920 1.00 13.65 ? 262 LEU A CG 1 ATOM 1963 C CD1 . LEU A 1 262 ? 7.157 3.463 -23.679 1.00 13.83 ? 262 LEU A CD1 1 ATOM 1964 C CD2 . LEU A 1 262 ? 4.815 4.290 -23.901 1.00 13.07 ? 262 LEU A CD2 1 ATOM 1965 N N . TYR A 1 263 ? 7.745 3.458 -19.806 1.00 13.79 ? 263 TYR A N 1 ATOM 1966 C CA . TYR A 1 263 ? 8.114 4.448 -18.806 1.00 14.23 ? 263 TYR A CA 1 ATOM 1967 C C . TYR A 1 263 ? 8.451 5.794 -19.440 1.00 14.33 ? 263 TYR A C 1 ATOM 1968 O O . TYR A 1 263 ? 9.191 5.864 -20.430 1.00 14.17 ? 263 TYR A O 1 ATOM 1969 C CB . TYR A 1 263 ? 9.283 3.957 -17.945 1.00 14.46 ? 263 TYR A CB 1 ATOM 1970 C CG . TYR A 1 263 ? 9.583 4.907 -16.809 1.00 15.20 ? 263 TYR A CG 1 ATOM 1971 C CD1 . TYR A 1 263 ? 8.821 4.884 -15.645 1.00 15.32 ? 263 TYR A CD1 1 ATOM 1972 C CD2 . TYR A 1 263 ? 10.606 5.851 -16.908 1.00 15.28 ? 263 TYR A CD2 1 ATOM 1973 C CE1 . TYR A 1 263 ? 9.070 5.762 -14.609 1.00 15.37 ? 263 TYR A CE1 1 ATOM 1974 C CE2 . TYR A 1 263 ? 10.858 6.739 -15.879 1.00 15.64 ? 263 TYR A CE2 1 ATOM 1975 C CZ . TYR A 1 263 ? 10.082 6.683 -14.730 1.00 15.73 ? 263 TYR A CZ 1 ATOM 1976 O OH . TYR A 1 263 ? 10.324 7.540 -13.688 1.00 16.30 ? 263 TYR A OH 1 ATOM 1977 N N . TYR A 1 264 ? 7.906 6.859 -18.860 1.00 14.95 ? 264 TYR A N 1 ATOM 1978 C CA . TYR A 1 264 ? 8.226 8.219 -19.288 1.00 15.72 ? 264 TYR A CA 1 ATOM 1979 C C . TYR A 1 264 ? 9.501 8.684 -18.607 1.00 16.97 ? 264 TYR A C 1 ATOM 1980 O O . TYR A 1 264 ? 9.463 9.322 -17.546 1.00 18.49 ? 264 TYR A O 1 ATOM 1981 C CB . TYR A 1 264 ? 7.057 9.164 -18.998 1.00 15.90 ? 264 TYR A CB 1 ATOM 1982 C CG . TYR A 1 264 ? 6.031 9.164 -20.100 1.00 16.11 ? 264 TYR A CG 1 ATOM 1983 C CD1 . TYR A 1 264 ? 5.899 10.263 -20.947 1.00 15.85 ? 264 TYR A CD1 1 ATOM 1984 C CD2 . TYR A 1 264 ? 5.220 8.041 -20.333 1.00 15.67 ? 264 TYR A CD2 1 ATOM 1985 C CE1 . TYR A 1 264 ? 4.969 10.260 -21.982 1.00 15.85 ? 264 TYR A CE1 1 ATOM 1986 C CE2 . TYR A 1 264 ? 4.291 8.027 -21.365 1.00 15.47 ? 264 TYR A CE2 1 ATOM 1987 C CZ . TYR A 1 264 ? 4.167 9.140 -22.187 1.00 15.59 ? 264 TYR A CZ 1 ATOM 1988 O OH . TYR A 1 264 ? 3.247 9.146 -23.212 1.00 14.87 ? 264 TYR A OH 1 ATOM 1989 N N . GLY A 1 265 ? 10.630 8.319 -19.209 1.00 17.42 ? 265 GLY A N 1 ATOM 1990 C CA . GLY A 1 265 ? 11.947 8.680 -18.711 1.00 18.24 ? 265 GLY A CA 1 ATOM 1991 C C . GLY A 1 265 ? 13.017 7.721 -19.187 1.00 19.20 ? 265 GLY A C 1 ATOM 1992 O O . GLY A 1 265 ? 12.785 6.915 -20.092 1.00 19.76 ? 265 GLY A O 1 ATOM 1993 N N . THR A 1 266 ? 14.190 7.802 -18.561 1.00 19.11 ? 266 THR A N 1 ATOM 1994 C CA . THR A 1 266 ? 15.335 6.972 -18.928 1.00 18.42 ? 266 THR A CA 1 ATOM 1995 C C . THR A 1 266 ? 15.241 5.537 -18.374 1.00 19.21 ? 266 THR A C 1 ATOM 1996 O O . THR A 1 266 ? 14.423 5.265 -17.484 1.00 18.64 ? 266 THR A O 1 ATOM 1997 C CB . THR A 1 266 ? 16.657 7.621 -18.469 1.00 18.28 ? 266 THR A CB 1 ATOM 1998 O OG1 . THR A 1 266 ? 16.668 7.739 -17.039 1.00 18.43 ? 266 THR A OG1 1 ATOM 1999 C CG2 . THR A 1 266 ? 16.835 8.985 -19.111 1.00 16.56 ? 266 THR A CG2 1 ATOM 2000 N N . PRO A 1 267 ? 16.066 4.604 -18.913 1.00 19.38 ? 267 PRO A N 1 ATOM 2001 C CA . PRO A 1 267 ? 16.140 3.250 -18.347 1.00 19.99 ? 267 PRO A CA 1 ATOM 2002 C C . PRO A 1 267 ? 16.526 3.216 -16.845 1.00 21.29 ? 267 PRO A C 1 ATOM 2003 O O . PRO A 1 267 ? 16.009 2.386 -16.090 1.00 21.74 ? 267 PRO A O 1 ATOM 2004 C CB . PRO A 1 267 ? 17.221 2.573 -19.209 1.00 19.78 ? 267 PRO A CB 1 ATOM 2005 C CG . PRO A 1 267 ? 17.160 3.287 -20.511 1.00 18.62 ? 267 PRO A CG 1 ATOM 2006 C CD . PRO A 1 267 ? 16.845 4.717 -20.165 1.00 18.24 ? 267 PRO A CD 1 ATOM 2007 N N . GLU A 1 268 ? 17.408 4.125 -16.429 1.00 22.19 ? 268 GLU A N 1 ATOM 2008 C CA . GLU A 1 268 ? 17.865 4.221 -15.039 1.00 22.95 ? 268 GLU A CA 1 ATOM 2009 C C . GLU A 1 268 ? 16.753 4.787 -14.156 1.00 23.81 ? 268 GLU A C 1 ATOM 2010 O O . GLU A 1 268 ? 16.574 4.348 -13.010 1.00 24.20 ? 268 GLU A O 1 ATOM 2011 C CB . GLU A 1 268 ? 19.146 5.078 -14.923 1.00 24.35 ? 268 GLU A CB 1 ATOM 2012 C CG . GLU A 1 268 ? 20.319 4.666 -15.872 1.00 25.97 ? 268 GLU A CG 1 ATOM 2013 C CD . GLU A 1 268 ? 20.063 4.997 -17.360 1.00 27.04 ? 268 GLU A CD 1 ATOM 2014 O OE1 . GLU A 1 268 ? 19.653 6.135 -17.673 1.00 28.22 ? 268 GLU A OE1 1 ATOM 2015 O OE2 . GLU A 1 268 ? 20.272 4.117 -18.226 1.00 29.28 ? 268 GLU A OE2 1 ATOM 2016 N N . GLN A 1 269 ? 16.002 5.751 -14.691 1.00 23.24 ? 269 GLN A N 1 ATOM 2017 C CA . GLN A 1 269 ? 14.848 6.314 -13.983 1.00 23.14 ? 269 GLN A CA 1 ATOM 2018 C C . GLN A 1 269 ? 13.732 5.281 -13.793 1.00 23.27 ? 269 GLN A C 1 ATOM 2019 O O . GLN A 1 269 ? 13.108 5.224 -12.727 1.00 24.35 ? 269 GLN A O 1 ATOM 2020 C CB . GLN A 1 269 ? 14.305 7.546 -14.700 1.00 24.04 ? 269 GLN A CB 1 ATOM 2021 C CG . GLN A 1 269 ? 15.169 8.784 -14.559 1.00 25.11 ? 269 GLN A CG 1 ATOM 2022 C CD . GLN A 1 269 ? 14.649 9.948 -15.376 1.00 26.38 ? 269 GLN A CD 1 ATOM 2023 O OE1 . GLN A 1 269 ? 14.355 9.812 -16.572 1.00 26.53 ? 269 GLN A OE1 1 ATOM 2024 N NE2 . GLN A 1 269 ? 14.527 11.105 -14.735 1.00 25.33 ? 269 GLN A NE2 1 ATOM 2025 N N . TRP A 1 270 ? 13.489 4.464 -14.821 1.00 21.64 ? 270 TRP A N 1 ATOM 2026 C CA . TRP A 1 270 ? 12.538 3.362 -14.706 1.00 19.62 ? 270 TRP A CA 1 ATOM 2027 C C . TRP A 1 270 ? 12.959 2.378 -13.614 1.00 19.73 ? 270 TRP A C 1 ATOM 2028 O O . TRP A 1 270 ? 12.152 2.009 -12.754 1.00 20.07 ? 270 TRP A O 1 ATOM 2029 C CB . TRP A 1 270 ? 12.358 2.600 -16.036 1.00 17.70 ? 270 TRP A CB 1 ATOM 2030 C CG . TRP A 1 270 ? 11.607 1.351 -15.781 1.00 15.60 ? 270 TRP A CG 1 ATOM 2031 C CD1 . TRP A 1 270 ? 10.277 1.246 -15.477 1.00 14.92 ? 270 TRP A CD1 1 ATOM 2032 C CD2 . TRP A 1 270 ? 12.146 0.030 -15.697 1.00 14.87 ? 270 TRP A CD2 1 ATOM 2033 N NE1 . TRP A 1 270 ? 9.951 -0.066 -15.236 1.00 14.46 ? 270 TRP A NE1 1 ATOM 2034 C CE2 . TRP A 1 270 ? 11.079 -0.835 -15.367 1.00 14.57 ? 270 TRP A CE2 1 ATOM 2035 C CE3 . TRP A 1 270 ? 13.427 -0.511 -15.869 1.00 14.29 ? 270 TRP A CE3 1 ATOM 2036 C CZ2 . TRP A 1 270 ? 11.254 -2.214 -15.220 1.00 14.05 ? 270 TRP A CZ2 1 ATOM 2037 C CZ3 . TRP A 1 270 ? 13.599 -1.875 -15.727 1.00 13.64 ? 270 TRP A CZ3 1 ATOM 2038 C CH2 . TRP A 1 270 ? 12.519 -2.712 -15.410 1.00 14.08 ? 270 TRP A CH2 1 ATOM 2039 N N . ARG A 1 271 ? 14.222 1.955 -13.657 1.00 20.53 ? 271 ARG A N 1 ATOM 2040 C CA . ARG A 1 271 ? 14.726 0.938 -12.727 1.00 21.10 ? 271 ARG A CA 1 ATOM 2041 C C . ARG A 1 271 ? 14.527 1.353 -11.268 1.00 19.22 ? 271 ARG A C 1 ATOM 2042 O O . ARG A 1 271 ? 14.094 0.544 -10.443 1.00 18.41 ? 271 ARG A O 1 ATOM 2043 C CB . ARG A 1 271 ? 16.203 0.589 -13.005 1.00 22.20 ? 271 ARG A CB 1 ATOM 2044 C CG . ARG A 1 271 ? 16.724 -0.614 -12.197 1.00 22.75 ? 271 ARG A CG 1 ATOM 2045 C CD . ARG A 1 271 ? 15.765 -1.804 -12.299 1.00 23.17 ? 271 ARG A CD 1 ATOM 2046 N NE . ARG A 1 271 ? 16.160 -2.935 -11.461 1.00 24.58 ? 271 ARG A NE 1 ATOM 2047 C CZ . ARG A 1 271 ? 16.716 -4.055 -11.923 1.00 24.95 ? 271 ARG A CZ 1 ATOM 2048 N NH1 . ARG A 1 271 ? 16.949 -4.199 -13.222 1.00 25.51 ? 271 ARG A NH1 1 ATOM 2049 N NH2 . ARG A 1 271 ? 17.027 -5.044 -11.090 1.00 23.45 ? 271 ARG A NH2 1 ATOM 2050 N N . ALA A 1 272 ? 14.829 2.615 -10.976 1.00 17.63 ? 272 ALA A N 1 ATOM 2051 C CA . ALA A 1 272 ? 14.610 3.186 -9.654 1.00 16.66 ? 272 ALA A CA 1 ATOM 2052 C C . ALA A 1 272 ? 13.110 3.261 -9.323 1.00 16.35 ? 272 ALA A C 1 ATOM 2053 O O . ALA A 1 272 ? 12.692 2.888 -8.226 1.00 16.19 ? 272 ALA A O 1 ATOM 2054 C CB . ALA A 1 272 ? 15.270 4.554 -9.553 1.00 15.53 ? 272 ALA A CB 1 ATOM 2055 N N . ALA A 1 273 ? 12.293 3.712 -10.273 1.00 15.37 ? 273 ALA A N 1 ATOM 2056 C CA . ALA A 1 273 ? 10.849 3.814 -10.012 1.00 15.16 ? 273 ALA A CA 1 ATOM 2057 C C . ALA A 1 273 ? 10.152 2.453 -9.765 1.00 14.72 ? 273 ALA A C 1 ATOM 2058 O O . ALA A 1 273 ? 9.205 2.376 -8.987 1.00 13.78 ? 273 ALA A O 1 ATOM 2059 C CB . ALA A 1 273 ? 10.145 4.608 -11.117 1.00 13.84 ? 273 ALA A CB 1 ATOM 2060 N N . PHE A 1 274 ? 10.640 1.400 -10.422 1.00 14.60 ? 274 PHE A N 1 ATOM 2061 C CA . PHE A 1 274 ? 10.010 0.084 -10.386 1.00 14.49 ? 274 PHE A CA 1 ATOM 2062 C C . PHE A 1 274 ? 10.597 -0.789 -9.289 1.00 15.69 ? 274 PHE A C 1 ATOM 2063 O O . PHE A 1 274 ? 9.956 -1.770 -8.873 1.00 17.75 ? 274 PHE A O 1 ATOM 2064 C CB . PHE A 1 274 ? 10.178 -0.619 -11.741 1.00 14.07 ? 274 PHE A CB 1 ATOM 2065 C CG . PHE A 1 274 ? 8.974 -1.430 -12.177 1.00 13.71 ? 274 PHE A CG 1 ATOM 2066 C CD1 . PHE A 1 274 ? 7.759 -0.805 -12.465 1.00 14.10 ? 274 PHE A CD1 1 ATOM 2067 C CD2 . PHE A 1 274 ? 9.071 -2.807 -12.342 1.00 13.39 ? 274 PHE A CD2 1 ATOM 2068 C CE1 . PHE A 1 274 ? 6.643 -1.548 -12.886 1.00 14.66 ? 274 PHE A CE1 1 ATOM 2069 C CE2 . PHE A 1 274 ? 7.978 -3.569 -12.768 1.00 13.82 ? 274 PHE A CE2 1 ATOM 2070 C CZ . PHE A 1 274 ? 6.758 -2.948 -13.043 1.00 14.31 ? 274 PHE A CZ 1 ATOM 2071 N N . GLN A 1 275 ? 11.800 -0.436 -8.815 1.00 15.47 ? 275 GLN A N 1 ATOM 2072 C CA . GLN A 1 275 ? 12.537 -1.251 -7.833 1.00 14.21 ? 275 GLN A CA 1 ATOM 2073 C C . GLN A 1 275 ? 11.714 -1.676 -6.630 1.00 13.40 ? 275 GLN A C 1 ATOM 2074 O O . GLN A 1 275 ? 11.871 -2.808 -6.182 1.00 13.39 ? 275 GLN A O 1 ATOM 2075 C CB . GLN A 1 275 ? 13.840 -0.582 -7.367 1.00 15.07 ? 275 GLN A CB 1 ATOM 2076 C CG . GLN A 1 275 ? 14.831 -1.541 -6.663 1.00 15.76 ? 275 GLN A CG 1 ATOM 2077 C CD . GLN A 1 275 ? 15.298 -2.666 -7.580 1.00 17.05 ? 275 GLN A CD 1 ATOM 2078 O OE1 . GLN A 1 275 ? 15.804 -2.418 -8.679 1.00 19.15 ? 275 GLN A OE1 1 ATOM 2079 N NE2 . GLN A 1 275 ? 15.112 -3.906 -7.144 1.00 16.51 ? 275 GLN A NE2 1 ATOM 2080 N N . PRO A 1 276 ? 10.840 -0.783 -6.094 1.00 13.13 ? 276 PRO A N 1 ATOM 2081 C CA . PRO A 1 276 ? 10.010 -1.279 -4.971 1.00 13.11 ? 276 PRO A CA 1 ATOM 2082 C C . PRO A 1 276 ? 9.152 -2.491 -5.314 1.00 13.49 ? 276 PRO A C 1 ATOM 2083 O O . PRO A 1 276 ? 8.997 -3.364 -4.480 1.00 15.48 ? 276 PRO A O 1 ATOM 2084 C CB . PRO A 1 276 ? 9.145 -0.068 -4.593 1.00 12.51 ? 276 PRO A CB 1 ATOM 2085 C CG . PRO A 1 276 ? 9.954 1.108 -5.027 1.00 12.56 ? 276 PRO A CG 1 ATOM 2086 C CD . PRO A 1 276 ? 10.721 0.681 -6.256 1.00 12.16 ? 276 PRO A CD 1 ATOM 2087 N N . LEU A 1 277 ? 8.619 -2.567 -6.528 1.00 14.10 ? 277 LEU A N 1 ATOM 2088 C CA . LEU A 1 277 ? 7.860 -3.750 -6.941 1.00 13.98 ? 277 LEU A CA 1 ATOM 2089 C C . LEU A 1 277 ? 8.781 -4.947 -7.182 1.00 13.97 ? 277 LEU A C 1 ATOM 2090 O O . LEU A 1 277 ? 8.499 -6.054 -6.715 1.00 13.80 ? 277 LEU A O 1 ATOM 2091 C CB . LEU A 1 277 ? 6.956 -3.464 -8.162 1.00 14.00 ? 277 LEU A CB 1 ATOM 2092 C CG . LEU A 1 277 ? 6.219 -4.631 -8.849 1.00 13.47 ? 277 LEU A CG 1 ATOM 2093 C CD1 . LEU A 1 277 ? 5.411 -5.448 -7.869 1.00 12.92 ? 277 LEU A CD1 1 ATOM 2094 C CD2 . LEU A 1 277 ? 5.343 -4.134 -9.995 1.00 13.48 ? 277 LEU A CD2 1 ATOM 2095 N N . LEU A 1 278 ? 9.880 -4.723 -7.901 1.00 15.00 ? 278 LEU A N 1 ATOM 2096 C CA . LEU A 1 278 ? 10.918 -5.757 -8.075 1.00 15.37 ? 278 LEU A CA 1 ATOM 2097 C C . LEU A 1 278 ? 11.337 -6.426 -6.745 1.00 16.50 ? 278 LEU A C 1 ATOM 2098 O O . LEU A 1 278 ? 11.468 -7.654 -6.687 1.00 16.85 ? 278 LEU A O 1 ATOM 2099 C CB . LEU A 1 278 ? 12.133 -5.193 -8.834 1.00 15.54 ? 278 LEU A CB 1 ATOM 2100 C CG . LEU A 1 278 ? 11.951 -4.808 -10.318 1.00 15.12 ? 278 LEU A CG 1 ATOM 2101 C CD1 . LEU A 1 278 ? 13.292 -4.401 -10.968 1.00 14.48 ? 278 LEU A CD1 1 ATOM 2102 C CD2 . LEU A 1 278 ? 11.292 -5.929 -11.119 1.00 14.17 ? 278 LEU A CD2 1 ATOM 2103 N N . ASP A 1 279 ? 11.503 -5.633 -5.679 1.00 16.86 ? 279 ASP A N 1 ATOM 2104 C CA . ASP A 1 279 ? 11.784 -6.183 -4.337 1.00 18.50 ? 279 ASP A CA 1 ATOM 2105 C C . ASP A 1 279 ? 10.642 -7.003 -3.728 1.00 18.81 ? 279 ASP A C 1 ATOM 2106 O O . ASP A 1 279 ? 10.887 -7.800 -2.818 1.00 19.08 ? 279 ASP A O 1 ATOM 2107 C CB . ASP A 1 279 ? 12.177 -5.089 -3.330 1.00 18.76 ? 279 ASP A CB 1 ATOM 2108 C CG . ASP A 1 279 ? 13.397 -4.302 -3.763 1.00 20.38 ? 279 ASP A CG 1 ATOM 2109 O OD1 . ASP A 1 279 ? 14.260 -4.876 -4.471 1.00 19.23 ? 279 ASP A OD1 1 ATOM 2110 O OD2 . ASP A 1 279 ? 13.480 -3.100 -3.392 1.00 21.48 ? 279 ASP A OD2 1 ATOM 2111 N N . THR A 1 280 ? 9.406 -6.809 -4.192 1.00 18.03 ? 280 THR A N 1 ATOM 2112 C CA . THR A 1 280 ? 8.291 -7.593 -3.627 1.00 18.36 ? 280 THR A CA 1 ATOM 2113 C C . THR A 1 280 ? 7.840 -8.766 -4.491 1.00 18.41 ? 280 THR A C 1 ATOM 2114 O O . THR A 1 280 ? 7.096 -9.624 -4.018 1.00 18.01 ? 280 THR A O 1 ATOM 2115 C CB . THR A 1 280 ? 7.059 -6.723 -3.171 1.00 18.26 ? 280 THR A CB 1 ATOM 2116 O OG1 . THR A 1 280 ? 6.702 -5.776 -4.191 1.00 17.63 ? 280 THR A OG1 1 ATOM 2117 C CG2 . THR A 1 280 ? 7.369 -5.989 -1.859 1.00 16.87 ? 280 THR A CG2 1 ATOM 2118 N N . LEU A 1 281 ? 8.297 -8.824 -5.743 1.00 18.60 ? 281 LEU A N 1 ATOM 2119 C CA . LEU A 1 281 ? 7.903 -9.915 -6.632 1.00 18.40 ? 281 LEU A CA 1 ATOM 2120 C C . LEU A 1 281 ? 8.451 -11.242 -6.132 1.00 19.54 ? 281 LEU A C 1 ATOM 2121 O O . LEU A 1 281 ? 9.520 -11.269 -5.519 1.00 21.87 ? 281 LEU A O 1 ATOM 2122 C CB . LEU A 1 281 ? 8.403 -9.668 -8.053 1.00 18.16 ? 281 LEU A CB 1 ATOM 2123 C CG . LEU A 1 281 ? 7.618 -8.734 -8.975 1.00 17.54 ? 281 LEU A CG 1 ATOM 2124 C CD1 . LEU A 1 281 ? 8.364 -8.680 -10.296 1.00 16.46 ? 281 LEU A CD1 1 ATOM 2125 C CD2 . LEU A 1 281 ? 6.137 -9.188 -9.158 1.00 16.44 ? 281 LEU A CD2 1 ATOM 2126 N N . PRO A 1 282 ? 7.734 -12.353 -6.389 1.00 19.66 ? 282 PRO A N 1 ATOM 2127 C CA . PRO A 1 282 ? 8.315 -13.644 -6.032 1.00 19.76 ? 282 PRO A CA 1 ATOM 2128 C C . PRO A 1 282 ? 9.678 -13.812 -6.706 1.00 20.81 ? 282 PRO A C 1 ATOM 2129 O O . PRO A 1 282 ? 9.883 -13.332 -7.841 1.00 20.56 ? 282 PRO A O 1 ATOM 2130 C CB . PRO A 1 282 ? 7.313 -14.657 -6.604 1.00 19.34 ? 282 PRO A CB 1 ATOM 2131 C CG . PRO A 1 282 ? 6.035 -13.923 -6.699 1.00 19.06 ? 282 PRO A CG 1 ATOM 2132 C CD . PRO A 1 282 ? 6.387 -12.494 -6.976 1.00 19.52 ? 282 PRO A CD 1 ATOM 2133 N N . ALA A 1 283 ? 10.597 -14.469 -5.999 1.00 20.08 ? 283 ALA A N 1 ATOM 2134 C CA . ALA A 1 283 ? 11.955 -14.696 -6.487 1.00 19.96 ? 283 ALA A CA 1 ATOM 2135 C C . ALA A 1 283 ? 11.941 -15.500 -7.786 1.00 19.30 ? 283 ALA A C 1 ATOM 2136 O O . ALA A 1 283 ? 11.076 -16.350 -7.989 1.00 19.64 ? 283 ALA A O 1 ATOM 2137 C CB . ALA A 1 283 ? 12.780 -15.410 -5.426 1.00 19.62 ? 283 ALA A CB 1 ATOM 2138 N N . GLY A 1 284 ? 12.879 -15.208 -8.675 1.00 19.01 ? 284 GLY A N 1 ATOM 2139 C CA . GLY A 1 284 ? 12.989 -15.951 -9.928 1.00 19.72 ? 284 GLY A CA 1 ATOM 2140 C C . GLY A 1 284 ? 12.563 -15.207 -11.182 1.00 19.26 ? 284 GLY A C 1 ATOM 2141 O O . GLY A 1 284 ? 12.623 -15.758 -12.274 1.00 20.19 ? 284 GLY A O 1 ATOM 2142 N N . TYR A 1 285 ? 12.126 -13.963 -11.030 1.00 18.73 ? 285 TYR A N 1 ATOM 2143 C CA . TYR A 1 285 ? 11.806 -13.107 -12.169 1.00 18.74 ? 285 TYR A CA 1 ATOM 2144 C C . TYR A 1 285 ? 13.101 -12.715 -12.863 1.00 19.32 ? 285 TYR A C 1 ATOM 2145 O O . TYR A 1 285 ? 14.161 -12.717 -12.241 1.00 19.02 ? 285 TYR A O 1 ATOM 2146 C CB . TYR A 1 285 ? 11.059 -11.848 -11.709 1.00 17.74 ? 285 TYR A CB 1 ATOM 2147 C CG . TYR A 1 285 ? 11.885 -10.931 -10.825 1.00 17.64 ? 285 TYR A CG 1 ATOM 2148 C CD1 . TYR A 1 285 ? 12.657 -9.905 -11.375 1.00 17.53 ? 285 TYR A CD1 1 ATOM 2149 C CD2 . TYR A 1 285 ? 11.888 -11.088 -9.439 1.00 17.73 ? 285 TYR A CD2 1 ATOM 2150 C CE1 . TYR A 1 285 ? 13.407 -9.061 -10.573 1.00 17.98 ? 285 TYR A CE1 1 ATOM 2151 C CE2 . TYR A 1 285 ? 12.643 -10.256 -8.623 1.00 18.20 ? 285 TYR A CE2 1 ATOM 2152 C CZ . TYR A 1 285 ? 13.402 -9.246 -9.191 1.00 18.57 ? 285 TYR A CZ 1 ATOM 2153 O OH . TYR A 1 285 ? 14.148 -8.419 -8.378 1.00 17.97 ? 285 TYR A OH 1 ATOM 2154 N N . VAL A 1 286 ? 13.009 -12.395 -14.151 1.00 20.27 ? 286 VAL A N 1 ATOM 2155 C CA . VAL A 1 286 ? 14.148 -11.898 -14.919 1.00 19.92 ? 286 VAL A CA 1 ATOM 2156 C C . VAL A 1 286 ? 13.747 -10.578 -15.558 1.00 20.89 ? 286 VAL A C 1 ATOM 2157 O O . VAL A 1 286 ? 12.809 -10.533 -16.369 1.00 20.99 ? 286 VAL A O 1 ATOM 2158 C CB . VAL A 1 286 ? 14.561 -12.886 -16.047 1.00 19.55 ? 286 VAL A CB 1 ATOM 2159 C CG1 . VAL A 1 286 ? 15.666 -12.281 -16.933 1.00 19.54 ? 286 VAL A CG1 1 ATOM 2160 C CG2 . VAL A 1 286 ? 14.996 -14.215 -15.475 1.00 18.61 ? 286 VAL A CG2 1 ATOM 2161 N N . VAL A 1 287 ? 14.442 -9.508 -15.180 1.00 20.62 ? 287 VAL A N 1 ATOM 2162 C CA . VAL A 1 287 ? 14.322 -8.229 -15.872 1.00 20.99 ? 287 VAL A CA 1 ATOM 2163 C C . VAL A 1 287 ? 14.920 -8.363 -17.289 1.00 22.43 ? 287 VAL A C 1 ATOM 2164 O O . VAL A 1 287 ? 16.115 -8.595 -17.456 1.00 21.36 ? 287 VAL A O 1 ATOM 2165 C CB . VAL A 1 287 ? 15.003 -7.088 -15.064 1.00 21.30 ? 287 VAL A CB 1 ATOM 2166 C CG1 . VAL A 1 287 ? 14.836 -5.718 -15.753 1.00 19.83 ? 287 VAL A CG1 1 ATOM 2167 C CG2 . VAL A 1 287 ? 14.444 -7.045 -13.632 1.00 20.97 ? 287 VAL A CG2 1 ATOM 2168 N N . ASN A 1 288 ? 14.071 -8.257 -18.308 1.00 24.59 ? 288 ASN A N 1 ATOM 2169 C CA . ASN A 1 288 ? 14.527 -8.281 -19.705 1.00 23.65 ? 288 ASN A CA 1 ATOM 2170 C C . ASN A 1 288 ? 15.243 -6.962 -20.057 1.00 22.42 ? 288 ASN A C 1 ATOM 2171 O O . ASN A 1 288 ? 15.096 -5.976 -19.335 1.00 21.12 ? 288 ASN A O 1 ATOM 2172 C CB . ASN A 1 288 ? 13.337 -8.521 -20.639 1.00 24.63 ? 288 ASN A CB 1 ATOM 2173 C CG . ASN A 1 288 ? 12.504 -9.735 -20.242 1.00 27.76 ? 288 ASN A CG 1 ATOM 2174 O OD1 . ASN A 1 288 ? 13.038 -10.781 -19.852 1.00 27.49 ? 288 ASN A OD1 1 ATOM 2175 N ND2 . ASN A 1 288 ? 11.178 -9.603 -20.357 1.00 29.39 ? 288 ASN A ND2 1 ATOM 2176 N N . PRO A 1 289 ? 16.028 -6.933 -21.156 1.00 22.29 ? 289 PRO A N 1 ATOM 2177 C CA . PRO A 1 289 ? 16.725 -5.680 -21.487 1.00 22.76 ? 289 PRO A CA 1 ATOM 2178 C C . PRO A 1 289 ? 15.735 -4.581 -21.864 1.00 22.72 ? 289 PRO A C 1 ATOM 2179 O O . PRO A 1 289 ? 14.694 -4.871 -22.448 1.00 23.89 ? 289 PRO A O 1 ATOM 2180 C CB . PRO A 1 289 ? 17.562 -6.063 -22.715 1.00 21.73 ? 289 PRO A CB 1 ATOM 2181 C CG . PRO A 1 289 ? 17.638 -7.552 -22.664 1.00 21.09 ? 289 PRO A CG 1 ATOM 2182 C CD . PRO A 1 289 ? 16.327 -7.982 -22.144 1.00 20.56 ? 289 PRO A CD 1 ATOM 2183 N N . THR A 1 290 ? 16.047 -3.335 -21.525 1.00 22.22 ? 290 THR A N 1 ATOM 2184 C CA . THR A 1 290 ? 15.167 -2.218 -21.875 1.00 20.97 ? 290 THR A CA 1 ATOM 2185 C C . THR A 1 290 ? 15.398 -1.766 -23.315 1.00 20.82 ? 290 THR A C 1 ATOM 2186 O O . THR A 1 290 ? 16.391 -2.139 -23.950 1.00 21.95 ? 290 THR A O 1 ATOM 2187 C CB . THR A 1 290 ? 15.330 -1.008 -20.931 1.00 20.14 ? 290 THR A CB 1 ATOM 2188 O OG1 . THR A 1 290 ? 16.675 -0.525 -21.001 1.00 21.15 ? 290 THR A OG1 1 ATOM 2189 C CG2 . THR A 1 290 ? 14.982 -1.363 -19.489 1.00 19.80 ? 290 THR A CG2 1 ATOM 2190 N N . THR A 1 291 ? 14.464 -0.973 -23.826 1.00 19.93 ? 291 THR A N 1 ATOM 2191 C CA . THR A 1 291 ? 14.569 -0.397 -25.157 1.00 19.03 ? 291 THR A CA 1 ATOM 2192 C C . THR A 1 291 ? 14.285 1.093 -25.050 1.00 18.22 ? 291 THR A C 1 ATOM 2193 O O . THR A 1 291 ? 13.235 1.483 -24.576 1.00 20.30 ? 291 THR A O 1 ATOM 2194 C CB . THR A 1 291 ? 13.560 -1.051 -26.117 1.00 19.04 ? 291 THR A CB 1 ATOM 2195 O OG1 . THR A 1 291 ? 13.611 -2.481 -25.972 1.00 19.34 ? 291 THR A OG1 1 ATOM 2196 C CG2 . THR A 1 291 ? 13.838 -0.654 -27.561 1.00 17.96 ? 291 THR A CG2 1 ATOM 2197 N N . SER A 1 292 ? 15.238 1.920 -25.457 1.00 18.22 ? 292 SER A N 1 ATOM 2198 C CA . SER A 1 292 ? 15.046 3.370 -25.503 1.00 17.20 ? 292 SER A CA 1 ATOM 2199 C C . SER A 1 292 ? 14.322 3.759 -26.782 1.00 16.81 ? 292 SER A C 1 ATOM 2200 O O . SER A 1 292 ? 14.724 3.349 -27.872 1.00 17.66 ? 292 SER A O 1 ATOM 2201 C CB . SER A 1 292 ? 16.388 4.090 -25.410 1.00 16.63 ? 292 SER A CB 1 ATOM 2202 O OG . SER A 1 292 ? 16.945 3.891 -24.127 1.00 16.41 ? 292 SER A OG 1 ATOM 2203 N N . LEU A 1 293 ? 13.251 4.536 -26.642 1.00 15.39 ? 293 LEU A N 1 ATOM 2204 C CA . LEU A 1 293 ? 12.370 4.863 -27.770 1.00 14.23 ? 293 LEU A CA 1 ATOM 2205 C C . LEU A 1 293 ? 12.001 6.343 -27.767 1.00 13.77 ? 293 LEU A C 1 ATOM 2206 O O . LEU A 1 293 ? 11.999 6.980 -26.711 1.00 12.75 ? 293 LEU A O 1 ATOM 2207 C CB . LEU A 1 293 ? 11.083 4.033 -27.701 1.00 13.00 ? 293 LEU A CB 1 ATOM 2208 C CG . LEU A 1 293 ? 11.143 2.512 -27.752 1.00 13.01 ? 293 LEU A CG 1 ATOM 2209 C CD1 . LEU A 1 293 ? 9.949 1.891 -27.060 1.00 12.87 ? 293 LEU A CD1 1 ATOM 2210 C CD2 . LEU A 1 293 ? 11.202 2.039 -29.170 1.00 13.06 ? 293 LEU A CD2 1 ATOM 2211 N N . ASN A 1 294 ? 11.707 6.891 -28.948 1.00 13.46 ? 294 ASN A N 1 ATOM 2212 C CA . ASN A 1 294 ? 10.993 8.164 -29.019 1.00 13.31 ? 294 ASN A CA 1 ATOM 2213 C C . ASN A 1 294 ? 9.506 7.846 -29.243 1.00 13.38 ? 294 ASN A C 1 ATOM 2214 O O . ASN A 1 294 ? 9.126 6.662 -29.335 1.00 13.09 ? 294 ASN A O 1 ATOM 2215 C CB . ASN A 1 294 ? 11.567 9.098 -30.095 1.00 13.21 ? 294 ASN A CB 1 ATOM 2216 C CG . ASN A 1 294 ? 11.296 8.612 -31.512 1.00 13.23 ? 294 ASN A CG 1 ATOM 2217 O OD1 . ASN A 1 294 ? 10.740 7.552 -31.714 1.00 13.44 ? 294 ASN A OD1 1 ATOM 2218 N ND2 . ASN A 1 294 ? 11.700 9.393 -32.494 1.00 13.42 ? 294 ASN A ND2 1 ATOM 2219 N N . TRP A 1 295 ? 8.673 8.882 -29.333 1.00 13.02 ? 295 TRP A N 1 ATOM 2220 C CA . TRP A 1 295 ? 7.222 8.690 -29.380 1.00 12.45 ? 295 TRP A CA 1 ATOM 2221 C C . TRP A 1 295 ? 6.749 7.708 -30.468 1.00 13.52 ? 295 TRP A C 1 ATOM 2222 O O . TRP A 1 295 ? 6.028 6.744 -30.167 1.00 13.21 ? 295 TRP A O 1 ATOM 2223 C CB . TRP A 1 295 ? 6.490 10.016 -29.536 1.00 10.94 ? 295 TRP A CB 1 ATOM 2224 C CG . TRP A 1 295 ? 5.035 9.805 -29.722 1.00 10.07 ? 295 TRP A CG 1 ATOM 2225 C CD1 . TRP A 1 295 ? 4.304 10.033 -30.853 1.00 9.83 ? 295 TRP A CD1 1 ATOM 2226 C CD2 . TRP A 1 295 ? 4.128 9.257 -28.761 1.00 9.73 ? 295 TRP A CD2 1 ATOM 2227 N NE1 . TRP A 1 295 ? 2.988 9.688 -30.645 1.00 9.41 ? 295 TRP A NE1 1 ATOM 2228 C CE2 . TRP A 1 295 ? 2.854 9.207 -29.369 1.00 9.64 ? 295 TRP A CE2 1 ATOM 2229 C CE3 . TRP A 1 295 ? 4.263 8.823 -27.434 1.00 9.29 ? 295 TRP A CE3 1 ATOM 2230 C CZ2 . TRP A 1 295 ? 1.719 8.754 -28.685 1.00 9.55 ? 295 TRP A CZ2 1 ATOM 2231 C CZ3 . TRP A 1 295 ? 3.138 8.371 -26.766 1.00 9.31 ? 295 TRP A CZ3 1 ATOM 2232 C CH2 . TRP A 1 295 ? 1.886 8.341 -27.390 1.00 9.22 ? 295 TRP A CH2 1 ATOM 2233 N N . ILE A 1 296 ? 7.158 7.959 -31.712 1.00 14.00 ? 296 ILE A N 1 ATOM 2234 C CA . ILE A 1 296 ? 6.688 7.173 -32.865 1.00 14.54 ? 296 ILE A CA 1 ATOM 2235 C C . ILE A 1 296 ? 7.281 5.750 -32.931 1.00 14.26 ? 296 ILE A C 1 ATOM 2236 O O . ILE A 1 296 ? 6.654 4.822 -33.461 1.00 14.36 ? 296 ILE A O 1 ATOM 2237 C CB . ILE A 1 296 ? 6.853 7.961 -34.230 1.00 14.62 ? 296 ILE A CB 1 ATOM 2238 C CG1 . ILE A 1 296 ? 6.018 7.299 -35.331 1.00 14.45 ? 296 ILE A CG1 1 ATOM 2239 C CG2 . ILE A 1 296 ? 8.306 8.141 -34.614 1.00 13.00 ? 296 ILE A CG2 1 ATOM 2240 C CD1 . ILE A 1 296 ? 4.534 7.324 -35.038 1.00 14.66 ? 296 ILE A CD1 1 ATOM 2241 N N . GLU A 1 297 ? 8.473 5.590 -32.366 1.00 13.76 ? 297 GLU A N 1 ATOM 2242 C CA . GLU A 1 297 ? 9.085 4.275 -32.220 1.00 13.87 ? 297 GLU A CA 1 ATOM 2243 C C . GLU A 1 297 ? 8.304 3.414 -31.216 1.00 13.84 ? 297 GLU A C 1 ATOM 2244 O O . GLU A 1 297 ? 8.142 2.212 -31.432 1.00 14.86 ? 297 GLU A O 1 ATOM 2245 C CB . GLU A 1 297 ? 10.560 4.400 -31.809 1.00 14.24 ? 297 GLU A CB 1 ATOM 2246 C CG . GLU A 1 297 ? 11.459 4.972 -32.900 1.00 15.30 ? 297 GLU A CG 1 ATOM 2247 C CD . GLU A 1 297 ? 12.875 5.339 -32.425 1.00 16.53 ? 297 GLU A CD 1 ATOM 2248 O OE1 . GLU A 1 297 ? 13.137 5.476 -31.208 1.00 16.80 ? 297 GLU A OE1 1 ATOM 2249 O OE2 . GLU A 1 297 ? 13.737 5.514 -33.301 1.00 17.84 ? 297 GLU A OE2 1 ATOM 2250 N N . SER A 1 298 ? 7.814 4.029 -30.136 1.00 13.10 ? 298 SER A N 1 ATOM 2251 C CA . SER A 1 298 ? 6.994 3.321 -29.148 1.00 12.72 ? 298 SER A CA 1 ATOM 2252 C C . SER A 1 298 ? 5.668 2.824 -29.758 1.00 12.51 ? 298 SER A C 1 ATOM 2253 O O . SER A 1 298 ? 5.282 1.677 -29.538 1.00 11.98 ? 298 SER A O 1 ATOM 2254 C CB . SER A 1 298 ? 6.751 4.180 -27.902 1.00 12.33 ? 298 SER A CB 1 ATOM 2255 O OG . SER A 1 298 ? 5.861 5.240 -28.179 1.00 12.22 ? 298 SER A OG 1 ATOM 2256 N N . VAL A 1 299 ? 5.002 3.669 -30.546 1.00 12.35 ? 299 VAL A N 1 ATOM 2257 C CA . VAL A 1 299 ? 3.782 3.271 -31.265 1.00 12.92 ? 299 VAL A CA 1 ATOM 2258 C C . VAL A 1 299 ? 4.038 2.029 -32.135 1.00 13.64 ? 299 VAL A C 1 ATOM 2259 O O . VAL A 1 299 ? 3.230 1.091 -32.154 1.00 13.40 ? 299 VAL A O 1 ATOM 2260 C CB . VAL A 1 299 ? 3.270 4.400 -32.192 1.00 12.87 ? 299 VAL A CB 1 ATOM 2261 C CG1 . VAL A 1 299 ? 1.865 4.066 -32.723 1.00 12.69 ? 299 VAL A CG1 1 ATOM 2262 C CG2 . VAL A 1 299 ? 3.284 5.749 -31.468 1.00 13.01 ? 299 VAL A CG2 1 ATOM 2263 N N . LEU A 1 300 ? 5.161 2.045 -32.862 1.00 13.59 ? 300 LEU A N 1 ATOM 2264 C CA . LEU A 1 300 ? 5.593 0.895 -33.650 1.00 13.24 ? 300 LEU A CA 1 ATOM 2265 C C . LEU A 1 300 ? 5.929 -0.295 -32.748 1.00 13.38 ? 300 LEU A C 1 ATOM 2266 O O . LEU A 1 300 ? 5.455 -1.410 -32.981 1.00 12.51 ? 300 LEU A O 1 ATOM 2267 C CB . LEU A 1 300 ? 6.797 1.256 -34.542 1.00 12.94 ? 300 LEU A CB 1 ATOM 2268 C CG . LEU A 1 300 ? 7.329 0.146 -35.460 1.00 12.61 ? 300 LEU A CG 1 ATOM 2269 C CD1 . LEU A 1 300 ? 6.284 -0.243 -36.509 1.00 11.77 ? 300 LEU A CD1 1 ATOM 2270 C CD2 . LEU A 1 300 ? 8.653 0.560 -36.106 1.00 12.00 ? 300 LEU A CD2 1 ATOM 2271 N N . SER A 1 301 ? 6.731 -0.050 -31.712 1.00 13.48 ? 301 SER A N 1 ATOM 2272 C CA . SER A 1 301 ? 7.151 -1.117 -30.799 1.00 13.66 ? 301 SER A CA 1 ATOM 2273 C C . SER A 1 301 ? 6.010 -1.977 -30.226 1.00 14.38 ? 301 SER A C 1 ATOM 2274 O O . SER A 1 301 ? 6.176 -3.186 -30.136 1.00 14.33 ? 301 SER A O 1 ATOM 2275 C CB . SER A 1 301 ? 8.024 -0.557 -29.675 1.00 12.91 ? 301 SER A CB 1 ATOM 2276 O OG . SER A 1 301 ? 8.378 -1.556 -28.740 1.00 12.23 ? 301 SER A OG 1 ATOM 2277 N N . TYR A 1 302 ? 4.877 -1.373 -29.844 1.00 15.10 ? 302 TYR A N 1 ATOM 2278 C CA A TYR A 1 302 ? 3.789 -2.157 -29.236 0.50 16.19 ? 302 TYR A CA 1 ATOM 2279 C CA B TYR A 1 302 ? 3.751 -2.090 -29.226 0.50 16.22 ? 302 TYR A CA 1 ATOM 2280 C C . TYR A 1 302 ? 2.704 -2.518 -30.251 1.00 16.61 ? 302 TYR A C 1 ATOM 2281 O O . TYR A 1 302 ? 1.613 -2.970 -29.897 1.00 16.08 ? 302 TYR A O 1 ATOM 2282 C CB A TYR A 1 302 ? 3.208 -1.463 -27.998 0.50 16.19 ? 302 TYR A CB 1 ATOM 2283 C CB B TYR A 1 302 ? 3.084 -1.219 -28.161 0.50 16.22 ? 302 TYR A CB 1 ATOM 2284 C CG A TYR A 1 302 ? 3.958 -1.789 -26.716 0.50 16.81 ? 302 TYR A CG 1 ATOM 2285 C CG B TYR A 1 302 ? 3.995 -0.839 -27.023 0.50 16.95 ? 302 TYR A CG 1 ATOM 2286 C CD1 A TYR A 1 302 ? 3.924 -3.074 -26.172 0.50 16.77 ? 302 TYR A CD1 1 ATOM 2287 C CD1 B TYR A 1 302 ? 4.562 -1.816 -26.215 0.50 17.37 ? 302 TYR A CD1 1 ATOM 2288 C CD2 A TYR A 1 302 ? 4.697 -0.814 -26.046 0.50 16.91 ? 302 TYR A CD2 1 ATOM 2289 C CD2 B TYR A 1 302 ? 4.275 0.492 -26.741 0.50 16.63 ? 302 TYR A CD2 1 ATOM 2290 C CE1 A TYR A 1 302 ? 4.602 -3.379 -24.999 0.50 16.58 ? 302 TYR A CE1 1 ATOM 2291 C CE1 B TYR A 1 302 ? 5.389 -1.483 -25.165 0.50 17.30 ? 302 TYR A CE1 1 ATOM 2292 C CE2 A TYR A 1 302 ? 5.380 -1.111 -24.870 0.50 16.50 ? 302 TYR A CE2 1 ATOM 2293 C CE2 B TYR A 1 302 ? 5.101 0.833 -25.698 0.50 17.11 ? 302 TYR A CE2 1 ATOM 2294 C CZ A TYR A 1 302 ? 5.330 -2.392 -24.355 0.50 16.78 ? 302 TYR A CZ 1 ATOM 2295 C CZ B TYR A 1 302 ? 5.655 -0.163 -24.912 0.50 17.21 ? 302 TYR A CZ 1 ATOM 2296 O OH A TYR A 1 302 ? 6.010 -2.687 -23.194 0.50 16.66 ? 302 TYR A OH 1 ATOM 2297 O OH B TYR A 1 302 ? 6.482 0.155 -23.867 0.50 17.71 ? 302 TYR A OH 1 ATOM 2298 N N . SER A 1 303 ? 3.060 -2.358 -31.515 1.00 17.86 ? 303 SER A N 1 ATOM 2299 C CA . SER A 1 303 ? 2.207 -2.554 -32.670 1.00 18.35 ? 303 SER A CA 1 ATOM 2300 C C . SER A 1 303 ? 1.751 -3.988 -32.970 1.00 18.85 ? 303 SER A C 1 ATOM 2301 O O . SER A 1 303 ? 0.570 -4.205 -33.286 1.00 17.45 ? 303 SER A O 1 ATOM 2302 C CB . SER A 1 303 ? 2.979 -2.047 -33.877 1.00 18.30 ? 303 SER A CB 1 ATOM 2303 O OG . SER A 1 303 ? 2.099 -1.660 -34.879 1.00 22.59 ? 303 SER A OG 1 ATOM 2304 N N . ASN A 1 304 ? 2.691 -4.941 -32.908 1.00 18.93 ? 304 ASN A N 1 ATOM 2305 C CA . ASN A 1 304 ? 2.532 -6.281 -33.511 1.00 20.32 ? 304 ASN A CA 1 ATOM 2306 C C . ASN A 1 304 ? 2.489 -6.286 -35.024 1.00 20.64 ? 304 ASN A C 1 ATOM 2307 O O . ASN A 1 304 ? 1.951 -7.221 -35.617 1.00 24.17 ? 304 ASN A O 1 ATOM 2308 C CB . ASN A 1 304 ? 1.304 -7.019 -32.980 1.00 23.14 ? 304 ASN A CB 1 ATOM 2309 C CG . ASN A 1 304 ? 1.530 -7.570 -31.618 1.00 26.28 ? 304 ASN A CG 1 ATOM 2310 O OD1 . ASN A 1 304 ? 2.524 -8.252 -31.382 1.00 31.89 ? 304 ASN A OD1 1 ATOM 2311 N ND2 . ASN A 1 304 ? 0.637 -7.259 -30.692 1.00 26.76 ? 304 ASN A ND2 1 ATOM 2312 N N . PHE A 1 305 ? 3.045 -5.243 -35.639 1.00 19.03 ? 305 PHE A N 1 ATOM 2313 C CA . PHE A 1 305 ? 3.167 -5.134 -37.093 1.00 17.68 ? 305 PHE A CA 1 ATOM 2314 C C . PHE A 1 305 ? 4.465 -4.415 -37.437 1.00 17.29 ? 305 PHE A C 1 ATOM 2315 O O . PHE A 1 305 ? 5.075 -3.779 -36.568 1.00 17.89 ? 305 PHE A O 1 ATOM 2316 C CB . PHE A 1 305 ? 1.996 -4.345 -37.687 1.00 17.42 ? 305 PHE A CB 1 ATOM 2317 C CG . PHE A 1 305 ? 0.694 -5.079 -37.673 1.00 17.88 ? 305 PHE A CG 1 ATOM 2318 C CD1 . PHE A 1 305 ? 0.428 -6.075 -38.614 1.00 17.36 ? 305 PHE A CD1 1 ATOM 2319 C CD2 . PHE A 1 305 ? -0.283 -4.763 -36.730 1.00 16.91 ? 305 PHE A CD2 1 ATOM 2320 C CE1 . PHE A 1 305 ? -0.799 -6.756 -38.600 1.00 18.03 ? 305 PHE A CE1 1 ATOM 2321 C CE2 . PHE A 1 305 ? -1.506 -5.433 -36.705 1.00 17.01 ? 305 PHE A CE2 1 ATOM 2322 C CZ . PHE A 1 305 ? -1.772 -6.431 -37.634 1.00 17.52 ? 305 PHE A CZ 1 ATOM 2323 N N . ASP A 1 306 ? 4.870 -4.489 -38.703 1.00 16.02 ? 306 ASP A N 1 ATOM 2324 C CA . ASP A 1 306 ? 6.096 -3.828 -39.145 1.00 15.53 ? 306 ASP A CA 1 ATOM 2325 C C . ASP A 1 306 ? 5.909 -2.361 -39.588 1.00 14.72 ? 306 ASP A C 1 ATOM 2326 O O . ASP A 1 306 ? 6.880 -1.692 -39.915 1.00 14.20 ? 306 ASP A O 1 ATOM 2327 C CB . ASP A 1 306 ? 6.793 -4.661 -40.231 1.00 15.88 ? 306 ASP A CB 1 ATOM 2328 C CG . ASP A 1 306 ? 6.139 -4.522 -41.594 1.00 16.80 ? 306 ASP A CG 1 ATOM 2329 O OD1 . ASP A 1 306 ? 5.085 -3.855 -41.719 1.00 16.37 ? 306 ASP A OD1 1 ATOM 2330 O OD2 . ASP A 1 306 ? 6.691 -5.067 -42.563 1.00 17.65 ? 306 ASP A OD2 1 ATOM 2331 N N . HIS A 1 307 ? 4.666 -1.878 -39.611 1.00 14.70 ? 307 HIS A N 1 ATOM 2332 C CA . HIS A 1 307 ? 4.378 -0.435 -39.787 1.00 15.07 ? 307 HIS A CA 1 ATOM 2333 C C . HIS A 1 307 ? 3.134 -0.047 -38.969 1.00 15.51 ? 307 HIS A C 1 ATOM 2334 O O . HIS A 1 307 ? 2.460 -0.924 -38.424 1.00 16.38 ? 307 HIS A O 1 ATOM 2335 C CB . HIS A 1 307 ? 4.234 -0.050 -41.275 1.00 14.64 ? 307 HIS A CB 1 ATOM 2336 C CG . HIS A 1 307 ? 3.010 -0.607 -41.940 1.00 14.79 ? 307 HIS A CG 1 ATOM 2337 N ND1 . HIS A 1 307 ? 2.961 -1.873 -42.485 1.00 15.12 ? 307 HIS A ND1 1 ATOM 2338 C CD2 . HIS A 1 307 ? 1.792 -0.061 -42.159 1.00 15.06 ? 307 HIS A CD2 1 ATOM 2339 C CE1 . HIS A 1 307 ? 1.765 -2.088 -43.002 1.00 14.79 ? 307 HIS A CE1 1 ATOM 2340 N NE2 . HIS A 1 307 ? 1.038 -1.001 -42.821 1.00 15.75 ? 307 HIS A NE2 1 ATOM 2341 N N . VAL A 1 308 ? 2.839 1.248 -38.856 1.00 15.17 ? 308 VAL A N 1 ATOM 2342 C CA . VAL A 1 308 ? 1.638 1.676 -38.106 1.00 15.18 ? 308 VAL A CA 1 ATOM 2343 C C . VAL A 1 308 ? 0.658 2.554 -38.879 1.00 15.02 ? 308 VAL A C 1 ATOM 2344 O O . VAL A 1 308 ? -0.516 2.648 -38.512 1.00 14.25 ? 308 VAL A O 1 ATOM 2345 C CB . VAL A 1 308 ? 1.955 2.345 -36.725 1.00 14.69 ? 308 VAL A CB 1 ATOM 2346 C CG1 . VAL A 1 308 ? 2.556 1.322 -35.771 1.00 14.67 ? 308 VAL A CG1 1 ATOM 2347 C CG2 . VAL A 1 308 ? 2.836 3.578 -36.875 1.00 13.82 ? 308 VAL A CG2 1 ATOM 2348 N N . ASP A 1 309 ? 1.124 3.191 -39.944 1.00 14.65 ? 309 ASP A N 1 ATOM 2349 C CA . ASP A 1 309 ? 0.230 4.052 -40.706 1.00 15.30 ? 309 ASP A CA 1 ATOM 2350 C C . ASP A 1 309 ? -0.798 3.227 -41.507 1.00 14.76 ? 309 ASP A C 1 ATOM 2351 O O . ASP A 1 309 ? -0.587 2.925 -42.676 1.00 14.70 ? 309 ASP A O 1 ATOM 2352 C CB . ASP A 1 309 ? 1.026 4.999 -41.596 1.00 14.74 ? 309 ASP A CB 1 ATOM 2353 C CG . ASP A 1 309 ? 0.166 6.078 -42.205 1.00 14.95 ? 309 ASP A CG 1 ATOM 2354 O OD1 . ASP A 1 309 ? -1.006 6.257 -41.799 1.00 13.95 ? 309 ASP A OD1 1 ATOM 2355 O OD2 . ASP A 1 309 ? 0.668 6.753 -43.117 1.00 15.75 ? 309 ASP A OD2 1 ATOM 2356 N N . PHE A 1 310 ? -1.897 2.865 -40.847 1.00 14.84 ? 310 PHE A N 1 ATOM 2357 C CA . PHE A 1 310 ? -2.926 1.988 -41.416 1.00 14.83 ? 310 PHE A CA 1 ATOM 2358 C C . PHE A 1 310 ? -4.076 2.808 -41.967 1.00 14.51 ? 310 PHE A C 1 ATOM 2359 O O . PHE A 1 310 ? -4.742 3.536 -41.219 1.00 14.61 ? 310 PHE A O 1 ATOM 2360 C CB . PHE A 1 310 ? -3.493 1.046 -40.340 1.00 15.53 ? 310 PHE A CB 1 ATOM 2361 C CG . PHE A 1 310 ? -2.750 -0.247 -40.184 1.00 16.05 ? 310 PHE A CG 1 ATOM 2362 C CD1 . PHE A 1 310 ? -1.419 -0.267 -39.807 1.00 17.00 ? 310 PHE A CD1 1 ATOM 2363 C CD2 . PHE A 1 310 ? -3.404 -1.454 -40.379 1.00 17.52 ? 310 PHE A CD2 1 ATOM 2364 C CE1 . PHE A 1 310 ? -0.725 -1.472 -39.655 1.00 17.94 ? 310 PHE A CE1 1 ATOM 2365 C CE2 . PHE A 1 310 ? -2.731 -2.668 -40.233 1.00 18.99 ? 310 PHE A CE2 1 ATOM 2366 C CZ . PHE A 1 310 ? -1.382 -2.678 -39.861 1.00 18.38 ? 310 PHE A CZ 1 ATOM 2367 N N . ILE A 1 311 ? -4.331 2.680 -43.264 1.00 14.21 ? 311 ILE A N 1 ATOM 2368 C CA . ILE A 1 311 ? -5.531 3.289 -43.851 1.00 14.40 ? 311 ILE A CA 1 ATOM 2369 C C . ILE A 1 311 ? -6.489 2.236 -44.429 1.00 14.79 ? 311 ILE A C 1 ATOM 2370 O O . ILE A 1 311 ? -7.445 2.572 -45.122 1.00 16.12 ? 311 ILE A O 1 ATOM 2371 C CB . ILE A 1 311 ? -5.194 4.407 -44.883 1.00 13.27 ? 311 ILE A CB 1 ATOM 2372 C CG1 . ILE A 1 311 ? -4.415 3.851 -46.082 1.00 13.23 ? 311 ILE A CG1 1 ATOM 2373 C CG2 . ILE A 1 311 ? -4.416 5.529 -44.211 1.00 12.96 ? 311 ILE A CG2 1 ATOM 2374 C CD1 . ILE A 1 311 ? -4.318 4.848 -47.245 1.00 12.73 ? 311 ILE A CD1 1 ATOM 2375 N N . THR A 1 312 ? -6.200 0.968 -44.147 1.00 14.02 ? 312 THR A N 1 ATOM 2376 C CA . THR A 1 312 ? -7.029 -0.163 -44.550 1.00 14.01 ? 312 THR A CA 1 ATOM 2377 C C . THR A 1 312 ? -7.182 -1.081 -43.325 1.00 13.40 ? 312 THR A C 1 ATOM 2378 O O . THR A 1 312 ? -6.481 -0.900 -42.337 1.00 13.57 ? 312 THR A O 1 ATOM 2379 C CB . THR A 1 312 ? -6.430 -0.938 -45.764 1.00 14.38 ? 312 THR A CB 1 ATOM 2380 O OG1 . THR A 1 312 ? -5.053 -1.246 -45.518 1.00 14.76 ? 312 THR A OG1 1 ATOM 2381 C CG2 . THR A 1 312 ? -6.556 -0.132 -47.062 1.00 13.91 ? 312 THR A CG2 1 ATOM 2382 N N . PRO A 1 313 ? -8.115 -2.044 -43.362 1.00 12.90 ? 313 PRO A N 1 ATOM 2383 C CA . PRO A 1 313 ? -8.244 -2.899 -42.170 1.00 12.69 ? 313 PRO A CA 1 ATOM 2384 C C . PRO A 1 313 ? -7.008 -3.771 -41.895 1.00 12.84 ? 313 PRO A C 1 ATOM 2385 O O . PRO A 1 313 ? -6.279 -4.109 -42.819 1.00 14.09 ? 313 PRO A O 1 ATOM 2386 C CB . PRO A 1 313 ? -9.451 -3.794 -42.490 1.00 11.80 ? 313 PRO A CB 1 ATOM 2387 C CG . PRO A 1 313 ? -10.155 -3.149 -43.603 1.00 12.11 ? 313 PRO A CG 1 ATOM 2388 C CD . PRO A 1 313 ? -9.173 -2.300 -44.359 1.00 12.57 ? 313 PRO A CD 1 ATOM 2389 N N . GLN A 1 314 ? -6.777 -4.140 -40.639 1.00 13.20 ? 314 GLN A N 1 ATOM 2390 C CA . GLN A 1 314 ? -5.767 -5.147 -40.353 1.00 13.53 ? 314 GLN A CA 1 ATOM 2391 C C . GLN A 1 314 ? -6.347 -6.558 -40.511 1.00 13.12 ? 314 GLN A C 1 ATOM 2392 O O . GLN A 1 314 ? -7.564 -6.700 -40.666 1.00 12.95 ? 314 GLN A O 1 ATOM 2393 C CB . GLN A 1 314 ? -5.111 -4.919 -38.988 1.00 15.02 ? 314 GLN A CB 1 ATOM 2394 C CG . GLN A 1 314 ? -6.028 -4.917 -37.767 1.00 15.53 ? 314 GLN A CG 1 ATOM 2395 C CD . GLN A 1 314 ? -5.210 -4.751 -36.496 1.00 15.67 ? 314 GLN A CD 1 ATOM 2396 O OE1 . GLN A 1 314 ? -5.012 -3.633 -36.009 1.00 15.77 ? 314 GLN A OE1 1 ATOM 2397 N NE2 . GLN A 1 314 ? -4.684 -5.861 -35.985 1.00 15.86 ? 314 GLN A NE2 1 ATOM 2398 N N . PRO A 1 315 ? -5.481 -7.598 -40.535 1.00 12.35 ? 315 PRO A N 1 ATOM 2399 C CA . PRO A 1 315 ? -5.994 -8.964 -40.743 1.00 12.21 ? 315 PRO A CA 1 ATOM 2400 C C . PRO A 1 315 ? -7.107 -9.355 -39.755 1.00 11.86 ? 315 PRO A C 1 ATOM 2401 O O . PRO A 1 315 ? -7.006 -9.097 -38.560 1.00 11.81 ? 315 PRO A O 1 ATOM 2402 C CB . PRO A 1 315 ? -4.751 -9.839 -40.536 1.00 12.08 ? 315 PRO A CB 1 ATOM 2403 C CG . PRO A 1 315 ? -3.616 -8.965 -40.945 1.00 11.84 ? 315 PRO A CG 1 ATOM 2404 C CD . PRO A 1 315 ? -4.004 -7.564 -40.533 1.00 11.97 ? 315 PRO A CD 1 ATOM 2405 N N . VAL A 1 316 ? -8.167 -9.964 -40.261 1.00 11.49 ? 316 VAL A N 1 ATOM 2406 C CA . VAL A 1 316 ? -9.298 -10.320 -39.417 1.00 11.72 ? 316 VAL A CA 1 ATOM 2407 C C . VAL A 1 316 ? -8.933 -11.482 -38.499 1.00 11.68 ? 316 VAL A C 1 ATOM 2408 O O . VAL A 1 316 ? -7.917 -12.163 -38.704 1.00 11.53 ? 316 VAL A O 1 ATOM 2409 C CB . VAL A 1 316 ? -10.575 -10.639 -40.255 1.00 11.81 ? 316 VAL A CB 1 ATOM 2410 C CG1 . VAL A 1 316 ? -10.816 -9.535 -41.288 1.00 11.46 ? 316 VAL A CG1 1 ATOM 2411 C CG2 . VAL A 1 316 ? -10.470 -12.003 -40.921 1.00 11.40 ? 316 VAL A CG2 1 ATOM 2412 N N . GLU A 1 317 ? -9.757 -11.689 -37.480 1.00 11.43 ? 317 GLU A N 1 ATOM 2413 C CA . GLU A 1 317 ? -9.552 -12.761 -36.512 1.00 11.05 ? 317 GLU A CA 1 ATOM 2414 C C . GLU A 1 317 ? -10.886 -13.445 -36.197 1.00 10.51 ? 317 GLU A C 1 ATOM 2415 O O . GLU A 1 317 ? -11.946 -12.991 -36.638 1.00 10.60 ? 317 GLU A O 1 ATOM 2416 C CB . GLU A 1 317 ? -8.874 -12.206 -35.245 1.00 12.14 ? 317 GLU A CB 1 ATOM 2417 C CG . GLU A 1 317 ? -7.416 -11.761 -35.483 1.00 12.75 ? 317 GLU A CG 1 ATOM 2418 C CD . GLU A 1 317 ? -6.726 -11.169 -34.255 1.00 14.11 ? 317 GLU A CD 1 ATOM 2419 O OE1 . GLU A 1 317 ? -6.943 -11.654 -33.110 1.00 14.83 ? 317 GLU A OE1 1 ATOM 2420 O OE2 . GLU A 1 317 ? -5.941 -10.209 -34.443 1.00 14.98 ? 317 GLU A OE2 1 ATOM 2421 N N . ASN A 1 318 ? -10.823 -14.529 -35.431 1.00 9.86 ? 318 ASN A N 1 ATOM 2422 C CA . ASN A 1 318 ? -11.966 -15.383 -35.159 1.00 9.32 ? 318 ASN A CA 1 ATOM 2423 C C . ASN A 1 318 ? -11.952 -15.786 -33.682 1.00 9.31 ? 318 ASN A C 1 ATOM 2424 O O . ASN A 1 318 ? -11.245 -16.729 -33.277 1.00 9.10 ? 318 ASN A O 1 ATOM 2425 C CB . ASN A 1 318 ? -11.887 -16.606 -36.082 1.00 9.72 ? 318 ASN A CB 1 ATOM 2426 C CG . ASN A 1 318 ? -13.032 -17.589 -35.882 1.00 9.67 ? 318 ASN A CG 1 ATOM 2427 O OD1 . ASN A 1 318 ? -14.163 -17.213 -35.547 1.00 9.10 ? 318 ASN A OD1 1 ATOM 2428 N ND2 . ASN A 1 318 ? -12.735 -18.872 -36.103 1.00 9.83 ? 318 ASN A ND2 1 ATOM 2429 N N . PHE A 1 319 ? -12.726 -15.067 -32.866 1.00 8.67 ? 319 PHE A N 1 ATOM 2430 C CA . PHE A 1 319 ? -12.494 -15.101 -31.433 1.00 8.16 ? 319 PHE A CA 1 ATOM 2431 C C . PHE A 1 319 ? -13.704 -14.740 -30.610 1.00 8.17 ? 319 PHE A C 1 ATOM 2432 O O . PHE A 1 319 ? -14.676 -14.209 -31.129 1.00 8.39 ? 319 PHE A O 1 ATOM 2433 C CB . PHE A 1 319 ? -11.336 -14.160 -31.064 1.00 7.60 ? 319 PHE A CB 1 ATOM 2434 C CG . PHE A 1 319 ? -11.653 -12.693 -31.250 1.00 7.52 ? 319 PHE A CG 1 ATOM 2435 C CD1 . PHE A 1 319 ? -12.053 -11.908 -30.167 1.00 7.51 ? 319 PHE A CD1 1 ATOM 2436 C CD2 . PHE A 1 319 ? -11.536 -12.092 -32.504 1.00 7.31 ? 319 PHE A CD2 1 ATOM 2437 C CE1 . PHE A 1 319 ? -12.340 -10.542 -30.333 1.00 7.42 ? 319 PHE A CE1 1 ATOM 2438 C CE2 . PHE A 1 319 ? -11.810 -10.739 -32.677 1.00 7.34 ? 319 PHE A CE2 1 ATOM 2439 C CZ . PHE A 1 319 ? -12.210 -9.961 -31.594 1.00 7.37 ? 319 PHE A CZ 1 ATOM 2440 N N . TYR A 1 320 ? -13.603 -15.032 -29.316 1.00 8.05 ? 320 TYR A N 1 ATOM 2441 C CA . TYR A 1 320 ? -14.489 -14.516 -28.288 1.00 7.88 ? 320 TYR A CA 1 ATOM 2442 C C . TYR A 1 320 ? -13.623 -13.746 -27.268 1.00 7.91 ? 320 TYR A C 1 ATOM 2443 O O . TYR A 1 320 ? -12.436 -14.060 -27.077 1.00 8.51 ? 320 TYR A O 1 ATOM 2444 C CB . TYR A 1 320 ? -15.222 -15.679 -27.611 1.00 7.61 ? 320 TYR A CB 1 ATOM 2445 C CG . TYR A 1 320 ? -16.224 -15.262 -26.550 1.00 7.76 ? 320 TYR A CG 1 ATOM 2446 C CD1 . TYR A 1 320 ? -17.265 -14.363 -26.843 1.00 7.72 ? 320 TYR A CD1 1 ATOM 2447 C CD2 . TYR A 1 320 ? -16.137 -15.762 -25.254 1.00 7.79 ? 320 TYR A CD2 1 ATOM 2448 C CE1 . TYR A 1 320 ? -18.190 -13.985 -25.873 1.00 7.55 ? 320 TYR A CE1 1 ATOM 2449 C CE2 . TYR A 1 320 ? -17.045 -15.386 -24.274 1.00 7.73 ? 320 TYR A CE2 1 ATOM 2450 C CZ . TYR A 1 320 ? -18.075 -14.500 -24.587 1.00 7.73 ? 320 TYR A CZ 1 ATOM 2451 O OH . TYR A 1 320 ? -18.977 -14.136 -23.599 1.00 7.45 ? 320 TYR A OH 1 ATOM 2452 N N . ALA A 1 321 ? -14.197 -12.742 -26.622 1.00 7.62 ? 321 ALA A N 1 ATOM 2453 C CA . ALA A 1 321 ? -13.479 -11.976 -25.603 1.00 7.69 ? 321 ALA A CA 1 ATOM 2454 C C . ALA A 1 321 ? -14.407 -11.540 -24.471 1.00 7.76 ? 321 ALA A C 1 ATOM 2455 O O . ALA A 1 321 ? -15.635 -11.376 -24.672 1.00 7.75 ? 321 ALA A O 1 ATOM 2456 C CB . ALA A 1 321 ? -12.796 -10.745 -26.227 1.00 7.42 ? 321 ALA A CB 1 ATOM 2457 N N . LYS A 1 322 ? -13.818 -11.349 -23.292 1.00 7.55 ? 322 LYS A N 1 ATOM 2458 C CA . LYS A 1 322 ? -14.534 -10.818 -22.126 1.00 7.50 ? 322 LYS A CA 1 ATOM 2459 C C . LYS A 1 322 ? -13.664 -9.825 -21.397 1.00 7.32 ? 322 LYS A C 1 ATOM 2460 O O . LYS A 1 322 ? -12.458 -9.713 -21.650 1.00 7.31 ? 322 LYS A O 1 ATOM 2461 C CB . LYS A 1 322 ? -14.944 -11.930 -21.167 1.00 7.52 ? 322 LYS A CB 1 ATOM 2462 C CG . LYS A 1 322 ? -15.890 -12.964 -21.754 1.00 7.68 ? 322 LYS A CG 1 ATOM 2463 C CD . LYS A 1 322 ? -16.353 -13.964 -20.683 1.00 7.93 ? 322 LYS A CD 1 ATOM 2464 C CE . LYS A 1 322 ? -17.542 -13.449 -19.878 1.00 7.68 ? 322 LYS A CE 1 ATOM 2465 N NZ . LYS A 1 322 ? -18.787 -13.602 -20.687 1.00 7.86 ? 322 LYS A NZ 1 ATOM 2466 N N . SER A 1 323 ? -14.268 -9.099 -20.476 1.00 7.48 ? 323 SER A N 1 ATOM 2467 C CA . SER A 1 323 ? -13.512 -8.116 -19.722 1.00 7.79 ? 323 SER A CA 1 ATOM 2468 C C . SER A 1 323 ? -14.044 -7.958 -18.314 1.00 8.11 ? 323 SER A C 1 ATOM 2469 O O . SER A 1 323 ? -15.161 -8.398 -17.995 1.00 8.35 ? 323 SER A O 1 ATOM 2470 C CB . SER A 1 323 ? -13.457 -6.757 -20.472 1.00 7.73 ? 323 SER A CB 1 ATOM 2471 O OG . SER A 1 323 ? -14.629 -5.983 -20.331 1.00 7.29 ? 323 SER A OG 1 ATOM 2472 N N . LEU A 1 324 ? -13.230 -7.326 -17.479 1.00 8.44 ? 324 LEU A N 1 ATOM 2473 C CA . LEU A 1 324 ? -13.602 -6.985 -16.120 1.00 8.72 ? 324 LEU A CA 1 ATOM 2474 C C . LEU A 1 324 ? -12.883 -5.701 -15.746 1.00 9.14 ? 324 LEU A C 1 ATOM 2475 O O . LEU A 1 324 ? -11.710 -5.501 -16.115 1.00 9.37 ? 324 LEU A O 1 ATOM 2476 C CB . LEU A 1 324 ? -13.222 -8.100 -15.137 1.00 8.58 ? 324 LEU A CB 1 ATOM 2477 C CG . LEU A 1 324 ? -14.135 -9.321 -14.985 1.00 8.89 ? 324 LEU A CG 1 ATOM 2478 C CD1 . LEU A 1 324 ? -13.493 -10.393 -14.116 1.00 8.59 ? 324 LEU A CD1 1 ATOM 2479 C CD2 . LEU A 1 324 ? -15.533 -8.935 -14.435 1.00 8.83 ? 324 LEU A CD2 1 ATOM 2480 N N . THR A 1 325 ? -13.594 -4.836 -15.028 1.00 9.43 ? 325 THR A N 1 ATOM 2481 C CA . THR A 1 325 ? -12.988 -3.698 -14.332 1.00 10.11 ? 325 THR A CA 1 ATOM 2482 C C . THR A 1 325 ? -13.252 -3.878 -12.826 1.00 10.63 ? 325 THR A C 1 ATOM 2483 O O . THR A 1 325 ? -14.418 -3.971 -12.404 1.00 10.93 ? 325 THR A O 1 ATOM 2484 C CB . THR A 1 325 ? -13.535 -2.307 -14.837 1.00 9.83 ? 325 THR A CB 1 ATOM 2485 O OG1 . THR A 1 325 ? -14.915 -2.149 -14.463 1.00 9.99 ? 325 THR A OG1 1 ATOM 2486 C CG2 . THR A 1 325 ? -13.413 -2.183 -16.342 1.00 9.56 ? 325 THR A CG2 1 ATOM 2487 N N . LEU A 1 326 ? -12.179 -3.909 -12.034 1.00 11.20 ? 326 LEU A N 1 ATOM 2488 C CA . LEU A 1 326 ? -12.250 -4.202 -10.596 1.00 12.41 ? 326 LEU A CA 1 ATOM 2489 C C . LEU A 1 326 ? -11.674 -3.094 -9.732 1.00 13.38 ? 326 LEU A C 1 ATOM 2490 O O . LEU A 1 326 ? -10.623 -2.523 -10.063 1.00 14.23 ? 326 LEU A O 1 ATOM 2491 C CB . LEU A 1 326 ? -11.448 -5.465 -10.270 1.00 12.63 ? 326 LEU A CB 1 ATOM 2492 C CG . LEU A 1 326 ? -11.521 -6.694 -11.174 1.00 12.58 ? 326 LEU A CG 1 ATOM 2493 C CD1 . LEU A 1 326 ? -10.513 -7.722 -10.690 1.00 12.24 ? 326 LEU A CD1 1 ATOM 2494 C CD2 . LEU A 1 326 ? -12.944 -7.269 -11.219 1.00 12.05 ? 326 LEU A CD2 1 ATOM 2495 N N . LYS A 1 327 ? -12.330 -2.832 -8.603 1.00 13.93 ? 327 LYS A N 1 ATOM 2496 C CA . LYS A 1 327 ? -11.748 -2.011 -7.533 1.00 14.32 ? 327 LYS A CA 1 ATOM 2497 C C . LYS A 1 327 ? -10.468 -2.644 -6.992 1.00 14.15 ? 327 LYS A C 1 ATOM 2498 O O . LYS A 1 327 ? -9.455 -1.965 -6.838 1.00 14.08 ? 327 LYS A O 1 ATOM 2499 C CB . LYS A 1 327 ? -12.749 -1.786 -6.394 1.00 14.29 ? 327 LYS A CB 1 ATOM 2500 C CG . LYS A 1 327 ? -13.909 -0.911 -6.804 1.00 15.38 ? 327 LYS A CG 1 ATOM 2501 C CD . LYS A 1 327 ? -14.874 -0.592 -5.673 1.00 16.15 ? 327 LYS A CD 1 ATOM 2502 C CE . LYS A 1 327 ? -16.051 0.201 -6.241 1.00 17.15 ? 327 LYS A CE 1 ATOM 2503 N NZ . LYS A 1 327 ? -17.118 0.501 -5.239 1.00 18.65 ? 327 LYS A NZ 1 ATOM 2504 N N . SER A 1 328 ? -10.541 -3.944 -6.707 1.00 14.34 ? 328 SER A N 1 ATOM 2505 C CA . SER A 1 328 ? -9.419 -4.745 -6.226 1.00 14.41 ? 328 SER A CA 1 ATOM 2506 C C . SER A 1 328 ? -9.622 -6.190 -6.629 1.00 14.59 ? 328 SER A C 1 ATOM 2507 O O . SER A 1 328 ? -10.759 -6.644 -6.801 1.00 15.18 ? 328 SER A O 1 ATOM 2508 C CB . SER A 1 328 ? -9.328 -4.691 -4.704 1.00 14.61 ? 328 SER A CB 1 ATOM 2509 O OG . SER A 1 328 ? -8.143 -5.335 -4.237 1.00 14.92 ? 328 SER A OG 1 ATOM 2510 N N . ILE A 1 329 ? -8.525 -6.924 -6.758 1.00 14.66 ? 329 ILE A N 1 ATOM 2511 C CA . ILE A 1 329 ? -8.605 -8.360 -6.988 1.00 14.34 ? 329 ILE A CA 1 ATOM 2512 C C . ILE A 1 329 ? -8.230 -9.157 -5.704 1.00 15.59 ? 329 ILE A C 1 ATOM 2513 O O . ILE A 1 329 ? -8.080 -10.391 -5.737 1.00 15.81 ? 329 ILE A O 1 ATOM 2514 C CB . ILE A 1 329 ? -7.765 -8.758 -8.229 1.00 14.06 ? 329 ILE A CB 1 ATOM 2515 C CG1 . ILE A 1 329 ? -8.264 -10.089 -8.837 1.00 14.10 ? 329 ILE A CG1 1 ATOM 2516 C CG2 . ILE A 1 329 ? -6.264 -8.748 -7.911 1.00 13.82 ? 329 ILE A CG2 1 ATOM 2517 C CD1 . ILE A 1 329 ? -7.575 -10.504 -10.163 1.00 13.38 ? 329 ILE A CD1 1 ATOM 2518 N N . LYS A 1 330 ? -8.117 -8.458 -4.571 1.00 14.85 ? 330 LYS A N 1 ATOM 2519 C CA . LYS A 1 330 ? -7.651 -9.083 -3.323 1.00 15.18 ? 330 LYS A CA 1 ATOM 2520 C C . LYS A 1 330 ? -8.652 -10.072 -2.719 1.00 16.04 ? 330 LYS A C 1 ATOM 2521 O O . LYS A 1 330 ? -9.853 -10.000 -2.984 1.00 15.16 ? 330 LYS A O 1 ATOM 2522 C CB . LYS A 1 330 ? -7.238 -8.023 -2.300 1.00 14.13 ? 330 LYS A CB 1 ATOM 2523 C CG . LYS A 1 330 ? -5.870 -7.406 -2.597 1.00 13.80 ? 330 LYS A CG 1 ATOM 2524 C CD . LYS A 1 330 ? -5.418 -6.445 -1.507 1.00 12.89 ? 330 LYS A CD 1 ATOM 2525 C CE . LYS A 1 330 ? -4.088 -5.828 -1.888 1.00 13.16 ? 330 LYS A CE 1 ATOM 2526 N NZ . LYS A 1 330 ? -3.582 -4.838 -0.900 1.00 13.13 ? 330 LYS A NZ 1 ATOM 2527 N N . GLY A 1 331 ? -8.150 -11.013 -1.924 1.00 17.25 ? 331 GLY A N 1 ATOM 2528 C CA . GLY A 1 331 ? -9.025 -11.998 -1.281 1.00 18.62 ? 331 GLY A CA 1 ATOM 2529 C C . GLY A 1 331 ? -9.407 -13.176 -2.158 1.00 18.65 ? 331 GLY A C 1 ATOM 2530 O O . GLY A 1 331 ? -8.574 -13.716 -2.877 1.00 19.47 ? 331 GLY A O 1 ATOM 2531 N N . ASP A 1 332 ? -10.672 -13.578 -2.096 1.00 20.63 ? 332 ASP A N 1 ATOM 2532 C CA . ASP A 1 332 ? -11.133 -14.770 -2.807 1.00 22.13 ? 332 ASP A CA 1 ATOM 2533 C C . ASP A 1 332 ? -11.088 -14.634 -4.319 1.00 22.53 ? 332 ASP A C 1 ATOM 2534 O O . ASP A 1 332 ? -10.895 -15.625 -5.019 1.00 23.35 ? 332 ASP A O 1 ATOM 2535 C CB . ASP A 1 332 ? -12.535 -15.162 -2.358 1.00 23.74 ? 332 ASP A CB 1 ATOM 2536 C CG . ASP A 1 332 ? -12.548 -15.801 -0.981 1.00 25.60 ? 332 ASP A CG 1 ATOM 2537 O OD1 . ASP A 1 332 ? -11.454 -16.102 -0.445 1.00 24.41 ? 332 ASP A OD1 1 ATOM 2538 O OD2 . ASP A 1 332 ? -13.660 -15.997 -0.437 1.00 27.32 ? 332 ASP A OD2 1 ATOM 2539 N N . ALA A 1 333 ? -11.265 -13.403 -4.801 1.00 21.63 ? 333 ALA A N 1 ATOM 2540 C CA . ALA A 1 333 ? -11.196 -13.080 -6.217 1.00 20.68 ? 333 ALA A CA 1 ATOM 2541 C C . ALA A 1 333 ? -9.905 -13.568 -6.888 1.00 19.50 ? 333 ALA A C 1 ATOM 2542 O O . ALA A 1 333 ? -9.971 -14.257 -7.907 1.00 18.96 ? 333 ALA A O 1 ATOM 2543 C CB . ALA A 1 333 ? -11.384 -11.578 -6.428 1.00 21.24 ? 333 ALA A CB 1 ATOM 2544 N N . VAL A 1 334 ? -8.744 -13.210 -6.325 1.00 18.65 ? 334 VAL A N 1 ATOM 2545 C CA . VAL A 1 334 ? -7.449 -13.625 -6.897 1.00 18.05 ? 334 VAL A CA 1 ATOM 2546 C C . VAL A 1 334 ? -7.182 -15.102 -6.625 1.00 17.76 ? 334 VAL A C 1 ATOM 2547 O O . VAL A 1 334 ? -6.590 -15.784 -7.448 1.00 19.26 ? 334 VAL A O 1 ATOM 2548 C CB . VAL A 1 334 ? -6.250 -12.717 -6.446 1.00 18.20 ? 334 VAL A CB 1 ATOM 2549 C CG1 . VAL A 1 334 ? -6.004 -12.797 -4.914 1.00 17.40 ? 334 VAL A CG1 1 ATOM 2550 C CG2 . VAL A 1 334 ? -4.983 -13.018 -7.245 1.00 16.08 ? 334 VAL A CG2 1 ATOM 2551 N N . LYS A 1 335 ? -7.644 -15.596 -5.482 1.00 17.73 ? 335 LYS A N 1 ATOM 2552 C CA . LYS A 1 335 ? -7.533 -17.009 -5.178 1.00 17.71 ? 335 LYS A CA 1 ATOM 2553 C C . LYS A 1 335 ? -8.241 -17.833 -6.270 1.00 17.40 ? 335 LYS A C 1 ATOM 2554 O O . LYS A 1 335 ? -7.600 -18.681 -6.915 1.00 17.88 ? 335 LYS A O 1 ATOM 2555 C CB . LYS A 1 335 ? -8.057 -17.308 -3.765 1.00 18.53 ? 335 LYS A CB 1 ATOM 2556 C CG . LYS A 1 335 ? -8.159 -18.799 -3.405 1.00 19.42 ? 335 LYS A CG 1 ATOM 2557 C CD . LYS A 1 335 ? -6.810 -19.438 -3.108 0.50 20.36 ? 335 LYS A CD 1 ATOM 2558 C CE . LYS A 1 335 ? -6.808 -20.933 -3.445 0.50 21.22 ? 335 LYS A CE 1 ATOM 2559 N NZ . LYS A 1 335 ? -8.139 -21.598 -3.230 0.50 20.96 ? 335 LYS A NZ 1 ATOM 2560 N N . ASN A 1 336 ? -9.531 -17.556 -6.502 1.00 15.82 ? 336 ASN A N 1 ATOM 2561 C CA . ASN A 1 336 ? -10.305 -18.195 -7.582 1.00 15.09 ? 336 ASN A CA 1 ATOM 2562 C C . ASN A 1 336 ? -9.693 -18.002 -8.971 1.00 14.48 ? 336 ASN A C 1 ATOM 2563 O O . ASN A 1 336 ? -9.655 -18.939 -9.782 1.00 13.82 ? 336 ASN A O 1 ATOM 2564 C CB . ASN A 1 336 ? -11.741 -17.682 -7.607 1.00 16.15 ? 336 ASN A CB 1 ATOM 2565 C CG . ASN A 1 336 ? -12.471 -17.895 -6.296 1.00 16.90 ? 336 ASN A CG 1 ATOM 2566 O OD1 . ASN A 1 336 ? -11.974 -18.577 -5.393 1.00 18.44 ? 336 ASN A OD1 1 ATOM 2567 N ND2 . ASN A 1 336 ? -13.658 -17.305 -6.180 1.00 16.38 ? 336 ASN A ND2 1 ATOM 2568 N N . PHE A 1 337 ? -9.202 -16.789 -9.235 1.00 13.51 ? 337 PHE A N 1 ATOM 2569 C CA . PHE A 1 337 ? -8.550 -16.493 -10.503 1.00 13.02 ? 337 PHE A CA 1 ATOM 2570 C C . PHE A 1 337 ? -7.328 -17.394 -10.739 1.00 13.34 ? 337 PHE A C 1 ATOM 2571 O O . PHE A 1 337 ? -7.151 -17.944 -11.831 1.00 13.12 ? 337 PHE A O 1 ATOM 2572 C CB . PHE A 1 337 ? -8.164 -15.007 -10.594 1.00 11.89 ? 337 PHE A CB 1 ATOM 2573 C CG . PHE A 1 337 ? -7.448 -14.647 -11.871 1.00 11.64 ? 337 PHE A CG 1 ATOM 2574 C CD1 . PHE A 1 337 ? -8.158 -14.190 -12.977 1.00 10.95 ? 337 PHE A CD1 1 ATOM 2575 C CD2 . PHE A 1 337 ? -6.056 -14.784 -11.975 1.00 10.98 ? 337 PHE A CD2 1 ATOM 2576 C CE1 . PHE A 1 337 ? -7.495 -13.878 -14.159 1.00 11.00 ? 337 PHE A CE1 1 ATOM 2577 C CE2 . PHE A 1 337 ? -5.393 -14.461 -13.157 1.00 10.53 ? 337 PHE A CE2 1 ATOM 2578 C CZ . PHE A 1 337 ? -6.105 -14.014 -14.247 1.00 10.44 ? 337 PHE A CZ 1 ATOM 2579 N N . VAL A 1 338 ? -6.482 -17.526 -9.716 1.00 14.15 ? 338 VAL A N 1 ATOM 2580 C CA . VAL A 1 338 ? -5.256 -18.320 -9.824 1.00 14.66 ? 338 VAL A CA 1 ATOM 2581 C C . VAL A 1 338 ? -5.538 -19.832 -9.940 1.00 14.79 ? 338 VAL A C 1 ATOM 2582 O O . VAL A 1 338 ? -4.839 -20.539 -10.682 1.00 15.26 ? 338 VAL A O 1 ATOM 2583 C CB . VAL A 1 338 ? -4.255 -17.988 -8.680 1.00 14.63 ? 338 VAL A CB 1 ATOM 2584 C CG1 . VAL A 1 338 ? -3.147 -18.975 -8.640 1.00 13.91 ? 338 VAL A CG1 1 ATOM 2585 C CG2 . VAL A 1 338 ? -3.668 -16.582 -8.871 1.00 14.98 ? 338 VAL A CG2 1 ATOM 2586 N N . ASP A 1 339 ? -6.560 -20.311 -9.231 1.00 14.17 ? 339 ASP A N 1 ATOM 2587 C CA . ASP A 1 339 ? -6.957 -21.727 -9.282 1.00 15.22 ? 339 ASP A CA 1 ATOM 2588 C C . ASP A 1 339 ? -7.323 -22.102 -10.713 1.00 15.77 ? 339 ASP A C 1 ATOM 2589 O O . ASP A 1 339 ? -6.726 -23.014 -11.323 1.00 16.31 ? 339 ASP A O 1 ATOM 2590 C CB . ASP A 1 339 ? -8.156 -22.002 -8.343 1.00 15.09 ? 339 ASP A CB 1 ATOM 2591 C CG . ASP A 1 339 ? -7.726 -22.225 -6.872 1.00 15.73 ? 339 ASP A CG 1 ATOM 2592 O OD1 . ASP A 1 339 ? -6.564 -22.627 -6.619 1.00 14.68 ? 339 ASP A OD1 1 ATOM 2593 O OD2 . ASP A 1 339 ? -8.557 -21.985 -5.966 1.00 15.88 ? 339 ASP A OD2 1 ATOM 2594 N N . TYR A 1 340 ? -8.302 -21.366 -11.233 1.00 14.27 ? 340 TYR A N 1 ATOM 2595 C CA . TYR A 1 340 ? -8.750 -21.470 -12.605 1.00 13.19 ? 340 TYR A CA 1 ATOM 2596 C C . TYR A 1 340 ? -7.590 -21.345 -13.609 1.00 12.89 ? 340 TYR A C 1 ATOM 2597 O O . TYR A 1 340 ? -7.461 -22.176 -14.510 1.00 12.46 ? 340 TYR A O 1 ATOM 2598 C CB . TYR A 1 340 ? -9.838 -20.420 -12.850 1.00 12.06 ? 340 TYR A CB 1 ATOM 2599 C CG . TYR A 1 340 ? -10.732 -20.739 -14.017 1.00 11.55 ? 340 TYR A CG 1 ATOM 2600 C CD1 . TYR A 1 340 ? -11.966 -21.372 -13.823 1.00 11.14 ? 340 TYR A CD1 1 ATOM 2601 C CD2 . TYR A 1 340 ? -10.348 -20.408 -15.321 1.00 11.09 ? 340 TYR A CD2 1 ATOM 2602 C CE1 . TYR A 1 340 ? -12.800 -21.664 -14.900 1.00 10.71 ? 340 TYR A CE1 1 ATOM 2603 C CE2 . TYR A 1 340 ? -11.159 -20.706 -16.399 1.00 11.12 ? 340 TYR A CE2 1 ATOM 2604 C CZ . TYR A 1 340 ? -12.394 -21.327 -16.183 1.00 11.04 ? 340 TYR A CZ 1 ATOM 2605 O OH . TYR A 1 340 ? -13.199 -21.609 -17.263 1.00 10.87 ? 340 TYR A OH 1 ATOM 2606 N N . TYR A 1 341 ? -6.756 -20.316 -13.437 1.00 13.58 ? 341 TYR A N 1 ATOM 2607 C CA . TYR A 1 341 ? -5.483 -20.141 -14.202 1.00 14.02 ? 341 TYR A CA 1 ATOM 2608 C C . TYR A 1 341 ? -4.734 -21.471 -14.356 1.00 14.44 ? 341 TYR A C 1 ATOM 2609 O O . TYR A 1 341 ? -4.417 -21.881 -15.471 1.00 16.37 ? 341 TYR A O 1 ATOM 2610 C CB . TYR A 1 341 ? -4.586 -19.103 -13.491 1.00 13.40 ? 341 TYR A CB 1 ATOM 2611 C CG . TYR A 1 341 ? -3.405 -18.490 -14.245 1.00 13.27 ? 341 TYR A CG 1 ATOM 2612 C CD1 . TYR A 1 341 ? -2.685 -17.433 -13.673 1.00 13.06 ? 341 TYR A CD1 1 ATOM 2613 C CD2 . TYR A 1 341 ? -2.988 -18.958 -15.508 1.00 13.36 ? 341 TYR A CD2 1 ATOM 2614 C CE1 . TYR A 1 341 ? -1.583 -16.856 -14.326 1.00 12.75 ? 341 TYR A CE1 1 ATOM 2615 C CE2 . TYR A 1 341 ? -1.895 -18.377 -16.181 1.00 12.46 ? 341 TYR A CE2 1 ATOM 2616 C CZ . TYR A 1 341 ? -1.195 -17.329 -15.583 1.00 12.62 ? 341 TYR A CZ 1 ATOM 2617 O OH . TYR A 1 341 ? -0.115 -16.740 -16.226 1.00 11.97 ? 341 TYR A OH 1 ATOM 2618 N N . PHE A 1 342 ? -4.481 -22.162 -13.247 1.00 14.24 ? 342 PHE A N 1 ATOM 2619 C CA . PHE A 1 342 ? -3.625 -23.352 -13.284 1.00 14.00 ? 342 PHE A CA 1 ATOM 2620 C C . PHE A 1 342 ? -4.380 -24.669 -13.517 1.00 14.04 ? 342 PHE A C 1 ATOM 2621 O O . PHE A 1 342 ? -3.861 -25.562 -14.184 1.00 13.44 ? 342 PHE A O 1 ATOM 2622 C CB . PHE A 1 342 ? -2.733 -23.421 -12.029 1.00 13.34 ? 342 PHE A CB 1 ATOM 2623 C CG . PHE A 1 342 ? -1.589 -22.428 -12.040 1.00 13.26 ? 342 PHE A CG 1 ATOM 2624 C CD1 . PHE A 1 342 ? -0.296 -22.833 -12.385 1.00 13.08 ? 342 PHE A CD1 1 ATOM 2625 C CD2 . PHE A 1 342 ? -1.805 -21.083 -11.709 1.00 13.13 ? 342 PHE A CD2 1 ATOM 2626 C CE1 . PHE A 1 342 ? 0.774 -21.915 -12.398 1.00 12.73 ? 342 PHE A CE1 1 ATOM 2627 C CE2 . PHE A 1 342 ? -0.757 -20.154 -11.718 1.00 12.77 ? 342 PHE A CE2 1 ATOM 2628 C CZ . PHE A 1 342 ? 0.543 -20.576 -12.068 1.00 13.23 ? 342 PHE A CZ 1 ATOM 2629 N N . ASP A 1 343 ? -5.588 -24.787 -12.963 1.00 14.56 ? 343 ASP A N 1 ATOM 2630 C CA . ASP A 1 343 ? -6.385 -26.012 -13.075 1.00 14.81 ? 343 ASP A CA 1 ATOM 2631 C C . ASP A 1 343 ? -7.048 -26.156 -14.453 1.00 15.30 ? 343 ASP A C 1 ATOM 2632 O O . ASP A 1 343 ? -7.205 -27.281 -14.961 1.00 14.94 ? 343 ASP A O 1 ATOM 2633 C CB . ASP A 1 343 ? -7.476 -26.059 -11.995 1.00 15.53 ? 343 ASP A CB 1 ATOM 2634 C CG . ASP A 1 343 ? -6.916 -26.178 -10.572 1.00 16.72 ? 343 ASP A CG 1 ATOM 2635 O OD1 . ASP A 1 343 ? -5.741 -26.547 -10.397 1.00 16.50 ? 343 ASP A OD1 1 ATOM 2636 O OD2 . ASP A 1 343 ? -7.676 -25.906 -9.612 1.00 17.94 ? 343 ASP A OD2 1 ATOM 2637 N N . VAL A 1 344 ? -7.441 -25.020 -15.045 1.00 14.82 ? 344 VAL A N 1 ATOM 2638 C CA . VAL A 1 344 ? -8.235 -25.008 -16.283 1.00 14.99 ? 344 VAL A CA 1 ATOM 2639 C C . VAL A 1 344 ? -7.463 -24.367 -17.435 1.00 14.41 ? 344 VAL A C 1 ATOM 2640 O O . VAL A 1 344 ? -6.989 -25.074 -18.317 1.00 14.33 ? 344 VAL A O 1 ATOM 2641 C CB . VAL A 1 344 ? -9.623 -24.309 -16.096 1.00 15.47 ? 344 VAL A CB 1 ATOM 2642 C CG1 . VAL A 1 344 ? -10.445 -24.376 -17.377 1.00 15.00 ? 344 VAL A CG1 1 ATOM 2643 C CG2 . VAL A 1 344 ? -10.404 -24.902 -14.891 1.00 14.78 ? 344 VAL A CG2 1 ATOM 2644 N N . SER A 1 345 ? -7.322 -23.042 -17.393 1.00 13.91 ? 345 SER A N 1 ATOM 2645 C CA . SER A 1 345 ? -6.694 -22.251 -18.454 1.00 14.66 ? 345 SER A CA 1 ATOM 2646 C C . SER A 1 345 ? -5.399 -22.825 -19.026 1.00 15.19 ? 345 SER A C 1 ATOM 2647 O O . SER A 1 345 ? -5.230 -22.883 -20.249 1.00 14.61 ? 345 SER A O 1 ATOM 2648 C CB . SER A 1 345 ? -6.450 -20.805 -17.984 1.00 14.78 ? 345 SER A CB 1 ATOM 2649 O OG . SER A 1 345 ? -7.574 -20.280 -17.280 1.00 14.23 ? 345 SER A OG 1 ATOM 2650 N N . ASN A 1 346 ? -4.483 -23.243 -18.155 1.00 16.26 ? 346 ASN A N 1 ATOM 2651 C CA . ASN A 1 346 ? -3.168 -23.705 -18.642 1.00 17.59 ? 346 ASN A CA 1 ATOM 2652 C C . ASN A 1 346 ? -3.200 -25.067 -19.329 1.00 17.30 ? 346 ASN A C 1 ATOM 2653 O O . ASN A 1 346 ? -2.229 -25.463 -19.969 1.00 18.58 ? 346 ASN A O 1 ATOM 2654 C CB . ASN A 1 346 ? -2.080 -23.630 -17.555 1.00 17.39 ? 346 ASN A CB 1 ATOM 2655 C CG . ASN A 1 346 ? -1.682 -22.188 -17.218 1.00 18.23 ? 346 ASN A CG 1 ATOM 2656 O OD1 . ASN A 1 346 ? -2.102 -21.237 -17.889 1.00 19.22 ? 346 ASN A OD1 1 ATOM 2657 N ND2 . ASN A 1 346 ? -0.867 -22.023 -16.172 1.00 17.53 ? 346 ASN A ND2 1 ATOM 2658 N N . LYS A 1 347 ? -4.329 -25.759 -19.222 1.00 17.34 ? 347 LYS A N 1 ATOM 2659 C CA . LYS A 1 347 ? -4.540 -27.010 -19.938 1.00 17.52 ? 347 LYS A CA 1 ATOM 2660 C C . LYS A 1 347 ? -5.348 -26.795 -21.232 1.00 17.55 ? 347 LYS A C 1 ATOM 2661 O O . LYS A 1 347 ? -5.593 -27.746 -21.973 1.00 17.19 ? 347 LYS A O 1 ATOM 2662 C CB . LYS A 1 347 ? -5.200 -28.048 -19.030 1.00 19.02 ? 347 LYS A CB 1 ATOM 2663 C CG . LYS A 1 347 ? -4.550 -28.155 -17.646 1.00 20.48 ? 347 LYS A CG 1 ATOM 2664 C CD . LYS A 1 347 ? -4.989 -29.411 -16.926 1.00 22.86 ? 347 LYS A CD 1 ATOM 2665 C CE . LYS A 1 347 ? -4.596 -29.387 -15.451 1.00 25.13 ? 347 LYS A CE 1 ATOM 2666 N NZ . LYS A 1 347 ? -3.239 -28.796 -15.257 1.00 26.83 ? 347 LYS A NZ 1 ATOM 2667 N N . VAL A 1 348 ? -5.740 -25.550 -21.511 1.00 16.92 ? 348 VAL A N 1 ATOM 2668 C CA . VAL A 1 348 ? -6.415 -25.220 -22.771 1.00 17.46 ? 348 VAL A CA 1 ATOM 2669 C C . VAL A 1 348 ? -5.353 -24.965 -23.846 1.00 18.73 ? 348 VAL A C 1 ATOM 2670 O O . VAL A 1 348 ? -4.693 -23.925 -23.863 1.00 18.18 ? 348 VAL A O 1 ATOM 2671 C CB . VAL A 1 348 ? -7.402 -24.024 -22.630 1.00 16.85 ? 348 VAL A CB 1 ATOM 2672 C CG1 . VAL A 1 348 ? -8.050 -23.695 -23.960 1.00 15.91 ? 348 VAL A CG1 1 ATOM 2673 C CG2 . VAL A 1 348 ? -8.473 -24.323 -21.590 1.00 15.74 ? 348 VAL A CG2 1 ATOM 2674 N N . LYS A 1 349 ? -5.215 -25.930 -24.752 1.00 21.43 ? 349 LYS A N 1 ATOM 2675 C CA . LYS A 1 349 ? -4.038 -26.036 -25.601 1.00 23.53 ? 349 LYS A CA 1 ATOM 2676 C C . LYS A 1 349 ? -4.375 -25.975 -27.100 1.00 23.83 ? 349 LYS A C 1 ATOM 2677 O O . LYS A 1 349 ? -3.476 -25.863 -27.939 1.00 21.86 ? 349 LYS A O 1 ATOM 2678 C CB . LYS A 1 349 ? -3.344 -27.364 -25.291 1.00 26.37 ? 349 LYS A CB 1 ATOM 2679 C CG . LYS A 1 349 ? -1.876 -27.244 -24.984 1.00 30.55 ? 349 LYS A CG 1 ATOM 2680 C CD . LYS A 1 349 ? -1.638 -27.103 -23.488 1.00 33.05 ? 349 LYS A CD 1 ATOM 2681 C CE . LYS A 1 349 ? -0.206 -26.666 -23.215 1.00 34.65 ? 349 LYS A CE 1 ATOM 2682 N NZ . LYS A 1 349 ? 0.008 -25.250 -23.644 1.00 33.62 ? 349 LYS A NZ 1 ATOM 2683 N N . ASP A 1 350 ? -5.668 -26.053 -27.418 1.00 21.43 ? 350 ASP A N 1 ATOM 2684 C CA . ASP A 1 350 ? -6.134 -26.210 -28.793 1.00 22.18 ? 350 ASP A CA 1 ATOM 2685 C C . ASP A 1 350 ? -6.325 -24.899 -29.580 1.00 22.16 ? 350 ASP A C 1 ATOM 2686 O O . ASP A 1 350 ? -6.560 -24.929 -30.800 1.00 21.32 ? 350 ASP A O 1 ATOM 2687 C CB . ASP A 1 350 ? -7.414 -27.069 -28.835 1.00 24.26 ? 350 ASP A CB 1 ATOM 2688 C CG . ASP A 1 350 ? -8.557 -26.502 -27.987 1.00 25.28 ? 350 ASP A CG 1 ATOM 2689 O OD1 . ASP A 1 350 ? -8.330 -25.908 -26.913 1.00 26.19 ? 350 ASP A OD1 1 ATOM 2690 O OD2 . ASP A 1 350 ? -9.715 -26.669 -28.399 1.00 30.81 ? 350 ASP A OD2 1 ATOM 2691 N N . ARG A 1 351 ? -6.222 -23.762 -28.888 1.00 19.23 ? 351 ARG A N 1 ATOM 2692 C CA . ARG A 1 351 ? -6.298 -22.452 -29.533 1.00 17.53 ? 351 ARG A CA 1 ATOM 2693 C C . ARG A 1 351 ? -5.532 -21.415 -28.721 1.00 17.24 ? 351 ARG A C 1 ATOM 2694 O O . ARG A 1 351 ? -5.224 -21.653 -27.552 1.00 18.15 ? 351 ARG A O 1 ATOM 2695 C CB . ARG A 1 351 ? -7.766 -22.023 -29.741 1.00 17.31 ? 351 ARG A CB 1 ATOM 2696 C CG . ARG A 1 351 ? -8.481 -21.445 -28.524 1.00 15.78 ? 351 ARG A CG 1 ATOM 2697 C CD . ARG A 1 351 ? -8.941 -22.519 -27.563 1.00 15.62 ? 351 ARG A CD 1 ATOM 2698 N NE . ARG A 1 351 ? -10.067 -22.052 -26.763 1.00 15.25 ? 351 ARG A NE 1 ATOM 2699 C CZ . ARG A 1 351 ? -10.870 -22.831 -26.051 1.00 15.35 ? 351 ARG A CZ 1 ATOM 2700 N NH1 . ARG A 1 351 ? -10.684 -24.149 -26.020 1.00 15.21 ? 351 ARG A NH1 1 ATOM 2701 N NH2 . ARG A 1 351 ? -11.871 -22.285 -25.368 1.00 15.34 ? 351 ARG A NH2 1 ATOM 2702 N N . PHE A 1 352 ? -5.231 -20.273 -29.341 1.00 16.26 ? 352 PHE A N 1 ATOM 2703 C CA . PHE A 1 352 ? -4.531 -19.182 -28.670 1.00 15.10 ? 352 PHE A CA 1 ATOM 2704 C C . PHE A 1 352 ? -5.451 -18.389 -27.731 1.00 14.39 ? 352 PHE A C 1 ATOM 2705 O O . PHE A 1 352 ? -6.559 -18.007 -28.106 1.00 13.97 ? 352 PHE A O 1 ATOM 2706 C CB . PHE A 1 352 ? -3.880 -18.257 -29.709 1.00 15.51 ? 352 PHE A CB 1 ATOM 2707 C CG . PHE A 1 352 ? -3.226 -17.022 -29.116 1.00 15.94 ? 352 PHE A CG 1 ATOM 2708 C CD1 . PHE A 1 352 ? -2.191 -17.130 -28.183 1.00 15.37 ? 352 PHE A CD1 1 ATOM 2709 C CD2 . PHE A 1 352 ? -3.661 -15.744 -29.488 1.00 15.94 ? 352 PHE A CD2 1 ATOM 2710 C CE1 . PHE A 1 352 ? -1.599 -15.984 -27.637 1.00 15.75 ? 352 PHE A CE1 1 ATOM 2711 C CE2 . PHE A 1 352 ? -3.069 -14.590 -28.951 1.00 15.37 ? 352 PHE A CE2 1 ATOM 2712 C CZ . PHE A 1 352 ? -2.038 -14.711 -28.026 1.00 15.45 ? 352 PHE A CZ 1 ATOM 2713 N N . TRP A 1 353 ? -4.987 -18.147 -26.508 1.00 13.39 ? 353 TRP A N 1 ATOM 2714 C CA . TRP A 1 353 ? -5.731 -17.310 -25.568 1.00 12.72 ? 353 TRP A CA 1 ATOM 2715 C C . TRP A 1 353 ? -4.786 -16.408 -24.779 1.00 13.13 ? 353 TRP A C 1 ATOM 2716 O O . TRP A 1 353 ? -3.583 -16.677 -24.701 1.00 12.94 ? 353 TRP A O 1 ATOM 2717 C CB . TRP A 1 353 ? -6.614 -18.154 -24.632 1.00 12.49 ? 353 TRP A CB 1 ATOM 2718 C CG . TRP A 1 353 ? -5.841 -19.073 -23.724 1.00 12.61 ? 353 TRP A CG 1 ATOM 2719 C CD1 . TRP A 1 353 ? -5.594 -20.406 -23.921 1.00 12.93 ? 353 TRP A CD1 1 ATOM 2720 C CD2 . TRP A 1 353 ? -5.203 -18.725 -22.489 1.00 12.61 ? 353 TRP A CD2 1 ATOM 2721 N NE1 . TRP A 1 353 ? -4.848 -20.914 -22.877 1.00 13.02 ? 353 TRP A NE1 1 ATOM 2722 C CE2 . TRP A 1 353 ? -4.583 -19.902 -21.991 1.00 12.86 ? 353 TRP A CE2 1 ATOM 2723 C CE3 . TRP A 1 353 ? -5.086 -17.535 -21.757 1.00 12.52 ? 353 TRP A CE3 1 ATOM 2724 C CZ2 . TRP A 1 353 ? -3.854 -19.921 -20.793 1.00 12.37 ? 353 TRP A CZ2 1 ATOM 2725 C CZ3 . TRP A 1 353 ? -4.365 -17.552 -20.570 1.00 13.05 ? 353 TRP A CZ3 1 ATOM 2726 C CH2 . TRP A 1 353 ? -3.751 -18.744 -20.101 1.00 12.67 ? 353 TRP A CH2 1 ATOM 2727 N N . PHE A 1 354 ? -5.328 -15.333 -24.198 1.00 13.75 ? 354 PHE A N 1 ATOM 2728 C CA . PHE A 1 354 ? -4.561 -14.483 -23.287 1.00 13.03 ? 354 PHE A CA 1 ATOM 2729 C C . PHE A 1 354 ? -5.432 -13.792 -22.251 1.00 12.94 ? 354 PHE A C 1 ATOM 2730 O O . PHE A 1 354 ? -6.666 -13.726 -22.393 1.00 12.43 ? 354 PHE A O 1 ATOM 2731 C CB . PHE A 1 354 ? -3.670 -13.474 -24.045 1.00 13.89 ? 354 PHE A CB 1 ATOM 2732 C CG . PHE A 1 354 ? -4.415 -12.309 -24.681 1.00 14.30 ? 354 PHE A CG 1 ATOM 2733 C CD1 . PHE A 1 354 ? -4.943 -11.274 -23.897 1.00 13.99 ? 354 PHE A CD1 1 ATOM 2734 C CD2 . PHE A 1 354 ? -4.525 -12.216 -26.077 1.00 14.55 ? 354 PHE A CD2 1 ATOM 2735 C CE1 . PHE A 1 354 ? -5.618 -10.186 -24.494 1.00 14.46 ? 354 PHE A CE1 1 ATOM 2736 C CE2 . PHE A 1 354 ? -5.183 -11.138 -26.686 1.00 14.11 ? 354 PHE A CE2 1 ATOM 2737 C CZ . PHE A 1 354 ? -5.736 -10.118 -25.896 1.00 14.00 ? 354 PHE A CZ 1 ATOM 2738 N N . TYR A 1 355 ? -4.781 -13.327 -21.187 1.00 12.07 ? 355 TYR A N 1 ATOM 2739 C CA . TYR A 1 355 ? -5.369 -12.340 -20.303 1.00 12.05 ? 355 TYR A CA 1 ATOM 2740 C C . TYR A 1 355 ? -4.392 -11.189 -20.213 1.00 11.89 ? 355 TYR A C 1 ATOM 2741 O O . TYR A 1 355 ? -3.181 -11.362 -20.430 1.00 11.69 ? 355 TYR A O 1 ATOM 2742 C CB . TYR A 1 355 ? -5.662 -12.898 -18.903 1.00 12.37 ? 355 TYR A CB 1 ATOM 2743 C CG . TYR A 1 355 ? -4.430 -13.228 -18.074 1.00 12.52 ? 355 TYR A CG 1 ATOM 2744 C CD1 . TYR A 1 355 ? -3.777 -12.244 -17.325 1.00 13.00 ? 355 TYR A CD1 1 ATOM 2745 C CD2 . TYR A 1 355 ? -3.918 -14.541 -18.031 1.00 12.92 ? 355 TYR A CD2 1 ATOM 2746 C CE1 . TYR A 1 355 ? -2.626 -12.556 -16.551 1.00 13.72 ? 355 TYR A CE1 1 ATOM 2747 C CE2 . TYR A 1 355 ? -2.777 -14.867 -17.265 1.00 12.88 ? 355 TYR A CE2 1 ATOM 2748 C CZ . TYR A 1 355 ? -2.140 -13.870 -16.533 1.00 13.69 ? 355 TYR A CZ 1 ATOM 2749 O OH . TYR A 1 355 ? -1.024 -14.175 -15.789 1.00 14.42 ? 355 TYR A OH 1 ATOM 2750 N N . GLN A 1 356 ? -4.926 -10.014 -19.898 1.00 11.45 ? 356 GLN A N 1 ATOM 2751 C CA . GLN A 1 356 ? -4.112 -8.849 -19.578 1.00 10.67 ? 356 GLN A CA 1 ATOM 2752 C C . GLN A 1 356 ? -4.712 -8.212 -18.372 1.00 10.71 ? 356 GLN A C 1 ATOM 2753 O O . GLN A 1 356 ? -5.911 -7.911 -18.362 1.00 10.39 ? 356 GLN A O 1 ATOM 2754 C CB . GLN A 1 356 ? -4.114 -7.837 -20.710 1.00 10.20 ? 356 GLN A CB 1 ATOM 2755 C CG . GLN A 1 356 ? -3.386 -8.288 -21.944 1.00 10.09 ? 356 GLN A CG 1 ATOM 2756 C CD . GLN A 1 356 ? -3.710 -7.440 -23.141 1.00 9.86 ? 356 GLN A CD 1 ATOM 2757 O OE1 . GLN A 1 356 ? -2.912 -7.327 -24.059 1.00 9.69 ? 356 GLN A OE1 1 ATOM 2758 N NE2 . GLN A 1 356 ? -4.884 -6.824 -23.135 1.00 10.24 ? 356 GLN A NE2 1 ATOM 2759 N N . LEU A 1 357 ? -3.886 -8.022 -17.346 1.00 11.09 ? 357 LEU A N 1 ATOM 2760 C CA . LEU A 1 357 ? -4.291 -7.246 -16.168 1.00 11.37 ? 357 LEU A CA 1 ATOM 2761 C C . LEU A 1 357 ? -3.648 -5.854 -16.278 1.00 11.93 ? 357 LEU A C 1 ATOM 2762 O O . LEU A 1 357 ? -2.450 -5.676 -15.966 1.00 11.54 ? 357 LEU A O 1 ATOM 2763 C CB . LEU A 1 357 ? -3.896 -7.960 -14.872 1.00 10.99 ? 357 LEU A CB 1 ATOM 2764 C CG . LEU A 1 357 ? -4.131 -9.478 -14.787 1.00 11.75 ? 357 LEU A CG 1 ATOM 2765 C CD1 . LEU A 1 357 ? -3.308 -10.085 -13.667 1.00 11.61 ? 357 LEU A CD1 1 ATOM 2766 C CD2 . LEU A 1 357 ? -5.620 -9.873 -14.613 1.00 11.82 ? 357 LEU A CD2 1 ATOM 2767 N N . ASP A 1 358 ? -4.430 -4.892 -16.776 1.00 11.92 ? 358 ASP A N 1 ATOM 2768 C CA . ASP A 1 358 ? -3.947 -3.520 -16.950 1.00 11.85 ? 358 ASP A CA 1 ATOM 2769 C C . ASP A 1 358 ? -3.998 -2.714 -15.649 1.00 11.12 ? 358 ASP A C 1 ATOM 2770 O O . ASP A 1 358 ? -5.017 -2.708 -14.943 1.00 9.76 ? 358 ASP A O 1 ATOM 2771 C CB . ASP A 1 358 ? -4.777 -2.774 -17.999 1.00 12.79 ? 358 ASP A CB 1 ATOM 2772 C CG . ASP A 1 358 ? -4.499 -3.230 -19.420 1.00 13.65 ? 358 ASP A CG 1 ATOM 2773 O OD1 . ASP A 1 358 ? -3.321 -3.348 -19.807 1.00 14.13 ? 358 ASP A OD1 1 ATOM 2774 O OD2 . ASP A 1 358 ? -5.481 -3.440 -20.169 1.00 14.52 ? 358 ASP A OD2 1 ATOM 2775 N N . VAL A 1 359 ? -2.900 -2.011 -15.370 1.00 10.43 ? 359 VAL A N 1 ATOM 2776 C CA . VAL A 1 359 ? -2.843 -1.040 -14.279 1.00 9.93 ? 359 VAL A CA 1 ATOM 2777 C C . VAL A 1 359 ? -3.541 0.247 -14.745 1.00 9.54 ? 359 VAL A C 1 ATOM 2778 O O . VAL A 1 359 ? -2.934 1.157 -15.322 1.00 9.18 ? 359 VAL A O 1 ATOM 2779 C CB . VAL A 1 359 ? -1.387 -0.830 -13.767 1.00 9.92 ? 359 VAL A CB 1 ATOM 2780 C CG1 . VAL A 1 359 ? -1.329 0.170 -12.619 1.00 9.56 ? 359 VAL A CG1 1 ATOM 2781 C CG2 . VAL A 1 359 ? -0.794 -2.167 -13.319 1.00 10.00 ? 359 VAL A CG2 1 ATOM 2782 N N . HIS A 1 360 ? -4.845 0.278 -14.499 1.00 9.63 ? 360 HIS A N 1 ATOM 2783 C CA . HIS A 1 360 ? -5.755 1.287 -15.046 1.00 9.95 ? 360 HIS A CA 1 ATOM 2784 C C . HIS A 1 360 ? -5.991 2.422 -14.042 1.00 10.22 ? 360 HIS A C 1 ATOM 2785 O O . HIS A 1 360 ? -6.012 3.588 -14.407 1.00 9.71 ? 360 HIS A O 1 ATOM 2786 C CB . HIS A 1 360 ? -7.047 0.568 -15.442 1.00 9.94 ? 360 HIS A CB 1 ATOM 2787 C CG . HIS A 1 360 ? -8.220 1.461 -15.737 1.00 10.08 ? 360 HIS A CG 1 ATOM 2788 N ND1 . HIS A 1 360 ? -9.052 1.951 -14.750 1.00 9.58 ? 360 HIS A ND1 1 ATOM 2789 C CD2 . HIS A 1 360 ? -8.751 1.873 -16.915 1.00 9.77 ? 360 HIS A CD2 1 ATOM 2790 C CE1 . HIS A 1 360 ? -10.017 2.662 -15.305 1.00 9.55 ? 360 HIS A CE1 1 ATOM 2791 N NE2 . HIS A 1 360 ? -9.862 2.626 -16.617 1.00 9.70 ? 360 HIS A NE2 1 ATOM 2792 N N . GLY A 1 361 ? -6.156 2.061 -12.771 1.00 11.09 ? 361 GLY A N 1 ATOM 2793 C CA . GLY A 1 361 ? -6.339 3.030 -11.708 1.00 12.21 ? 361 GLY A CA 1 ATOM 2794 C C . GLY A 1 361 ? -5.147 3.119 -10.778 1.00 13.63 ? 361 GLY A C 1 ATOM 2795 O O . GLY A 1 361 ? -4.010 2.854 -11.179 1.00 14.77 ? 361 GLY A O 1 ATOM 2796 N N . GLY A 1 362 ? -5.399 3.496 -9.531 1.00 14.52 ? 362 GLY A N 1 ATOM 2797 C CA . GLY A 1 362 ? -4.323 3.668 -8.569 1.00 16.05 ? 362 GLY A CA 1 ATOM 2798 C C . GLY A 1 362 ? -3.992 5.128 -8.362 1.00 16.99 ? 362 GLY A C 1 ATOM 2799 O O . GLY A 1 362 ? -4.390 5.984 -9.158 1.00 16.55 ? 362 GLY A O 1 ATOM 2800 N N . LYS A 1 363 ? -3.249 5.400 -7.293 1.00 17.97 ? 363 LYS A N 1 ATOM 2801 C CA . LYS A 1 363 ? -3.049 6.756 -6.793 1.00 18.73 ? 363 LYS A CA 1 ATOM 2802 C C . LYS A 1 363 ? -2.515 7.758 -7.835 1.00 18.41 ? 363 LYS A C 1 ATOM 2803 O O . LYS A 1 363 ? -3.016 8.881 -7.940 1.00 18.28 ? 363 LYS A O 1 ATOM 2804 C CB . LYS A 1 363 ? -2.146 6.721 -5.561 1.00 20.60 ? 363 LYS A CB 1 ATOM 2805 C CG . LYS A 1 363 ? -2.076 8.034 -4.813 1.00 23.12 ? 363 LYS A CG 1 ATOM 2806 C CD . LYS A 1 363 ? -0.916 8.048 -3.846 1.00 26.31 ? 363 LYS A CD 1 ATOM 2807 C CE . LYS A 1 363 ? -0.107 9.335 -3.995 1.00 28.52 ? 363 LYS A CE 1 ATOM 2808 N NZ . LYS A 1 363 ? 1.198 9.191 -3.286 1.00 30.83 ? 363 LYS A NZ 1 ATOM 2809 N N . ASN A 1 364 ? -1.511 7.353 -8.604 1.00 17.62 ? 364 ASN A N 1 ATOM 2810 C CA . ASN A 1 364 ? -0.862 8.280 -9.529 1.00 17.11 ? 364 ASN A CA 1 ATOM 2811 C C . ASN A 1 364 ? -1.260 8.108 -10.999 1.00 17.06 ? 364 ASN A C 1 ATOM 2812 O O . ASN A 1 364 ? -0.597 8.623 -11.907 1.00 18.28 ? 364 ASN A O 1 ATOM 2813 C CB . ASN A 1 364 ? 0.659 8.243 -9.342 1.00 17.22 ? 364 ASN A CB 1 ATOM 2814 C CG . ASN A 1 364 ? 1.082 8.479 -7.885 1.00 17.36 ? 364 ASN A CG 1 ATOM 2815 O OD1 . ASN A 1 364 ? 0.719 9.483 -7.270 1.00 17.94 ? 364 ASN A OD1 1 ATOM 2816 N ND2 . ASN A 1 364 ? 1.844 7.546 -7.336 1.00 16.71 ? 364 ASN A ND2 1 ATOM 2817 N N . SER A 1 365 ? -2.352 7.385 -11.225 1.00 16.33 ? 365 SER A N 1 ATOM 2818 C CA . SER A 1 365 ? -2.871 7.180 -12.565 1.00 15.86 ? 365 SER A CA 1 ATOM 2819 C C . SER A 1 365 ? -3.621 8.433 -13.030 1.00 15.55 ? 365 SER A C 1 ATOM 2820 O O . SER A 1 365 ? -4.503 8.942 -12.319 1.00 14.25 ? 365 SER A O 1 ATOM 2821 C CB . SER A 1 365 ? -3.782 5.943 -12.595 1.00 15.79 ? 365 SER A CB 1 ATOM 2822 O OG . SER A 1 365 ? -4.321 5.710 -13.887 1.00 15.41 ? 365 SER A OG 1 ATOM 2823 N N . GLN A 1 366 ? -3.269 8.934 -14.218 1.00 15.10 ? 366 GLN A N 1 ATOM 2824 C CA . GLN A 1 366 ? -3.992 10.074 -14.782 1.00 15.43 ? 366 GLN A CA 1 ATOM 2825 C C . GLN A 1 366 ? -5.440 9.749 -15.087 1.00 15.02 ? 366 GLN A C 1 ATOM 2826 O O . GLN A 1 366 ? -6.292 10.642 -15.061 1.00 14.73 ? 366 GLN A O 1 ATOM 2827 C CB . GLN A 1 366 ? -3.316 10.626 -16.023 1.00 16.21 ? 366 GLN A CB 1 ATOM 2828 C CG . GLN A 1 366 ? -2.339 11.719 -15.722 1.00 18.83 ? 366 GLN A CG 1 ATOM 2829 C CD . GLN A 1 366 ? -2.931 12.819 -14.857 1.00 19.03 ? 366 GLN A CD 1 ATOM 2830 O OE1 . GLN A 1 366 ? -2.546 12.978 -13.695 1.00 20.88 ? 366 GLN A OE1 1 ATOM 2831 N NE2 . GLN A 1 366 ? -3.875 13.566 -15.410 1.00 17.66 ? 366 GLN A NE2 1 ATOM 2832 N N . VAL A 1 367 ? -5.710 8.473 -15.364 1.00 14.04 ? 367 VAL A N 1 ATOM 2833 C CA . VAL A 1 367 ? -7.062 8.005 -15.642 1.00 14.65 ? 367 VAL A CA 1 ATOM 2834 C C . VAL A 1 367 ? -7.979 8.368 -14.478 1.00 15.35 ? 367 VAL A C 1 ATOM 2835 O O . VAL A 1 367 ? -9.133 8.729 -14.679 1.00 15.21 ? 367 VAL A O 1 ATOM 2836 C CB . VAL A 1 367 ? -7.083 6.467 -15.920 1.00 13.69 ? 367 VAL A CB 1 ATOM 2837 C CG1 . VAL A 1 367 ? -8.521 5.910 -15.976 1.00 12.17 ? 367 VAL A CG1 1 ATOM 2838 C CG2 . VAL A 1 367 ? -6.304 6.155 -17.204 1.00 13.09 ? 367 VAL A CG2 1 ATOM 2839 N N . THR A 1 368 ? -7.422 8.313 -13.271 1.00 16.87 ? 368 THR A N 1 ATOM 2840 C CA . THR A 1 368 ? -8.190 8.423 -12.028 1.00 19.02 ? 368 THR A CA 1 ATOM 2841 C C . THR A 1 368 ? -8.352 9.856 -11.524 1.00 19.98 ? 368 THR A C 1 ATOM 2842 O O . THR A 1 368 ? -9.038 10.078 -10.531 1.00 21.15 ? 368 THR A O 1 ATOM 2843 C CB . THR A 1 368 ? -7.585 7.553 -10.892 1.00 19.01 ? 368 THR A CB 1 ATOM 2844 O OG1 . THR A 1 368 ? -6.290 8.055 -10.532 1.00 20.53 ? 368 THR A OG1 1 ATOM 2845 C CG2 . THR A 1 368 ? -7.466 6.106 -11.320 1.00 17.61 ? 368 THR A CG2 1 ATOM 2846 N N . LYS A 1 369 ? -7.747 10.818 -12.226 1.00 21.10 ? 369 LYS A N 1 ATOM 2847 C CA . LYS A 1 369 ? -7.867 12.251 -11.891 1.00 21.15 ? 369 LYS A CA 1 ATOM 2848 C C . LYS A 1 369 ? -9.180 12.877 -12.380 1.00 21.25 ? 369 LYS A C 1 ATOM 2849 O O . LYS A 1 369 ? -9.475 14.034 -12.086 1.00 23.69 ? 369 LYS A O 1 ATOM 2850 C CB . LYS A 1 369 ? -6.660 13.038 -12.434 1.00 20.56 ? 369 LYS A CB 1 ATOM 2851 C CG . LYS A 1 369 ? -5.296 12.571 -11.881 1.00 21.22 ? 369 LYS A CG 1 ATOM 2852 C CD . LYS A 1 369 ? -5.297 12.449 -10.350 1.00 21.15 ? 369 LYS A CD 1 ATOM 2853 C CE . LYS A 1 369 ? -4.050 11.741 -9.848 1.00 22.69 ? 369 LYS A CE 1 ATOM 2854 N NZ . LYS A 1 369 ? -4.150 11.402 -8.408 1.00 24.07 ? 369 LYS A NZ 1 ATOM 2855 N N . VAL A 1 370 ? -9.947 12.103 -13.143 1.00 19.94 ? 370 VAL A N 1 ATOM 2856 C CA . VAL A 1 370 ? -11.279 12.480 -13.593 1.00 18.14 ? 370 VAL A CA 1 ATOM 2857 C C . VAL A 1 370 ? -12.230 11.588 -12.801 1.00 17.58 ? 370 VAL A C 1 ATOM 2858 O O . VAL A 1 370 ? -11.949 10.404 -12.639 1.00 17.97 ? 370 VAL A O 1 ATOM 2859 C CB . VAL A 1 370 ? -11.435 12.197 -15.119 1.00 17.23 ? 370 VAL A CB 1 ATOM 2860 C CG1 . VAL A 1 370 ? -12.800 12.601 -15.628 1.00 15.69 ? 370 VAL A CG1 1 ATOM 2861 C CG2 . VAL A 1 370 ? -10.321 12.872 -15.918 1.00 16.44 ? 370 VAL A CG2 1 ATOM 2862 N N . THR A 1 371 ? -13.336 12.136 -12.297 1.00 16.73 ? 371 THR A N 1 ATOM 2863 C CA . THR A 1 371 ? -14.322 11.323 -11.564 1.00 16.28 ? 371 THR A CA 1 ATOM 2864 C C . THR A 1 371 ? -15.325 10.629 -12.491 1.00 15.85 ? 371 THR A C 1 ATOM 2865 O O . THR A 1 371 ? -15.416 10.963 -13.669 1.00 15.62 ? 371 THR A O 1 ATOM 2866 C CB . THR A 1 371 ? -15.104 12.155 -10.528 1.00 16.36 ? 371 THR A CB 1 ATOM 2867 O OG1 . THR A 1 371 ? -16.226 12.788 -11.161 1.00 16.96 ? 371 THR A OG1 1 ATOM 2868 C CG2 . THR A 1 371 ? -14.199 13.188 -9.858 1.00 15.18 ? 371 THR A CG2 1 ATOM 2869 N N . ASN A 1 372 ? -16.073 9.667 -11.952 1.00 16.06 ? 372 ASN A N 1 ATOM 2870 C CA . ASN A 1 372 ? -17.151 9.012 -12.694 1.00 16.34 ? 372 ASN A CA 1 ATOM 2871 C C . ASN A 1 372 ? -18.258 9.990 -13.067 1.00 16.06 ? 372 ASN A C 1 ATOM 2872 O O . ASN A 1 372 ? -18.993 9.780 -14.031 1.00 16.66 ? 372 ASN A O 1 ATOM 2873 C CB . ASN A 1 372 ? -17.746 7.834 -11.902 1.00 16.42 ? 372 ASN A CB 1 ATOM 2874 C CG . ASN A 1 372 ? -16.941 6.531 -12.065 1.00 17.81 ? 372 ASN A CG 1 ATOM 2875 O OD1 . ASN A 1 372 ? -16.034 6.427 -12.912 1.00 16.46 ? 372 ASN A OD1 1 ATOM 2876 N ND2 . ASN A 1 372 ? -17.277 5.527 -11.244 1.00 17.38 ? 372 ASN A ND2 1 ATOM 2877 N N . ALA A 1 373 ? -18.365 11.067 -12.304 1.00 16.43 ? 373 ALA A N 1 ATOM 2878 C CA . ALA A 1 373 ? -19.415 12.048 -12.522 1.00 16.19 ? 373 ALA A CA 1 ATOM 2879 C C . ALA A 1 373 ? -19.085 12.981 -13.690 1.00 15.90 ? 373 ALA A C 1 ATOM 2880 O O . ALA A 1 373 ? -19.992 13.530 -14.303 1.00 16.83 ? 373 ALA A O 1 ATOM 2881 C CB . ALA A 1 373 ? -19.677 12.845 -11.235 1.00 15.03 ? 373 ALA A CB 1 ATOM 2882 N N . GLU A 1 374 ? -17.800 13.144 -14.006 1.00 15.22 ? 374 GLU A N 1 ATOM 2883 C CA . GLU A 1 374 ? -17.366 14.140 -15.007 1.00 15.62 ? 374 GLU A CA 1 ATOM 2884 C C . GLU A 1 374 ? -17.539 13.794 -16.499 1.00 14.04 ? 374 GLU A C 1 ATOM 2885 O O . GLU A 1 374 ? -17.517 14.684 -17.346 1.00 13.75 ? 374 GLU A O 1 ATOM 2886 C CB . GLU A 1 374 ? -15.914 14.555 -14.766 1.00 17.30 ? 374 GLU A CB 1 ATOM 2887 C CG . GLU A 1 374 ? -15.672 15.237 -13.437 1.00 20.20 ? 374 GLU A CG 1 ATOM 2888 C CD . GLU A 1 374 ? -14.205 15.564 -13.245 1.00 22.43 ? 374 GLU A CD 1 ATOM 2889 O OE1 . GLU A 1 374 ? -13.518 14.857 -12.490 1.00 22.54 ? 374 GLU A OE1 1 ATOM 2890 O OE2 . GLU A 1 374 ? -13.731 16.519 -13.887 1.00 26.76 ? 374 GLU A OE2 1 ATOM 2891 N N . THR A 1 375 ? -17.658 12.511 -16.822 1.00 12.71 ? 375 THR A N 1 ATOM 2892 C CA . THR A 1 375 ? -17.847 12.064 -18.204 1.00 12.07 ? 375 THR A CA 1 ATOM 2893 C C . THR A 1 375 ? -18.645 10.765 -18.116 1.00 11.63 ? 375 THR A C 1 ATOM 2894 O O . THR A 1 375 ? -18.807 10.215 -17.024 1.00 11.98 ? 375 THR A O 1 ATOM 2895 C CB . THR A 1 375 ? -16.510 11.723 -18.944 1.00 11.73 ? 375 THR A CB 1 ATOM 2896 O OG1 . THR A 1 375 ? -16.002 10.484 -18.440 1.00 11.99 ? 375 THR A OG1 1 ATOM 2897 C CG2 . THR A 1 375 ? -15.444 12.805 -18.813 1.00 11.49 ? 375 THR A CG2 1 ATOM 2898 N N . ALA A 1 376 ? -19.101 10.259 -19.259 1.00 10.83 ? 376 ALA A N 1 ATOM 2899 C CA . ALA A 1 376 ? -19.786 8.970 -19.321 1.00 10.38 ? 376 ALA A CA 1 ATOM 2900 C C . ALA A 1 376 ? -18.965 7.779 -18.766 1.00 10.19 ? 376 ALA A C 1 ATOM 2901 O O . ALA A 1 376 ? -19.545 6.857 -18.167 1.00 9.48 ? 376 ALA A O 1 ATOM 2902 C CB . ALA A 1 376 ? -20.214 8.687 -20.744 1.00 10.54 ? 376 ALA A CB 1 ATOM 2903 N N . TYR A 1 377 ? -17.636 7.800 -18.970 1.00 9.36 ? 377 TYR A N 1 ATOM 2904 C CA . TYR A 1 377 ? -16.771 6.704 -18.544 1.00 9.08 ? 377 TYR A CA 1 ATOM 2905 C C . TYR A 1 377 ? -16.992 6.388 -17.069 1.00 9.23 ? 377 TYR A C 1 ATOM 2906 O O . TYR A 1 377 ? -16.854 7.272 -16.220 1.00 9.47 ? 377 TYR A O 1 ATOM 2907 C CB . TYR A 1 377 ? -15.300 7.033 -18.803 1.00 8.79 ? 377 TYR A CB 1 ATOM 2908 C CG . TYR A 1 377 ? -14.364 5.857 -18.698 1.00 8.43 ? 377 TYR A CG 1 ATOM 2909 C CD1 . TYR A 1 377 ? -14.247 4.940 -19.748 1.00 8.41 ? 377 TYR A CD1 1 ATOM 2910 C CD2 . TYR A 1 377 ? -13.571 5.666 -17.560 1.00 8.45 ? 377 TYR A CD2 1 ATOM 2911 C CE1 . TYR A 1 377 ? -13.377 3.868 -19.680 1.00 8.06 ? 377 TYR A CE1 1 ATOM 2912 C CE2 . TYR A 1 377 ? -12.686 4.586 -17.475 1.00 8.25 ? 377 TYR A CE2 1 ATOM 2913 C CZ . TYR A 1 377 ? -12.600 3.691 -18.543 1.00 8.22 ? 377 TYR A CZ 1 ATOM 2914 O OH . TYR A 1 377 ? -11.739 2.622 -18.484 1.00 8.06 ? 377 TYR A OH 1 ATOM 2915 N N . PRO A 1 378 ? -17.356 5.133 -16.765 1.00 9.24 ? 378 PRO A N 1 ATOM 2916 C CA . PRO A 1 378 ? -17.774 4.764 -15.422 1.00 9.42 ? 378 PRO A CA 1 ATOM 2917 C C . PRO A 1 378 ? -16.760 4.003 -14.569 1.00 9.63 ? 378 PRO A C 1 ATOM 2918 O O . PRO A 1 378 ? -17.142 3.485 -13.519 1.00 9.83 ? 378 PRO A O 1 ATOM 2919 C CB . PRO A 1 378 ? -18.942 3.819 -15.709 1.00 9.63 ? 378 PRO A CB 1 ATOM 2920 C CG . PRO A 1 378 ? -18.486 3.080 -16.920 1.00 9.24 ? 378 PRO A CG 1 ATOM 2921 C CD . PRO A 1 378 ? -17.741 4.098 -17.748 1.00 9.26 ? 378 PRO A CD 1 ATOM 2922 N N . HIS A 1 379 ? -15.498 3.920 -14.995 1.00 9.53 ? 379 HIS A N 1 ATOM 2923 C CA . HIS A 1 379 ? -14.536 3.012 -14.349 1.00 9.10 ? 379 HIS A CA 1 ATOM 2924 C C . HIS A 1 379 ? -13.409 3.757 -13.666 1.00 9.47 ? 379 HIS A C 1 ATOM 2925 O O . HIS A 1 379 ? -12.294 3.233 -13.547 1.00 9.51 ? 379 HIS A O 1 ATOM 2926 C CB . HIS A 1 379 ? -13.916 2.059 -15.371 1.00 8.57 ? 379 HIS A CB 1 ATOM 2927 C CG . HIS A 1 379 ? -14.908 1.364 -16.236 1.00 8.49 ? 379 HIS A CG 1 ATOM 2928 N ND1 . HIS A 1 379 ? -15.759 0.392 -15.757 1.00 8.50 ? 379 HIS A ND1 1 ATOM 2929 C CD2 . HIS A 1 379 ? -15.189 1.499 -17.553 1.00 8.31 ? 379 HIS A CD2 1 ATOM 2930 C CE1 . HIS A 1 379 ? -16.520 -0.046 -16.745 1.00 8.59 ? 379 HIS A CE1 1 ATOM 2931 N NE2 . HIS A 1 379 ? -16.190 0.606 -17.846 1.00 8.60 ? 379 HIS A NE2 1 ATOM 2932 N N . ARG A 1 380 ? -13.674 4.986 -13.241 1.00 9.90 ? 380 ARG A N 1 ATOM 2933 C CA . ARG A 1 380 ? -12.600 5.826 -12.700 1.00 10.28 ? 380 ARG A CA 1 ATOM 2934 C C . ARG A 1 380 ? -12.194 5.342 -11.306 1.00 10.60 ? 380 ARG A C 1 ATOM 2935 O O . ARG A 1 380 ? -11.110 5.681 -10.815 1.00 10.51 ? 380 ARG A O 1 ATOM 2936 C CB . ARG A 1 380 ? -12.990 7.314 -12.675 1.00 9.57 ? 380 ARG A CB 1 ATOM 2937 C CG . ARG A 1 380 ? -13.524 7.854 -13.989 1.00 9.35 ? 380 ARG A CG 1 ATOM 2938 C CD . ARG A 1 380 ? -12.454 8.146 -15.019 1.00 9.29 ? 380 ARG A CD 1 ATOM 2939 N NE . ARG A 1 380 ? -13.018 8.874 -16.157 1.00 9.31 ? 380 ARG A NE 1 ATOM 2940 C CZ . ARG A 1 380 ? -12.321 9.301 -17.211 1.00 9.23 ? 380 ARG A CZ 1 ATOM 2941 N NH1 . ARG A 1 380 ? -11.002 9.088 -17.291 1.00 8.89 ? 380 ARG A NH1 1 ATOM 2942 N NH2 . ARG A 1 380 ? -12.950 9.942 -18.194 1.00 8.65 ? 380 ARG A NH2 1 ATOM 2943 N N . ASP A 1 381 ? -13.066 4.530 -10.702 1.00 11.15 ? 381 ASP A N 1 ATOM 2944 C CA . ASP A 1 381 ? -12.840 3.988 -9.359 1.00 11.65 ? 381 ASP A CA 1 ATOM 2945 C C . ASP A 1 381 ? -12.316 2.551 -9.395 1.00 11.67 ? 381 ASP A C 1 ATOM 2946 O O . ASP A 1 381 ? -12.370 1.844 -8.388 1.00 12.49 ? 381 ASP A O 1 ATOM 2947 C CB . ASP A 1 381 ? -14.110 4.101 -8.507 1.00 11.78 ? 381 ASP A CB 1 ATOM 2948 C CG . ASP A 1 381 ? -15.333 3.399 -9.136 1.00 12.67 ? 381 ASP A CG 1 ATOM 2949 O OD1 . ASP A 1 381 ? -15.298 2.967 -10.315 1.00 13.87 ? 381 ASP A OD1 1 ATOM 2950 O OD2 . ASP A 1 381 ? -16.351 3.271 -8.434 1.00 12.51 ? 381 ASP A OD2 1 ATOM 2951 N N . LYS A 1 382 ? -11.802 2.134 -10.549 1.00 10.97 ? 382 LYS A N 1 ATOM 2952 C CA . LYS A 1 382 ? -11.353 0.749 -10.758 1.00 10.75 ? 382 LYS A CA 1 ATOM 2953 C C . LYS A 1 382 ? -9.843 0.715 -11.023 1.00 10.39 ? 382 LYS A C 1 ATOM 2954 O O . LYS A 1 382 ? -9.362 1.420 -11.908 1.00 10.26 ? 382 LYS A O 1 ATOM 2955 C CB . LYS A 1 382 ? -12.113 0.097 -11.932 1.00 10.62 ? 382 LYS A CB 1 ATOM 2956 C CG . LYS A 1 382 ? -13.655 0.195 -11.888 1.00 10.11 ? 382 LYS A CG 1 ATOM 2957 C CD . LYS A 1 382 ? -14.255 -0.633 -10.753 1.00 10.32 ? 382 LYS A CD 1 ATOM 2958 C CE . LYS A 1 382 ? -15.782 -0.788 -10.840 1.00 9.90 ? 382 LYS A CE 1 ATOM 2959 N NZ . LYS A 1 382 ? -16.481 0.511 -10.861 1.00 10.06 ? 382 LYS A NZ 1 ATOM 2960 N N . LEU A 1 383 ? -9.109 -0.093 -10.251 1.00 9.96 ? 383 LEU A N 1 ATOM 2961 C CA . LEU A 1 383 ? -7.646 -0.211 -10.384 1.00 9.72 ? 383 LEU A CA 1 ATOM 2962 C C . LEU A 1 383 ? -7.246 -1.067 -11.584 1.00 10.01 ? 383 LEU A C 1 ATOM 2963 O O . LEU A 1 383 ? -6.319 -0.710 -12.319 1.00 10.85 ? 383 LEU A O 1 ATOM 2964 C CB . LEU A 1 383 ? -6.991 -0.770 -9.108 1.00 9.23 ? 383 LEU A CB 1 ATOM 2965 C CG . LEU A 1 383 ? -5.455 -0.701 -9.037 1.00 9.15 ? 383 LEU A CG 1 ATOM 2966 C CD1 . LEU A 1 383 ? -4.991 -0.231 -7.675 1.00 9.18 ? 383 LEU A CD1 1 ATOM 2967 C CD2 . LEU A 1 383 ? -4.771 -2.017 -9.386 1.00 9.26 ? 383 LEU A CD2 1 ATOM 2968 N N . TRP A 1 384 ? -7.942 -2.190 -11.759 1.00 9.56 ? 384 TRP A N 1 ATOM 2969 C CA . TRP A 1 384 ? -7.656 -3.154 -12.803 1.00 9.51 ? 384 TRP A CA 1 ATOM 2970 C C . TRP A 1 384 ? -8.609 -3.051 -13.998 1.00 9.43 ? 384 TRP A C 1 ATOM 2971 O O . TRP A 1 384 ? -9.838 -2.988 -13.833 1.00 10.00 ? 384 TRP A O 1 ATOM 2972 C CB . TRP A 1 384 ? -7.765 -4.579 -12.254 1.00 9.58 ? 384 TRP A CB 1 ATOM 2973 C CG . TRP A 1 384 ? -6.746 -4.977 -11.216 1.00 9.73 ? 384 TRP A CG 1 ATOM 2974 C CD1 . TRP A 1 384 ? -6.982 -5.210 -9.890 1.00 9.68 ? 384 TRP A CD1 1 ATOM 2975 C CD2 . TRP A 1 384 ? -5.351 -5.230 -11.421 1.00 9.60 ? 384 TRP A CD2 1 ATOM 2976 N NE1 . TRP A 1 384 ? -5.827 -5.585 -9.256 1.00 9.63 ? 384 TRP A NE1 1 ATOM 2977 C CE2 . TRP A 1 384 ? -4.806 -5.604 -10.166 1.00 9.62 ? 384 TRP A CE2 1 ATOM 2978 C CE3 . TRP A 1 384 ? -4.504 -5.164 -12.534 1.00 9.50 ? 384 TRP A CE3 1 ATOM 2979 C CZ2 . TRP A 1 384 ? -3.452 -5.916 -9.992 1.00 9.26 ? 384 TRP A CZ2 1 ATOM 2980 C CZ3 . TRP A 1 384 ? -3.150 -5.470 -12.360 1.00 9.47 ? 384 TRP A CZ3 1 ATOM 2981 C CH2 . TRP A 1 384 ? -2.645 -5.842 -11.093 1.00 9.61 ? 384 TRP A CH2 1 ATOM 2982 N N . LEU A 1 385 ? -8.029 -3.035 -15.194 1.00 9.12 ? 385 LEU A N 1 ATOM 2983 C CA . LEU A 1 385 ? -8.742 -3.350 -16.439 1.00 8.93 ? 385 LEU A CA 1 ATOM 2984 C C . LEU A 1 385 ? -8.237 -4.706 -16.892 1.00 8.69 ? 385 LEU A C 1 ATOM 2985 O O . LEU A 1 385 ? -7.028 -4.913 -17.051 1.00 9.04 ? 385 LEU A O 1 ATOM 2986 C CB . LEU A 1 385 ? -8.493 -2.290 -17.532 1.00 8.69 ? 385 LEU A CB 1 ATOM 2987 C CG . LEU A 1 385 ? -8.936 -2.562 -18.983 1.00 8.57 ? 385 LEU A CG 1 ATOM 2988 C CD1 . LEU A 1 385 ? -10.433 -2.899 -19.088 1.00 8.61 ? 385 LEU A CD1 1 ATOM 2989 C CD2 . LEU A 1 385 ? -8.619 -1.368 -19.838 1.00 8.50 ? 385 LEU A CD2 1 ATOM 2990 N N . ILE A 1 386 ? -9.164 -5.636 -17.070 1.00 8.66 ? 386 ILE A N 1 ATOM 2991 C CA . ILE A 1 386 ? -8.816 -6.999 -17.442 1.00 8.65 ? 386 ILE A CA 1 ATOM 2992 C C . ILE A 1 386 ? -9.429 -7.356 -18.793 1.00 8.69 ? 386 ILE A C 1 ATOM 2993 O O . ILE A 1 386 ? -10.628 -7.182 -18.996 1.00 8.64 ? 386 ILE A O 1 ATOM 2994 C CB . ILE A 1 386 ? -9.254 -8.065 -16.358 1.00 8.36 ? 386 ILE A CB 1 ATOM 2995 C CG1 . ILE A 1 386 ? -8.673 -7.734 -14.969 1.00 8.34 ? 386 ILE A CG1 1 ATOM 2996 C CG2 . ILE A 1 386 ? -8.820 -9.465 -16.780 1.00 7.97 ? 386 ILE A CG2 1 ATOM 2997 C CD1 . ILE A 1 386 ? -9.088 -8.712 -13.844 1.00 8.07 ? 386 ILE A CD1 1 ATOM 2998 N N . GLN A 1 387 ? -8.592 -7.859 -19.697 1.00 8.80 ? 387 GLN A N 1 ATOM 2999 C CA . GLN A 1 387 ? -9.049 -8.486 -20.918 1.00 8.93 ? 387 GLN A CA 1 ATOM 3000 C C . GLN A 1 387 ? -8.801 -10.004 -20.918 1.00 9.51 ? 387 GLN A C 1 ATOM 3001 O O . GLN A 1 387 ? -7.684 -10.458 -20.638 1.00 9.45 ? 387 GLN A O 1 ATOM 3002 C CB . GLN A 1 387 ? -8.403 -7.847 -22.150 1.00 8.38 ? 387 GLN A CB 1 ATOM 3003 C CG . GLN A 1 387 ? -9.079 -8.311 -23.452 1.00 8.36 ? 387 GLN A CG 1 ATOM 3004 C CD . GLN A 1 387 ? -8.521 -7.702 -24.718 1.00 8.31 ? 387 GLN A CD 1 ATOM 3005 O OE1 . GLN A 1 387 ? -9.119 -7.837 -25.799 1.00 8.21 ? 387 GLN A OE1 1 ATOM 3006 N NE2 . GLN A 1 387 ? -7.376 -7.028 -24.608 1.00 8.31 ? 387 GLN A NE2 1 ATOM 3007 N N . PHE A 1 388 ? -9.848 -10.773 -21.239 1.00 10.09 ? 388 PHE A N 1 ATOM 3008 C CA . PHE A 1 388 ? -9.705 -12.201 -21.603 1.00 10.35 ? 388 PHE A CA 1 ATOM 3009 C C . PHE A 1 388 ? -10.022 -12.389 -23.086 1.00 10.32 ? 388 PHE A C 1 ATOM 3010 O O . PHE A 1 388 ? -11.001 -11.830 -23.592 1.00 10.08 ? 388 PHE A O 1 ATOM 3011 C CB . PHE A 1 388 ? -10.673 -13.084 -20.832 1.00 10.69 ? 388 PHE A CB 1 ATOM 3012 C CG . PHE A 1 388 ? -10.631 -12.922 -19.338 1.00 10.85 ? 388 PHE A CG 1 ATOM 3013 C CD1 . PHE A 1 388 ? -9.821 -13.749 -18.559 1.00 10.53 ? 388 PHE A CD1 1 ATOM 3014 C CD2 . PHE A 1 388 ? -11.484 -12.013 -18.706 1.00 10.52 ? 388 PHE A CD2 1 ATOM 3015 C CE1 . PHE A 1 388 ? -9.826 -13.644 -17.170 1.00 10.78 ? 388 PHE A CE1 1 ATOM 3016 C CE2 . PHE A 1 388 ? -11.490 -11.884 -17.319 1.00 10.67 ? 388 PHE A CE2 1 ATOM 3017 C CZ . PHE A 1 388 ? -10.665 -12.700 -16.542 1.00 10.64 ? 388 PHE A CZ 1 ATOM 3018 N N . TYR A 1 389 ? -9.213 -13.196 -23.771 1.00 10.37 ? 389 TYR A N 1 ATOM 3019 C CA . TYR A 1 389 ? -9.276 -13.312 -25.237 1.00 10.35 ? 389 TYR A CA 1 ATOM 3020 C C . TYR A 1 389 ? -9.075 -14.758 -25.695 1.00 10.97 ? 389 TYR A C 1 ATOM 3021 O O . TYR A 1 389 ? -8.091 -15.398 -25.316 1.00 10.44 ? 389 TYR A O 1 ATOM 3022 C CB . TYR A 1 389 ? -8.201 -12.435 -25.847 1.00 9.21 ? 389 TYR A CB 1 ATOM 3023 C CG . TYR A 1 389 ? -8.430 -11.958 -27.268 1.00 9.01 ? 389 TYR A CG 1 ATOM 3024 C CD1 . TYR A 1 389 ? -8.890 -10.670 -27.519 1.00 8.95 ? 389 TYR A CD1 1 ATOM 3025 C CD2 . TYR A 1 389 ? -8.128 -12.769 -28.361 1.00 8.92 ? 389 TYR A CD2 1 ATOM 3026 C CE1 . TYR A 1 389 ? -9.066 -10.203 -28.825 1.00 8.92 ? 389 TYR A CE1 1 ATOM 3027 C CE2 . TYR A 1 389 ? -8.298 -12.316 -29.672 1.00 8.77 ? 389 TYR A CE2 1 ATOM 3028 C CZ . TYR A 1 389 ? -8.760 -11.027 -29.895 1.00 8.77 ? 389 TYR A CZ 1 ATOM 3029 O OH . TYR A 1 389 ? -8.939 -10.560 -31.178 1.00 8.41 ? 389 TYR A OH 1 ATOM 3030 N N . ASP A 1 390 ? -10.007 -15.247 -26.518 1.00 11.61 ? 390 ASP A N 1 ATOM 3031 C CA . ASP A 1 390 ? -10.070 -16.660 -26.931 1.00 11.91 ? 390 ASP A CA 1 ATOM 3032 C C . ASP A 1 390 ? -10.148 -16.814 -28.467 1.00 12.13 ? 390 ASP A C 1 ATOM 3033 O O . ASP A 1 390 ? -11.218 -16.646 -29.055 1.00 11.69 ? 390 ASP A O 1 ATOM 3034 C CB . ASP A 1 390 ? -11.291 -17.300 -26.260 1.00 12.26 ? 390 ASP A CB 1 ATOM 3035 C CG . ASP A 1 390 ? -11.269 -18.807 -26.305 1.00 12.62 ? 390 ASP A CG 1 ATOM 3036 O OD1 . ASP A 1 390 ? -10.291 -19.374 -26.845 1.00 13.12 ? 390 ASP A OD1 1 ATOM 3037 O OD2 . ASP A 1 390 ? -12.227 -19.420 -25.780 1.00 11.97 ? 390 ASP A OD2 1 ATOM 3038 N N . ARG A 1 391 ? -9.016 -17.148 -29.094 1.00 12.86 ? 391 ARG A N 1 ATOM 3039 C CA . ARG A 1 391 ? -8.849 -17.062 -30.545 1.00 13.60 ? 391 ARG A CA 1 ATOM 3040 C C . ARG A 1 391 ? -8.509 -18.372 -31.291 1.00 14.04 ? 391 ARG A C 1 ATOM 3041 O O . ARG A 1 391 ? -7.471 -18.999 -31.048 1.00 13.49 ? 391 ARG A O 1 ATOM 3042 C CB . ARG A 1 391 ? -7.811 -15.992 -30.887 1.00 14.32 ? 391 ARG A CB 1 ATOM 3043 C CG . ARG A 1 391 ? -7.770 -15.644 -32.356 1.00 15.97 ? 391 ARG A CG 1 ATOM 3044 C CD . ARG A 1 391 ? -6.521 -14.861 -32.679 1.00 17.94 ? 391 ARG A CD 1 ATOM 3045 N NE . ARG A 1 391 ? -5.390 -15.754 -32.890 1.00 21.42 ? 391 ARG A NE 1 ATOM 3046 C CZ . ARG A 1 391 ? -4.105 -15.410 -32.773 1.00 23.04 ? 391 ARG A CZ 1 ATOM 3047 N NH1 . ARG A 1 391 ? -3.765 -14.169 -32.416 1.00 21.31 ? 391 ARG A NH1 1 ATOM 3048 N NH2 . ARG A 1 391 ? -3.156 -16.327 -33.000 1.00 21.88 ? 391 ARG A NH2 1 ATOM 3049 N N . TYR A 1 392 ? -9.397 -18.746 -32.219 1.00 14.34 ? 392 TYR A N 1 ATOM 3050 C CA . TYR A 1 392 ? -9.221 -19.881 -33.122 1.00 14.03 ? 392 TYR A CA 1 ATOM 3051 C C . TYR A 1 392 ? -8.641 -19.436 -34.470 1.00 15.06 ? 392 TYR A C 1 ATOM 3052 O O . TYR A 1 392 ? -8.572 -18.243 -34.765 1.00 14.18 ? 392 TYR A O 1 ATOM 3053 C CB . TYR A 1 392 ? -10.568 -20.602 -33.319 1.00 12.92 ? 392 TYR A CB 1 ATOM 3054 C CG . TYR A 1 392 ? -10.972 -21.486 -32.143 1.00 12.60 ? 392 TYR A CG 1 ATOM 3055 C CD1 . TYR A 1 392 ? -10.783 -22.887 -32.183 1.00 12.00 ? 392 TYR A CD1 1 ATOM 3056 C CD2 . TYR A 1 392 ? -11.519 -20.932 -30.987 1.00 11.63 ? 392 TYR A CD2 1 ATOM 3057 C CE1 . TYR A 1 392 ? -11.144 -23.695 -31.104 1.00 11.14 ? 392 TYR A CE1 1 ATOM 3058 C CE2 . TYR A 1 392 ? -11.878 -21.726 -29.910 1.00 11.14 ? 392 TYR A CE2 1 ATOM 3059 C CZ . TYR A 1 392 ? -11.688 -23.104 -29.969 1.00 11.17 ? 392 TYR A CZ 1 ATOM 3060 O OH . TYR A 1 392 ? -12.043 -23.874 -28.887 1.00 10.55 ? 392 TYR A OH 1 ATOM 3061 N N . ASP A 1 393 ? -8.229 -20.389 -35.298 1.00 17.82 ? 393 ASP A N 1 ATOM 3062 C CA . ASP A 1 393 ? -7.810 -20.060 -36.660 1.00 21.21 ? 393 ASP A CA 1 ATOM 3063 C C . ASP A 1 393 ? -8.981 -19.555 -37.483 1.00 20.09 ? 393 ASP A C 1 ATOM 3064 O O . ASP A 1 393 ? -10.138 -19.869 -37.177 1.00 19.84 ? 393 ASP A O 1 ATOM 3065 C CB . ASP A 1 393 ? -7.172 -21.265 -37.343 1.00 25.18 ? 393 ASP A CB 1 ATOM 3066 C CG . ASP A 1 393 ? -5.829 -21.605 -36.762 1.00 29.36 ? 393 ASP A CG 1 ATOM 3067 O OD1 . ASP A 1 393 ? -5.184 -20.710 -36.168 1.00 31.84 ? 393 ASP A OD1 1 ATOM 3068 O OD2 . ASP A 1 393 ? -5.419 -22.778 -36.885 1.00 35.69 ? 393 ASP A OD2 1 ATOM 3069 N N . ASN A 1 394 ? -8.684 -18.783 -38.525 1.00 19.18 ? 394 ASN A N 1 ATOM 3070 C CA . ASN A 1 394 ? -9.746 -18.237 -39.364 1.00 20.99 ? 394 ASN A CA 1 ATOM 3071 C C . ASN A 1 394 ? -10.506 -19.316 -40.136 1.00 23.34 ? 394 ASN A C 1 ATOM 3072 O O . ASN A 1 394 ? -11.724 -19.198 -40.338 1.00 21.93 ? 394 ASN A O 1 ATOM 3073 C CB . ASN A 1 394 ? -9.236 -17.111 -40.269 1.00 19.50 ? 394 ASN A CB 1 ATOM 3074 C CG . ASN A 1 394 ? -8.970 -15.824 -39.493 1.00 18.20 ? 394 ASN A CG 1 ATOM 3075 O OD1 . ASN A 1 394 ? -9.446 -15.655 -38.366 1.00 17.49 ? 394 ASN A OD1 1 ATOM 3076 N ND2 . ASN A 1 394 ? -8.207 -14.922 -40.083 1.00 17.03 ? 394 ASN A ND2 1 ATOM 3077 N N . ASN A 1 395 ? -9.803 -20.385 -40.515 1.00 24.07 ? 395 ASN A N 1 ATOM 3078 C CA . ASN A 1 395 ? -10.480 -21.516 -41.144 1.00 25.88 ? 395 ASN A CA 1 ATOM 3079 C C . ASN A 1 395 ? -11.140 -22.517 -40.176 1.00 24.39 ? 395 ASN A C 1 ATOM 3080 O O . ASN A 1 395 ? -11.608 -23.553 -40.620 1.00 24.59 ? 395 ASN A O 1 ATOM 3081 C CB . ASN A 1 395 ? -9.599 -22.207 -42.205 1.00 27.69 ? 395 ASN A CB 1 ATOM 3082 C CG . ASN A 1 395 ? -8.240 -22.642 -41.666 1.00 31.56 ? 395 ASN A CG 1 ATOM 3083 O OD1 . ASN A 1 395 ? -8.121 -23.131 -40.542 1.00 33.02 ? 395 ASN A OD1 1 ATOM 3084 N ND2 . ASN A 1 395 ? -7.203 -22.483 -42.489 1.00 34.28 ? 395 ASN A ND2 1 ATOM 3085 N N . GLN A 1 396 ? -11.199 -22.202 -38.878 1.00 23.00 ? 396 GLN A N 1 ATOM 3086 C CA . GLN A 1 396 ? -11.937 -23.034 -37.904 1.00 23.16 ? 396 GLN A CA 1 ATOM 3087 C C . GLN A 1 396 ? -13.228 -22.358 -37.476 1.00 22.80 ? 396 GLN A C 1 ATOM 3088 O O . GLN A 1 396 ? -13.370 -21.148 -37.592 1.00 28.22 ? 396 GLN A O 1 ATOM 3089 C CB . GLN A 1 396 ? -11.117 -23.297 -36.637 1.00 23.68 ? 396 GLN A CB 1 ATOM 3090 C CG . GLN A 1 396 ? -9.891 -24.177 -36.778 1.00 25.19 ? 396 GLN A CG 1 ATOM 3091 C CD . GLN A 1 396 ? -9.150 -24.332 -35.446 1.00 26.98 ? 396 GLN A CD 1 ATOM 3092 O OE1 . GLN A 1 396 ? -8.712 -23.344 -34.841 1.00 27.39 ? 396 GLN A OE1 1 ATOM 3093 N NE2 . GLN A 1 396 ? -9.019 -25.574 -34.980 1.00 24.88 ? 396 GLN A NE2 1 ATOM 3094 N N . THR A 1 397 ? -14.160 -23.140 -36.951 1.00 21.34 ? 397 THR A N 1 ATOM 3095 C CA . THR A 1 397 ? -15.402 -22.619 -36.413 1.00 19.44 ? 397 THR A CA 1 ATOM 3096 C C . THR A 1 397 ? -15.262 -22.505 -34.899 1.00 19.37 ? 397 THR A C 1 ATOM 3097 O O . THR A 1 397 ? -14.878 -23.477 -34.238 1.00 18.97 ? 397 THR A O 1 ATOM 3098 C CB . THR A 1 397 ? -16.583 -23.546 -36.787 1.00 20.12 ? 397 THR A CB 1 ATOM 3099 O OG1 . THR A 1 397 ? -16.942 -23.323 -38.152 1.00 21.87 ? 397 THR A OG1 1 ATOM 3100 C CG2 . THR A 1 397 ? -17.808 -23.286 -35.926 1.00 20.41 ? 397 THR A CG2 1 ATOM 3101 N N . TYR A 1 398 ? -15.554 -21.323 -34.346 1.00 17.34 ? 398 TYR A N 1 ATOM 3102 C CA . TYR A 1 398 ? -15.564 -21.184 -32.904 1.00 16.15 ? 398 TYR A CA 1 ATOM 3103 C C . TYR A 1 398 ? -16.669 -22.084 -32.375 1.00 17.18 ? 398 TYR A C 1 ATOM 3104 O O . TYR A 1 398 ? -17.831 -21.871 -32.694 1.00 18.30 ? 398 TYR A O 1 ATOM 3105 C CB . TYR A 1 398 ? -15.754 -19.721 -32.456 1.00 14.46 ? 398 TYR A CB 1 ATOM 3106 C CG . TYR A 1 398 ? -15.486 -19.522 -30.978 1.00 13.03 ? 398 TYR A CG 1 ATOM 3107 C CD1 . TYR A 1 398 ? -14.221 -19.123 -30.517 1.00 12.61 ? 398 TYR A CD1 1 ATOM 3108 C CD2 . TYR A 1 398 ? -16.490 -19.765 -30.033 1.00 12.21 ? 398 TYR A CD2 1 ATOM 3109 C CE1 . TYR A 1 398 ? -13.970 -18.966 -29.150 1.00 12.16 ? 398 TYR A CE1 1 ATOM 3110 C CE2 . TYR A 1 398 ? -16.258 -19.618 -28.684 1.00 11.65 ? 398 TYR A CE2 1 ATOM 3111 C CZ . TYR A 1 398 ? -15.006 -19.223 -28.237 1.00 12.27 ? 398 TYR A CZ 1 ATOM 3112 O OH . TYR A 1 398 ? -14.810 -19.084 -26.873 1.00 12.19 ? 398 TYR A OH 1 ATOM 3113 N N . PRO A 1 399 ? -16.312 -23.106 -31.572 1.00 18.70 ? 399 PRO A N 1 ATOM 3114 C CA . PRO A 1 399 ? -17.311 -24.077 -31.106 1.00 18.90 ? 399 PRO A CA 1 ATOM 3115 C C . PRO A 1 399 ? -18.171 -23.516 -29.977 1.00 21.59 ? 399 PRO A C 1 ATOM 3116 O O . PRO A 1 399 ? -17.661 -22.761 -29.135 1.00 22.34 ? 399 PRO A O 1 ATOM 3117 C CB . PRO A 1 399 ? -16.459 -25.247 -30.599 1.00 17.73 ? 399 PRO A CB 1 ATOM 3118 C CG . PRO A 1 399 ? -14.985 -24.859 -30.843 1.00 18.00 ? 399 PRO A CG 1 ATOM 3119 C CD . PRO A 1 399 ? -14.981 -23.376 -30.999 1.00 18.73 ? 399 PRO A CD 1 ATOM 3120 N N . GLU A 1 400 ? -19.451 -23.901 -29.941 1.00 23.16 ? 400 GLU A N 1 ATOM 3121 C CA A GLU A 1 400 ? -20.393 -23.424 -28.926 0.50 24.10 ? 400 GLU A CA 1 ATOM 3122 C CA B GLU A 1 400 ? -20.378 -23.393 -28.916 0.50 23.88 ? 400 GLU A CA 1 ATOM 3123 C C . GLU A 1 400 ? -19.933 -23.726 -27.492 1.00 24.59 ? 400 GLU A C 1 ATOM 3124 O O . GLU A 1 400 ? -20.184 -22.951 -26.566 1.00 24.56 ? 400 GLU A O 1 ATOM 3125 C CB A GLU A 1 400 ? -21.813 -23.971 -29.197 0.50 25.40 ? 400 GLU A CB 1 ATOM 3126 C CB B GLU A 1 400 ? -21.811 -23.897 -29.149 0.50 24.94 ? 400 GLU A CB 1 ATOM 3127 C CG A GLU A 1 400 ? -22.216 -25.295 -28.499 0.50 25.69 ? 400 GLU A CG 1 ATOM 3128 C CG B GLU A 1 400 ? -22.844 -23.442 -28.090 0.50 24.16 ? 400 GLU A CG 1 ATOM 3129 C CD A GLU A 1 400 ? -22.176 -26.522 -29.406 0.50 25.02 ? 400 GLU A CD 1 ATOM 3130 C CD B GLU A 1 400 ? -23.052 -21.937 -28.082 0.50 25.05 ? 400 GLU A CD 1 ATOM 3131 O OE1 A GLU A 1 400 ? -21.323 -26.579 -30.316 0.50 24.00 ? 400 GLU A OE1 1 ATOM 3132 O OE1 B GLU A 1 400 ? -23.037 -21.327 -29.173 0.50 24.73 ? 400 GLU A OE1 1 ATOM 3133 O OE2 A GLU A 1 400 ? -22.999 -27.440 -29.191 0.50 24.69 ? 400 GLU A OE2 1 ATOM 3134 O OE2 B GLU A 1 400 ? -23.241 -21.361 -26.987 0.50 25.74 ? 400 GLU A OE2 1 ATOM 3135 N N . THR A 1 401 ? -19.265 -24.863 -27.320 1.00 24.95 ? 401 THR A N 1 ATOM 3136 C CA . THR A 1 401 ? -18.806 -25.297 -25.997 1.00 25.42 ? 401 THR A CA 1 ATOM 3137 C C . THR A 1 401 ? -17.580 -24.536 -25.477 1.00 24.02 ? 401 THR A C 1 ATOM 3138 O O . THR A 1 401 ? -17.276 -24.607 -24.287 1.00 24.79 ? 401 THR A O 1 ATOM 3139 C CB . THR A 1 401 ? -18.477 -26.794 -25.990 1.00 26.70 ? 401 THR A CB 1 ATOM 3140 O OG1 . THR A 1 401 ? -17.546 -27.064 -27.046 1.00 26.52 ? 401 THR A OG1 1 ATOM 3141 C CG2 . THR A 1 401 ? -19.753 -27.622 -26.190 1.00 27.23 ? 401 THR A CG2 1 ATOM 3142 N N . SER A 1 402 ? -16.891 -23.812 -26.365 1.00 22.76 ? 402 SER A N 1 ATOM 3143 C CA . SER A 1 402 ? -15.703 -23.032 -26.000 1.00 20.61 ? 402 SER A CA 1 ATOM 3144 C C . SER A 1 402 ? -15.985 -21.729 -25.244 1.00 20.00 ? 402 SER A C 1 ATOM 3145 O O . SER A 1 402 ? -15.074 -21.179 -24.613 1.00 19.15 ? 402 SER A O 1 ATOM 3146 C CB . SER A 1 402 ? -14.826 -22.758 -27.224 1.00 20.19 ? 402 SER A CB 1 ATOM 3147 O OG . SER A 1 402 ? -14.229 -23.954 -27.689 1.00 19.64 ? 402 SER A OG 1 ATOM 3148 N N . PHE A 1 403 ? -17.228 -21.241 -25.292 1.00 19.61 ? 403 PHE A N 1 ATOM 3149 C CA . PHE A 1 403 ? -17.600 -20.027 -24.539 1.00 20.69 ? 403 PHE A CA 1 ATOM 3150 C C . PHE A 1 403 ? -17.338 -20.157 -23.035 1.00 20.88 ? 403 PHE A C 1 ATOM 3151 O O . PHE A 1 403 ? -16.952 -19.183 -22.367 1.00 18.80 ? 403 PHE A O 1 ATOM 3152 C CB . PHE A 1 403 ? -19.065 -19.623 -24.775 1.00 20.20 ? 403 PHE A CB 1 ATOM 3153 C CG . PHE A 1 403 ? -19.336 -19.107 -26.157 1.00 20.94 ? 403 PHE A CG 1 ATOM 3154 C CD1 . PHE A 1 403 ? -20.267 -19.743 -26.979 1.00 22.18 ? 403 PHE A CD1 1 ATOM 3155 C CD2 . PHE A 1 403 ? -18.657 -17.989 -26.644 1.00 20.95 ? 403 PHE A CD2 1 ATOM 3156 C CE1 . PHE A 1 403 ? -20.529 -19.270 -28.282 1.00 23.25 ? 403 PHE A CE1 1 ATOM 3157 C CE2 . PHE A 1 403 ? -18.896 -17.508 -27.936 1.00 22.46 ? 403 PHE A CE2 1 ATOM 3158 C CZ . PHE A 1 403 ? -19.838 -18.152 -28.763 1.00 23.21 ? 403 PHE A CZ 1 ATOM 3159 N N . LYS A 1 404 ? -17.533 -21.370 -22.517 1.00 22.20 ? 404 LYS A N 1 ATOM 3160 C CA . LYS A 1 404 ? -17.528 -21.586 -21.078 1.00 22.59 ? 404 LYS A CA 1 ATOM 3161 C C . LYS A 1 404 ? -16.135 -21.401 -20.471 1.00 20.23 ? 404 LYS A C 1 ATOM 3162 O O . LYS A 1 404 ? -16.019 -21.139 -19.276 1.00 20.74 ? 404 LYS A O 1 ATOM 3163 C CB . LYS A 1 404 ? -18.190 -22.924 -20.693 1.00 25.39 ? 404 LYS A CB 1 ATOM 3164 C CG . LYS A 1 404 ? -17.423 -24.182 -21.085 1.00 30.28 ? 404 LYS A CG 1 ATOM 3165 C CD . LYS A 1 404 ? -18.130 -25.451 -20.579 1.00 34.29 ? 404 LYS A CD 1 ATOM 3166 C CE . LYS A 1 404 ? -17.327 -26.733 -20.877 1.00 38.51 ? 404 LYS A CE 1 ATOM 3167 N NZ . LYS A 1 404 ? -17.161 -26.986 -22.351 1.00 36.86 ? 404 LYS A NZ 1 ATOM 3168 N N . PHE A 1 405 ? -15.097 -21.477 -21.307 1.00 18.81 ? 405 PHE A N 1 ATOM 3169 C CA . PHE A 1 405 ? -13.710 -21.218 -20.871 1.00 17.25 ? 405 PHE A CA 1 ATOM 3170 C C . PHE A 1 405 ? -13.548 -19.804 -20.272 1.00 17.23 ? 405 PHE A C 1 ATOM 3171 O O . PHE A 1 405 ? -13.246 -19.669 -19.073 1.00 16.52 ? 405 PHE A O 1 ATOM 3172 C CB . PHE A 1 405 ? -12.702 -21.515 -22.003 1.00 16.04 ? 405 PHE A CB 1 ATOM 3173 C CG . PHE A 1 405 ? -11.299 -20.989 -21.752 1.00 15.95 ? 405 PHE A CG 1 ATOM 3174 C CD1 . PHE A 1 405 ? -10.654 -21.182 -20.525 1.00 15.67 ? 405 PHE A CD1 1 ATOM 3175 C CD2 . PHE A 1 405 ? -10.611 -20.316 -22.758 1.00 15.09 ? 405 PHE A CD2 1 ATOM 3176 C CE1 . PHE A 1 405 ? -9.362 -20.690 -20.314 1.00 15.09 ? 405 PHE A CE1 1 ATOM 3177 C CE2 . PHE A 1 405 ? -9.314 -19.827 -22.551 1.00 14.40 ? 405 PHE A CE2 1 ATOM 3178 C CZ . PHE A 1 405 ? -8.697 -20.011 -21.334 1.00 14.53 ? 405 PHE A CZ 1 ATOM 3179 N N . LEU A 1 406 ? -13.775 -18.762 -21.078 1.00 16.41 ? 406 LEU A N 1 ATOM 3180 C CA . LEU A 1 406 ? -13.679 -17.393 -20.558 1.00 15.68 ? 406 LEU A CA 1 ATOM 3181 C C . LEU A 1 406 ? -14.833 -17.066 -19.615 1.00 16.00 ? 406 LEU A C 1 ATOM 3182 O O . LEU A 1 406 ? -14.658 -16.316 -18.663 1.00 16.81 ? 406 LEU A O 1 ATOM 3183 C CB . LEU A 1 406 ? -13.567 -16.355 -21.676 1.00 14.68 ? 406 LEU A CB 1 ATOM 3184 C CG . LEU A 1 406 ? -12.317 -16.421 -22.553 1.00 15.25 ? 406 LEU A CG 1 ATOM 3185 C CD1 . LEU A 1 406 ? -12.251 -15.242 -23.520 1.00 14.28 ? 406 LEU A CD1 1 ATOM 3186 C CD2 . LEU A 1 406 ? -11.039 -16.523 -21.716 1.00 14.83 ? 406 LEU A CD2 1 ATOM 3187 N N . ASP A 1 407 ? -16.009 -17.627 -19.876 1.00 16.27 ? 407 ASP A N 1 ATOM 3188 C CA . ASP A 1 407 ? -17.130 -17.485 -18.946 1.00 17.71 ? 407 ASP A CA 1 ATOM 3189 C C . ASP A 1 407 ? -16.724 -17.937 -17.537 1.00 17.63 ? 407 ASP A C 1 ATOM 3190 O O . ASP A 1 407 ? -16.942 -17.209 -16.565 1.00 17.85 ? 407 ASP A O 1 ATOM 3191 C CB . ASP A 1 407 ? -18.354 -18.281 -19.428 1.00 18.24 ? 407 ASP A CB 1 ATOM 3192 C CG . ASP A 1 407 ? -19.157 -17.550 -20.495 1.00 17.84 ? 407 ASP A CG 1 ATOM 3193 O OD1 . ASP A 1 407 ? -18.773 -16.434 -20.899 1.00 17.87 ? 407 ASP A OD1 1 ATOM 3194 O OD2 . ASP A 1 407 ? -20.188 -18.103 -20.930 1.00 17.57 ? 407 ASP A OD2 1 ATOM 3195 N N . GLY A 1 408 ? -16.102 -19.119 -17.453 1.00 16.38 ? 408 GLY A N 1 ATOM 3196 C CA . GLY A 1 408 ? -15.641 -19.688 -16.189 1.00 15.74 ? 408 GLY A CA 1 ATOM 3197 C C . GLY A 1 408 ? -14.657 -18.811 -15.430 1.00 15.58 ? 408 GLY A C 1 ATOM 3198 O O . GLY A 1 408 ? -14.803 -18.600 -14.217 1.00 16.15 ? 408 GLY A O 1 ATOM 3199 N N . TRP A 1 409 ? -13.658 -18.297 -16.147 1.00 14.46 ? 409 TRP A N 1 ATOM 3200 C CA . TRP A 1 409 ? -12.651 -17.422 -15.559 1.00 13.66 ? 409 TRP A CA 1 ATOM 3201 C C . TRP A 1 409 ? -13.253 -16.129 -14.982 1.00 13.98 ? 409 TRP A C 1 ATOM 3202 O O . TRP A 1 409 ? -12.940 -15.736 -13.857 1.00 14.14 ? 409 TRP A O 1 ATOM 3203 C CB . TRP A 1 409 ? -11.573 -17.095 -16.586 1.00 12.56 ? 409 TRP A CB 1 ATOM 3204 C CG . TRP A 1 409 ? -10.203 -17.084 -16.005 1.00 11.84 ? 409 TRP A CG 1 ATOM 3205 C CD1 . TRP A 1 409 ? -9.870 -17.025 -14.680 1.00 11.32 ? 409 TRP A CD1 1 ATOM 3206 C CD2 . TRP A 1 409 ? -8.972 -17.103 -16.728 1.00 11.63 ? 409 TRP A CD2 1 ATOM 3207 N NE1 . TRP A 1 409 ? -8.505 -17.019 -14.534 1.00 11.32 ? 409 TRP A NE1 1 ATOM 3208 C CE2 . TRP A 1 409 ? -7.928 -17.074 -15.774 1.00 11.33 ? 409 TRP A CE2 1 ATOM 3209 C CE3 . TRP A 1 409 ? -8.646 -17.164 -18.088 1.00 11.23 ? 409 TRP A CE3 1 ATOM 3210 C CZ2 . TRP A 1 409 ? -6.589 -17.083 -16.138 1.00 11.13 ? 409 TRP A CZ2 1 ATOM 3211 C CZ3 . TRP A 1 409 ? -7.324 -17.170 -18.449 1.00 11.08 ? 409 TRP A CZ3 1 ATOM 3212 C CH2 . TRP A 1 409 ? -6.303 -17.128 -17.476 1.00 11.17 ? 409 TRP A CH2 1 ATOM 3213 N N . VAL A 1 410 ? -14.143 -15.498 -15.742 1.00 13.71 ? 410 VAL A N 1 ATOM 3214 C CA . VAL A 1 410 ? -14.807 -14.286 -15.297 1.00 13.71 ? 410 VAL A CA 1 ATOM 3215 C C . VAL A 1 410 ? -15.650 -14.570 -14.051 1.00 15.04 ? 410 VAL A C 1 ATOM 3216 O O . VAL A 1 410 ? -15.568 -13.824 -13.057 1.00 15.63 ? 410 VAL A O 1 ATOM 3217 C CB . VAL A 1 410 ? -15.639 -13.651 -16.441 1.00 12.87 ? 410 VAL A CB 1 ATOM 3218 C CG1 . VAL A 1 410 ? -16.586 -12.552 -15.920 1.00 12.13 ? 410 VAL A CG1 1 ATOM 3219 C CG2 . VAL A 1 410 ? -14.712 -13.111 -17.512 1.00 12.13 ? 410 VAL A CG2 1 ATOM 3220 N N . ASN A 1 411 ? -16.420 -15.661 -14.099 1.00 15.62 ? 411 ASN A N 1 ATOM 3221 C CA A ASN A 1 411 ? -17.251 -16.086 -12.963 0.50 15.89 ? 411 ASN A CA 1 ATOM 3222 C CA B ASN A 1 411 ? -17.247 -16.085 -12.971 0.50 15.97 ? 411 ASN A CA 1 ATOM 3223 C C . ASN A 1 411 ? -16.418 -16.318 -11.705 1.00 16.31 ? 411 ASN A C 1 ATOM 3224 O O . ASN A 1 411 ? -16.812 -15.894 -10.612 1.00 17.36 ? 411 ASN A O 1 ATOM 3225 C CB A ASN A 1 411 ? -18.069 -17.344 -13.296 0.50 15.67 ? 411 ASN A CB 1 ATOM 3226 C CB B ASN A 1 411 ? -18.052 -17.339 -13.333 0.50 15.90 ? 411 ASN A CB 1 ATOM 3227 C CG A ASN A 1 411 ? -19.050 -17.726 -12.182 0.50 15.84 ? 411 ASN A CG 1 ATOM 3228 C CG B ASN A 1 411 ? -18.978 -17.118 -14.521 0.50 16.09 ? 411 ASN A CG 1 ATOM 3229 O OD1 A ASN A 1 411 ? -19.974 -16.972 -11.856 0.50 15.23 ? 411 ASN A OD1 1 ATOM 3230 O OD1 B ASN A 1 411 ? -19.472 -16.009 -14.746 0.50 15.88 ? 411 ASN A OD1 1 ATOM 3231 N ND2 A ASN A 1 411 ? -18.856 -18.912 -11.605 0.50 15.90 ? 411 ASN A ND2 1 ATOM 3232 N ND2 B ASN A 1 411 ? -19.208 -18.176 -15.297 0.50 16.51 ? 411 ASN A ND2 1 ATOM 3233 N N . SER A 1 412 ? -15.263 -16.972 -11.861 1.00 15.26 ? 412 SER A N 1 ATOM 3234 C CA . SER A 1 412 ? -14.356 -17.195 -10.738 1.00 15.08 ? 412 SER A CA 1 ATOM 3235 C C . SER A 1 412 ? -14.001 -15.894 -9.997 1.00 15.11 ? 412 SER A C 1 ATOM 3236 O O . SER A 1 412 ? -13.807 -15.912 -8.776 1.00 14.47 ? 412 SER A O 1 ATOM 3237 C CB . SER A 1 412 ? -13.079 -17.928 -11.180 1.00 14.58 ? 412 SER A CB 1 ATOM 3238 O OG . SER A 1 412 ? -12.070 -17.013 -11.577 1.00 13.66 ? 412 SER A OG 1 ATOM 3239 N N . VAL A 1 413 ? -13.898 -14.776 -10.721 1.00 15.22 ? 413 VAL A N 1 ATOM 3240 C CA . VAL A 1 413 ? -13.668 -13.478 -10.054 1.00 15.44 ? 413 VAL A CA 1 ATOM 3241 C C . VAL A 1 413 ? -14.991 -12.902 -9.494 1.00 16.20 ? 413 VAL A C 1 ATOM 3242 O O . VAL A 1 413 ? -15.086 -12.599 -8.301 1.00 15.95 ? 413 VAL A O 1 ATOM 3243 C CB . VAL A 1 413 ? -12.906 -12.439 -10.949 1.00 14.44 ? 413 VAL A CB 1 ATOM 3244 C CG1 . VAL A 1 413 ? -12.728 -11.111 -10.219 1.00 13.48 ? 413 VAL A CG1 1 ATOM 3245 C CG2 . VAL A 1 413 ? -11.539 -12.968 -11.381 1.00 13.94 ? 413 VAL A CG2 1 ATOM 3246 N N . THR A 1 414 ? -16.013 -12.791 -10.341 1.00 16.73 ? 414 THR A N 1 ATOM 3247 C CA . THR A 1 414 ? -17.264 -12.112 -9.946 1.00 17.65 ? 414 THR A CA 1 ATOM 3248 C C . THR A 1 414 ? -18.014 -12.748 -8.760 1.00 19.01 ? 414 THR A C 1 ATOM 3249 O O . THR A 1 414 ? -18.502 -12.035 -7.876 1.00 18.62 ? 414 THR A O 1 ATOM 3250 C CB . THR A 1 414 ? -18.224 -11.870 -11.146 1.00 16.43 ? 414 THR A CB 1 ATOM 3251 O OG1 . THR A 1 414 ? -18.600 -13.122 -11.738 1.00 16.18 ? 414 THR A OG1 1 ATOM 3252 C CG2 . THR A 1 414 ? -17.550 -10.982 -12.189 1.00 15.84 ? 414 THR A CG2 1 ATOM 3253 N N . LYS A 1 415 ? -18.088 -14.078 -8.723 1.00 20.16 ? 415 LYS A N 1 ATOM 3254 C CA . LYS A 1 415 ? -18.761 -14.751 -7.612 1.00 21.86 ? 415 LYS A CA 1 ATOM 3255 C C . LYS A 1 415 ? -18.147 -14.398 -6.254 1.00 22.74 ? 415 LYS A C 1 ATOM 3256 O O . LYS A 1 415 ? -18.779 -14.587 -5.222 1.00 24.03 ? 415 LYS A O 1 ATOM 3257 C CB . LYS A 1 415 ? -18.798 -16.267 -7.819 1.00 22.60 ? 415 LYS A CB 1 ATOM 3258 C CG . LYS A 1 415 ? -17.471 -16.973 -7.613 1.00 23.38 ? 415 LYS A CG 1 ATOM 3259 C CD . LYS A 1 415 ? -17.620 -18.456 -7.845 1.00 24.11 ? 415 LYS A CD 1 ATOM 3260 C CE . LYS A 1 415 ? -16.301 -19.172 -7.641 1.00 26.02 ? 415 LYS A CE 1 ATOM 3261 N NZ . LYS A 1 415 ? -16.554 -20.617 -7.377 1.00 27.59 ? 415 LYS A NZ 1 ATOM 3262 N N . ALA A 1 416 ? -16.931 -13.858 -6.272 1.00 23.89 ? 416 ALA A N 1 ATOM 3263 C CA . ALA A 1 416 ? -16.202 -13.511 -5.054 1.00 24.19 ? 416 ALA A CA 1 ATOM 3264 C C . ALA A 1 416 ? -16.344 -12.047 -4.619 1.00 24.22 ? 416 ALA A C 1 ATOM 3265 O O . ALA A 1 416 ? -15.788 -11.656 -3.593 1.00 26.08 ? 416 ALA A O 1 ATOM 3266 C CB . ALA A 1 416 ? -14.719 -13.871 -5.223 1.00 24.37 ? 416 ALA A CB 1 ATOM 3267 N N . LEU A 1 417 ? -17.074 -11.242 -5.391 1.00 23.44 ? 417 LEU A N 1 ATOM 3268 C CA . LEU A 1 417 ? -17.162 -9.795 -5.149 1.00 23.05 ? 417 LEU A CA 1 ATOM 3269 C C . LEU A 1 417 ? -18.594 -9.280 -5.031 1.00 23.64 ? 417 LEU A C 1 ATOM 3270 O O . LEU A 1 417 ? -19.506 -9.839 -5.643 1.00 23.68 ? 417 LEU A O 1 ATOM 3271 C CB . LEU A 1 417 ? -16.466 -9.012 -6.271 1.00 22.18 ? 417 LEU A CB 1 ATOM 3272 C CG . LEU A 1 417 ? -14.973 -9.213 -6.528 1.00 22.34 ? 417 LEU A CG 1 ATOM 3273 C CD1 . LEU A 1 417 ? -14.584 -8.635 -7.894 1.00 20.00 ? 417 LEU A CD1 1 ATOM 3274 C CD2 . LEU A 1 417 ? -14.136 -8.617 -5.386 1.00 21.55 ? 417 LEU A CD2 1 ATOM 3275 N N . PRO A 1 418 ? -18.794 -8.191 -4.263 1.00 23.85 ? 418 PRO A N 1 ATOM 3276 C CA . PRO A 1 418 ? -20.102 -7.551 -4.374 1.00 24.30 ? 418 PRO A CA 1 ATOM 3277 C C . PRO A 1 418 ? -20.244 -6.957 -5.777 1.00 26.05 ? 418 PRO A C 1 ATOM 3278 O O . PRO A 1 418 ? -19.229 -6.612 -6.405 1.00 23.95 ? 418 PRO A O 1 ATOM 3279 C CB . PRO A 1 418 ? -20.061 -6.447 -3.307 1.00 23.97 ? 418 PRO A CB 1 ATOM 3280 C CG . PRO A 1 418 ? -18.604 -6.197 -3.032 1.00 23.01 ? 418 PRO A CG 1 ATOM 3281 C CD . PRO A 1 418 ? -17.846 -7.433 -3.416 1.00 22.77 ? 418 PRO A CD 1 ATOM 3282 N N . LYS A 1 419 ? -21.483 -6.855 -6.263 1.00 27.58 ? 419 LYS A N 1 ATOM 3283 C CA . LYS A 1 419 ? -21.755 -6.321 -7.603 1.00 26.78 ? 419 LYS A CA 1 ATOM 3284 C C . LYS A 1 419 ? -21.207 -4.896 -7.804 1.00 24.50 ? 419 LYS A C 1 ATOM 3285 O O . LYS A 1 419 ? -20.774 -4.532 -8.892 1.00 24.24 ? 419 LYS A O 1 ATOM 3286 C CB . LYS A 1 419 ? -23.257 -6.371 -7.929 1.00 28.57 ? 419 LYS A CB 1 ATOM 3287 C CG . LYS A 1 419 ? -23.875 -7.778 -7.934 1.00 32.86 ? 419 LYS A CG 1 ATOM 3288 C CD . LYS A 1 419 ? -24.955 -7.926 -9.024 1.00 36.01 ? 419 LYS A CD 1 ATOM 3289 C CE . LYS A 1 419 ? -26.224 -8.665 -8.530 1.00 38.48 ? 419 LYS A CE 1 ATOM 3290 N NZ . LYS A 1 419 ? -26.034 -10.105 -8.130 1.00 37.63 ? 419 LYS A NZ 1 ATOM 3291 N N . SER A 1 420 ? -21.205 -4.094 -6.752 1.00 22.16 ? 420 SER A N 1 ATOM 3292 C CA . SER A 1 420 ? -20.735 -2.721 -6.883 1.00 21.96 ? 420 SER A CA 1 ATOM 3293 C C . SER A 1 420 ? -19.231 -2.625 -7.128 1.00 19.88 ? 420 SER A C 1 ATOM 3294 O O . SER A 1 420 ? -18.743 -1.564 -7.503 1.00 19.35 ? 420 SER A O 1 ATOM 3295 C CB . SER A 1 420 ? -21.124 -1.892 -5.654 1.00 21.78 ? 420 SER A CB 1 ATOM 3296 O OG . SER A 1 420 ? -20.596 -2.479 -4.479 1.00 23.25 ? 420 SER A OG 1 ATOM 3297 N N . ASP A 1 421 ? -18.510 -3.730 -6.924 1.00 18.74 ? 421 ASP A N 1 ATOM 3298 C CA . ASP A 1 421 ? -17.042 -3.746 -7.020 1.00 18.12 ? 421 ASP A CA 1 ATOM 3299 C C . ASP A 1 421 ? -16.484 -3.867 -8.435 1.00 16.38 ? 421 ASP A C 1 ATOM 3300 O O . ASP A 1 421 ? -15.317 -3.548 -8.670 1.00 15.40 ? 421 ASP A O 1 ATOM 3301 C CB . ASP A 1 421 ? -16.461 -4.889 -6.181 1.00 20.09 ? 421 ASP A CB 1 ATOM 3302 C CG . ASP A 1 421 ? -16.072 -4.458 -4.778 1.00 21.96 ? 421 ASP A CG 1 ATOM 3303 O OD1 . ASP A 1 421 ? -16.679 -3.498 -4.247 1.00 22.34 ? 421 ASP A OD1 1 ATOM 3304 O OD2 . ASP A 1 421 ? -15.162 -5.097 -4.200 1.00 23.30 ? 421 ASP A OD2 1 ATOM 3305 N N . TRP A 1 422 ? -17.298 -4.362 -9.362 1.00 15.05 ? 422 TRP A N 1 ATOM 3306 C CA . TRP A 1 422 ? -16.807 -4.653 -10.708 1.00 14.55 ? 422 TRP A CA 1 ATOM 3307 C C . TRP A 1 422 ? -17.749 -4.185 -11.824 1.00 13.48 ? 422 TRP A C 1 ATOM 3308 O O . TRP A 1 422 ? -18.962 -4.074 -11.630 1.00 12.30 ? 422 TRP A O 1 ATOM 3309 C CB . TRP A 1 422 ? -16.487 -6.151 -10.858 1.00 14.46 ? 422 TRP A CB 1 ATOM 3310 C CG . TRP A 1 422 ? -17.701 -7.041 -10.741 1.00 15.01 ? 422 TRP A CG 1 ATOM 3311 C CD1 . TRP A 1 422 ? -18.212 -7.582 -9.597 1.00 14.99 ? 422 TRP A CD1 1 ATOM 3312 C CD2 . TRP A 1 422 ? -18.558 -7.480 -11.811 1.00 14.83 ? 422 TRP A CD2 1 ATOM 3313 N NE1 . TRP A 1 422 ? -19.333 -8.338 -9.888 1.00 15.37 ? 422 TRP A NE1 1 ATOM 3314 C CE2 . TRP A 1 422 ? -19.570 -8.286 -11.235 1.00 14.63 ? 422 TRP A CE2 1 ATOM 3315 C CE3 . TRP A 1 422 ? -18.574 -7.263 -13.196 1.00 14.22 ? 422 TRP A CE3 1 ATOM 3316 C CZ2 . TRP A 1 422 ? -20.583 -8.884 -11.996 1.00 14.33 ? 422 TRP A CZ2 1 ATOM 3317 C CZ3 . TRP A 1 422 ? -19.587 -7.862 -13.956 1.00 14.54 ? 422 TRP A CZ3 1 ATOM 3318 C CH2 . TRP A 1 422 ? -20.571 -8.667 -13.350 1.00 14.07 ? 422 TRP A CH2 1 ATOM 3319 N N . GLY A 1 423 ? -17.157 -3.920 -12.987 1.00 13.09 ? 423 GLY A N 1 ATOM 3320 C CA . GLY A 1 423 ? -17.900 -3.676 -14.216 1.00 12.65 ? 423 GLY A CA 1 ATOM 3321 C C . GLY A 1 423 ? -17.250 -4.376 -15.396 1.00 12.80 ? 423 GLY A C 1 ATOM 3322 O O . GLY A 1 423 ? -16.340 -5.194 -15.232 1.00 12.39 ? 423 GLY A O 1 ATOM 3323 N N . MET A 1 424 ? -17.730 -4.052 -16.596 1.00 12.62 ? 424 MET A N 1 ATOM 3324 C CA . MET A 1 424 ? -17.149 -4.550 -17.833 1.00 11.67 ? 424 MET A CA 1 ATOM 3325 C C . MET A 1 424 ? -16.950 -3.369 -18.767 1.00 11.06 ? 424 MET A C 1 ATOM 3326 O O . MET A 1 424 ? -17.633 -2.354 -18.642 1.00 11.41 ? 424 MET A O 1 ATOM 3327 C CB . MET A 1 424 ? -18.039 -5.637 -18.447 1.00 11.91 ? 424 MET A CB 1 ATOM 3328 C CG . MET A 1 424 ? -18.205 -6.849 -17.536 1.00 12.01 ? 424 MET A CG 1 ATOM 3329 S SD . MET A 1 424 ? -19.035 -8.241 -18.306 1.00 12.85 ? 424 MET A SD 1 ATOM 3330 C CE . MET A 1 424 ? -18.581 -9.573 -17.210 1.00 12.31 ? 424 MET A CE 1 ATOM 3331 N N . TYR A 1 425 ? -16.008 -3.501 -19.694 1.00 10.20 ? 425 TYR A N 1 ATOM 3332 C CA . TYR A 1 425 ? -15.554 -2.396 -20.539 1.00 9.86 ? 425 TYR A CA 1 ATOM 3333 C C . TYR A 1 425 ? -16.021 -2.593 -21.985 1.00 9.80 ? 425 TYR A C 1 ATOM 3334 O O . TYR A 1 425 ? -15.562 -3.513 -22.674 1.00 10.14 ? 425 TYR A O 1 ATOM 3335 C CB . TYR A 1 425 ? -14.027 -2.325 -20.434 1.00 9.61 ? 425 TYR A CB 1 ATOM 3336 C CG . TYR A 1 425 ? -13.272 -1.349 -21.313 1.00 9.55 ? 425 TYR A CG 1 ATOM 3337 C CD1 . TYR A 1 425 ? -13.663 -0.011 -21.429 1.00 9.72 ? 425 TYR A CD1 1 ATOM 3338 C CD2 . TYR A 1 425 ? -12.114 -1.753 -21.979 1.00 9.42 ? 425 TYR A CD2 1 ATOM 3339 C CE1 . TYR A 1 425 ? -12.946 0.877 -22.216 1.00 9.61 ? 425 TYR A CE1 1 ATOM 3340 C CE2 . TYR A 1 425 ? -11.388 -0.874 -22.760 1.00 9.50 ? 425 TYR A CE2 1 ATOM 3341 C CZ . TYR A 1 425 ? -11.802 0.446 -22.870 1.00 9.82 ? 425 TYR A CZ 1 ATOM 3342 O OH . TYR A 1 425 ? -11.075 1.341 -23.644 1.00 10.17 ? 425 TYR A OH 1 ATOM 3343 N N . ILE A 1 426 ? -16.932 -1.732 -22.437 1.00 9.53 ? 426 ILE A N 1 ATOM 3344 C CA . ILE A 1 426 ? -17.526 -1.848 -23.788 1.00 9.66 ? 426 ILE A CA 1 ATOM 3345 C C . ILE A 1 426 ? -16.534 -1.783 -24.993 1.00 9.59 ? 426 ILE A C 1 ATOM 3346 O O . ILE A 1 426 ? -16.883 -2.180 -26.109 1.00 9.47 ? 426 ILE A O 1 ATOM 3347 C CB . ILE A 1 426 ? -18.793 -0.937 -23.968 1.00 9.22 ? 426 ILE A CB 1 ATOM 3348 C CG1 . ILE A 1 426 ? -19.677 -1.431 -25.126 1.00 9.31 ? 426 ILE A CG1 1 ATOM 3349 C CG2 . ILE A 1 426 ? -18.414 0.509 -24.115 1.00 9.23 ? 426 ILE A CG2 1 ATOM 3350 C CD1 . ILE A 1 426 ? -21.010 -0.662 -25.287 1.00 9.04 ? 426 ILE A CD1 1 ATOM 3351 N N . ASN A 1 427 ? -15.307 -1.306 -24.781 1.00 9.50 ? 427 ASN A N 1 ATOM 3352 C CA . ASN A 1 427 ? -14.304 -1.429 -25.853 1.00 9.67 ? 427 ASN A CA 1 ATOM 3353 C C . ASN A 1 427 ? -13.788 -2.849 -26.031 1.00 9.75 ? 427 ASN A C 1 ATOM 3354 O O . ASN A 1 427 ? -13.170 -3.169 -27.053 1.00 9.77 ? 427 ASN A O 1 ATOM 3355 C CB . ASN A 1 427 ? -13.148 -0.437 -25.706 1.00 9.68 ? 427 ASN A CB 1 ATOM 3356 C CG . ASN A 1 427 ? -13.443 0.907 -26.380 1.00 9.89 ? 427 ASN A CG 1 ATOM 3357 O OD1 . ASN A 1 427 ? -14.312 0.996 -27.261 1.00 9.38 ? 427 ASN A OD1 1 ATOM 3358 N ND2 . ASN A 1 427 ? -12.722 1.957 -25.962 1.00 9.82 ? 427 ASN A ND2 1 ATOM 3359 N N . TYR A 1 428 ? -14.036 -3.688 -25.024 1.00 9.63 ? 428 TYR A N 1 ATOM 3360 C CA . TYR A 1 428 ? -13.824 -5.123 -25.139 1.00 9.86 ? 428 TYR A CA 1 ATOM 3361 C C . TYR A 1 428 ? -15.195 -5.798 -25.134 1.00 10.04 ? 428 TYR A C 1 ATOM 3362 O O . TYR A 1 428 ? -15.504 -6.637 -24.281 1.00 10.20 ? 428 TYR A O 1 ATOM 3363 C CB . TYR A 1 428 ? -12.932 -5.634 -24.001 1.00 9.62 ? 428 TYR A CB 1 ATOM 3364 C CG . TYR A 1 428 ? -11.503 -5.093 -23.990 1.00 9.30 ? 428 TYR A CG 1 ATOM 3365 C CD1 . TYR A 1 428 ? -10.850 -4.733 -25.186 1.00 9.18 ? 428 TYR A CD1 1 ATOM 3366 C CD2 . TYR A 1 428 ? -10.789 -4.985 -22.789 1.00 9.15 ? 428 TYR A CD2 1 ATOM 3367 C CE1 . TYR A 1 428 ? -9.547 -4.256 -25.182 1.00 9.07 ? 428 TYR A CE1 1 ATOM 3368 C CE2 . TYR A 1 428 ? -9.465 -4.501 -22.767 1.00 8.98 ? 428 TYR A CE2 1 ATOM 3369 C CZ . TYR A 1 428 ? -8.855 -4.144 -23.970 1.00 9.27 ? 428 TYR A CZ 1 ATOM 3370 O OH . TYR A 1 428 ? -7.561 -3.667 -23.979 1.00 9.27 ? 428 TYR A OH 1 ATOM 3371 N N . ALA A 1 429 ? -16.004 -5.403 -26.108 1.00 10.25 ? 429 ALA A N 1 ATOM 3372 C CA . ALA A 1 429 ? -17.426 -5.749 -26.196 1.00 10.46 ? 429 ALA A CA 1 ATOM 3373 C C . ALA A 1 429 ? -17.729 -7.259 -26.223 1.00 10.83 ? 429 ALA A C 1 ATOM 3374 O O . ALA A 1 429 ? -17.248 -8.002 -27.097 1.00 11.30 ? 429 ALA A O 1 ATOM 3375 C CB . ALA A 1 429 ? -18.032 -5.066 -27.420 1.00 10.36 ? 429 ALA A CB 1 ATOM 3376 N N . ASP A 1 430 ? -18.550 -7.688 -25.273 1.00 10.81 ? 430 ASP A N 1 ATOM 3377 C CA . ASP A 1 430 ? -18.954 -9.077 -25.112 1.00 11.07 ? 430 ASP A CA 1 ATOM 3378 C C . ASP A 1 430 ? -20.449 -9.235 -25.426 1.00 11.11 ? 430 ASP A C 1 ATOM 3379 O O . ASP A 1 430 ? -21.297 -8.924 -24.590 1.00 11.17 ? 430 ASP A O 1 ATOM 3380 C CB . ASP A 1 430 ? -18.638 -9.486 -23.667 1.00 11.75 ? 430 ASP A CB 1 ATOM 3381 C CG . ASP A 1 430 ? -19.170 -10.871 -23.274 1.00 11.55 ? 430 ASP A CG 1 ATOM 3382 O OD1 . ASP A 1 430 ? -19.623 -11.674 -24.118 1.00 11.27 ? 430 ASP A OD1 1 ATOM 3383 O OD2 . ASP A 1 430 ? -19.123 -11.137 -22.060 1.00 12.01 ? 430 ASP A OD2 1 ATOM 3384 N N . PRO A 1 431 ? -20.783 -9.734 -26.630 1.00 11.54 ? 431 PRO A N 1 ATOM 3385 C CA . PRO A 1 431 ? -22.209 -9.728 -27.031 1.00 12.14 ? 431 PRO A CA 1 ATOM 3386 C C . PRO A 1 431 ? -23.115 -10.713 -26.288 1.00 12.31 ? 431 PRO A C 1 ATOM 3387 O O . PRO A 1 431 ? -24.323 -10.695 -26.498 1.00 12.75 ? 431 PRO A O 1 ATOM 3388 C CB . PRO A 1 431 ? -22.167 -10.085 -28.518 1.00 11.84 ? 431 PRO A CB 1 ATOM 3389 C CG . PRO A 1 431 ? -20.871 -10.823 -28.707 1.00 11.81 ? 431 PRO A CG 1 ATOM 3390 C CD . PRO A 1 431 ? -19.912 -10.375 -27.636 1.00 11.46 ? 431 PRO A CD 1 ATOM 3391 N N . ARG A 1 432 ? -22.557 -11.558 -25.426 1.00 12.81 ? 432 ARG A N 1 ATOM 3392 C CA . ARG A 1 432 ? -23.363 -12.613 -24.796 1.00 13.09 ? 432 ARG A CA 1 ATOM 3393 C C . ARG A 1 432 ? -24.030 -12.172 -23.473 1.00 13.91 ? 432 ARG A C 1 ATOM 3394 O O . ARG A 1 432 ? -23.952 -12.840 -22.439 1.00 14.69 ? 432 ARG A O 1 ATOM 3395 C CB . ARG A 1 432 ? -22.567 -13.919 -24.706 1.00 12.21 ? 432 ARG A CB 1 ATOM 3396 C CG . ARG A 1 432 ? -22.278 -14.520 -26.093 1.00 11.84 ? 432 ARG A CG 1 ATOM 3397 C CD . ARG A 1 432 ? -21.338 -15.729 -26.062 1.00 11.74 ? 432 ARG A CD 1 ATOM 3398 N NE . ARG A 1 432 ? -21.916 -16.881 -25.375 1.00 12.02 ? 432 ARG A NE 1 ATOM 3399 C CZ . ARG A 1 432 ? -21.662 -17.225 -24.109 1.00 12.19 ? 432 ARG A CZ 1 ATOM 3400 N NH1 . ARG A 1 432 ? -20.814 -16.519 -23.353 1.00 11.78 ? 432 ARG A NH1 1 ATOM 3401 N NH2 . ARG A 1 432 ? -22.252 -18.297 -23.593 1.00 11.99 ? 432 ARG A NH2 1 ATOM 3402 N N . MET A 1 433 ? -24.692 -11.018 -23.542 1.00 14.63 ? 433 MET A N 1 ATOM 3403 C CA . MET A 1 433 ? -25.410 -10.410 -22.419 1.00 15.00 ? 433 MET A CA 1 ATOM 3404 C C . MET A 1 433 ? -26.584 -9.643 -23.034 1.00 15.47 ? 433 MET A C 1 ATOM 3405 O O . MET A 1 433 ? -26.409 -8.960 -24.056 1.00 14.83 ? 433 MET A O 1 ATOM 3406 C CB . MET A 1 433 ? -24.514 -9.434 -21.636 1.00 15.22 ? 433 MET A CB 1 ATOM 3407 C CG . MET A 1 433 ? -23.170 -10.000 -21.096 1.00 16.05 ? 433 MET A CG 1 ATOM 3408 S SD . MET A 1 433 ? -22.256 -8.826 -20.038 1.00 16.61 ? 433 MET A SD 1 ATOM 3409 C CE . MET A 1 433 ? -21.550 -7.747 -21.294 1.00 16.48 ? 433 MET A CE 1 ATOM 3410 N N . ASP A 1 434 ? -27.774 -9.771 -22.438 1.00 15.20 ? 434 ASP A N 1 ATOM 3411 C CA . ASP A 1 434 ? -28.942 -9.042 -22.916 1.00 15.51 ? 434 ASP A CA 1 ATOM 3412 C C . ASP A 1 434 ? -28.756 -7.533 -22.696 1.00 15.38 ? 434 ASP A C 1 ATOM 3413 O O . ASP A 1 434 ? -27.815 -7.099 -22.001 1.00 14.67 ? 434 ASP A O 1 ATOM 3414 C CB . ASP A 1 434 ? -30.241 -9.567 -22.273 1.00 16.96 ? 434 ASP A CB 1 ATOM 3415 C CG . ASP A 1 434 ? -30.318 -9.308 -20.759 1.00 19.01 ? 434 ASP A CG 1 ATOM 3416 O OD1 . ASP A 1 434 ? -30.249 -8.141 -20.302 1.00 18.04 ? 434 ASP A OD1 1 ATOM 3417 O OD2 . ASP A 1 434 ? -30.473 -10.296 -20.011 1.00 23.07 ? 434 ASP A OD2 1 ATOM 3418 N N . ARG A 1 435 ? -29.651 -6.741 -23.278 1.00 14.47 ? 435 ARG A N 1 ATOM 3419 C CA . ARG A 1 435 ? -29.491 -5.294 -23.316 1.00 14.64 ? 435 ARG A CA 1 ATOM 3420 C C . ARG A 1 435 ? -29.444 -4.669 -21.924 1.00 15.08 ? 435 ARG A C 1 ATOM 3421 O O . ARG A 1 435 ? -28.672 -3.734 -21.678 1.00 14.40 ? 435 ARG A O 1 ATOM 3422 C CB . ARG A 1 435 ? -30.588 -4.652 -24.168 1.00 14.47 ? 435 ARG A CB 1 ATOM 3423 C CG . ARG A 1 435 ? -30.316 -3.201 -24.524 1.00 14.66 ? 435 ARG A CG 1 ATOM 3424 C CD . ARG A 1 435 ? -31.372 -2.682 -25.460 1.00 14.77 ? 435 ARG A CD 1 ATOM 3425 N NE . ARG A 1 435 ? -31.245 -1.253 -25.703 1.00 14.29 ? 435 ARG A NE 1 ATOM 3426 C CZ . ARG A 1 435 ? -31.972 -0.586 -26.592 1.00 14.00 ? 435 ARG A CZ 1 ATOM 3427 N NH1 . ARG A 1 435 ? -32.871 -1.228 -27.324 1.00 13.39 ? 435 ARG A NH1 1 ATOM 3428 N NH2 . ARG A 1 435 ? -31.788 0.716 -26.760 1.00 14.16 ? 435 ARG A NH2 1 ATOM 3429 N N . ASP A 1 436 ? -30.241 -5.210 -21.008 1.00 16.13 ? 436 ASP A N 1 ATOM 3430 C CA . ASP A 1 436 ? -30.305 -4.649 -19.673 1.00 18.03 ? 436 ASP A CA 1 ATOM 3431 C C . ASP A 1 436 ? -29.087 -4.969 -18.840 1.00 17.47 ? 436 ASP A C 1 ATOM 3432 O O . ASP A 1 436 ? -28.499 -4.072 -18.248 1.00 17.65 ? 436 ASP A O 1 ATOM 3433 C CB . ASP A 1 436 ? -31.577 -5.072 -18.952 1.00 19.93 ? 436 ASP A CB 1 ATOM 3434 C CG . ASP A 1 436 ? -32.810 -4.599 -19.663 1.00 22.35 ? 436 ASP A CG 1 ATOM 3435 O OD1 . ASP A 1 436 ? -32.848 -3.415 -20.080 1.00 23.41 ? 436 ASP A OD1 1 ATOM 3436 O OD2 . ASP A 1 436 ? -33.727 -5.424 -19.830 1.00 24.78 ? 436 ASP A OD2 1 ATOM 3437 N N . TYR A 1 437 ? -28.722 -6.245 -18.799 1.00 17.47 ? 437 TYR A N 1 ATOM 3438 C CA . TYR A 1 437 ? -27.557 -6.697 -18.056 1.00 18.25 ? 437 TYR A CA 1 ATOM 3439 C C . TYR A 1 437 ? -26.282 -6.014 -18.548 1.00 17.56 ? 437 TYR A C 1 ATOM 3440 O O . TYR A 1 437 ? -25.516 -5.474 -17.744 1.00 17.11 ? 437 TYR A O 1 ATOM 3441 C CB . TYR A 1 437 ? -27.428 -8.221 -18.133 1.00 19.66 ? 437 TYR A CB 1 ATOM 3442 C CG . TYR A 1 437 ? -26.370 -8.795 -17.222 1.00 22.13 ? 437 TYR A CG 1 ATOM 3443 C CD1 . TYR A 1 437 ? -26.654 -9.089 -15.883 1.00 22.59 ? 437 TYR A CD1 1 ATOM 3444 C CD2 . TYR A 1 437 ? -25.073 -9.039 -17.694 1.00 22.56 ? 437 TYR A CD2 1 ATOM 3445 C CE1 . TYR A 1 437 ? -25.670 -9.621 -15.043 1.00 23.39 ? 437 TYR A CE1 1 ATOM 3446 C CE2 . TYR A 1 437 ? -24.092 -9.566 -16.870 1.00 22.42 ? 437 TYR A CE2 1 ATOM 3447 C CZ . TYR A 1 437 ? -24.393 -9.853 -15.549 1.00 23.74 ? 437 TYR A CZ 1 ATOM 3448 O OH . TYR A 1 437 ? -23.411 -10.369 -14.741 1.00 25.11 ? 437 TYR A OH 1 ATOM 3449 N N . ALA A 1 438 ? -26.078 -6.006 -19.868 1.00 17.20 ? 438 ALA A N 1 ATOM 3450 C CA . ALA A 1 438 ? -24.858 -5.448 -20.446 1.00 16.22 ? 438 ALA A CA 1 ATOM 3451 C C . ALA A 1 438 ? -24.688 -3.966 -20.145 1.00 15.76 ? 438 ALA A C 1 ATOM 3452 O O . ALA A 1 438 ? -23.594 -3.527 -19.788 1.00 15.66 ? 438 ALA A O 1 ATOM 3453 C CB . ALA A 1 438 ? -24.794 -5.708 -21.935 1.00 16.25 ? 438 ALA A CB 1 ATOM 3454 N N . THR A 1 439 ? -25.762 -3.192 -20.269 1.00 15.79 ? 439 THR A N 1 ATOM 3455 C CA . THR A 1 439 ? -25.664 -1.759 -19.988 1.00 15.68 ? 439 THR A CA 1 ATOM 3456 C C . THR A 1 439 ? -25.549 -1.453 -18.493 1.00 15.95 ? 439 THR A C 1 ATOM 3457 O O . THR A 1 439 ? -25.013 -0.416 -18.100 1.00 16.30 ? 439 THR A O 1 ATOM 3458 C CB . THR A 1 439 ? -26.772 -0.933 -20.679 1.00 16.03 ? 439 THR A CB 1 ATOM 3459 O OG1 . THR A 1 439 ? -28.063 -1.353 -20.224 1.00 15.72 ? 439 THR A OG1 1 ATOM 3460 C CG2 . THR A 1 439 ? -26.683 -1.079 -22.203 1.00 15.39 ? 439 THR A CG2 1 ATOM 3461 N N . LYS A 1 440 ? -26.012 -2.376 -17.659 1.00 17.11 ? 440 LYS A N 1 ATOM 3462 C CA . LYS A 1 440 ? -25.768 -2.287 -16.220 1.00 18.10 ? 440 LYS A CA 1 ATOM 3463 C C . LYS A 1 440 ? -24.250 -2.363 -15.938 1.00 16.67 ? 440 LYS A C 1 ATOM 3464 O O . LYS A 1 440 ? -23.714 -1.542 -15.190 1.00 16.58 ? 440 LYS A O 1 ATOM 3465 C CB . LYS A 1 440 ? -26.563 -3.375 -15.473 1.00 20.97 ? 440 LYS A CB 1 ATOM 3466 C CG . LYS A 1 440 ? -26.632 -3.230 -13.946 1.00 25.62 ? 440 LYS A CG 1 ATOM 3467 C CD . LYS A 1 440 ? -27.228 -4.487 -13.240 1.00 28.72 ? 440 LYS A CD 1 ATOM 3468 C CE . LYS A 1 440 ? -26.271 -5.709 -13.269 1.00 30.65 ? 440 LYS A CE 1 ATOM 3469 N NZ . LYS A 1 440 ? -26.748 -6.908 -12.490 1.00 31.30 ? 440 LYS A NZ 1 ATOM 3470 N N . VAL A 1 441 ? -23.566 -3.310 -16.580 1.00 14.46 ? 441 VAL A N 1 ATOM 3471 C CA . VAL A 1 441 ? -22.158 -3.591 -16.287 1.00 13.56 ? 441 VAL A CA 1 ATOM 3472 C C . VAL A 1 441 ? -21.173 -2.717 -17.066 1.00 13.34 ? 441 VAL A C 1 ATOM 3473 O O . VAL A 1 441 ? -20.079 -2.427 -16.560 1.00 13.23 ? 441 VAL A O 1 ATOM 3474 C CB . VAL A 1 441 ? -21.783 -5.125 -16.434 1.00 13.51 ? 441 VAL A CB 1 ATOM 3475 C CG1 . VAL A 1 441 ? -22.684 -6.000 -15.550 1.00 12.91 ? 441 VAL A CG1 1 ATOM 3476 C CG2 . VAL A 1 441 ? -21.811 -5.602 -17.898 1.00 12.89 ? 441 VAL A CG2 1 ATOM 3477 N N . TYR A 1 442 ? -21.559 -2.301 -18.275 1.00 12.17 ? 442 TYR A N 1 ATOM 3478 C CA . TYR A 1 442 ? -20.752 -1.371 -19.071 1.00 11.98 ? 442 TYR A CA 1 ATOM 3479 C C . TYR A 1 442 ? -20.744 0.051 -18.491 1.00 11.81 ? 442 TYR A C 1 ATOM 3480 O O . TYR A 1 442 ? -19.742 0.767 -18.600 1.00 11.75 ? 442 TYR A O 1 ATOM 3481 C CB . TYR A 1 442 ? -21.222 -1.296 -20.543 1.00 11.94 ? 442 TYR A CB 1 ATOM 3482 C CG . TYR A 1 442 ? -20.951 -2.514 -21.430 1.00 11.78 ? 442 TYR A CG 1 ATOM 3483 C CD1 . TYR A 1 442 ? -19.786 -3.275 -21.300 1.00 11.47 ? 442 TYR A CD1 1 ATOM 3484 C CD2 . TYR A 1 442 ? -21.850 -2.865 -22.443 1.00 11.60 ? 442 TYR A CD2 1 ATOM 3485 C CE1 . TYR A 1 442 ? -19.549 -4.391 -22.141 1.00 11.55 ? 442 TYR A CE1 1 ATOM 3486 C CE2 . TYR A 1 442 ? -21.625 -3.964 -23.277 1.00 11.30 ? 442 TYR A CE2 1 ATOM 3487 C CZ . TYR A 1 442 ? -20.477 -4.721 -23.125 1.00 11.43 ? 442 TYR A CZ 1 ATOM 3488 O OH . TYR A 1 442 ? -20.259 -5.791 -23.965 1.00 10.82 ? 442 TYR A OH 1 ATOM 3489 N N . TYR A 1 443 ? -21.853 0.469 -17.889 1.00 11.46 ? 443 TYR A N 1 ATOM 3490 C CA . TYR A 1 443 ? -21.993 1.879 -17.514 1.00 11.75 ? 443 TYR A CA 1 ATOM 3491 C C . TYR A 1 443 ? -22.160 2.221 -16.021 1.00 12.18 ? 443 TYR A C 1 ATOM 3492 O O . TYR A 1 443 ? -22.108 3.393 -15.658 1.00 12.39 ? 443 TYR A O 1 ATOM 3493 C CB . TYR A 1 443 ? -23.058 2.556 -18.379 1.00 10.98 ? 443 TYR A CB 1 ATOM 3494 C CG . TYR A 1 443 ? -22.738 2.484 -19.861 1.00 10.56 ? 443 TYR A CG 1 ATOM 3495 C CD1 . TYR A 1 443 ? -21.583 3.097 -20.378 1.00 10.04 ? 443 TYR A CD1 1 ATOM 3496 C CD2 . TYR A 1 443 ? -23.570 1.789 -20.742 1.00 9.90 ? 443 TYR A CD2 1 ATOM 3497 C CE1 . TYR A 1 443 ? -21.292 3.036 -21.724 1.00 9.64 ? 443 TYR A CE1 1 ATOM 3498 C CE2 . TYR A 1 443 ? -23.274 1.721 -22.097 1.00 9.73 ? 443 TYR A CE2 1 ATOM 3499 C CZ . TYR A 1 443 ? -22.141 2.352 -22.576 1.00 9.49 ? 443 TYR A CZ 1 ATOM 3500 O OH . TYR A 1 443 ? -21.853 2.291 -23.909 1.00 9.47 ? 443 TYR A OH 1 ATOM 3501 N N . GLY A 1 444 ? -22.349 1.205 -15.178 1.00 12.34 ? 444 GLY A N 1 ATOM 3502 C CA . GLY A 1 444 ? -22.260 1.364 -13.726 1.00 13.25 ? 444 GLY A CA 1 ATOM 3503 C C . GLY A 1 444 ? -23.128 2.466 -13.159 1.00 13.83 ? 444 GLY A C 1 ATOM 3504 O O . GLY A 1 444 ? -24.318 2.563 -13.493 1.00 13.62 ? 444 GLY A O 1 ATOM 3505 N N . GLU A 1 445 ? -22.524 3.302 -12.317 1.00 14.52 ? 445 GLU A N 1 ATOM 3506 C CA . GLU A 1 445 ? -23.227 4.423 -11.671 1.00 15.57 ? 445 GLU A CA 1 ATOM 3507 C C . GLU A 1 445 ? -23.703 5.525 -12.636 1.00 15.27 ? 445 GLU A C 1 ATOM 3508 O O . GLU A 1 445 ? -24.481 6.384 -12.233 1.00 15.39 ? 445 GLU A O 1 ATOM 3509 C CB . GLU A 1 445 ? -22.379 5.028 -10.533 1.00 16.64 ? 445 GLU A CB 1 ATOM 3510 C CG . GLU A 1 445 ? -21.104 5.735 -10.974 1.00 18.41 ? 445 GLU A CG 1 ATOM 3511 C CD . GLU A 1 445 ? -20.301 6.306 -9.797 1.00 20.92 ? 445 GLU A CD 1 ATOM 3512 O OE1 . GLU A 1 445 ? -19.215 5.763 -9.471 1.00 23.76 ? 445 GLU A OE1 1 ATOM 3513 O OE2 . GLU A 1 445 ? -20.740 7.304 -9.196 1.00 20.65 ? 445 GLU A OE2 1 ATOM 3514 N N . ASN A 1 446 ? -23.243 5.489 -13.893 1.00 14.10 ? 446 ASN A N 1 ATOM 3515 C CA . ASN A 1 446 ? -23.594 6.487 -14.902 1.00 13.72 ? 446 ASN A CA 1 ATOM 3516 C C . ASN A 1 446 ? -24.777 6.096 -15.805 1.00 13.87 ? 446 ASN A C 1 ATOM 3517 O O . ASN A 1 446 ? -25.229 6.895 -16.629 1.00 13.17 ? 446 ASN A O 1 ATOM 3518 C CB . ASN A 1 446 ? -22.360 6.854 -15.747 1.00 13.63 ? 446 ASN A CB 1 ATOM 3519 C CG . ASN A 1 446 ? -21.425 7.836 -15.036 1.00 14.06 ? 446 ASN A CG 1 ATOM 3520 O OD1 . ASN A 1 446 ? -21.830 8.532 -14.118 1.00 14.12 ? 446 ASN A OD1 1 ATOM 3521 N ND2 . ASN A 1 446 ? -20.165 7.894 -15.470 1.00 14.87 ? 446 ASN A ND2 1 ATOM 3522 N N . LEU A 1 447 ? -25.282 4.876 -15.634 1.00 14.44 ? 447 LEU A N 1 ATOM 3523 C CA . LEU A 1 447 ? -26.355 4.343 -16.474 1.00 15.45 ? 447 LEU A CA 1 ATOM 3524 C C . LEU A 1 447 ? -27.688 5.112 -16.408 1.00 16.91 ? 447 LEU A C 1 ATOM 3525 O O . LEU A 1 447 ? -28.348 5.282 -17.431 1.00 17.15 ? 447 LEU A O 1 ATOM 3526 C CB . LEU A 1 447 ? -26.597 2.856 -16.184 1.00 15.13 ? 447 LEU A CB 1 ATOM 3527 C CG . LEU A 1 447 ? -27.614 2.153 -17.111 1.00 15.35 ? 447 LEU A CG 1 ATOM 3528 C CD1 . LEU A 1 447 ? -27.189 2.195 -18.586 1.00 15.02 ? 447 LEU A CD1 1 ATOM 3529 C CD2 . LEU A 1 447 ? -27.880 0.724 -16.682 1.00 14.80 ? 447 LEU A CD2 1 ATOM 3530 N N . ALA A 1 448 ? -28.088 5.548 -15.215 1.00 17.61 ? 448 ALA A N 1 ATOM 3531 C CA . ALA A 1 448 ? -29.339 6.296 -15.051 1.00 18.66 ? 448 ALA A CA 1 ATOM 3532 C C . ALA A 1 448 ? -29.327 7.630 -15.828 1.00 19.21 ? 448 ALA A C 1 ATOM 3533 O O . ALA A 1 448 ? -30.323 7.992 -16.453 1.00 19.54 ? 448 ALA A O 1 ATOM 3534 C CB . ALA A 1 448 ? -29.656 6.520 -13.559 1.00 16.47 ? 448 ALA A CB 1 ATOM 3535 N N . ARG A 1 449 ? -28.207 8.351 -15.782 1.00 19.78 ? 449 ARG A N 1 ATOM 3536 C CA . ARG A 1 449 ? -28.051 9.588 -16.555 1.00 21.31 ? 449 ARG A CA 1 ATOM 3537 C C . ARG A 1 449 ? -27.975 9.334 -18.063 1.00 20.57 ? 449 ARG A C 1 ATOM 3538 O O . ARG A 1 449 ? -28.474 10.149 -18.855 1.00 20.15 ? 449 ARG A O 1 ATOM 3539 C CB . ARG A 1 449 ? -26.817 10.375 -16.112 1.00 24.42 ? 449 ARG A CB 1 ATOM 3540 C CG . ARG A 1 449 ? -27.050 11.300 -14.940 1.00 29.83 ? 449 ARG A CG 1 ATOM 3541 C CD . ARG A 1 449 ? -26.196 12.559 -15.070 1.00 35.91 ? 449 ARG A CD 1 ATOM 3542 N NE . ARG A 1 449 ? -24.953 12.467 -14.301 1.00 42.07 ? 449 ARG A NE 1 ATOM 3543 C CZ . ARG A 1 449 ? -23.871 13.221 -14.509 1.00 45.13 ? 449 ARG A CZ 1 ATOM 3544 N NH1 . ARG A 1 449 ? -22.793 13.050 -13.744 1.00 40.99 ? 449 ARG A NH1 1 ATOM 3545 N NH2 . ARG A 1 449 ? -23.855 14.135 -15.484 1.00 44.78 ? 449 ARG A NH2 1 ATOM 3546 N N . LEU A 1 450 ? -27.354 8.211 -18.449 1.00 17.79 ? 450 LEU A N 1 ATOM 3547 C CA . LEU A 1 450 ? -27.225 7.843 -19.851 1.00 15.99 ? 450 LEU A CA 1 ATOM 3548 C C . LEU A 1 450 ? -28.588 7.548 -20.452 1.00 15.79 ? 450 LEU A C 1 ATOM 3549 O O . LEU A 1 450 ? -28.905 8.027 -21.541 1.00 14.99 ? 450 LEU A O 1 ATOM 3550 C CB . LEU A 1 450 ? -26.221 6.698 -20.056 1.00 15.41 ? 450 LEU A CB 1 ATOM 3551 C CG . LEU A 1 450 ? -24.752 7.140 -19.908 1.00 15.31 ? 450 LEU A CG 1 ATOM 3552 C CD1 . LEU A 1 450 ? -23.781 5.964 -19.832 1.00 14.60 ? 450 LEU A CD1 1 ATOM 3553 C CD2 . LEU A 1 450 ? -24.343 8.101 -21.004 1.00 14.81 ? 450 LEU A CD2 1 ATOM 3554 N N . GLN A 1 451 ? -29.409 6.806 -19.713 1.00 15.95 ? 451 GLN A N 1 ATOM 3555 C CA . GLN A 1 451 ? -30.780 6.503 -20.135 1.00 16.96 ? 451 GLN A CA 1 ATOM 3556 C C . GLN A 1 451 ? -31.646 7.745 -20.380 1.00 18.18 ? 451 GLN A C 1 ATOM 3557 O O . GLN A 1 451 ? -32.378 7.801 -21.379 1.00 17.91 ? 451 GLN A O 1 ATOM 3558 C CB . GLN A 1 451 ? -31.453 5.531 -19.158 1.00 16.76 ? 451 GLN A CB 1 ATOM 3559 C CG . GLN A 1 451 ? -30.900 4.106 -19.230 1.00 15.99 ? 451 GLN A CG 1 ATOM 3560 C CD . GLN A 1 451 ? -31.306 3.246 -18.047 1.00 16.58 ? 451 GLN A CD 1 ATOM 3561 O OE1 . GLN A 1 451 ? -31.083 2.027 -18.045 1.00 15.83 ? 451 GLN A OE1 1 ATOM 3562 N NE2 . GLN A 1 451 ? -31.899 3.875 -17.023 1.00 16.88 ? 451 GLN A NE2 1 ATOM 3563 N N . LYS A 1 452 ? -31.552 8.736 -19.490 1.00 19.63 ? 452 LYS A N 1 ATOM 3564 C CA . LYS A 1 452 ? -32.288 9.996 -19.671 1.00 20.55 ? 452 LYS A CA 1 ATOM 3565 C C . LYS A 1 452 ? -31.771 10.796 -20.868 1.00 19.41 ? 452 LYS A C 1 ATOM 3566 O O . LYS A 1 452 ? -32.560 11.373 -21.637 1.00 19.93 ? 452 LYS A O 1 ATOM 3567 C CB . LYS A 1 452 ? -32.264 10.847 -18.398 1.00 23.01 ? 452 LYS A CB 1 ATOM 3568 C CG . LYS A 1 452 ? -33.147 10.308 -17.292 1.00 26.48 ? 452 LYS A CG 1 ATOM 3569 C CD . LYS A 1 452 ? -32.574 10.589 -15.917 1.00 30.29 ? 452 LYS A CD 1 ATOM 3570 C CE . LYS A 1 452 ? -32.713 12.052 -15.510 1.00 34.06 ? 452 LYS A CE 1 ATOM 3571 N NZ . LYS A 1 452 ? -31.851 12.347 -14.311 1.00 39.78 ? 452 LYS A NZ 1 ATOM 3572 N N . LEU A 1 453 ? -30.451 10.829 -21.018 1.00 17.45 ? 453 LEU A N 1 ATOM 3573 C CA . LEU A 1 453 ? -29.817 11.464 -22.173 1.00 16.66 ? 453 LEU A CA 1 ATOM 3574 C C . LEU A 1 453 ? -30.229 10.775 -23.481 1.00 16.68 ? 453 LEU A C 1 ATOM 3575 O O . LEU A 1 453 ? -30.444 11.438 -24.497 1.00 17.94 ? 453 LEU A O 1 ATOM 3576 C CB . LEU A 1 453 ? -28.297 11.440 -22.010 1.00 15.91 ? 453 LEU A CB 1 ATOM 3577 C CG . LEU A 1 453 ? -27.498 12.281 -22.989 1.00 16.32 ? 453 LEU A CG 1 ATOM 3578 C CD1 . LEU A 1 453 ? -27.727 13.787 -22.754 1.00 15.15 ? 453 LEU A CD1 1 ATOM 3579 C CD2 . LEU A 1 453 ? -26.011 11.911 -22.912 1.00 16.23 ? 453 LEU A CD2 1 ATOM 3580 N N . LYS A 1 454 ? -30.373 9.453 -23.430 1.00 15.83 ? 454 LYS A N 1 ATOM 3581 C CA . LYS A 1 454 ? -30.760 8.648 -24.580 1.00 15.63 ? 454 LYS A CA 1 ATOM 3582 C C . LYS A 1 454 ? -32.182 8.990 -25.007 1.00 16.07 ? 454 LYS A C 1 ATOM 3583 O O . LYS A 1 454 ? -32.504 8.981 -26.197 1.00 15.85 ? 454 LYS A O 1 ATOM 3584 C CB . LYS A 1 454 ? -30.643 7.154 -24.228 1.00 15.46 ? 454 LYS A CB 1 ATOM 3585 C CG . LYS A 1 454 ? -30.974 6.177 -25.347 1.00 15.72 ? 454 LYS A CG 1 ATOM 3586 C CD . LYS A 1 454 ? -29.817 6.003 -26.329 1.00 16.19 ? 454 LYS A CD 1 ATOM 3587 C CE . LYS A 1 454 ? -30.193 5.026 -27.423 1.00 16.36 ? 454 LYS A CE 1 ATOM 3588 N NZ . LYS A 1 454 ? -29.112 4.878 -28.419 1.00 17.15 ? 454 LYS A NZ 1 ATOM 3589 N N . ALA A 1 455 ? -33.028 9.297 -24.026 1.00 16.28 ? 455 ALA A N 1 ATOM 3590 C CA . ALA A 1 455 ? -34.428 9.614 -24.274 1.00 16.32 ? 455 ALA A CA 1 ATOM 3591 C C . ALA A 1 455 ? -34.571 11.033 -24.841 1.00 16.72 ? 455 ALA A C 1 ATOM 3592 O O . ALA A 1 455 ? -35.592 11.380 -25.434 1.00 16.56 ? 455 ALA A O 1 ATOM 3593 C CB . ALA A 1 455 ? -35.246 9.447 -22.998 1.00 16.36 ? 455 ALA A CB 1 ATOM 3594 N N . LYS A 1 456 ? -33.537 11.844 -24.666 1.00 16.09 ? 456 LYS A N 1 ATOM 3595 C CA . LYS A 1 456 ? -33.510 13.157 -25.265 1.00 16.10 ? 456 LYS A CA 1 ATOM 3596 C C . LYS A 1 456 ? -32.944 13.109 -26.700 1.00 16.08 ? 456 LYS A C 1 ATOM 3597 O O . LYS A 1 456 ? -33.530 13.681 -27.617 1.00 16.17 ? 456 LYS A O 1 ATOM 3598 C CB . LYS A 1 456 ? -32.733 14.133 -24.365 1.00 16.27 ? 456 LYS A CB 1 ATOM 3599 C CG . LYS A 1 456 ? -32.649 15.559 -24.911 1.00 16.13 ? 456 LYS A CG 1 ATOM 3600 C CD . LYS A 1 456 ? -31.850 16.471 -24.009 1.00 15.42 ? 456 LYS A CD 1 ATOM 3601 C CE . LYS A 1 456 ? -31.636 17.793 -24.698 1.00 15.53 ? 456 LYS A CE 1 ATOM 3602 N NZ . LYS A 1 456 ? -30.812 18.732 -23.888 1.00 15.38 ? 456 LYS A NZ 1 ATOM 3603 N N . PHE A 1 457 ? -31.826 12.409 -26.899 1.00 16.43 ? 457 PHE A N 1 ATOM 3604 C CA . PHE A 1 457 ? -31.127 12.435 -28.195 1.00 15.65 ? 457 PHE A CA 1 ATOM 3605 C C . PHE A 1 457 ? -31.458 11.315 -29.187 1.00 16.23 ? 457 PHE A C 1 ATOM 3606 O O . PHE A 1 457 ? -31.311 11.504 -30.398 1.00 16.89 ? 457 PHE A O 1 ATOM 3607 C CB . PHE A 1 457 ? -29.616 12.591 -28.002 1.00 14.98 ? 457 PHE A CB 1 ATOM 3608 C CG . PHE A 1 457 ? -29.215 13.963 -27.527 1.00 14.89 ? 457 PHE A CG 1 ATOM 3609 C CD1 . PHE A 1 457 ? -29.149 15.033 -28.420 1.00 14.56 ? 457 PHE A CD1 1 ATOM 3610 C CD2 . PHE A 1 457 ? -28.929 14.194 -26.185 1.00 14.18 ? 457 PHE A CD2 1 ATOM 3611 C CE1 . PHE A 1 457 ? -28.790 16.311 -27.989 1.00 14.19 ? 457 PHE A CE1 1 ATOM 3612 C CE2 . PHE A 1 457 ? -28.569 15.468 -25.746 1.00 14.28 ? 457 PHE A CE2 1 ATOM 3613 C CZ . PHE A 1 457 ? -28.497 16.530 -26.650 1.00 13.89 ? 457 PHE A CZ 1 ATOM 3614 N N . ASP A 1 458 ? -31.905 10.165 -28.689 1.00 16.26 ? 458 ASP A N 1 ATOM 3615 C CA . ASP A 1 458 ? -32.341 9.064 -29.561 1.00 16.54 ? 458 ASP A CA 1 ATOM 3616 C C . ASP A 1 458 ? -33.625 8.360 -29.040 1.00 16.30 ? 458 ASP A C 1 ATOM 3617 O O . ASP A 1 458 ? -33.600 7.151 -28.789 1.00 16.67 ? 458 ASP A O 1 ATOM 3618 C CB . ASP A 1 458 ? -31.188 8.059 -29.698 1.00 17.10 ? 458 ASP A CB 1 ATOM 3619 C CG . ASP A 1 458 ? -31.329 7.107 -30.903 1.00 17.89 ? 458 ASP A CG 1 ATOM 3620 O OD1 . ASP A 1 458 ? -32.253 7.240 -31.746 1.00 17.56 ? 458 ASP A OD1 1 ATOM 3621 O OD2 . ASP A 1 458 ? -30.478 6.195 -30.988 1.00 17.81 ? 458 ASP A OD2 1 ATOM 3622 N N . PRO A 1 459 ? -34.745 9.104 -28.869 1.00 15.85 ? 459 PRO A N 1 ATOM 3623 C CA . PRO A 1 459 ? -35.967 8.460 -28.319 1.00 16.35 ? 459 PRO A CA 1 ATOM 3624 C C . PRO A 1 459 ? -36.496 7.276 -29.149 1.00 15.59 ? 459 PRO A C 1 ATOM 3625 O O . PRO A 1 459 ? -36.961 6.295 -28.576 1.00 14.47 ? 459 PRO A O 1 ATOM 3626 C CB . PRO A 1 459 ? -37.004 9.599 -28.271 1.00 16.38 ? 459 PRO A CB 1 ATOM 3627 C CG . PRO A 1 459 ? -36.462 10.679 -29.126 1.00 16.11 ? 459 PRO A CG 1 ATOM 3628 C CD . PRO A 1 459 ? -34.951 10.547 -29.091 1.00 16.40 ? 459 PRO A CD 1 ATOM 3629 N N . THR A 1 460 ? -36.377 7.346 -30.474 1.00 15.61 ? 460 THR A N 1 ATOM 3630 C CA . THR A 1 460 ? -36.858 6.256 -31.322 1.00 15.38 ? 460 THR A CA 1 ATOM 3631 C C . THR A 1 460 ? -35.878 5.081 -31.413 1.00 14.69 ? 460 THR A C 1 ATOM 3632 O O . THR A 1 460 ? -36.238 4.024 -31.928 1.00 14.65 ? 460 THR A O 1 ATOM 3633 C CB . THR A 1 460 ? -37.244 6.733 -32.743 1.00 15.93 ? 460 THR A CB 1 ATOM 3634 O OG1 . THR A 1 460 ? -36.058 7.055 -33.478 1.00 16.80 ? 460 THR A OG1 1 ATOM 3635 C CG2 . THR A 1 460 ? -38.161 7.963 -32.681 1.00 16.17 ? 460 THR A CG2 1 ATOM 3636 N N . ASP A 1 461 ? -34.653 5.257 -30.911 1.00 14.38 ? 461 ASP A N 1 ATOM 3637 C CA . ASP A 1 461 ? -33.648 4.186 -30.940 1.00 14.48 ? 461 ASP A CA 1 ATOM 3638 C C . ASP A 1 461 ? -33.216 3.952 -32.417 1.00 13.74 ? 461 ASP A C 1 ATOM 3639 O O . ASP A 1 461 ? -33.111 2.811 -32.882 1.00 13.23 ? 461 ASP A O 1 ATOM 3640 C CB . ASP A 1 461 ? -34.235 2.910 -30.298 1.00 15.88 ? 461 ASP A CB 1 ATOM 3641 C CG . ASP A 1 461 ? -33.221 2.103 -29.473 1.00 16.67 ? 461 ASP A CG 1 ATOM 3642 O OD1 . ASP A 1 461 ? -32.097 2.562 -29.217 1.00 16.64 ? 461 ASP A OD1 1 ATOM 3643 O OD2 . ASP A 1 461 ? -33.579 0.980 -29.056 1.00 18.13 ? 461 ASP A OD2 1 ATOM 3644 N N . ARG A 1 462 ? -32.994 5.060 -33.134 1.00 12.47 ? 462 ARG A N 1 ATOM 3645 C CA A ARG A 1 462 ? -32.546 5.069 -34.524 0.50 12.35 ? 462 ARG A CA 1 ATOM 3646 C CA B ARG A 1 462 ? -32.587 4.991 -34.529 0.50 12.35 ? 462 ARG A CA 1 ATOM 3647 C C . ARG A 1 462 ? -31.182 4.392 -34.658 1.00 12.17 ? 462 ARG A C 1 ATOM 3648 O O . ARG A 1 462 ? -30.866 3.770 -35.676 1.00 12.42 ? 462 ARG A O 1 ATOM 3649 C CB A ARG A 1 462 ? -32.433 6.527 -34.993 0.50 12.14 ? 462 ARG A CB 1 ATOM 3650 C CB B ARG A 1 462 ? -32.678 6.369 -35.208 0.50 12.21 ? 462 ARG A CB 1 ATOM 3651 C CG A ARG A 1 462 ? -32.182 6.734 -36.480 0.50 11.81 ? 462 ARG A CG 1 ATOM 3652 C CG B ARG A 1 462 ? -32.795 6.301 -36.735 0.50 11.79 ? 462 ARG A CG 1 ATOM 3653 C CD A ARG A 1 462 ? -33.452 7.179 -37.188 0.50 11.36 ? 462 ARG A CD 1 ATOM 3654 C CD B ARG A 1 462 ? -33.286 7.613 -37.352 0.50 11.51 ? 462 ARG A CD 1 ATOM 3655 N NE A ARG A 1 462 ? -34.190 6.049 -37.726 0.50 11.15 ? 462 ARG A NE 1 ATOM 3656 N NE B ARG A 1 462 ? -34.736 7.765 -37.285 0.50 11.41 ? 462 ARG A NE 1 ATOM 3657 C CZ A ARG A 1 462 ? -35.485 6.070 -38.016 0.50 11.23 ? 462 ARG A CZ 1 ATOM 3658 C CZ B ARG A 1 462 ? -35.368 8.830 -36.792 0.50 11.24 ? 462 ARG A CZ 1 ATOM 3659 N NH1 A ARG A 1 462 ? -36.072 4.985 -38.508 0.50 11.26 ? 462 ARG A NH1 1 ATOM 3660 N NH1 B ARG A 1 462 ? -34.691 9.861 -36.321 0.50 10.67 ? 462 ARG A NH1 1 ATOM 3661 N NH2 A ARG A 1 462 ? -36.198 7.168 -37.801 0.50 11.04 ? 462 ARG A NH2 1 ATOM 3662 N NH2 B ARG A 1 462 ? -36.691 8.866 -36.778 0.50 11.55 ? 462 ARG A NH2 1 ATOM 3663 N N . PHE A 1 463 ? -30.368 4.541 -33.616 1.00 11.85 ? 463 PHE A N 1 ATOM 3664 C CA . PHE A 1 463 ? -29.008 4.009 -33.595 1.00 11.86 ? 463 PHE A CA 1 ATOM 3665 C C . PHE A 1 463 ? -28.914 2.651 -32.888 1.00 11.88 ? 463 PHE A C 1 ATOM 3666 O O . PHE A 1 463 ? -27.841 2.250 -32.438 1.00 12.00 ? 463 PHE A O 1 ATOM 3667 C CB . PHE A 1 463 ? -28.064 5.037 -32.947 1.00 11.51 ? 463 PHE A CB 1 ATOM 3668 C CG . PHE A 1 463 ? -27.997 6.357 -33.689 1.00 11.39 ? 463 PHE A CG 1 ATOM 3669 C CD1 . PHE A 1 463 ? -27.580 6.408 -35.016 1.00 10.99 ? 463 PHE A CD1 1 ATOM 3670 C CD2 . PHE A 1 463 ? -28.349 7.546 -33.056 1.00 11.36 ? 463 PHE A CD2 1 ATOM 3671 C CE1 . PHE A 1 463 ? -27.514 7.631 -35.699 1.00 11.50 ? 463 PHE A CE1 1 ATOM 3672 C CE2 . PHE A 1 463 ? -28.286 8.774 -33.737 1.00 11.41 ? 463 PHE A CE2 1 ATOM 3673 C CZ . PHE A 1 463 ? -27.865 8.815 -35.053 1.00 11.18 ? 463 PHE A CZ 1 ATOM 3674 N N . TYR A 1 464 ? -30.049 1.957 -32.796 1.00 11.90 ? 464 TYR A N 1 ATOM 3675 C CA . TYR A 1 464 ? -30.150 0.687 -32.069 1.00 11.72 ? 464 TYR A CA 1 ATOM 3676 C C . TYR A 1 464 ? -29.002 -0.293 -32.331 1.00 11.97 ? 464 TYR A C 1 ATOM 3677 O O . TYR A 1 464 ? -28.657 -0.560 -33.486 1.00 12.23 ? 464 TYR A O 1 ATOM 3678 C CB . TYR A 1 464 ? -31.475 -0.029 -32.392 1.00 11.03 ? 464 TYR A CB 1 ATOM 3679 C CG . TYR A 1 464 ? -31.520 -1.457 -31.882 1.00 11.19 ? 464 TYR A CG 1 ATOM 3680 C CD1 . TYR A 1 464 ? -31.872 -1.734 -30.550 1.00 10.92 ? 464 TYR A CD1 1 ATOM 3681 C CD2 . TYR A 1 464 ? -31.184 -2.535 -32.718 1.00 10.96 ? 464 TYR A CD2 1 ATOM 3682 C CE1 . TYR A 1 464 ? -31.899 -3.032 -30.065 1.00 10.63 ? 464 TYR A CE1 1 ATOM 3683 C CE2 . TYR A 1 464 ? -31.210 -3.849 -32.235 1.00 10.86 ? 464 TYR A CE2 1 ATOM 3684 C CZ . TYR A 1 464 ? -31.572 -4.087 -30.906 1.00 10.91 ? 464 TYR A CZ 1 ATOM 3685 O OH . TYR A 1 464 ? -31.590 -5.374 -30.407 1.00 10.57 ? 464 TYR A OH 1 ATOM 3686 N N . TYR A 1 465 ? -28.434 -0.824 -31.249 1.00 11.45 ? 465 TYR A N 1 ATOM 3687 C CA . TYR A 1 465 ? -27.728 -2.104 -31.295 1.00 11.08 ? 465 TYR A CA 1 ATOM 3688 C C . TYR A 1 465 ? -28.066 -2.923 -30.038 1.00 10.13 ? 465 TYR A C 1 ATOM 3689 O O . TYR A 1 465 ? -28.500 -2.363 -29.044 1.00 9.72 ? 465 TYR A O 1 ATOM 3690 C CB . TYR A 1 465 ? -26.208 -1.941 -31.549 1.00 10.94 ? 465 TYR A CB 1 ATOM 3691 C CG . TYR A 1 465 ? -25.397 -1.199 -30.506 1.00 11.26 ? 465 TYR A CG 1 ATOM 3692 C CD1 . TYR A 1 465 ? -24.539 -1.889 -29.635 1.00 11.45 ? 465 TYR A CD1 1 ATOM 3693 C CD2 . TYR A 1 465 ? -25.444 0.192 -30.417 1.00 11.52 ? 465 TYR A CD2 1 ATOM 3694 C CE1 . TYR A 1 465 ? -23.754 -1.216 -28.684 1.00 11.57 ? 465 TYR A CE1 1 ATOM 3695 C CE2 . TYR A 1 465 ? -24.669 0.886 -29.463 1.00 12.12 ? 465 TYR A CE2 1 ATOM 3696 C CZ . TYR A 1 465 ? -23.820 0.177 -28.598 1.00 12.03 ? 465 TYR A CZ 1 ATOM 3697 O OH . TYR A 1 465 ? -23.051 0.872 -27.672 1.00 11.23 ? 465 TYR A OH 1 ATOM 3698 N N . PRO A 1 466 ? -27.898 -4.256 -30.091 1.00 9.91 ? 466 PRO A N 1 ATOM 3699 C CA . PRO A 1 466 ? -28.339 -5.077 -28.958 1.00 10.04 ? 466 PRO A CA 1 ATOM 3700 C C . PRO A 1 466 ? -27.847 -4.673 -27.550 1.00 10.43 ? 466 PRO A C 1 ATOM 3701 O O . PRO A 1 466 ? -28.457 -5.104 -26.569 1.00 11.14 ? 466 PRO A O 1 ATOM 3702 C CB . PRO A 1 466 ? -27.836 -6.474 -29.335 1.00 9.38 ? 466 PRO A CB 1 ATOM 3703 C CG . PRO A 1 466 ? -27.956 -6.492 -30.797 1.00 9.45 ? 466 PRO A CG 1 ATOM 3704 C CD . PRO A 1 466 ? -27.488 -5.106 -31.228 1.00 9.58 ? 466 PRO A CD 1 ATOM 3705 N N . GLN A 1 467 ? -26.781 -3.864 -27.449 1.00 10.46 ? 467 GLN A N 1 ATOM 3706 C CA . GLN A 1 467 ? -26.246 -3.405 -26.152 1.00 10.13 ? 467 GLN A CA 1 ATOM 3707 C C . GLN A 1 467 ? -26.193 -1.872 -25.994 1.00 10.33 ? 467 GLN A C 1 ATOM 3708 O O . GLN A 1 467 ? -25.359 -1.324 -25.237 1.00 9.92 ? 467 GLN A O 1 ATOM 3709 C CB . GLN A 1 467 ? -24.882 -4.044 -25.865 1.00 10.18 ? 467 GLN A CB 1 ATOM 3710 C CG . GLN A 1 467 ? -24.979 -5.526 -25.520 1.00 10.52 ? 467 GLN A CG 1 ATOM 3711 C CD . GLN A 1 467 ? -23.637 -6.181 -25.329 1.00 10.61 ? 467 GLN A CD 1 ATOM 3712 O OE1 . GLN A 1 467 ? -22.607 -5.625 -25.703 1.00 11.04 ? 467 GLN A OE1 1 ATOM 3713 N NE2 . GLN A 1 467 ? -23.636 -7.381 -24.752 1.00 10.33 ? 467 GLN A NE2 1 ATOM 3714 N N . ALA A 1 468 ? -27.080 -1.193 -26.721 1.00 10.19 ? 468 ALA A N 1 ATOM 3715 C CA . ALA A 1 468 ? -27.334 0.231 -26.541 1.00 10.75 ? 468 ALA A CA 1 ATOM 3716 C C . ALA A 1 468 ? -28.049 0.486 -25.211 1.00 11.40 ? 468 ALA A C 1 ATOM 3717 O O . ALA A 1 468 ? -28.822 -0.353 -24.721 1.00 10.77 ? 468 ALA A O 1 ATOM 3718 C CB . ALA A 1 468 ? -28.179 0.790 -27.716 1.00 10.56 ? 468 ALA A CB 1 ATOM 3719 N N . VAL A 1 469 ? -27.767 1.649 -24.631 1.00 12.01 ? 469 VAL A N 1 ATOM 3720 C CA . VAL A 1 469 ? -28.494 2.158 -23.480 1.00 12.83 ? 469 VAL A CA 1 ATOM 3721 C C . VAL A 1 469 ? -29.978 2.313 -23.874 1.00 13.71 ? 469 VAL A C 1 ATOM 3722 O O . VAL A 1 469 ? -30.269 2.755 -24.986 1.00 14.53 ? 469 VAL A O 1 ATOM 3723 C CB . VAL A 1 469 ? -27.857 3.519 -23.063 1.00 13.22 ? 469 VAL A CB 1 ATOM 3724 C CG1 . VAL A 1 469 ? -28.693 4.259 -22.032 1.00 13.14 ? 469 VAL A CG1 1 ATOM 3725 C CG2 . VAL A 1 469 ? -26.427 3.302 -22.547 1.00 12.99 ? 469 VAL A CG2 1 ATOM 3726 N N . ARG A 1 470 ? -30.906 1.925 -22.995 1.00 14.23 ? 470 ARG A N 1 ATOM 3727 C CA . ARG A 1 470 ? -32.339 2.113 -23.253 1.00 15.54 ? 470 ARG A CA 1 ATOM 3728 C C . ARG A 1 470 ? -32.743 3.556 -23.054 1.00 16.22 ? 470 ARG A C 1 ATOM 3729 O O . ARG A 1 470 ? -32.348 4.171 -22.068 1.00 15.56 ? 470 ARG A O 1 ATOM 3730 C CB . ARG A 1 470 ? -33.217 1.249 -22.331 1.00 16.00 ? 470 ARG A CB 1 ATOM 3731 C CG . ARG A 1 470 ? -33.361 -0.184 -22.780 1.00 16.02 ? 470 ARG A CG 1 ATOM 3732 C CD . ARG A 1 470 ? -34.425 -0.938 -22.004 1.00 15.13 ? 470 ARG A CD 1 ATOM 3733 N NE . ARG A 1 470 ? -34.264 -2.380 -22.192 1.00 14.94 ? 470 ARG A NE 1 ATOM 3734 C CZ . ARG A 1 470 ? -34.649 -3.063 -23.273 1.00 15.86 ? 470 ARG A CZ 1 ATOM 3735 N NH1 . ARG A 1 470 ? -35.225 -2.458 -24.299 1.00 14.95 ? 470 ARG A NH1 1 ATOM 3736 N NH2 . ARG A 1 470 ? -34.445 -4.374 -23.339 1.00 16.96 ? 470 ARG A NH2 1 ATOM 3737 N N . PRO A 1 471 ? -33.542 4.104 -23.985 1.00 17.94 ? 471 PRO A N 1 ATOM 3738 C CA . PRO A 1 471 ? -34.110 5.429 -23.705 1.00 20.06 ? 471 PRO A CA 1 ATOM 3739 C C . PRO A 1 471 ? -35.160 5.319 -22.592 1.00 21.15 ? 471 PRO A C 1 ATOM 3740 O O . PRO A 1 471 ? -36.136 4.597 -22.745 1.00 21.26 ? 471 PRO A O 1 ATOM 3741 C CB . PRO A 1 471 ? -34.747 5.840 -25.043 1.00 19.37 ? 471 PRO A CB 1 ATOM 3742 C CG . PRO A 1 471 ? -34.969 4.568 -25.782 1.00 18.74 ? 471 PRO A CG 1 ATOM 3743 C CD . PRO A 1 471 ? -33.934 3.584 -25.309 1.00 17.69 ? 471 PRO A CD 1 ATOM 3744 N N . VAL A 1 472 ? -34.909 5.977 -21.464 1.00 23.77 ? 472 VAL A N 1 ATOM 3745 C CA . VAL A 1 472 ? -35.833 5.986 -20.329 1.00 26.43 ? 472 VAL A CA 1 ATOM 3746 C C . VAL A 1 472 ? -35.989 7.418 -19.845 1.00 31.10 ? 472 VAL A C 1 ATOM 3747 O O . VAL A 1 472 ? -35.023 8.023 -19.363 1.00 33.53 ? 472 VAL A O 1 ATOM 3748 C CB . VAL A 1 472 ? -35.340 5.112 -19.148 1.00 25.85 ? 472 VAL A CB 1 ATOM 3749 C CG1 . VAL A 1 472 ? -36.398 5.046 -18.065 1.00 22.80 ? 472 VAL A CG1 1 ATOM 3750 C CG2 . VAL A 1 472 ? -34.966 3.698 -19.617 1.00 25.24 ? 472 VAL A CG2 1 ATOM 3751 N N . LYS A 1 473 ? -37.196 7.959 -19.984 1.00 35.82 ? 473 LYS A N 1 ATOM 3752 C CA . LYS A 1 473 ? -37.478 9.323 -19.552 1.00 41.24 ? 473 LYS A CA 1 ATOM 3753 C C . LYS A 1 473 ? -37.782 9.359 -18.060 1.00 44.85 ? 473 LYS A C 1 ATOM 3754 O O . LYS A 1 473 ? -36.926 9.735 -17.255 1.00 50.20 ? 473 LYS A O 1 ATOM 3755 C CB . LYS A 1 473 ? -38.634 9.927 -20.349 1.00 44.36 ? 473 LYS A CB 1 ATOM 3756 C CG . LYS A 1 473 ? -38.592 11.441 -20.390 1.00 50.42 ? 473 LYS A CG 1 ATOM 3757 C CD . LYS A 1 473 ? -39.703 12.033 -21.254 1.00 55.61 ? 473 LYS A CD 1 ATOM 3758 C CE . LYS A 1 473 ? -39.267 13.364 -21.888 1.00 58.07 ? 473 LYS A CE 1 ATOM 3759 N NZ . LYS A 1 473 ? -38.523 14.264 -20.944 1.00 55.75 ? 473 LYS A NZ 1 HETATM 3760 P PA . FAD B 2 . ? -16.287 0.036 -34.693 1.00 5.91 ? 501 FAD A PA 1 HETATM 3761 O O1A . FAD B 2 . ? -16.188 0.749 -36.034 1.00 5.74 ? 501 FAD A O1A 1 HETATM 3762 O O2A . FAD B 2 . ? -16.619 -1.435 -34.800 1.00 5.85 ? 501 FAD A O2A 1 HETATM 3763 O O5B . FAD B 2 . ? -17.298 0.820 -33.714 1.00 5.92 ? 501 FAD A O5B 1 HETATM 3764 C C5B . FAD B 2 . ? -17.511 0.435 -32.371 1.00 5.71 ? 501 FAD A C5B 1 HETATM 3765 C C4B . FAD B 2 . ? -18.750 1.175 -31.872 1.00 5.56 ? 501 FAD A C4B 1 HETATM 3766 O O4B . FAD B 2 . ? -18.602 2.571 -32.110 1.00 5.36 ? 501 FAD A O4B 1 HETATM 3767 C C3B . FAD B 2 . ? -20.017 0.752 -32.607 1.00 5.43 ? 501 FAD A C3B 1 HETATM 3768 O O3B . FAD B 2 . ? -21.103 0.863 -31.728 1.00 5.39 ? 501 FAD A O3B 1 HETATM 3769 C C2B . FAD B 2 . ? -20.159 1.839 -33.649 1.00 5.33 ? 501 FAD A C2B 1 HETATM 3770 O O2B . FAD B 2 . ? -21.463 1.984 -34.148 1.00 5.15 ? 501 FAD A O2B 1 HETATM 3771 C C1B . FAD B 2 . ? -19.670 3.054 -32.896 1.00 5.30 ? 501 FAD A C1B 1 HETATM 3772 N N9A . FAD B 2 . ? -19.161 4.094 -33.789 1.00 5.32 ? 501 FAD A N9A 1 HETATM 3773 C C8A . FAD B 2 . ? -18.257 3.942 -34.819 1.00 5.35 ? 501 FAD A C8A 1 HETATM 3774 N N7A . FAD B 2 . ? -18.054 5.146 -35.374 1.00 5.36 ? 501 FAD A N7A 1 HETATM 3775 C C5A . FAD B 2 . ? -18.785 6.074 -34.704 1.00 5.40 ? 501 FAD A C5A 1 HETATM 3776 C C6A . FAD B 2 . ? -18.951 7.457 -34.848 1.00 5.37 ? 501 FAD A C6A 1 HETATM 3777 N N6A . FAD B 2 . ? -18.308 8.151 -35.789 1.00 5.20 ? 501 FAD A N6A 1 HETATM 3778 N N1A . FAD B 2 . ? -19.794 8.124 -33.977 1.00 5.45 ? 501 FAD A N1A 1 HETATM 3779 C C2A . FAD B 2 . ? -20.467 7.452 -32.989 1.00 5.41 ? 501 FAD A C2A 1 HETATM 3780 N N3A . FAD B 2 . ? -20.312 6.084 -32.867 1.00 5.45 ? 501 FAD A N3A 1 HETATM 3781 C C4A . FAD B 2 . ? -19.486 5.412 -33.705 1.00 5.37 ? 501 FAD A C4A 1 HETATM 3782 N N1 . FAD B 2 . ? -9.097 -1.079 -26.671 1.00 10.25 ? 501 FAD A N1 1 HETATM 3783 C C2 . FAD B 2 . ? -8.406 -0.320 -25.750 1.00 10.47 ? 501 FAD A C2 1 HETATM 3784 O O2 . FAD B 2 . ? -8.995 0.423 -24.961 1.00 10.44 ? 501 FAD A O2 1 HETATM 3785 N N3 . FAD B 2 . ? -7.029 -0.301 -25.846 1.00 10.31 ? 501 FAD A N3 1 HETATM 3786 C C4 . FAD B 2 . ? -6.278 -1.112 -26.664 1.00 10.57 ? 501 FAD A C4 1 HETATM 3787 O O4 . FAD B 2 . ? -5.077 -0.897 -26.793 1.00 10.47 ? 501 FAD A O4 1 HETATM 3788 C C4X . FAD B 2 . ? -7.054 -1.861 -27.712 1.00 10.50 ? 501 FAD A C4X 1 HETATM 3789 N N5 . FAD B 2 . ? -6.439 -2.660 -28.550 1.00 10.78 ? 501 FAD A N5 1 HETATM 3790 C C5X . FAD B 2 . ? -7.146 -3.231 -29.585 1.00 10.63 ? 501 FAD A C5X 1 HETATM 3791 C C6 . FAD B 2 . ? -6.458 -3.863 -30.648 1.00 11.41 ? 501 FAD A C6 1 HETATM 3792 C C7 . FAD B 2 . ? -7.184 -4.439 -31.673 1.00 10.39 ? 501 FAD A C7 1 HETATM 3793 C C7M . FAD B 2 . ? -6.457 -5.224 -32.765 1.00 10.45 ? 501 FAD A C7M 1 HETATM 3794 C C8 . FAD B 2 . ? -8.615 -4.380 -31.678 1.00 10.62 ? 501 FAD A C8 1 HETATM 3795 C C8M . FAD B 2 . ? -9.416 -4.936 -32.843 1.00 10.52 ? 501 FAD A C8M 1 HETATM 3796 C C9 . FAD B 2 . ? -9.283 -3.707 -30.677 1.00 10.55 ? 501 FAD A C9 1 HETATM 3797 C C9A . FAD B 2 . ? -8.561 -3.143 -29.605 1.00 10.40 ? 501 FAD A C9A 1 HETATM 3798 N N10 . FAD B 2 . ? -9.207 -2.464 -28.549 1.00 10.03 ? 501 FAD A N10 1 HETATM 3799 C C10 . FAD B 2 . ? -8.482 -1.743 -27.653 1.00 10.23 ? 501 FAD A C10 1 HETATM 3800 C "C1'" . FAD B 2 . ? -10.701 -2.397 -28.475 1.00 9.32 ? 501 FAD A "C1'" 1 HETATM 3801 C "C2'" . FAD B 2 . ? -11.172 -1.198 -29.280 1.00 8.56 ? 501 FAD A "C2'" 1 HETATM 3802 O "O2'" . FAD B 2 . ? -10.741 -0.014 -28.639 1.00 9.10 ? 501 FAD A "O2'" 1 HETATM 3803 C "C3'" . FAD B 2 . ? -12.679 -1.230 -29.497 1.00 7.87 ? 501 FAD A "C3'" 1 HETATM 3804 O "O3'" . FAD B 2 . ? -12.970 -2.370 -30.293 1.00 7.94 ? 501 FAD A "O3'" 1 HETATM 3805 C "C4'" . FAD B 2 . ? -13.176 0.044 -30.186 1.00 7.26 ? 501 FAD A "C4'" 1 HETATM 3806 O "O4'" . FAD B 2 . ? -14.555 0.185 -29.955 1.00 6.85 ? 501 FAD A "O4'" 1 HETATM 3807 C "C5'" . FAD B 2 . ? -12.855 0.000 -31.682 1.00 6.75 ? 501 FAD A "C5'" 1 HETATM 3808 O "O5'" . FAD B 2 . ? -13.356 1.117 -32.363 1.00 6.39 ? 501 FAD A "O5'" 1 HETATM 3809 P P . FAD B 2 . ? -13.660 1.030 -33.944 1.00 6.06 ? 501 FAD A P 1 HETATM 3810 O O1P . FAD B 2 . ? -13.949 2.408 -34.474 1.00 6.12 ? 501 FAD A O1P 1 HETATM 3811 O O2P . FAD B 2 . ? -12.501 0.404 -34.683 1.00 6.37 ? 501 FAD A O2P 1 HETATM 3812 O O3P . FAD B 2 . ? -14.920 0.056 -33.866 1.00 6.13 ? 501 FAD A O3P 1 HETATM 3813 C C1 . NAG C 3 . ? 6.633 -22.579 -6.512 0.50 25.46 ? 502 NAG A C1 1 HETATM 3814 C C2 . NAG C 3 . ? 6.964 -23.376 -5.246 0.50 25.99 ? 502 NAG A C2 1 HETATM 3815 C C3 . NAG C 3 . ? 8.177 -22.829 -4.508 0.50 26.60 ? 502 NAG A C3 1 HETATM 3816 C C4 . NAG C 3 . ? 9.321 -22.688 -5.490 0.50 26.48 ? 502 NAG A C4 1 HETATM 3817 C C5 . NAG C 3 . ? 8.869 -21.790 -6.626 0.50 26.39 ? 502 NAG A C5 1 HETATM 3818 C C6 . NAG C 3 . ? 10.040 -21.528 -7.561 0.50 26.73 ? 502 NAG A C6 1 HETATM 3819 C C7 . NAG C 3 . ? 5.245 -24.571 -4.062 0.50 26.62 ? 502 NAG A C7 1 HETATM 3820 C C8 . NAG C 3 . ? 5.786 -25.779 -4.770 0.50 26.79 ? 502 NAG A C8 1 HETATM 3821 N N2 . NAG C 3 . ? 5.847 -23.417 -4.325 0.50 25.96 ? 502 NAG A N2 1 HETATM 3822 O O3 . NAG C 3 . ? 8.561 -23.714 -3.478 0.50 27.75 ? 502 NAG A O3 1 HETATM 3823 O O4 . NAG C 3 . ? 10.463 -22.161 -4.849 0.50 27.26 ? 502 NAG A O4 1 HETATM 3824 O O5 . NAG C 3 . ? 7.795 -22.412 -7.307 0.50 25.52 ? 502 NAG A O5 1 HETATM 3825 O O6 . NAG C 3 . ? 9.620 -21.675 -8.896 0.50 28.74 ? 502 NAG A O6 1 HETATM 3826 O O7 . NAG C 3 . ? 4.295 -24.670 -3.288 0.50 27.01 ? 502 NAG A O7 1 HETATM 3827 C C1 . NAG D 3 . ? 11.576 -23.002 -5.211 0.50 27.68 ? 503 NAG A C1 1 HETATM 3828 C C2 . NAG D 3 . ? 12.910 -22.286 -5.024 0.50 27.76 ? 503 NAG A C2 1 HETATM 3829 C C3 . NAG D 3 . ? 13.933 -23.297 -4.536 0.50 28.42 ? 503 NAG A C3 1 HETATM 3830 C C4 . NAG D 3 . ? 13.453 -23.814 -3.194 0.50 28.50 ? 503 NAG A C4 1 HETATM 3831 C C5 . NAG D 3 . ? 12.134 -24.565 -3.368 0.50 28.73 ? 503 NAG A C5 1 HETATM 3832 C C6 . NAG D 3 . ? 11.147 -24.345 -2.214 0.50 29.13 ? 503 NAG A C6 1 HETATM 3833 C C7 . NAG D 3 . ? 13.321 -20.356 -6.476 0.50 27.08 ? 503 NAG A C7 1 HETATM 3834 C C8 . NAG D 3 . ? 13.781 -19.875 -7.823 0.50 26.40 ? 503 NAG A C8 1 HETATM 3835 N N2 . NAG D 3 . ? 13.332 -21.677 -6.275 0.50 27.51 ? 503 NAG A N2 1 HETATM 3836 O O3 . NAG D 3 . ? 15.211 -22.717 -4.412 0.50 27.16 ? 503 NAG A O3 1 HETATM 3837 O O4 . NAG D 3 . ? 14.423 -24.696 -2.691 0.50 29.34 ? 503 NAG A O4 1 HETATM 3838 O O5 . NAG D 3 . ? 11.527 -24.304 -4.628 0.50 28.14 ? 503 NAG A O5 1 HETATM 3839 O O6 . NAG D 3 . ? 10.915 -22.973 -1.975 0.50 28.31 ? 503 NAG A O6 1 HETATM 3840 O O7 . NAG D 3 . ? 12.956 -19.545 -5.626 0.50 25.86 ? 503 NAG A O7 1 HETATM 3841 ZN ZN . ZN E 4 . ? 4.434 -3.064 -43.306 0.50 15.37 ? 601 ZN A ZN 1 HETATM 3842 ZN ZN . ZN F 4 . ? 0.000 -6.680 0.009 0.50 12.97 ? 602 ZN A ZN 1 HETATM 3843 ZN ZN . ZN G 4 . ? -1.263 8.150 -43.021 0.50 30.49 ? 603 ZN A ZN 1 HETATM 3844 K K . K H 5 . ? -29.631 -7.526 -45.194 0.50 8.22 ? 604 K A K 1 HETATM 3845 C C . TRS I 6 . ? -11.256 13.444 -47.472 1.00 32.99 ? 605 TRS A C 1 HETATM 3846 C C1 . TRS I 6 . ? -10.314 12.884 -48.518 1.00 35.03 ? 605 TRS A C1 1 HETATM 3847 C C2 . TRS I 6 . ? -12.579 12.999 -48.039 1.00 32.68 ? 605 TRS A C2 1 HETATM 3848 C C3 . TRS I 6 . ? -11.110 14.927 -47.147 1.00 36.96 ? 605 TRS A C3 1 HETATM 3849 N N . TRS I 6 . ? -11.010 12.689 -46.247 1.00 29.33 ? 605 TRS A N 1 HETATM 3850 O O1 . TRS I 6 . ? -9.056 13.488 -48.322 1.00 45.84 ? 605 TRS A O1 1 HETATM 3851 O O2 . TRS I 6 . ? -12.754 11.646 -47.705 1.00 37.07 ? 605 TRS A O2 1 HETATM 3852 O O3 . TRS I 6 . ? -12.227 15.370 -46.404 1.00 42.02 ? 605 TRS A O3 1 HETATM 3853 O O . HOH J 7 . ? -6.803 5.408 -41.279 1.00 20.36 ? 606 HOH A O 1 HETATM 3854 O O . HOH J 7 . ? -17.688 0.560 -20.418 1.00 3.60 ? 607 HOH A O 1 HETATM 3855 O O . HOH J 7 . ? -17.977 -3.482 -35.945 1.00 4.22 ? 608 HOH A O 1 HETATM 3856 O O . HOH J 7 . ? -15.735 6.413 -45.656 1.00 14.66 ? 609 HOH A O 1 HETATM 3857 O O . HOH J 7 . ? -20.470 -0.215 -29.269 1.00 2.00 ? 610 HOH A O 1 HETATM 3858 O O . HOH J 7 . ? -2.258 5.210 -23.974 1.00 2.00 ? 611 HOH A O 1 HETATM 3859 O O . HOH J 7 . ? -24.021 0.960 -25.376 1.00 2.56 ? 612 HOH A O 1 HETATM 3860 O O . HOH J 7 . ? -10.020 -6.076 -39.897 1.00 12.94 ? 613 HOH A O 1 HETATM 3861 O O . HOH J 7 . ? -16.107 -19.032 -35.896 1.00 12.35 ? 614 HOH A O 1 HETATM 3862 O O . HOH J 7 . ? -14.973 -4.264 -40.398 1.00 10.21 ? 615 HOH A O 1 HETATM 3863 O O . HOH J 7 . ? -15.036 -4.142 -29.045 1.00 15.58 ? 616 HOH A O 1 HETATM 3864 O O . HOH J 7 . ? -5.044 -8.814 -36.785 1.00 5.59 ? 617 HOH A O 1 HETATM 3865 O O . HOH J 7 . ? -26.669 -4.688 -40.328 1.00 2.00 ? 618 HOH A O 1 HETATM 3866 O O . HOH J 7 . ? -12.599 -0.983 -45.024 1.00 8.39 ? 619 HOH A O 1 HETATM 3867 O O . HOH J 7 . ? -14.171 -18.863 -23.962 1.00 3.02 ? 620 HOH A O 1 HETATM 3868 O O . HOH J 7 . ? -34.500 8.887 -32.078 1.00 11.49 ? 621 HOH A O 1 HETATM 3869 O O . HOH J 7 . ? -16.900 -6.964 -21.699 1.00 4.49 ? 622 HOH A O 1 HETATM 3870 O O . HOH J 7 . ? -25.235 14.312 -49.110 1.00 5.57 ? 623 HOH A O 1 HETATM 3871 O O . HOH J 7 . ? -17.085 3.001 -21.508 1.00 2.74 ? 624 HOH A O 1 HETATM 3872 O O . HOH J 7 . ? -20.457 -9.275 -42.733 1.00 6.47 ? 625 HOH A O 1 HETATM 3873 O O . HOH J 7 . ? -1.309 2.824 -10.437 1.00 19.30 ? 627 HOH A O 1 HETATM 3874 O O . HOH J 7 . ? -7.482 22.633 -34.929 1.00 17.59 ? 628 HOH A O 1 HETATM 3875 O O . HOH J 7 . ? 6.867 -16.430 -16.924 1.00 13.39 ? 629 HOH A O 1 HETATM 3876 O O . HOH J 7 . ? -32.206 13.561 -32.164 1.00 14.53 ? 630 HOH A O 1 HETATM 3877 O O . HOH J 7 . ? -15.624 9.577 -16.099 1.00 8.92 ? 631 HOH A O 1 HETATM 3878 O O . HOH J 7 . ? 3.698 -6.735 -40.371 1.00 13.70 ? 632 HOH A O 1 HETATM 3879 O O . HOH J 7 . ? -16.748 6.816 -50.706 1.00 18.51 ? 633 HOH A O 1 HETATM 3880 O O . HOH J 7 . ? -0.781 10.114 -31.215 1.00 6.19 ? 634 HOH A O 1 HETATM 3881 O O . HOH J 7 . ? 1.269 10.987 -32.520 1.00 5.29 ? 635 HOH A O 1 HETATM 3882 O O . HOH J 7 . ? -8.919 -3.708 -39.009 1.00 15.02 ? 636 HOH A O 1 HETATM 3883 O O . HOH J 7 . ? -19.995 -0.792 -14.037 1.00 6.92 ? 637 HOH A O 1 HETATM 3884 O O . HOH J 7 . ? -23.337 0.000 -32.733 1.00 2.00 ? 638 HOH A O 1 HETATM 3885 O O . HOH J 7 . ? -1.565 -1.546 -43.701 1.00 13.27 ? 639 HOH A O 1 HETATM 3886 O O . HOH J 7 . ? -1.025 6.543 -27.642 1.00 2.00 ? 640 HOH A O 1 HETATM 3887 O O . HOH J 7 . ? -27.888 -7.937 -26.185 1.00 7.87 ? 641 HOH A O 1 HETATM 3888 O O . HOH J 7 . ? -3.077 0.448 -44.920 1.00 11.10 ? 642 HOH A O 1 HETATM 3889 O O . HOH J 7 . ? -18.956 -0.466 -54.738 1.00 15.79 ? 643 HOH A O 1 HETATM 3890 O O . HOH J 7 . ? -4.584 11.683 -44.001 1.00 7.85 ? 644 HOH A O 1 HETATM 3891 O O . HOH J 7 . ? -3.077 -22.278 -25.530 1.00 19.89 ? 645 HOH A O 1 HETATM 3892 O O . HOH J 7 . ? -0.516 1.472 -16.512 1.00 6.60 ? 646 HOH A O 1 HETATM 3893 O O . HOH J 7 . ? 4.589 -4.538 -3.872 1.00 10.45 ? 647 HOH A O 1 HETATM 3894 O O . HOH J 7 . ? -17.177 -11.598 -29.557 1.00 5.98 ? 648 HOH A O 1 HETATM 3895 O O . HOH J 7 . ? 8.463 10.733 -32.244 1.00 11.46 ? 649 HOH A O 1 HETATM 3896 O O . HOH J 7 . ? -14.264 -0.187 -40.976 1.00 3.68 ? 650 HOH A O 1 HETATM 3897 O O . HOH J 7 . ? 16.664 -9.742 -13.539 1.00 19.26 ? 651 HOH A O 1 HETATM 3898 O O . HOH J 7 . ? -7.029 11.521 -17.496 1.00 9.57 ? 652 HOH A O 1 HETATM 3899 O O . HOH J 7 . ? -25.739 -8.611 -27.703 1.00 5.11 ? 653 HOH A O 1 HETATM 3900 O O . HOH J 7 . ? -8.519 -16.069 -35.905 1.00 6.17 ? 654 HOH A O 1 HETATM 3901 O O . HOH J 7 . ? 0.431 -24.999 -8.503 1.00 18.00 ? 655 HOH A O 1 HETATM 3902 O O . HOH J 7 . ? -16.677 -5.393 -37.246 1.00 5.34 ? 656 HOH A O 1 HETATM 3903 O O . HOH J 7 . ? -25.689 1.595 -33.799 1.00 4.44 ? 657 HOH A O 1 HETATM 3904 O O . HOH J 7 . ? -9.244 4.132 -42.243 1.00 2.38 ? 658 HOH A O 1 HETATM 3905 O O . HOH J 7 . ? -2.250 -19.782 -25.502 1.00 15.42 ? 659 HOH A O 1 HETATM 3906 O O . HOH J 7 . ? -29.163 11.413 -31.827 1.00 26.36 ? 660 HOH A O 1 HETATM 3907 O O . HOH J 7 . ? -17.358 -9.484 -20.622 1.00 6.41 ? 661 HOH A O 1 HETATM 3908 O O . HOH J 7 . ? -26.430 7.882 -13.487 1.00 19.53 ? 662 HOH A O 1 HETATM 3909 O O . HOH J 7 . ? 4.505 6.081 -38.591 1.00 13.35 ? 663 HOH A O 1 HETATM 3910 O O . HOH J 7 . ? -1.222 -3.764 -30.284 1.00 8.38 ? 664 HOH A O 1 HETATM 3911 O O . HOH J 7 . ? -19.390 3.074 -12.057 1.00 8.72 ? 665 HOH A O 1 HETATM 3912 O O . HOH J 7 . ? -13.813 -2.792 -43.582 1.00 15.14 ? 666 HOH A O 1 HETATM 3913 O O . HOH J 7 . ? -23.611 3.487 -34.447 1.00 2.00 ? 667 HOH A O 1 HETATM 3914 O O . HOH J 7 . ? -16.191 -7.558 -35.793 1.00 7.85 ? 668 HOH A O 1 HETATM 3915 O O . HOH J 7 . ? -18.606 -2.084 -30.143 1.00 11.03 ? 669 HOH A O 1 HETATM 3916 O O . HOH J 7 . ? -12.064 13.930 -19.587 1.00 9.32 ? 670 HOH A O 1 HETATM 3917 O O . HOH J 7 . ? -8.125 3.078 -8.391 1.00 14.24 ? 671 HOH A O 1 HETATM 3918 O O . HOH J 7 . ? -15.391 16.531 -20.276 1.00 5.94 ? 672 HOH A O 1 HETATM 3919 O O . HOH J 7 . ? 4.015 3.376 -40.217 1.00 13.77 ? 673 HOH A O 1 HETATM 3920 O O . HOH J 7 . ? 4.949 15.495 -24.008 1.00 12.94 ? 674 HOH A O 1 HETATM 3921 O O . HOH J 7 . ? -17.686 2.436 -53.599 1.00 24.84 ? 675 HOH A O 1 HETATM 3922 O O . HOH J 7 . ? -24.419 -1.377 -50.174 1.00 14.27 ? 676 HOH A O 1 HETATM 3923 O O . HOH J 7 . ? -11.973 -6.184 -42.226 1.00 2.26 ? 677 HOH A O 1 HETATM 3924 O O . HOH J 7 . ? -25.291 -5.360 -48.028 1.00 10.77 ? 678 HOH A O 1 HETATM 3925 O O . HOH J 7 . ? 13.117 -4.111 -19.007 1.00 20.30 ? 679 HOH A O 1 HETATM 3926 O O . HOH J 7 . ? -0.174 5.131 -7.939 1.00 9.35 ? 680 HOH A O 1 HETATM 3927 O O . HOH J 7 . ? -15.097 -17.593 -3.939 1.00 26.18 ? 681 HOH A O 1 HETATM 3928 O O . HOH J 7 . ? -14.587 16.059 -42.839 1.00 15.89 ? 682 HOH A O 1 HETATM 3929 O O . HOH J 7 . ? 1.145 0.549 -30.131 1.00 14.59 ? 683 HOH A O 1 HETATM 3930 O O . HOH J 7 . ? -21.954 -14.160 -29.750 1.00 10.73 ? 684 HOH A O 1 HETATM 3931 O O . HOH J 7 . ? -7.597 -10.746 -43.375 1.00 20.27 ? 685 HOH A O 1 HETATM 3932 O O . HOH J 7 . ? -14.893 8.259 -9.224 1.00 12.34 ? 686 HOH A O 1 HETATM 3933 O O . HOH J 7 . ? -20.534 -10.305 -8.056 1.00 13.82 ? 687 HOH A O 1 HETATM 3934 O O . HOH J 7 . ? 15.467 7.834 -27.255 1.00 28.71 ? 688 HOH A O 1 HETATM 3935 O O . HOH J 7 . ? -27.174 3.795 -29.951 1.00 16.56 ? 689 HOH A O 1 HETATM 3936 O O . HOH J 7 . ? 3.174 -14.514 -21.976 1.00 17.18 ? 690 HOH A O 1 HETATM 3937 O O . HOH J 7 . ? -19.579 -22.870 -24.088 1.00 40.83 ? 691 HOH A O 1 HETATM 3938 O O . HOH J 7 . ? -30.272 3.568 -30.437 1.00 26.63 ? 692 HOH A O 1 HETATM 3939 O O . HOH J 7 . ? -28.512 21.049 -38.575 1.00 8.98 ? 693 HOH A O 1 HETATM 3940 O O . HOH J 7 . ? 1.515 2.344 -28.074 1.00 11.49 ? 694 HOH A O 1 HETATM 3941 O O . HOH J 7 . ? -33.016 -1.317 -40.196 1.00 13.97 ? 695 HOH A O 1 HETATM 3942 O O . HOH J 7 . ? -20.200 18.176 -45.684 1.00 11.33 ? 696 HOH A O 1 HETATM 3943 O O . HOH J 7 . ? -19.925 17.610 -20.220 1.00 8.61 ? 697 HOH A O 1 HETATM 3944 O O . HOH J 7 . ? -16.539 15.057 -41.305 1.00 11.40 ? 698 HOH A O 1 HETATM 3945 O O . HOH J 7 . ? -11.505 -5.893 -44.882 1.00 16.91 ? 699 HOH A O 1 HETATM 3946 O O . HOH J 7 . ? -21.632 -5.810 -11.437 1.00 13.18 ? 700 HOH A O 1 HETATM 3947 O O . HOH J 7 . ? -21.029 16.373 -49.619 1.00 8.49 ? 701 HOH A O 1 HETATM 3948 O O . HOH J 7 . ? 9.667 12.176 -30.374 1.00 22.42 ? 702 HOH A O 1 HETATM 3949 O O . HOH J 7 . ? -12.234 9.091 -9.030 1.00 18.65 ? 703 HOH A O 1 HETATM 3950 O O . HOH J 7 . ? -8.134 -7.837 -44.150 1.00 20.14 ? 704 HOH A O 1 HETATM 3951 O O . HOH J 7 . ? 8.044 -12.717 -9.994 1.00 24.32 ? 705 HOH A O 1 HETATM 3952 O O . HOH J 7 . ? 16.041 -6.407 -8.801 1.00 25.71 ? 706 HOH A O 1 HETATM 3953 O O . HOH J 7 . ? -19.919 -18.205 -32.624 1.00 9.51 ? 707 HOH A O 1 HETATM 3954 O O . HOH J 7 . ? -30.401 0.839 -20.342 1.00 14.79 ? 708 HOH A O 1 HETATM 3955 O O . HOH J 7 . ? -16.143 -1.679 -28.788 1.00 15.78 ? 709 HOH A O 1 HETATM 3956 O O . HOH J 7 . ? 7.109 13.434 -16.066 1.00 11.83 ? 710 HOH A O 1 HETATM 3957 O O . HOH J 7 . ? -34.279 -4.164 -27.271 1.00 11.67 ? 711 HOH A O 1 HETATM 3958 O O . HOH J 7 . ? -17.023 17.072 -44.304 1.00 14.05 ? 712 HOH A O 1 HETATM 3959 O O . HOH J 7 . ? -38.403 7.397 -24.780 1.00 22.68 ? 713 HOH A O 1 HETATM 3960 O O . HOH J 7 . ? -5.756 11.757 -22.652 1.00 2.00 ? 714 HOH A O 1 HETATM 3961 O O . HOH J 7 . ? -2.976 -6.782 -33.423 1.00 16.45 ? 715 HOH A O 1 HETATM 3962 O O . HOH J 7 . ? -23.213 -4.471 -4.330 1.00 29.03 ? 716 HOH A O 1 HETATM 3963 O O . HOH J 7 . ? -25.597 25.310 -29.488 1.00 13.61 ? 717 HOH A O 1 HETATM 3964 O O . HOH J 7 . ? -26.346 16.662 -46.060 1.00 14.73 ? 718 HOH A O 1 HETATM 3965 O O . HOH J 7 . ? -16.036 -9.748 -47.728 1.00 4.30 ? 719 HOH A O 1 HETATM 3966 O O . HOH J 7 . ? 5.553 -2.042 -3.674 1.00 19.77 ? 720 HOH A O 1 HETATM 3967 O O . HOH J 7 . ? -34.631 -0.089 -49.381 1.00 18.32 ? 721 HOH A O 1 HETATM 3968 O O . HOH J 7 . ? -0.509 2.935 -26.178 1.00 15.91 ? 722 HOH A O 1 HETATM 3969 O O . HOH J 7 . ? 19.047 8.960 -16.264 1.00 10.93 ? 723 HOH A O 1 HETATM 3970 O O . HOH J 7 . ? -17.545 0.156 -13.400 1.00 5.12 ? 724 HOH A O 1 HETATM 3971 O O . HOH J 7 . ? -19.743 -13.565 -14.162 1.00 8.96 ? 725 HOH A O 1 HETATM 3972 O O . HOH J 7 . ? -24.764 23.214 -22.462 1.00 25.18 ? 726 HOH A O 1 HETATM 3973 O O . HOH J 7 . ? -14.902 21.217 -24.166 1.00 8.91 ? 727 HOH A O 1 HETATM 3974 O O . HOH J 7 . ? -8.826 6.674 -48.331 1.00 27.12 ? 728 HOH A O 1 HETATM 3975 O O . HOH J 7 . ? -24.158 6.004 -33.222 1.00 17.07 ? 729 HOH A O 1 HETATM 3976 O O . HOH J 7 . ? 0.830 5.438 -26.051 1.00 19.39 ? 730 HOH A O 1 HETATM 3977 O O . HOH J 7 . ? 2.581 22.865 -32.347 1.00 28.53 ? 731 HOH A O 1 HETATM 3978 O O . HOH J 7 . ? -1.091 -1.642 -20.174 1.00 18.52 ? 732 HOH A O 1 HETATM 3979 O O . HOH J 7 . ? -13.222 -24.725 -23.078 1.00 23.26 ? 733 HOH A O 1 HETATM 3980 O O . HOH J 7 . ? -28.817 13.373 -17.983 1.00 27.20 ? 734 HOH A O 1 HETATM 3981 O O . HOH J 7 . ? -7.380 -28.360 -24.842 1.00 24.75 ? 735 HOH A O 1 HETATM 3982 O O . HOH J 7 . ? -3.030 17.517 -41.718 1.00 29.38 ? 736 HOH A O 1 HETATM 3983 O O . HOH J 7 . ? -17.581 10.443 -8.906 1.00 21.04 ? 737 HOH A O 1 HETATM 3984 O O . HOH J 7 . ? -3.988 12.279 -24.670 1.00 12.24 ? 738 HOH A O 1 HETATM 3985 O O . HOH J 7 . ? -33.736 -3.671 -43.525 1.00 18.51 ? 739 HOH A O 1 HETATM 3986 O O . HOH J 7 . ? -33.976 15.274 -31.009 1.00 10.29 ? 740 HOH A O 1 HETATM 3987 O O . HOH J 7 . ? 13.800 -8.698 -5.666 1.00 27.86 ? 741 HOH A O 1 HETATM 3988 O O . HOH J 7 . ? -17.896 15.776 -19.988 1.00 14.31 ? 742 HOH A O 1 HETATM 3989 O O . HOH J 7 . ? -21.146 -20.630 -20.345 1.00 28.41 ? 743 HOH A O 1 HETATM 3990 O O . HOH J 7 . ? -6.164 -4.922 -27.119 1.00 29.13 ? 744 HOH A O 1 HETATM 3991 O O . HOH J 7 . ? -5.519 -12.914 -38.101 1.00 23.74 ? 745 HOH A O 1 HETATM 3992 O O . HOH J 7 . ? 7.714 -19.733 -9.531 0.50 2.00 ? 746 HOH A O 1 HETATM 3993 O O . HOH J 7 . ? 14.409 7.116 -24.851 1.00 24.13 ? 747 HOH A O 1 HETATM 3994 O O . HOH J 7 . ? -24.997 -8.732 -31.133 1.00 18.82 ? 748 HOH A O 1 HETATM 3995 O O . HOH J 7 . ? -17.459 7.648 -7.874 1.00 25.99 ? 749 HOH A O 1 HETATM 3996 O O . HOH J 7 . ? -12.914 -25.323 -20.503 1.00 14.57 ? 750 HOH A O 1 HETATM 3997 O O . HOH J 7 . ? -17.973 19.206 -41.223 1.00 16.48 ? 751 HOH A O 1 HETATM 3998 O O . HOH J 7 . ? 15.063 5.606 -22.903 1.00 16.87 ? 752 HOH A O 1 HETATM 3999 O O . HOH J 7 . ? -0.764 1.316 -19.315 1.00 10.01 ? 753 HOH A O 1 HETATM 4000 O O . HOH J 7 . ? 17.363 0.372 -26.409 1.00 18.10 ? 754 HOH A O 1 HETATM 4001 O O . HOH J 7 . ? 2.980 4.399 -27.525 1.00 8.40 ? 755 HOH A O 1 HETATM 4002 O O . HOH J 7 . ? -32.077 -7.703 -24.375 1.00 30.97 ? 756 HOH A O 1 HETATM 4003 O O . HOH J 7 . ? -23.953 -7.266 -4.219 1.00 36.69 ? 757 HOH A O 1 HETATM 4004 O O . HOH J 7 . ? -8.970 4.375 -46.299 1.00 17.80 ? 758 HOH A O 1 HETATM 4005 O O . HOH J 7 . ? 18.484 2.787 -11.133 1.00 27.01 ? 759 HOH A O 1 HETATM 4006 O O . HOH J 7 . ? -6.847 -23.030 -32.903 1.00 20.15 ? 760 HOH A O 1 HETATM 4007 O O . HOH J 7 . ? -13.174 -5.287 -6.810 1.00 23.85 ? 761 HOH A O 1 HETATM 4008 O O . HOH J 7 . ? -23.271 -12.246 -30.975 1.00 17.09 ? 762 HOH A O 1 HETATM 4009 O O . HOH J 7 . ? -1.900 14.646 -19.648 1.00 17.66 ? 763 HOH A O 1 HETATM 4010 O O . HOH J 7 . ? -4.254 15.068 -24.407 1.00 18.96 ? 764 HOH A O 1 HETATM 4011 O O . HOH J 7 . ? -19.054 -0.395 -9.898 1.00 18.44 ? 765 HOH A O 1 HETATM 4012 O O . HOH J 7 . ? 4.962 13.589 -21.950 1.00 5.62 ? 766 HOH A O 1 HETATM 4013 O O . HOH J 7 . ? -9.796 1.190 -6.402 1.00 33.32 ? 767 HOH A O 1 HETATM 4014 O O . HOH J 7 . ? -6.859 -29.710 -13.100 1.00 28.81 ? 768 HOH A O 1 HETATM 4015 O O . HOH J 7 . ? -20.488 -9.981 -52.291 1.00 29.95 ? 769 HOH A O 1 HETATM 4016 O O . HOH J 7 . ? -19.241 15.837 -51.972 1.00 16.46 ? 770 HOH A O 1 HETATM 4017 O O . HOH J 7 . ? -23.950 -7.788 -12.576 1.00 38.84 ? 771 HOH A O 1 HETATM 4018 O O . HOH J 7 . ? 7.675 1.103 -40.397 1.00 18.45 ? 772 HOH A O 1 HETATM 4019 O O . HOH J 7 . ? -36.588 -0.065 -37.949 1.00 31.14 ? 773 HOH A O 1 HETATM 4020 O O . HOH J 7 . ? 0.232 -24.634 -20.938 1.00 30.94 ? 774 HOH A O 1 HETATM 4021 O O . HOH J 7 . ? -13.699 -4.663 -57.656 1.00 19.50 ? 775 HOH A O 1 HETATM 4022 O O . HOH J 7 . ? -1.644 1.280 -47.067 1.00 22.14 ? 776 HOH A O 1 HETATM 4023 O O . HOH J 7 . ? -25.268 0.131 -13.810 1.00 11.62 ? 777 HOH A O 1 HETATM 4024 O O . HOH J 7 . ? -32.652 -5.817 -26.969 1.00 21.58 ? 778 HOH A O 1 HETATM 4025 O O . HOH J 7 . ? -18.949 2.782 -9.184 1.00 16.84 ? 779 HOH A O 1 HETATM 4026 O O . HOH J 7 . ? -33.704 -3.895 -34.922 1.00 29.46 ? 780 HOH A O 1 HETATM 4027 O O . HOH J 7 . ? -13.454 -26.321 -37.537 1.00 30.21 ? 781 HOH A O 1 HETATM 4028 O O . HOH J 7 . ? -35.737 -0.973 -31.215 1.00 20.84 ? 782 HOH A O 1 HETATM 4029 O O . HOH J 7 . ? 0.895 22.168 -42.858 1.00 35.32 ? 783 HOH A O 1 HETATM 4030 O O . HOH J 7 . ? -33.397 -1.823 -50.666 0.50 2.00 ? 784 HOH A O 1 HETATM 4031 O O . HOH J 7 . ? -20.872 -14.583 -10.343 1.00 24.43 ? 785 HOH A O 1 HETATM 4032 O O . HOH J 7 . ? -12.431 -2.160 -41.329 1.00 17.10 ? 786 HOH A O 1 HETATM 4033 O O . HOH J 7 . ? 17.612 0.476 -8.822 1.00 30.34 ? 787 HOH A O 1 HETATM 4034 O O . HOH J 7 . ? -32.184 11.398 -50.768 1.00 23.24 ? 788 HOH A O 1 HETATM 4035 O O . HOH J 7 . ? -6.098 -4.955 -21.948 1.00 12.55 ? 789 HOH A O 1 HETATM 4036 O O . HOH J 7 . ? -12.231 -4.032 -39.414 1.00 16.50 ? 790 HOH A O 1 HETATM 4037 O O . HOH J 7 . ? -28.165 19.549 -25.098 1.00 14.44 ? 791 HOH A O 1 HETATM 4038 O O . HOH J 7 . ? -14.632 -24.238 -17.722 1.00 20.57 ? 792 HOH A O 1 HETATM 4039 O O . HOH J 7 . ? -32.606 6.309 -15.979 1.00 33.68 ? 793 HOH A O 1 HETATM 4040 O O . HOH J 7 . ? 6.680 20.102 -35.905 1.00 20.85 ? 794 HOH A O 1 HETATM 4041 O O . HOH J 7 . ? -20.435 18.997 -48.332 1.00 22.69 ? 795 HOH A O 1 HETATM 4042 O O . HOH J 7 . ? -1.957 26.921 -35.938 1.00 40.91 ? 796 HOH A O 1 HETATM 4043 O O . HOH J 7 . ? -16.733 -20.718 -11.882 1.00 27.00 ? 797 HOH A O 1 HETATM 4044 O O . HOH J 7 . ? -26.869 -9.501 -29.610 1.00 21.38 ? 798 HOH A O 1 HETATM 4045 O O . HOH J 7 . ? 14.202 11.609 -28.775 1.00 25.76 ? 799 HOH A O 1 HETATM 4046 O O . HOH J 7 . ? -12.331 2.351 -5.506 1.00 22.51 ? 800 HOH A O 1 HETATM 4047 O O . HOH J 7 . ? -12.930 20.152 -22.294 1.00 13.13 ? 801 HOH A O 1 HETATM 4048 O O . HOH J 7 . ? -27.761 -11.337 -33.879 1.00 35.69 ? 802 HOH A O 1 HETATM 4049 O O . HOH J 7 . ? -2.024 -4.632 -32.788 1.00 19.29 ? 803 HOH A O 1 HETATM 4050 O O . HOH J 7 . ? 0.817 -23.801 -5.392 1.00 34.53 ? 804 HOH A O 1 HETATM 4051 O O . HOH J 7 . ? -7.849 25.403 -31.107 1.00 20.11 ? 805 HOH A O 1 HETATM 4052 O O . HOH J 7 . ? -14.971 -26.479 -26.442 1.00 36.21 ? 806 HOH A O 1 HETATM 4053 O O . HOH J 7 . ? 17.060 -3.106 -3.953 1.00 29.11 ? 807 HOH A O 1 HETATM 4054 O O . HOH J 7 . ? 8.515 14.385 -33.735 1.00 18.78 ? 808 HOH A O 1 HETATM 4055 O O . HOH J 7 . ? -17.267 -10.746 -45.334 1.00 16.54 ? 809 HOH A O 1 HETATM 4056 O O . HOH J 7 . ? 13.842 11.959 -18.410 1.00 24.65 ? 810 HOH A O 1 HETATM 4057 O O . HOH J 7 . ? 13.379 -16.354 -17.512 1.00 27.89 ? 811 HOH A O 1 HETATM 4058 O O . HOH J 7 . ? -19.490 19.863 -18.850 1.00 16.80 ? 812 HOH A O 1 HETATM 4059 O O . HOH J 7 . ? -6.790 -19.949 -41.063 0.50 2.84 ? 813 HOH A O 1 HETATM 4060 O O . HOH J 7 . ? -3.496 -5.962 1.632 1.00 28.07 ? 814 HOH A O 1 HETATM 4061 O O . HOH J 7 . ? -6.525 3.375 -3.199 1.00 15.35 ? 815 HOH A O 1 HETATM 4062 O O . HOH J 7 . ? -4.099 -8.753 0.813 1.00 17.91 ? 816 HOH A O 1 HETATM 4063 O O . HOH J 7 . ? -4.479 -8.897 -31.957 1.00 22.97 ? 817 HOH A O 1 HETATM 4064 O O . HOH J 7 . ? 4.904 -6.346 -28.506 1.00 30.45 ? 818 HOH A O 1 HETATM 4065 O O . HOH J 7 . ? 17.413 1.313 -23.282 1.00 21.68 ? 819 HOH A O 1 HETATM 4066 O O . HOH J 7 . ? -6.935 14.061 -17.602 1.00 9.07 ? 820 HOH A O 1 HETATM 4067 O O . HOH J 7 . ? 7.299 -4.054 -34.653 1.00 19.43 ? 821 HOH A O 1 HETATM 4068 O O . HOH J 7 . ? -6.685 -7.064 -28.607 1.00 20.44 ? 822 HOH A O 1 HETATM 4069 O O . HOH J 7 . ? -37.218 8.104 -14.690 1.00 28.19 ? 823 HOH A O 1 HETATM 4070 O O . HOH J 7 . ? 10.939 -2.319 -29.674 1.00 20.57 ? 824 HOH A O 1 HETATM 4071 O O . HOH J 7 . ? -38.313 14.511 -42.274 1.00 22.24 ? 825 HOH A O 1 HETATM 4072 O O . HOH J 7 . ? 7.117 -12.991 -20.571 1.00 25.60 ? 826 HOH A O 1 HETATM 4073 O O . HOH J 7 . ? -35.676 14.781 -42.874 1.00 13.79 ? 827 HOH A O 1 HETATM 4074 O O . HOH J 7 . ? -19.737 -11.012 -44.522 1.00 15.75 ? 828 HOH A O 1 HETATM 4075 O O . HOH J 7 . ? -0.976 -25.478 -27.924 1.00 38.65 ? 829 HOH A O 1 HETATM 4076 O O . HOH J 7 . ? -4.247 23.400 -40.087 1.00 22.23 ? 830 HOH A O 1 HETATM 4077 O O . HOH J 7 . ? 4.874 20.607 -30.023 1.00 20.27 ? 831 HOH A O 1 HETATM 4078 O O . HOH J 7 . ? -39.003 7.002 -21.767 1.00 35.48 ? 832 HOH A O 1 HETATM 4079 O O . HOH J 7 . ? 10.540 -6.658 -23.009 1.00 23.34 ? 833 HOH A O 1 HETATM 4080 O O . HOH J 7 . ? -9.054 -5.730 -46.515 1.00 33.58 ? 834 HOH A O 1 HETATM 4081 O O . HOH J 7 . ? -35.113 -3.175 -32.543 1.00 28.89 ? 835 HOH A O 1 HETATM 4082 O O . HOH J 7 . ? -6.406 -17.851 -38.784 1.00 20.73 ? 836 HOH A O 1 HETATM 4083 O O . HOH J 7 . ? -35.436 15.260 -39.347 1.00 28.50 ? 837 HOH A O 1 HETATM 4084 O O . HOH J 7 . ? -24.359 -20.174 -24.747 1.00 34.79 ? 838 HOH A O 1 HETATM 4085 O O . HOH J 7 . ? -14.409 -26.111 -16.270 1.00 20.12 ? 839 HOH A O 1 HETATM 4086 O O . HOH J 7 . ? -30.201 -10.367 -37.723 1.00 20.68 ? 840 HOH A O 1 HETATM 4087 O O . HOH J 7 . ? 14.491 13.881 -16.724 1.00 28.25 ? 841 HOH A O 1 HETATM 4088 O O . HOH J 7 . ? 9.379 15.622 -31.032 1.00 22.88 ? 842 HOH A O 1 HETATM 4089 O O . HOH J 7 . ? -23.990 23.629 -33.047 1.00 18.58 ? 843 HOH A O 1 HETATM 4090 O O . HOH J 7 . ? -31.398 -7.235 -31.860 1.00 19.55 ? 844 HOH A O 1 HETATM 4091 O O . HOH J 7 . ? -27.777 -11.496 -20.062 1.00 15.89 ? 845 HOH A O 1 HETATM 4092 O O . HOH J 7 . ? 12.219 -4.165 -24.337 1.00 21.46 ? 846 HOH A O 1 HETATM 4093 O O . HOH J 7 . ? -0.840 7.176 -45.570 0.50 5.76 ? 847 HOH A O 1 HETATM 4094 O O . HOH J 7 . ? -20.758 -2.014 -11.610 1.00 22.75 ? 848 HOH A O 1 HETATM 4095 O O . HOH J 7 . ? -22.399 -20.203 -31.404 1.00 29.75 ? 849 HOH A O 1 HETATM 4096 O O . HOH J 7 . ? 8.679 4.295 -6.943 1.00 35.91 ? 850 HOH A O 1 HETATM 4097 O O . HOH J 7 . ? -3.436 -4.066 -26.276 1.00 32.54 ? 851 HOH A O 1 HETATM 4098 O O . HOH J 7 . ? -7.642 2.805 -49.104 1.00 27.36 ? 852 HOH A O 1 HETATM 4099 O O . HOH J 7 . ? -0.482 -22.974 -25.691 1.00 23.78 ? 853 HOH A O 1 HETATM 4100 O O . HOH J 7 . ? -23.128 -9.921 -48.617 1.00 20.56 ? 854 HOH A O 1 HETATM 4101 O O . HOH J 7 . ? 8.041 -5.210 -22.856 1.00 23.05 ? 855 HOH A O 1 HETATM 4102 O O . HOH J 7 . ? -1.944 22.355 -41.255 1.00 20.16 ? 856 HOH A O 1 HETATM 4103 O O . HOH J 7 . ? -5.124 -19.686 -33.054 1.00 33.10 ? 857 HOH A O 1 HETATM 4104 O O . HOH J 7 . ? 4.321 21.920 -34.566 1.00 24.87 ? 858 HOH A O 1 HETATM 4105 O O . HOH J 7 . ? -30.139 16.195 -20.512 1.00 15.10 ? 859 HOH A O 1 HETATM 4106 O O . HOH J 7 . ? 7.827 -9.795 -20.923 1.00 24.95 ? 860 HOH A O 1 HETATM 4107 O O . HOH J 7 . ? -6.263 -2.863 -1.297 1.00 31.49 ? 861 HOH A O 1 HETATM 4108 O O . HOH J 7 . ? 6.365 7.626 -40.222 1.00 20.53 ? 862 HOH A O 1 HETATM 4109 O O . HOH J 7 . ? 1.705 2.476 -44.153 1.00 28.79 ? 863 HOH A O 1 HETATM 4110 O O . HOH J 7 . ? -30.108 -2.108 -17.478 1.00 24.86 ? 864 HOH A O 1 HETATM 4111 O O . HOH J 7 . ? -20.699 -19.104 -9.752 1.00 34.26 ? 865 HOH A O 1 HETATM 4112 O O . HOH J 7 . ? 13.604 -13.711 -19.250 1.00 35.25 ? 866 HOH A O 1 HETATM 4113 O O . HOH J 7 . ? 3.798 10.644 -9.709 1.00 17.10 ? 867 HOH A O 1 HETATM 4114 O O . HOH J 7 . ? -24.562 -6.166 -57.338 1.00 24.28 ? 868 HOH A O 1 HETATM 4115 O O . HOH J 7 . ? 13.827 2.623 -37.057 1.00 36.33 ? 869 HOH A O 1 HETATM 4116 O O . HOH J 7 . ? -2.202 15.516 -43.549 1.00 24.53 ? 870 HOH A O 1 HETATM 4117 O O . HOH J 7 . ? -11.576 -8.423 -48.304 1.00 23.97 ? 871 HOH A O 1 HETATM 4118 O O . HOH J 7 . ? -25.571 -20.613 -29.432 1.00 21.62 ? 872 HOH A O 1 HETATM 4119 O O . HOH J 7 . ? 13.014 5.084 -36.416 1.00 18.59 ? 873 HOH A O 1 HETATM 4120 O O . HOH J 7 . ? -36.302 6.044 -50.886 1.00 34.61 ? 874 HOH A O 1 HETATM 4121 O O . HOH J 7 . ? -29.489 22.009 -34.929 1.00 23.53 ? 875 HOH A O 1 HETATM 4122 O O . HOH J 7 . ? -12.731 -12.087 -0.639 1.00 37.45 ? 876 HOH A O 1 HETATM 4123 O O . HOH J 7 . ? -3.496 15.608 -12.539 1.00 41.02 ? 877 HOH A O 1 HETATM 4124 O O . HOH J 7 . ? -2.465 29.847 -35.614 1.00 26.59 ? 878 HOH A O 1 HETATM 4125 O O . HOH J 7 . ? -14.958 -19.421 -39.588 1.00 20.10 ? 879 HOH A O 1 HETATM 4126 O O . HOH J 7 . ? -21.406 -3.568 -1.571 1.00 32.59 ? 880 HOH A O 1 HETATM 4127 O O . HOH J 7 . ? 1.979 22.380 -26.492 1.00 34.62 ? 881 HOH A O 1 HETATM 4128 O O . HOH J 7 . ? 6.299 11.338 -10.453 1.00 24.50 ? 882 HOH A O 1 HETATM 4129 O O . HOH J 7 . ? -14.931 -13.379 -1.076 1.00 22.28 ? 883 HOH A O 1 HETATM 4130 O O . HOH J 7 . ? -21.964 -12.455 -5.634 1.00 25.13 ? 884 HOH A O 1 HETATM 4131 O O . HOH J 7 . ? -14.466 24.246 -23.162 1.00 38.21 ? 885 HOH A O 1 HETATM 4132 O O . HOH J 7 . ? 0.052 24.026 -27.083 1.00 13.75 ? 886 HOH A O 1 HETATM 4133 O O . HOH J 7 . ? 2.422 24.287 -28.151 1.00 19.26 ? 887 HOH A O 1 HETATM 4134 O O . HOH J 7 . ? -18.796 -11.569 -1.833 0.50 5.51 ? 888 HOH A O 1 HETATM 4135 O O . HOH J 7 . ? -7.595 15.804 -15.489 1.00 27.75 ? 889 HOH A O 1 HETATM 4136 O O . HOH J 7 . ? -20.050 1.746 -7.156 1.00 30.97 ? 890 HOH A O 1 HETATM 4137 O O . HOH J 7 . ? 14.637 7.151 -29.998 1.00 32.13 ? 891 HOH A O 1 HETATM 4138 O O . HOH J 7 . ? -11.736 -6.780 -51.180 1.00 27.66 ? 892 HOH A O 1 HETATM 4139 O O . HOH J 7 . ? 9.847 -8.270 0.008 1.00 25.58 ? 893 HOH A O 1 HETATM 4140 O O . HOH J 7 . ? 1.865 12.777 -9.748 1.00 24.39 ? 894 HOH A O 1 HETATM 4141 O O . HOH J 7 . ? -25.800 -13.205 -18.385 1.00 44.55 ? 895 HOH A O 1 HETATM 4142 O O . HOH J 7 . ? 4.656 13.413 -11.260 1.00 29.54 ? 896 HOH A O 1 HETATM 4143 O O . HOH J 7 . ? -14.833 -26.423 -34.376 1.00 31.28 ? 897 HOH A O 1 HETATM 4144 O O . HOH J 7 . ? -6.491 -1.575 1.020 1.00 21.03 ? 898 HOH A O 1 HETATM 4145 O O . HOH J 7 . ? -3.393 -27.142 -11.302 1.00 37.32 ? 899 HOH A O 1 HETATM 4146 O O . HOH J 7 . ? -0.287 11.749 -8.210 1.00 20.48 ? 900 HOH A O 1 HETATM 4147 O O . HOH J 7 . ? -4.110 20.578 -26.527 1.00 16.12 ? 901 HOH A O 1 HETATM 4148 O O . HOH J 7 . ? -24.317 6.744 -55.082 1.00 20.48 ? 902 HOH A O 1 HETATM 4149 O O . HOH J 7 . ? -1.511 11.171 -11.920 1.00 21.28 ? 903 HOH A O 1 HETATM 4150 O O . HOH J 7 . ? -35.616 -3.027 -29.591 1.00 17.45 ? 904 HOH A O 1 HETATM 4151 O O . HOH J 7 . ? -19.399 -14.903 -17.288 1.00 42.08 ? 905 HOH A O 1 HETATM 4152 O O . HOH J 7 . ? -1.859 -17.659 -22.780 1.00 11.50 ? 906 HOH A O 1 HETATM 4153 O O . HOH J 7 . ? -12.481 -11.209 -3.208 1.00 14.52 ? 907 HOH A O 1 HETATM 4154 O O . HOH J 7 . ? -17.017 14.973 -9.666 1.00 26.65 ? 908 HOH A O 1 HETATM 4155 O O . HOH J 7 . ? -4.092 -29.924 -21.813 1.00 14.80 ? 909 HOH A O 1 HETATM 4156 O O . HOH J 7 . ? -0.928 10.340 -44.292 0.50 2.00 ? 910 HOH A O 1 HETATM 4157 O O . HOH J 7 . ? -4.998 -11.377 -1.805 1.00 31.76 ? 911 HOH A O 1 HETATM 4158 O O . HOH J 7 . ? -32.766 -6.983 -21.774 1.00 25.60 ? 912 HOH A O 1 HETATM 4159 O O . HOH J 7 . ? 0.792 6.252 -1.097 1.00 26.91 ? 913 HOH A O 1 HETATM 4160 O O . HOH J 7 . ? -2.012 -4.227 -43.716 1.00 23.18 ? 914 HOH A O 1 HETATM 4161 O O . HOH J 7 . ? -30.063 10.489 -13.491 0.50 18.04 ? 915 HOH A O 1 HETATM 4162 O O . HOH J 7 . ? 8.114 7.452 -38.588 1.00 44.38 ? 916 HOH A O 1 HETATM 4163 O O . HOH J 7 . ? -29.883 13.567 -15.606 1.00 34.83 ? 917 HOH A O 1 HETATM 4164 O O . HOH J 7 . ? -28.292 9.403 -11.856 1.00 25.13 ? 918 HOH A O 1 HETATM 4165 O O . HOH J 7 . ? -20.906 -11.517 -18.704 1.00 17.94 ? 919 HOH A O 1 HETATM 4166 O O . HOH J 7 . ? -31.295 -3.085 -49.795 1.00 12.98 ? 920 HOH A O 1 HETATM 4167 O O . HOH J 7 . ? -30.815 2.260 -13.724 1.00 20.89 ? 921 HOH A O 1 HETATM 4168 O O . HOH J 7 . ? -18.177 -1.757 -4.110 1.00 20.55 ? 922 HOH A O 1 HETATM 4169 O O . HOH J 7 . ? -32.903 18.542 -21.475 1.00 41.98 ? 923 HOH A O 1 HETATM 4170 O O . HOH J 7 . ? -24.540 -18.406 -26.558 1.00 26.53 ? 924 HOH A O 1 HETATM 4171 O O . HOH J 7 . ? -4.626 16.099 -44.558 1.00 25.86 ? 925 HOH A O 1 HETATM 4172 O O . HOH J 7 . ? -15.075 -28.478 -23.810 1.00 38.21 ? 926 HOH A O 1 HETATM 4173 O O . HOH J 7 . ? -13.891 -16.068 2.470 1.00 32.77 ? 927 HOH A O 1 HETATM 4174 O O . HOH J 7 . ? -23.681 16.048 -50.119 1.00 16.03 ? 928 HOH A O 1 HETATM 4175 O O . HOH J 7 . ? -20.424 -25.162 -32.226 1.00 23.67 ? 929 HOH A O 1 HETATM 4176 O O . HOH J 7 . ? -16.416 -10.571 -27.297 1.00 5.42 ? 930 HOH A O 1 HETATM 4177 O O . HOH J 7 . ? -34.305 12.277 -48.385 0.50 5.07 ? 931 HOH A O 1 HETATM 4178 O O . HOH J 7 . ? -15.018 -1.544 -55.609 1.00 25.08 ? 932 HOH A O 1 HETATM 4179 O O . HOH J 7 . ? -7.255 1.483 1.287 1.00 24.94 ? 933 HOH A O 1 HETATM 4180 O O . HOH J 7 . ? -22.910 -16.641 -31.778 1.00 21.28 ? 934 HOH A O 1 HETATM 4181 O O . HOH J 7 . ? -22.559 -18.715 -33.074 1.00 22.91 ? 935 HOH A O 1 HETATM 4182 O O . HOH J 7 . ? -23.066 -9.669 -32.229 1.00 7.97 ? 936 HOH A O 1 HETATM 4183 O O . HOH J 7 . ? 6.041 -14.715 1.570 1.00 23.09 ? 937 HOH A O 1 HETATM 4184 O O . HOH J 7 . ? -4.403 14.180 -42.628 1.00 7.88 ? 938 HOH A O 1 HETATM 4185 O O . HOH J 7 . ? -32.184 0.352 -15.495 1.00 39.82 ? 939 HOH A O 1 HETATM 4186 O O . HOH J 7 . ? -16.514 21.483 -36.838 1.00 39.94 ? 940 HOH A O 1 HETATM 4187 O O . HOH J 7 . ? -23.780 17.378 -18.042 1.00 33.43 ? 941 HOH A O 1 HETATM 4188 O O . HOH J 7 . ? -25.378 24.445 -24.683 1.00 24.09 ? 942 HOH A O 1 HETATM 4189 O O . HOH J 7 . ? 7.673 4.037 -36.349 1.00 30.52 ? 943 HOH A O 1 HETATM 4190 O O . HOH J 7 . ? 3.636 14.669 -12.958 1.00 32.80 ? 944 HOH A O 1 HETATM 4191 O O . HOH J 7 . ? -22.042 22.555 -39.831 1.00 20.18 ? 945 HOH A O 1 HETATM 4192 O O . HOH J 7 . ? -20.569 21.009 -41.269 1.00 19.80 ? 946 HOH A O 1 HETATM 4193 O O . HOH J 7 . ? -22.083 19.919 -43.627 1.00 19.46 ? 947 HOH A O 1 HETATM 4194 O O . HOH J 7 . ? -25.669 21.651 -42.297 1.00 21.21 ? 948 HOH A O 1 HETATM 4195 O O . HOH J 7 . ? -29.926 20.098 -29.376 1.00 18.24 ? 949 HOH A O 1 HETATM 4196 O O . HOH J 7 . ? -32.144 18.455 -29.370 1.00 27.46 ? 950 HOH A O 1 HETATM 4197 O O . HOH J 7 . ? -23.476 22.732 -37.636 1.00 21.80 ? 951 HOH A O 1 HETATM 4198 O O . HOH J 7 . ? -24.980 20.068 -44.220 1.00 26.84 ? 952 HOH A O 1 HETATM 4199 O O . HOH J 7 . ? -13.509 -19.226 -2.729 1.00 39.23 ? 953 HOH A O 1 HETATM 4200 O O . HOH J 7 . ? -14.265 24.539 -33.236 1.00 32.45 ? 954 HOH A O 1 HETATM 4201 O O . HOH J 7 . ? 15.314 -12.708 -8.555 1.00 27.59 ? 955 HOH A O 1 HETATM 4202 O O . HOH J 7 . ? 9.564 11.875 -21.363 1.00 20.79 ? 956 HOH A O 1 HETATM 4203 O O . HOH J 7 . ? -12.384 17.818 -21.391 1.00 19.12 ? 957 HOH A O 1 HETATM 4204 O O . HOH J 7 . ? -37.145 10.382 -35.585 0.50 2.00 ? 958 HOH A O 1 HETATM 4205 O O . HOH J 7 . ? -35.138 4.959 -38.265 0.50 9.10 ? 959 HOH A O 1 HETATM 4206 O O . HOH J 7 . ? 10.290 13.535 -23.114 1.00 18.38 ? 960 HOH A O 1 HETATM 4207 O O . HOH J 7 . ? -22.316 4.972 -55.535 1.00 12.05 ? 961 HOH A O 1 HETATM 4208 O O . HOH J 7 . ? -25.234 14.892 -18.125 1.00 21.91 ? 962 HOH A O 1 HETATM 4209 O O . HOH J 7 . ? 6.015 -25.674 -8.324 1.00 26.33 ? 963 HOH A O 1 # 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 GLY 1 1 1 GLY GLY A . n A 1 2 ALA 2 2 2 ALA ALA A . n A 1 3 ILE 3 3 3 ILE ILE A . n A 1 4 GLU 4 4 4 GLU GLU A . n A 1 5 ALA 5 5 5 ALA ALA A . n A 1 6 CYS 6 6 6 CYS CYS A . n A 1 7 LEU 7 7 7 LEU LEU A . n A 1 8 SER 8 8 8 SER SER A . n A 1 9 ALA 9 9 9 ALA ALA A . n A 1 10 ALA 10 10 10 ALA ALA A . n A 1 11 GLY 11 11 11 GLY GLY A . n A 1 12 VAL 12 12 12 VAL VAL A . n A 1 13 PRO 13 13 13 PRO PRO A . n A 1 14 ILE 14 14 14 ILE ILE A . n A 1 15 ASP 15 15 15 ASP ASP A . n A 1 16 ILE 16 16 16 ILE ILE A . n A 1 17 PRO 17 17 17 PRO PRO A . n A 1 18 GLY 18 18 18 GLY GLY A . n A 1 19 THR 19 19 19 THR THR A . n A 1 20 ALA 20 20 20 ALA ALA A . n A 1 21 ASP 21 21 21 ASP ASP A . n A 1 22 TYR 22 22 22 TYR TYR A . n A 1 23 GLU 23 23 23 GLU GLU A . n A 1 24 ARG 24 24 24 ARG ARG A . n A 1 25 ASP 25 25 25 ASP ASP A . n A 1 26 VAL 26 26 26 VAL VAL A . n A 1 27 GLU 27 27 27 GLU GLU A . n A 1 28 PRO 28 28 28 PRO PRO A . n A 1 29 PHE 29 29 29 PHE PHE A . n A 1 30 ASN 30 30 30 ASN ASN A . n A 1 31 ILE 31 31 31 ILE ILE A . n A 1 32 ARG 32 32 32 ARG ARG A . n A 1 33 LEU 33 33 33 LEU LEU A . n A 1 34 PRO 34 34 34 PRO PRO A . n A 1 35 TYR 35 35 35 TYR TYR A . n A 1 36 ILE 36 36 36 ILE ILE A . n A 1 37 PRO 37 37 37 PRO PRO A . n A 1 38 THR 38 38 38 THR THR A . n A 1 39 ALA 39 39 39 ALA ALA A . n A 1 40 ILE 40 40 40 ILE ILE A . n A 1 41 ALA 41 41 41 ALA ALA A . n A 1 42 GLN 42 42 42 GLN GLN A . n A 1 43 THR 43 43 43 THR THR A . n A 1 44 GLN 44 44 44 GLN GLN A . n A 1 45 THR 45 45 45 THR THR A . n A 1 46 THR 46 46 46 THR THR A . n A 1 47 ALA 47 47 47 ALA ALA A . n A 1 48 HIS 48 48 48 HIS HIS A . n A 1 49 ILE 49 49 49 ILE ILE A . n A 1 50 GLN 50 50 50 GLN GLN A . n A 1 51 SER 51 51 51 SER SER A . n A 1 52 ALA 52 52 52 ALA ALA A . n A 1 53 VAL 53 53 53 VAL VAL A . n A 1 54 GLN 54 54 54 GLN GLN A . n A 1 55 CYS 55 55 55 CYS CYS A . n A 1 56 ALA 56 56 56 ALA ALA A . n A 1 57 LYS 57 57 57 LYS LYS A . n A 1 58 LYS 58 58 58 LYS LYS A . n A 1 59 LEU 59 59 59 LEU LEU A . n A 1 60 ASN 60 60 60 ASN ASN A . n A 1 61 LEU 61 61 61 LEU LEU A . n A 1 62 LYS 62 62 62 LYS LYS A . n A 1 63 VAL 63 63 63 VAL VAL A . n A 1 64 SER 64 64 64 SER SER A . n A 1 65 ALA 65 65 65 ALA ALA A . n A 1 66 LYS 66 66 66 LYS LYS A . n A 1 67 SER 67 67 67 SER SER A . n A 1 68 GLY 68 68 68 GLY GLY A . n A 1 69 GLY 69 69 69 GLY GLY A . n A 1 70 HIS 70 70 70 HIS HIS A . n A 1 71 SER 71 71 71 SER SER A . n A 1 72 TYR 72 72 72 TYR TYR A . n A 1 73 ALA 73 73 73 ALA ALA A . n A 1 74 SER 74 74 74 SER SER A . n A 1 75 PHE 75 75 75 PHE PHE A . n A 1 76 GLY 76 76 76 GLY GLY A . n A 1 77 PHE 77 77 77 PHE PHE A . n A 1 78 GLY 78 78 78 GLY GLY A . n A 1 79 GLY 79 79 79 GLY GLY A . n A 1 80 GLU 80 80 80 GLU GLU A . n A 1 81 ASN 81 81 81 ASN ASN A . n A 1 82 GLY 82 82 82 GLY GLY A . n A 1 83 HIS 83 83 83 HIS HIS A . n A 1 84 LEU 84 84 84 LEU LEU A . n A 1 85 MET 85 85 85 MET MET A . n A 1 86 VAL 86 86 86 VAL VAL A . n A 1 87 GLN 87 87 87 GLN GLN A . n A 1 88 LEU 88 88 88 LEU LEU A . n A 1 89 ASP 89 89 89 ASP ASP A . n A 1 90 ARG 90 90 90 ARG ARG A . n A 1 91 MET 91 91 91 MET MET A . n A 1 92 ILE 92 92 92 ILE ILE A . n A 1 93 ASP 93 93 93 ASP ASP A . n A 1 94 VAL 94 94 94 VAL VAL A . n A 1 95 ILE 95 95 95 ILE ILE A . n A 1 96 SER 96 96 96 SER SER A . n A 1 97 TYR 97 97 97 TYR TYR A . n A 1 98 ASN 98 98 98 ASN ASN A . n A 1 99 ASP 99 99 99 ASP ASP A . n A 1 100 LYS 100 100 100 LYS LYS A . n A 1 101 THR 101 101 101 THR THR A . n A 1 102 GLY 102 102 102 GLY GLY A . n A 1 103 ILE 103 103 103 ILE ILE A . n A 1 104 ALA 104 104 104 ALA ALA A . n A 1 105 HIS 105 105 105 HIS HIS A . n A 1 106 VAL 106 106 106 VAL VAL A . n A 1 107 GLU 107 107 107 GLU GLU A . n A 1 108 PRO 108 108 108 PRO PRO A . n A 1 109 GLY 109 109 109 GLY GLY A . n A 1 110 ALA 110 110 110 ALA ALA A . n A 1 111 ARG 111 111 111 ARG ARG A . n A 1 112 LEU 112 112 112 LEU LEU A . n A 1 113 GLY 113 113 113 GLY GLY A . n A 1 114 HIS 114 114 114 HIS HIS A . n A 1 115 LEU 115 115 115 LEU LEU A . n A 1 116 ALA 116 116 116 ALA ALA A . n A 1 117 THR 117 117 117 THR THR A . n A 1 118 VAL 118 118 118 VAL VAL A . n A 1 119 LEU 119 119 119 LEU LEU A . n A 1 120 ASN 120 120 120 ASN ASN A . n A 1 121 ASP 121 121 121 ASP ASP A . n A 1 122 LYS 122 122 122 LYS LYS 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 ARG 125 125 125 ARG ARG A . n A 1 126 ALA 126 126 126 ALA ALA A . n A 1 127 ILE 127 127 127 ILE ILE A . n A 1 128 SER 128 128 128 SER SER A . n A 1 129 HIS 129 129 129 HIS HIS A . n A 1 130 GLY 130 130 130 GLY GLY A . n A 1 131 THR 131 131 131 THR THR A . n A 1 132 CYS 132 132 132 CYS CYS A . n A 1 133 PRO 133 133 133 PRO PRO A . n A 1 134 GLY 134 134 134 GLY GLY A . n A 1 135 VAL 135 135 135 VAL VAL A . n A 1 136 GLY 136 136 136 GLY GLY A . n A 1 137 ILE 137 137 137 ILE ILE A . n A 1 138 SER 138 138 138 SER SER A . n A 1 139 GLY 139 139 139 GLY GLY A . n A 1 140 HIS 140 140 140 HIS HIS A . n A 1 141 PHE 141 141 141 PHE PHE A . n A 1 142 ALA 142 142 142 ALA ALA A . n A 1 143 HIS 143 143 143 HIS HIS A . n A 1 144 GLY 144 144 144 GLY GLY A . n A 1 145 GLY 145 145 145 GLY GLY A . n A 1 146 PHE 146 146 146 PHE PHE A . n A 1 147 GLY 147 147 147 GLY GLY A . n A 1 148 PHE 148 148 148 PHE PHE A . n A 1 149 SER 149 149 149 SER SER A . n A 1 150 SER 150 150 150 SER SER A . n A 1 151 HIS 151 151 151 HIS HIS A . n A 1 152 MET 152 152 152 MET MET A . n A 1 153 HIS 153 153 153 HIS HIS A . n A 1 154 GLY 154 154 154 GLY GLY A . n A 1 155 LEU 155 155 155 LEU LEU A . n A 1 156 ALA 156 156 156 ALA ALA A . n A 1 157 VAL 157 157 157 VAL VAL A . n A 1 158 ASP 158 158 158 ASP ASP A . n A 1 159 SER 159 159 159 SER SER A . n A 1 160 VAL 160 160 160 VAL VAL A . n A 1 161 VAL 161 161 161 VAL VAL A . n A 1 162 GLY 162 162 162 GLY GLY A . n A 1 163 VAL 163 163 163 VAL VAL A . n A 1 164 THR 164 164 164 THR THR A . n A 1 165 VAL 165 165 165 VAL VAL A . n A 1 166 VAL 166 166 166 VAL VAL A . n A 1 167 LEU 167 167 167 LEU LEU A . n A 1 168 ALA 168 168 168 ALA ALA A . n A 1 169 ASP 169 169 169 ASP ASP A . n A 1 170 GLY 170 170 170 GLY GLY A . n A 1 171 ARG 171 171 171 ARG ARG A . n A 1 172 ILE 172 172 172 ILE ILE A . n A 1 173 VAL 173 173 173 VAL VAL A . n A 1 174 GLU 174 174 174 GLU GLU A . n A 1 175 ALA 175 175 175 ALA ALA A . n A 1 176 SER 176 176 176 SER SER A . n A 1 177 ALA 177 177 177 ALA ALA A . n A 1 178 THR 178 178 178 THR THR A . n A 1 179 GLU 179 179 179 GLU GLU A . n A 1 180 ASN 180 180 180 ASN ASN A . n A 1 181 ALA 181 181 181 ALA ALA A . n A 1 182 ASP 182 182 182 ASP ASP A . n A 1 183 LEU 183 183 183 LEU LEU A . n A 1 184 PHE 184 184 184 PHE PHE A . n A 1 185 TRP 185 185 185 TRP TRP A . n A 1 186 GLY 186 186 186 GLY GLY A . n A 1 187 ILE 187 187 187 ILE ILE A . n A 1 188 LYS 188 188 188 LYS LYS A . n A 1 189 GLY 189 189 189 GLY GLY A . n A 1 190 ALA 190 190 190 ALA ALA A . n A 1 191 GLY 191 191 191 GLY GLY A . n A 1 192 SER 192 192 192 SER SER A . n A 1 193 ASN 193 193 193 ASN ASN A . n A 1 194 PHE 194 194 194 PHE PHE A . n A 1 195 GLY 195 195 195 GLY GLY A . n A 1 196 ILE 196 196 196 ILE ILE A . n A 1 197 VAL 197 197 197 VAL VAL A . n A 1 198 ALA 198 198 198 ALA ALA A . n A 1 199 VAL 199 199 199 VAL VAL A . n A 1 200 TRP 200 200 200 TRP TRP A . n A 1 201 LYS 201 201 201 LYS LYS A . n A 1 202 LEU 202 202 202 LEU LEU A . n A 1 203 ALA 203 203 203 ALA ALA A . n A 1 204 THR 204 204 204 THR THR A . n A 1 205 PHE 205 205 205 PHE PHE A . n A 1 206 PRO 206 206 206 PRO PRO A . n A 1 207 ALA 207 207 207 ALA ALA A . n A 1 208 PRO 208 208 208 PRO PRO A . n A 1 209 LYS 209 209 209 LYS LYS A . n A 1 210 VAL 210 210 210 VAL VAL A . n A 1 211 LEU 211 211 211 LEU LEU A . n A 1 212 THR 212 212 212 THR THR A . n A 1 213 ARG 213 213 213 ARG ARG A . n A 1 214 PHE 214 214 214 PHE PHE A . n A 1 215 GLY 215 215 215 GLY GLY A . n A 1 216 VAL 216 216 216 VAL VAL A . n A 1 217 THR 217 217 217 THR THR A . n A 1 218 LEU 218 218 218 LEU LEU A . n A 1 219 ASN 219 219 219 ASN ASN A . n A 1 220 TRP 220 220 220 TRP TRP A . n A 1 221 LYS 221 221 221 LYS LYS A . n A 1 222 ASN 222 222 222 ASN ASN A . n A 1 223 LYS 223 223 223 LYS LYS A . n A 1 224 THR 224 224 224 THR THR A . n A 1 225 SER 225 225 225 SER SER A . n A 1 226 ALA 226 226 226 ALA ALA A . n A 1 227 LEU 227 227 227 LEU LEU A . n A 1 228 LYS 228 228 228 LYS LYS A . n A 1 229 GLY 229 229 229 GLY GLY A . n A 1 230 ILE 230 230 230 ILE ILE A . n A 1 231 GLU 231 231 231 GLU GLU A . n A 1 232 ALA 232 232 232 ALA ALA A . n A 1 233 VAL 233 233 233 VAL VAL A . n A 1 234 GLU 234 234 234 GLU GLU A . n A 1 235 ASP 235 235 235 ASP ASP A . n A 1 236 TYR 236 236 236 TYR TYR A . n A 1 237 ALA 237 237 237 ALA ALA A . n A 1 238 ARG 238 238 238 ARG ARG A . n A 1 239 TRP 239 239 239 TRP TRP A . n A 1 240 VAL 240 240 240 VAL VAL A . n A 1 241 ALA 241 241 241 ALA ALA A . n A 1 242 PRO 242 242 242 PRO PRO A . n A 1 243 ARG 243 243 243 ARG ARG A . n A 1 244 GLU 244 244 244 GLU GLU A . n A 1 245 VAL 245 245 245 VAL VAL A . n A 1 246 ASN 246 246 246 ASN ASN A . n A 1 247 PHE 247 247 247 PHE PHE A . n A 1 248 ARG 248 248 248 ARG ARG A . n A 1 249 ILE 249 249 249 ILE ILE A . n A 1 250 GLY 250 250 250 GLY GLY A . n A 1 251 ASP 251 251 251 ASP ASP A . n A 1 252 TYR 252 252 252 TYR TYR A . n A 1 253 GLY 253 253 253 GLY GLY A . n A 1 254 ALA 254 254 254 ALA ALA A . n A 1 255 GLY 255 255 255 GLY GLY A . n A 1 256 ASN 256 256 256 ASN ASN A . n A 1 257 PRO 257 257 257 PRO PRO A . n A 1 258 GLY 258 258 258 GLY GLY A . n A 1 259 ILE 259 259 259 ILE ILE A . n A 1 260 GLU 260 260 260 GLU GLU A . n A 1 261 GLY 261 261 261 GLY GLY A . n A 1 262 LEU 262 262 262 LEU LEU A . n A 1 263 TYR 263 263 263 TYR TYR A . n A 1 264 TYR 264 264 264 TYR TYR A . n A 1 265 GLY 265 265 265 GLY GLY A . n A 1 266 THR 266 266 266 THR THR A . n A 1 267 PRO 267 267 267 PRO PRO A . n A 1 268 GLU 268 268 268 GLU GLU A . n A 1 269 GLN 269 269 269 GLN GLN A . n A 1 270 TRP 270 270 270 TRP TRP A . n A 1 271 ARG 271 271 271 ARG ARG A . n A 1 272 ALA 272 272 272 ALA ALA A . n A 1 273 ALA 273 273 273 ALA ALA A . n A 1 274 PHE 274 274 274 PHE PHE A . n A 1 275 GLN 275 275 275 GLN GLN A . n A 1 276 PRO 276 276 276 PRO PRO A . n A 1 277 LEU 277 277 277 LEU LEU A . n A 1 278 LEU 278 278 278 LEU LEU A . n A 1 279 ASP 279 279 279 ASP ASP A . n A 1 280 THR 280 280 280 THR THR A . n A 1 281 LEU 281 281 281 LEU LEU A . n A 1 282 PRO 282 282 282 PRO PRO A . n A 1 283 ALA 283 283 283 ALA ALA A . n A 1 284 GLY 284 284 284 GLY GLY A . n A 1 285 TYR 285 285 285 TYR TYR A . n A 1 286 VAL 286 286 286 VAL VAL A . n A 1 287 VAL 287 287 287 VAL VAL A . n A 1 288 ASN 288 288 288 ASN ASN A . n A 1 289 PRO 289 289 289 PRO PRO A . n A 1 290 THR 290 290 290 THR THR A . n A 1 291 THR 291 291 291 THR THR A . n A 1 292 SER 292 292 292 SER SER A . n A 1 293 LEU 293 293 293 LEU LEU A . n A 1 294 ASN 294 294 294 ASN ASN A . n A 1 295 TRP 295 295 295 TRP TRP A . n A 1 296 ILE 296 296 296 ILE ILE A . n A 1 297 GLU 297 297 297 GLU GLU A . n A 1 298 SER 298 298 298 SER SER A . n A 1 299 VAL 299 299 299 VAL VAL A . n A 1 300 LEU 300 300 300 LEU LEU A . n A 1 301 SER 301 301 301 SER SER A . n A 1 302 TYR 302 302 302 TYR TYR A . n A 1 303 SER 303 303 303 SER SER A . n A 1 304 ASN 304 304 304 ASN ASN A . n A 1 305 PHE 305 305 305 PHE PHE A . n A 1 306 ASP 306 306 306 ASP ASP A . n A 1 307 HIS 307 307 307 HIS HIS A . n A 1 308 VAL 308 308 308 VAL VAL A . n A 1 309 ASP 309 309 309 ASP ASP A . n A 1 310 PHE 310 310 310 PHE PHE A . n A 1 311 ILE 311 311 311 ILE ILE A . n A 1 312 THR 312 312 312 THR THR A . n A 1 313 PRO 313 313 313 PRO PRO A . n A 1 314 GLN 314 314 314 GLN GLN A . n A 1 315 PRO 315 315 315 PRO PRO A . n A 1 316 VAL 316 316 316 VAL VAL A . n A 1 317 GLU 317 317 317 GLU GLU A . n A 1 318 ASN 318 318 318 ASN ASN A . n A 1 319 PHE 319 319 319 PHE PHE A . n A 1 320 TYR 320 320 320 TYR TYR A . n A 1 321 ALA 321 321 321 ALA ALA A . n A 1 322 LYS 322 322 322 LYS LYS A . n A 1 323 SER 323 323 323 SER SER A . n A 1 324 LEU 324 324 324 LEU LEU A . n A 1 325 THR 325 325 325 THR THR A . n A 1 326 LEU 326 326 326 LEU LEU A . n A 1 327 LYS 327 327 327 LYS LYS A . n A 1 328 SER 328 328 328 SER SER A . n A 1 329 ILE 329 329 329 ILE ILE A . n A 1 330 LYS 330 330 330 LYS LYS A . n A 1 331 GLY 331 331 331 GLY GLY A . n A 1 332 ASP 332 332 332 ASP ASP A . n A 1 333 ALA 333 333 333 ALA ALA A . n A 1 334 VAL 334 334 334 VAL VAL A . n A 1 335 LYS 335 335 335 LYS LYS A . n A 1 336 ASN 336 336 336 ASN ASN A . n A 1 337 PHE 337 337 337 PHE PHE A . n A 1 338 VAL 338 338 338 VAL VAL A . n A 1 339 ASP 339 339 339 ASP ASP A . n A 1 340 TYR 340 340 340 TYR TYR A . n A 1 341 TYR 341 341 341 TYR TYR A . n A 1 342 PHE 342 342 342 PHE PHE A . n A 1 343 ASP 343 343 343 ASP ASP A . n A 1 344 VAL 344 344 344 VAL VAL A . n A 1 345 SER 345 345 345 SER SER A . n A 1 346 ASN 346 346 346 ASN ASN A . n A 1 347 LYS 347 347 347 LYS LYS A . n A 1 348 VAL 348 348 348 VAL VAL A . n A 1 349 LYS 349 349 349 LYS LYS A . n A 1 350 ASP 350 350 350 ASP ASP A . n A 1 351 ARG 351 351 351 ARG ARG A . n A 1 352 PHE 352 352 352 PHE PHE A . n A 1 353 TRP 353 353 353 TRP TRP A . n A 1 354 PHE 354 354 354 PHE PHE A . n A 1 355 TYR 355 355 355 TYR TYR A . n A 1 356 GLN 356 356 356 GLN GLN A . n A 1 357 LEU 357 357 357 LEU LEU A . n A 1 358 ASP 358 358 358 ASP ASP A . n A 1 359 VAL 359 359 359 VAL VAL A . n A 1 360 HIS 360 360 360 HIS HIS A . n A 1 361 GLY 361 361 361 GLY GLY A . n A 1 362 GLY 362 362 362 GLY GLY A . n A 1 363 LYS 363 363 363 LYS LYS A . n A 1 364 ASN 364 364 364 ASN ASN A . n A 1 365 SER 365 365 365 SER SER A . n A 1 366 GLN 366 366 366 GLN GLN A . n A 1 367 VAL 367 367 367 VAL VAL A . n A 1 368 THR 368 368 368 THR THR A . n A 1 369 LYS 369 369 369 LYS LYS A . n A 1 370 VAL 370 370 370 VAL VAL A . n A 1 371 THR 371 371 371 THR THR A . n A 1 372 ASN 372 372 372 ASN ASN A . n A 1 373 ALA 373 373 373 ALA ALA A . n A 1 374 GLU 374 374 374 GLU GLU A . n A 1 375 THR 375 375 375 THR THR A . n A 1 376 ALA 376 376 376 ALA ALA A . n A 1 377 TYR 377 377 377 TYR TYR A . n A 1 378 PRO 378 378 378 PRO PRO A . n A 1 379 HIS 379 379 379 HIS HIS A . n A 1 380 ARG 380 380 380 ARG ARG A . n A 1 381 ASP 381 381 381 ASP ASP A . n A 1 382 LYS 382 382 382 LYS LYS A . n A 1 383 LEU 383 383 383 LEU LEU A . n A 1 384 TRP 384 384 384 TRP TRP A . n A 1 385 LEU 385 385 385 LEU LEU A . n A 1 386 ILE 386 386 386 ILE ILE A . n A 1 387 GLN 387 387 387 GLN GLN A . n A 1 388 PHE 388 388 388 PHE PHE A . n A 1 389 TYR 389 389 389 TYR TYR A . n A 1 390 ASP 390 390 390 ASP ASP A . n A 1 391 ARG 391 391 391 ARG ARG A . n A 1 392 TYR 392 392 392 TYR TYR A . n A 1 393 ASP 393 393 393 ASP ASP A . n A 1 394 ASN 394 394 394 ASN ASN A . n A 1 395 ASN 395 395 395 ASN ASN A . n A 1 396 GLN 396 396 396 GLN GLN A . n A 1 397 THR 397 397 397 THR THR A . n A 1 398 TYR 398 398 398 TYR TYR A . n A 1 399 PRO 399 399 399 PRO PRO A . n A 1 400 GLU 400 400 400 GLU GLU A . n A 1 401 THR 401 401 401 THR THR A . n A 1 402 SER 402 402 402 SER SER A . n A 1 403 PHE 403 403 403 PHE PHE A . n A 1 404 LYS 404 404 404 LYS LYS A . n A 1 405 PHE 405 405 405 PHE PHE A . n A 1 406 LEU 406 406 406 LEU LEU A . n A 1 407 ASP 407 407 407 ASP ASP A . n A 1 408 GLY 408 408 408 GLY GLY A . n A 1 409 TRP 409 409 409 TRP TRP A . n A 1 410 VAL 410 410 410 VAL VAL A . n A 1 411 ASN 411 411 411 ASN ASN A . n A 1 412 SER 412 412 412 SER SER A . n A 1 413 VAL 413 413 413 VAL VAL A . n A 1 414 THR 414 414 414 THR THR A . n A 1 415 LYS 415 415 415 LYS LYS A . n A 1 416 ALA 416 416 416 ALA ALA A . n A 1 417 LEU 417 417 417 LEU LEU A . n A 1 418 PRO 418 418 418 PRO PRO A . n A 1 419 LYS 419 419 419 LYS LYS A . n A 1 420 SER 420 420 420 SER SER A . n A 1 421 ASP 421 421 421 ASP ASP A . n A 1 422 TRP 422 422 422 TRP TRP A . n A 1 423 GLY 423 423 423 GLY GLY A . n A 1 424 MET 424 424 424 MET MET A . n A 1 425 TYR 425 425 425 TYR TYR A . n A 1 426 ILE 426 426 426 ILE ILE A . n A 1 427 ASN 427 427 427 ASN ASN A . n A 1 428 TYR 428 428 428 TYR TYR A . n A 1 429 ALA 429 429 429 ALA ALA A . n A 1 430 ASP 430 430 430 ASP ASP A . n A 1 431 PRO 431 431 431 PRO PRO A . n A 1 432 ARG 432 432 432 ARG ARG A . n A 1 433 MET 433 433 433 MET MET A . n A 1 434 ASP 434 434 434 ASP ASP A . n A 1 435 ARG 435 435 435 ARG ARG A . n A 1 436 ASP 436 436 436 ASP ASP A . n A 1 437 TYR 437 437 437 TYR TYR A . n A 1 438 ALA 438 438 438 ALA ALA A . n A 1 439 THR 439 439 439 THR THR A . n A 1 440 LYS 440 440 440 LYS LYS A . n A 1 441 VAL 441 441 441 VAL VAL A . n A 1 442 TYR 442 442 442 TYR TYR A . n A 1 443 TYR 443 443 443 TYR TYR A . n A 1 444 GLY 444 444 444 GLY GLY A . n A 1 445 GLU 445 445 445 GLU GLU A . n A 1 446 ASN 446 446 446 ASN ASN A . n A 1 447 LEU 447 447 447 LEU LEU A . n A 1 448 ALA 448 448 448 ALA ALA A . n A 1 449 ARG 449 449 449 ARG ARG A . n A 1 450 LEU 450 450 450 LEU LEU A . n A 1 451 GLN 451 451 451 GLN GLN A . n A 1 452 LYS 452 452 452 LYS LYS A . n A 1 453 LEU 453 453 453 LEU LEU A . n A 1 454 LYS 454 454 454 LYS LYS A . n A 1 455 ALA 455 455 455 ALA ALA A . n A 1 456 LYS 456 456 456 LYS LYS A . n A 1 457 PHE 457 457 457 PHE PHE A . n A 1 458 ASP 458 458 458 ASP ASP A . n A 1 459 PRO 459 459 459 PRO PRO A . n A 1 460 THR 460 460 460 THR THR A . n A 1 461 ASP 461 461 461 ASP ASP A . n A 1 462 ARG 462 462 462 ARG ARG A . n A 1 463 PHE 463 463 463 PHE PHE A . n A 1 464 TYR 464 464 464 TYR TYR A . n A 1 465 TYR 465 465 465 TYR TYR A . n A 1 466 PRO 466 466 466 PRO PRO A . n A 1 467 GLN 467 467 467 GLN GLN A . n A 1 468 ALA 468 468 468 ALA ALA A . n A 1 469 VAL 469 469 469 VAL VAL A . n A 1 470 ARG 470 470 470 ARG ARG A . n A 1 471 PRO 471 471 471 PRO PRO A . n A 1 472 VAL 472 472 472 VAL VAL A . n A 1 473 LYS 473 473 473 LYS LYS A . 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 B 2 FAD 1 501 501 FAD FAD A . C 3 NAG 1 502 502 NAG NAG A . D 3 NAG 2 503 503 NAG NAG A . E 4 ZN 1 601 601 ZN ZN A . F 4 ZN 1 602 602 ZN ZN A . G 4 ZN 1 603 603 ZN ZN A . H 5 K 1 604 604 K K A . I 6 TRS 1 605 605 TRS TRS A . J 7 HOH 1 606 606 HOH HOH A . J 7 HOH 2 607 607 HOH HOH A . J 7 HOH 3 608 608 HOH HOH A . J 7 HOH 4 609 609 HOH HOH A . J 7 HOH 5 610 610 HOH HOH A . J 7 HOH 6 611 611 HOH HOH A . J 7 HOH 7 612 612 HOH HOH A . J 7 HOH 8 613 613 HOH HOH A . J 7 HOH 9 614 614 HOH HOH A . J 7 HOH 10 615 615 HOH HOH A . J 7 HOH 11 616 616 HOH HOH A . J 7 HOH 12 617 617 HOH HOH A . J 7 HOH 13 618 618 HOH HOH A . J 7 HOH 14 619 619 HOH HOH A . J 7 HOH 15 620 620 HOH HOH A . J 7 HOH 16 621 621 HOH HOH A . J 7 HOH 17 622 622 HOH HOH A . J 7 HOH 18 623 623 HOH HOH A . J 7 HOH 19 624 624 HOH HOH A . J 7 HOH 20 625 625 HOH HOH A . J 7 HOH 21 627 627 HOH HOH A . J 7 HOH 22 628 628 HOH HOH A . J 7 HOH 23 629 629 HOH HOH A . J 7 HOH 24 630 630 HOH HOH A . J 7 HOH 25 631 631 HOH HOH A . J 7 HOH 26 632 632 HOH HOH A . J 7 HOH 27 633 633 HOH HOH A . J 7 HOH 28 634 634 HOH HOH A . J 7 HOH 29 635 635 HOH HOH A . J 7 HOH 30 636 636 HOH HOH A . J 7 HOH 31 637 637 HOH HOH A . J 7 HOH 32 638 638 HOH HOH A . J 7 HOH 33 639 639 HOH HOH A . J 7 HOH 34 640 640 HOH HOH A . J 7 HOH 35 641 641 HOH HOH A . J 7 HOH 36 642 642 HOH HOH A . J 7 HOH 37 643 643 HOH HOH A . J 7 HOH 38 644 644 HOH HOH A . J 7 HOH 39 645 645 HOH HOH A . J 7 HOH 40 646 646 HOH HOH A . J 7 HOH 41 647 647 HOH HOH A . J 7 HOH 42 648 648 HOH HOH A . J 7 HOH 43 649 649 HOH HOH A . J 7 HOH 44 650 650 HOH HOH A . J 7 HOH 45 651 651 HOH HOH A . J 7 HOH 46 652 652 HOH HOH A . J 7 HOH 47 653 653 HOH HOH A . J 7 HOH 48 654 654 HOH HOH A . J 7 HOH 49 655 655 HOH HOH A . J 7 HOH 50 656 656 HOH HOH A . J 7 HOH 51 657 657 HOH HOH A . J 7 HOH 52 658 658 HOH HOH A . J 7 HOH 53 659 659 HOH HOH A . J 7 HOH 54 660 660 HOH HOH A . J 7 HOH 55 661 661 HOH HOH A . J 7 HOH 56 662 662 HOH HOH A . J 7 HOH 57 663 663 HOH HOH A . J 7 HOH 58 664 664 HOH HOH A . J 7 HOH 59 665 665 HOH HOH A . J 7 HOH 60 666 666 HOH HOH A . J 7 HOH 61 667 667 HOH HOH A . J 7 HOH 62 668 668 HOH HOH A . J 7 HOH 63 669 669 HOH HOH A . J 7 HOH 64 670 670 HOH HOH A . J 7 HOH 65 671 671 HOH HOH A . J 7 HOH 66 672 672 HOH HOH A . J 7 HOH 67 673 673 HOH HOH A . J 7 HOH 68 674 674 HOH HOH A . J 7 HOH 69 675 675 HOH HOH A . J 7 HOH 70 676 676 HOH HOH A . J 7 HOH 71 677 677 HOH HOH A . J 7 HOH 72 678 678 HOH HOH A . J 7 HOH 73 679 679 HOH HOH A . J 7 HOH 74 680 680 HOH HOH A . J 7 HOH 75 681 681 HOH HOH A . J 7 HOH 76 682 682 HOH HOH A . J 7 HOH 77 683 683 HOH HOH A . J 7 HOH 78 684 684 HOH HOH A . J 7 HOH 79 685 685 HOH HOH A . J 7 HOH 80 686 686 HOH HOH A . J 7 HOH 81 687 687 HOH HOH A . J 7 HOH 82 688 688 HOH HOH A . J 7 HOH 83 689 689 HOH HOH A . J 7 HOH 84 690 690 HOH HOH A . J 7 HOH 85 691 691 HOH HOH A . J 7 HOH 86 692 692 HOH HOH A . J 7 HOH 87 693 693 HOH HOH A . J 7 HOH 88 694 694 HOH HOH A . J 7 HOH 89 695 695 HOH HOH A . J 7 HOH 90 696 696 HOH HOH A . J 7 HOH 91 697 697 HOH HOH A . J 7 HOH 92 698 698 HOH HOH A . J 7 HOH 93 699 699 HOH HOH A . J 7 HOH 94 700 700 HOH HOH A . J 7 HOH 95 701 701 HOH HOH A . J 7 HOH 96 702 702 HOH HOH A . J 7 HOH 97 703 703 HOH HOH A . J 7 HOH 98 704 704 HOH HOH A . J 7 HOH 99 705 705 HOH HOH A . J 7 HOH 100 706 706 HOH HOH A . J 7 HOH 101 707 707 HOH HOH A . J 7 HOH 102 708 708 HOH HOH A . J 7 HOH 103 709 709 HOH HOH A . J 7 HOH 104 710 710 HOH HOH A . J 7 HOH 105 711 711 HOH HOH A . J 7 HOH 106 712 712 HOH HOH A . J 7 HOH 107 713 713 HOH HOH A . J 7 HOH 108 714 714 HOH HOH A . J 7 HOH 109 715 715 HOH HOH A . J 7 HOH 110 716 716 HOH HOH A . J 7 HOH 111 717 717 HOH HOH A . J 7 HOH 112 718 718 HOH HOH A . J 7 HOH 113 719 719 HOH HOH A . J 7 HOH 114 720 720 HOH HOH A . J 7 HOH 115 721 721 HOH HOH A . J 7 HOH 116 722 722 HOH HOH A . J 7 HOH 117 723 723 HOH HOH A . J 7 HOH 118 724 724 HOH HOH A . J 7 HOH 119 725 725 HOH HOH A . J 7 HOH 120 726 726 HOH HOH A . J 7 HOH 121 727 727 HOH HOH A . J 7 HOH 122 728 728 HOH HOH A . J 7 HOH 123 729 729 HOH HOH A . J 7 HOH 124 730 730 HOH HOH A . J 7 HOH 125 731 731 HOH HOH A . J 7 HOH 126 732 732 HOH HOH A . J 7 HOH 127 733 733 HOH HOH A . J 7 HOH 128 734 734 HOH HOH A . J 7 HOH 129 735 735 HOH HOH A . J 7 HOH 130 736 736 HOH HOH A . J 7 HOH 131 737 737 HOH HOH A . J 7 HOH 132 738 738 HOH HOH A . J 7 HOH 133 739 739 HOH HOH A . J 7 HOH 134 740 740 HOH HOH A . J 7 HOH 135 741 741 HOH HOH A . J 7 HOH 136 742 742 HOH HOH A . J 7 HOH 137 743 743 HOH HOH A . J 7 HOH 138 744 744 HOH HOH A . J 7 HOH 139 745 745 HOH HOH A . J 7 HOH 140 746 746 HOH HOH A . J 7 HOH 141 747 747 HOH HOH A . J 7 HOH 142 748 748 HOH HOH A . J 7 HOH 143 749 749 HOH HOH A . J 7 HOH 144 750 750 HOH HOH A . J 7 HOH 145 751 751 HOH HOH A . J 7 HOH 146 752 752 HOH HOH A . J 7 HOH 147 753 753 HOH HOH A . J 7 HOH 148 754 754 HOH HOH A . J 7 HOH 149 755 755 HOH HOH A . J 7 HOH 150 756 756 HOH HOH A . J 7 HOH 151 757 757 HOH HOH A . J 7 HOH 152 758 758 HOH HOH A . J 7 HOH 153 759 759 HOH HOH A . J 7 HOH 154 760 760 HOH HOH A . J 7 HOH 155 761 761 HOH HOH A . J 7 HOH 156 762 762 HOH HOH A . J 7 HOH 157 763 763 HOH HOH A . J 7 HOH 158 764 764 HOH HOH A . J 7 HOH 159 765 765 HOH HOH A . J 7 HOH 160 766 766 HOH HOH A . J 7 HOH 161 767 767 HOH HOH A . J 7 HOH 162 768 768 HOH HOH A . J 7 HOH 163 769 769 HOH HOH A . J 7 HOH 164 770 770 HOH HOH A . J 7 HOH 165 771 771 HOH HOH A . J 7 HOH 166 772 772 HOH HOH A . J 7 HOH 167 773 773 HOH HOH A . J 7 HOH 168 774 774 HOH HOH A . J 7 HOH 169 775 775 HOH HOH A . J 7 HOH 170 776 776 HOH HOH A . J 7 HOH 171 777 777 HOH HOH A . J 7 HOH 172 778 778 HOH HOH A . J 7 HOH 173 779 779 HOH HOH A . J 7 HOH 174 780 780 HOH HOH A . J 7 HOH 175 781 781 HOH HOH A . J 7 HOH 176 782 782 HOH HOH A . J 7 HOH 177 783 783 HOH HOH A . J 7 HOH 178 784 784 HOH HOH A . J 7 HOH 179 785 785 HOH HOH A . J 7 HOH 180 786 786 HOH HOH A . J 7 HOH 181 787 787 HOH HOH A . J 7 HOH 182 788 788 HOH HOH A . J 7 HOH 183 789 789 HOH HOH A . J 7 HOH 184 790 790 HOH HOH A . J 7 HOH 185 791 791 HOH HOH A . J 7 HOH 186 792 792 HOH HOH A . J 7 HOH 187 793 793 HOH HOH A . J 7 HOH 188 794 794 HOH HOH A . J 7 HOH 189 795 795 HOH HOH A . J 7 HOH 190 796 796 HOH HOH A . J 7 HOH 191 797 797 HOH HOH A . J 7 HOH 192 798 798 HOH HOH A . J 7 HOH 193 799 799 HOH HOH A . J 7 HOH 194 800 800 HOH HOH A . J 7 HOH 195 801 801 HOH HOH A . J 7 HOH 196 802 802 HOH HOH A . J 7 HOH 197 803 803 HOH HOH A . J 7 HOH 198 804 804 HOH HOH A . J 7 HOH 199 805 805 HOH HOH A . J 7 HOH 200 806 806 HOH HOH A . J 7 HOH 201 807 807 HOH HOH A . J 7 HOH 202 808 808 HOH HOH A . J 7 HOH 203 809 809 HOH HOH A . J 7 HOH 204 810 810 HOH HOH A . J 7 HOH 205 811 811 HOH HOH A . J 7 HOH 206 812 812 HOH HOH A . J 7 HOH 207 813 813 HOH HOH A . J 7 HOH 208 814 814 HOH HOH A . J 7 HOH 209 815 815 HOH HOH A . J 7 HOH 210 816 816 HOH HOH A . J 7 HOH 211 817 817 HOH HOH A . J 7 HOH 212 818 818 HOH HOH A . J 7 HOH 213 819 819 HOH HOH A . J 7 HOH 214 820 820 HOH HOH A . J 7 HOH 215 821 821 HOH HOH A . J 7 HOH 216 822 822 HOH HOH A . J 7 HOH 217 823 823 HOH HOH A . J 7 HOH 218 824 824 HOH HOH A . J 7 HOH 219 825 825 HOH HOH A . J 7 HOH 220 826 826 HOH HOH A . J 7 HOH 221 827 827 HOH HOH A . J 7 HOH 222 828 828 HOH HOH A . J 7 HOH 223 829 829 HOH HOH A . J 7 HOH 224 830 830 HOH HOH A . J 7 HOH 225 831 831 HOH HOH A . J 7 HOH 226 832 832 HOH HOH A . J 7 HOH 227 833 833 HOH HOH A . J 7 HOH 228 834 834 HOH HOH A . J 7 HOH 229 835 835 HOH HOH A . J 7 HOH 230 836 836 HOH HOH A . J 7 HOH 231 837 837 HOH HOH A . J 7 HOH 232 838 838 HOH HOH A . J 7 HOH 233 839 839 HOH HOH A . J 7 HOH 234 840 840 HOH HOH A . J 7 HOH 235 841 841 HOH HOH A . J 7 HOH 236 842 842 HOH HOH A . J 7 HOH 237 843 843 HOH HOH A . J 7 HOH 238 844 844 HOH HOH A . J 7 HOH 239 845 845 HOH HOH A . J 7 HOH 240 846 846 HOH HOH A . J 7 HOH 241 847 847 HOH HOH A . J 7 HOH 242 848 848 HOH HOH A . J 7 HOH 243 849 849 HOH HOH A . J 7 HOH 244 850 850 HOH HOH A . J 7 HOH 245 851 851 HOH HOH A . J 7 HOH 246 852 852 HOH HOH A . J 7 HOH 247 853 853 HOH HOH A . J 7 HOH 248 854 854 HOH HOH A . J 7 HOH 249 855 855 HOH HOH A . J 7 HOH 250 856 856 HOH HOH A . J 7 HOH 251 857 857 HOH HOH A . J 7 HOH 252 858 858 HOH HOH A . J 7 HOH 253 859 859 HOH HOH A . J 7 HOH 254 860 860 HOH HOH A . J 7 HOH 255 861 861 HOH HOH A . J 7 HOH 256 862 862 HOH HOH A . J 7 HOH 257 863 863 HOH HOH A . J 7 HOH 258 864 864 HOH HOH A . J 7 HOH 259 865 865 HOH HOH A . J 7 HOH 260 866 866 HOH HOH A . J 7 HOH 261 867 867 HOH HOH A . J 7 HOH 262 868 868 HOH HOH A . J 7 HOH 263 869 869 HOH HOH A . J 7 HOH 264 870 870 HOH HOH A . J 7 HOH 265 871 871 HOH HOH A . J 7 HOH 266 872 872 HOH HOH A . J 7 HOH 267 873 873 HOH HOH A . J 7 HOH 268 874 874 HOH HOH A . J 7 HOH 269 875 875 HOH HOH A . J 7 HOH 270 876 876 HOH HOH A . J 7 HOH 271 877 877 HOH HOH A . J 7 HOH 272 878 878 HOH HOH A . J 7 HOH 273 879 879 HOH HOH A . J 7 HOH 274 880 880 HOH HOH A . J 7 HOH 275 881 881 HOH HOH A . J 7 HOH 276 882 882 HOH HOH A . J 7 HOH 277 883 883 HOH HOH A . J 7 HOH 278 884 884 HOH HOH A . J 7 HOH 279 885 885 HOH HOH A . J 7 HOH 280 886 886 HOH HOH A . J 7 HOH 281 887 887 HOH HOH A . J 7 HOH 282 888 888 HOH HOH A . J 7 HOH 283 889 889 HOH HOH A . J 7 HOH 284 890 890 HOH HOH A . J 7 HOH 285 891 891 HOH HOH A . J 7 HOH 286 892 892 HOH HOH A . J 7 HOH 287 893 893 HOH HOH A . J 7 HOH 288 894 894 HOH HOH A . J 7 HOH 289 895 895 HOH HOH A . J 7 HOH 290 896 896 HOH HOH A . J 7 HOH 291 897 897 HOH HOH A . J 7 HOH 292 898 898 HOH HOH A . J 7 HOH 293 899 899 HOH HOH A . J 7 HOH 294 900 900 HOH HOH A . J 7 HOH 295 901 901 HOH HOH A . J 7 HOH 296 902 902 HOH HOH A . J 7 HOH 297 903 903 HOH HOH A . J 7 HOH 298 904 904 HOH HOH A . J 7 HOH 299 905 905 HOH HOH A . J 7 HOH 300 906 906 HOH HOH A . J 7 HOH 301 907 907 HOH HOH A . J 7 HOH 302 908 908 HOH HOH A . J 7 HOH 303 909 909 HOH HOH A . J 7 HOH 304 910 910 HOH HOH A . J 7 HOH 305 911 911 HOH HOH A . J 7 HOH 306 912 912 HOH HOH A . J 7 HOH 307 913 913 HOH HOH A . J 7 HOH 308 914 914 HOH HOH A . J 7 HOH 309 915 915 HOH HOH A . J 7 HOH 310 916 916 HOH HOH A . J 7 HOH 311 917 917 HOH HOH A . J 7 HOH 312 918 918 HOH HOH A . J 7 HOH 313 919 919 HOH HOH A . J 7 HOH 314 920 920 HOH HOH A . J 7 HOH 315 921 921 HOH HOH A . J 7 HOH 316 922 922 HOH HOH A . J 7 HOH 317 923 923 HOH HOH A . J 7 HOH 318 924 924 HOH HOH A . J 7 HOH 319 925 925 HOH HOH A . J 7 HOH 320 926 926 HOH HOH A . J 7 HOH 321 927 927 HOH HOH A . J 7 HOH 322 928 928 HOH HOH A . J 7 HOH 323 929 929 HOH HOH A . J 7 HOH 324 930 930 HOH HOH A . J 7 HOH 325 931 931 HOH HOH A . J 7 HOH 326 932 932 HOH HOH A . J 7 HOH 327 933 933 HOH HOH A . J 7 HOH 328 934 934 HOH HOH A . J 7 HOH 329 935 935 HOH HOH A . J 7 HOH 330 936 936 HOH HOH A . J 7 HOH 331 937 937 HOH HOH A . J 7 HOH 332 938 938 HOH HOH A . J 7 HOH 333 939 939 HOH HOH A . J 7 HOH 334 940 940 HOH HOH A . J 7 HOH 335 941 941 HOH HOH A . J 7 HOH 336 942 942 HOH HOH A . J 7 HOH 337 943 943 HOH HOH A . J 7 HOH 338 944 944 HOH HOH A . J 7 HOH 339 945 945 HOH HOH A . J 7 HOH 340 946 946 HOH HOH A . J 7 HOH 341 947 947 HOH HOH A . J 7 HOH 342 948 948 HOH HOH A . J 7 HOH 343 949 949 HOH HOH A . J 7 HOH 344 950 950 HOH HOH A . J 7 HOH 345 951 951 HOH HOH A . J 7 HOH 346 952 952 HOH HOH A . J 7 HOH 347 953 953 HOH HOH A . J 7 HOH 348 954 954 HOH HOH A . J 7 HOH 349 955 955 HOH HOH A . J 7 HOH 350 956 956 HOH HOH A . J 7 HOH 351 957 957 HOH HOH A . J 7 HOH 352 958 958 HOH HOH A . J 7 HOH 353 959 959 HOH HOH A . J 7 HOH 354 960 960 HOH HOH A . J 7 HOH 355 961 961 HOH HOH A . J 7 HOH 356 962 962 HOH HOH A . J 7 HOH 357 963 963 HOH HOH A . # _pdbx_struct_mod_residue.id 1 _pdbx_struct_mod_residue.label_asym_id A _pdbx_struct_mod_residue.label_comp_id ASN _pdbx_struct_mod_residue.label_seq_id 222 _pdbx_struct_mod_residue.auth_asym_id A _pdbx_struct_mod_residue.auth_comp_id ASN _pdbx_struct_mod_residue.auth_seq_id 222 _pdbx_struct_mod_residue.PDB_ins_code ? _pdbx_struct_mod_residue.parent_comp_id ASN _pdbx_struct_mod_residue.details 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_struct_special_symmetry.id _pdbx_struct_special_symmetry.PDB_model_num _pdbx_struct_special_symmetry.auth_asym_id _pdbx_struct_special_symmetry.auth_comp_id _pdbx_struct_special_symmetry.auth_seq_id _pdbx_struct_special_symmetry.PDB_ins_code _pdbx_struct_special_symmetry.label_asym_id _pdbx_struct_special_symmetry.label_comp_id _pdbx_struct_special_symmetry.label_seq_id 1 1 A ZN 601 ? E ZN . 2 1 A ZN 602 ? F ZN . # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 OD1 ? A ASP 306 ? A ASP 306 ? 1_555 ZN ? E ZN . ? A ZN 601 ? 1_555 ND1 ? A HIS 307 ? A HIS 307 ? 1_555 98.8 ? 2 OE2 ? A GLU 231 ? A GLU 231 ? 1_555 ZN ? F ZN . ? A ZN 602 ? 1_555 OD2 ? A ASP 235 ? A ASP 235 ? 1_555 113.6 ? 3 ND1 ? A HIS 114 ? A HIS 114 ? 1_555 ZN ? G ZN . ? A ZN 603 ? 1_555 OD1 ? A ASP 309 ? A ASP 309 ? 1_555 81.4 ? 4 ND1 ? A HIS 114 ? A HIS 114 ? 1_555 ZN ? G ZN . ? A ZN 603 ? 1_555 OD2 ? A ASP 309 ? A ASP 309 ? 1_555 137.3 ? 5 OD1 ? A ASP 309 ? A ASP 309 ? 1_555 ZN ? G ZN . ? A ZN 603 ? 1_555 OD2 ? A ASP 309 ? A ASP 309 ? 1_555 56.0 ? 6 ND1 ? A HIS 114 ? A HIS 114 ? 1_555 ZN ? G ZN . ? A ZN 603 ? 1_555 O ? J HOH . ? A HOH 910 ? 1_555 110.5 ? 7 OD1 ? A ASP 309 ? A ASP 309 ? 1_555 ZN ? G ZN . ? A ZN 603 ? 1_555 O ? J HOH . ? A HOH 910 ? 1_555 165.7 ? 8 OD2 ? A ASP 309 ? A ASP 309 ? 1_555 ZN ? G ZN . ? A ZN 603 ? 1_555 O ? J HOH . ? A HOH 910 ? 1_555 112.1 ? # 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 2012-04-18 2 'Structure model' 1 1 2017-09-27 # _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 ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Data collection' 2 2 'Structure model' 'Refinement description' # loop_ _pdbx_audit_revision_category.ordinal _pdbx_audit_revision_category.revision_ordinal _pdbx_audit_revision_category.data_content_type _pdbx_audit_revision_category.category 1 2 'Structure model' diffrn_detector 2 2 'Structure model' software # _pdbx_audit_revision_item.ordinal 1 _pdbx_audit_revision_item.revision_ordinal 2 _pdbx_audit_revision_item.data_content_type 'Structure model' _pdbx_audit_revision_item.item '_diffrn_detector.detector' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal MOLREP phasing . ? 1 REFMAC refinement 5.6.0060 ? 2 d*TREK 'data reduction' . ? 3 d*TREK 'data scaling' . ? 4 # 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 SER A 67 ? ? -105.37 -87.51 2 1 ALA A 241 ? ? -35.61 113.01 3 1 VAL A 344 ? ? -116.02 -73.34 4 1 TYR A 428 ? ? -110.68 58.71 5 1 ARG A 432 ? ? -89.39 49.80 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 'FLAVIN-ADENINE DINUCLEOTIDE' FAD 3 N-ACETYL-D-GLUCOSAMINE NAG 4 'ZINC ION' ZN 5 'POTASSIUM ION' K 6 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL TRS 7 water HOH #