data_2AEY # _entry.id 2AEY # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 2AEY RCSB RCSB033813 WWPDB D_1000033813 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 2ADD 'Crystal structure of fructan 1-exohydrolase IIa from Cichorium intybus in complex with sucrose' unspecified PDB 2ADE 'Crystal structure of fructan 1-exohydrolase IIa from Cichorium intybus in complex with fructose' unspecified PDB 2AEZ 'Crystal structure of fructan 1-exohydrolase IIa (E201Q) from Cichorium intybus in complex with 1-kestose' unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 2AEY _pdbx_database_status.recvd_initial_deposition_date 2005-07-25 _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.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Verhaest, M.' 1 'Le Roy, K.' 2 'De Ranter, C.J.' 3 'Van Laere, A.' 4 'Van den Ende, W.' 5 'Rabijns, A.' 6 # _citation.id primary _citation.title ;Insights into the fine architecture of the active site of chicory fructan 1-exohydrolase: 1-kestose as substrate vs sucrose as inhibitor. ; _citation.journal_abbrev 'New Phytol' _citation.journal_volume 174 _citation.page_first 90 _citation.page_last 100 _citation.year 2007 _citation.journal_id_ASTM ? _citation.country ? _citation.journal_id_ISSN ? _citation.journal_id_CSD 0353 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 17335500 _citation.pdbx_database_id_DOI 10.1111/j.1469-8137.2007.01988.x # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Verhaest, M.' 1 primary 'Lammens, W.' 2 primary 'Le Roy, K.' 3 primary 'De Ranter, C.J.' 4 primary 'Van Laere, A.' 5 primary 'Rabijns, A.' 6 primary 'Van den Ende, W.' 7 # _cell.entry_id 2AEY _cell.length_a 138.860 _cell.length_b 138.860 _cell.length_c 182.440 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 8 _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 2AEY _symmetry.space_group_name_H-M 'P 41 21 2' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 92 _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 'fructan 1-exohydrolase IIa' 61115.965 1 3.2.1.153 ? ? ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 4 ? ? ? ? 3 non-polymer man ALPHA-D-MANNOSE 180.156 1 ? ? ? ? 4 non-polymer man 2,5-DIDEOXY-2,5-IMINO-D-MANNITOL 163.172 1 ? ? ? ? 5 water nat water 18.015 10 ? ? ? ? # _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 ;QQIEQPYRTGYHFQPPSNWMNDPNGPMLYQGVYHFFYQYNPYAATFGDVIIWGHAVSYDLVNWIHLDPAIYPTQEADSKS CWSGSATILPGNIPAMLYTGSDSKSRQVQDLAWPKNLSDPFLREWVKHPKNPLITPPEGVKDDCFRDPSTAWLGPDGVWR IVVGGDRDNNGMAFLYQSTDFVNWKRYDQPLSSADATGTWECPDFYPVPLNSTNGLDTSVYGGSVRHVMKAGFEGHDWYT IGTYSPDRENFLPQNGLSLTGSTLDLRYDYGQFYASKSFFDDAKNRRVLWAWVPETDSQADDIEKGWAGLQSFPRALWID RNGKQLIQWPVEEIEELRQNQVNLQNKNLKPGSVLEIHGIAASQADVTISFKLEGLKEAEVLDTTLVDPQALCNERGASS RGALGPFGLLAMASKDLKEQSAIFFRVFQNQLGRYSVLMCSDLSRSTVRSNIDTTSYGAFVDIDPRSEEISLRNLIDHSI IESFGAGGKTCITSRIYPKFVNNEEAHLFVFNNGTQNVKISEMSAWSMKNAKFVVDQSVKSAA ; _entity_poly.pdbx_seq_one_letter_code_can ;QQIEQPYRTGYHFQPPSNWMNDPNGPMLYQGVYHFFYQYNPYAATFGDVIIWGHAVSYDLVNWIHLDPAIYPTQEADSKS CWSGSATILPGNIPAMLYTGSDSKSRQVQDLAWPKNLSDPFLREWVKHPKNPLITPPEGVKDDCFRDPSTAWLGPDGVWR IVVGGDRDNNGMAFLYQSTDFVNWKRYDQPLSSADATGTWECPDFYPVPLNSTNGLDTSVYGGSVRHVMKAGFEGHDWYT IGTYSPDRENFLPQNGLSLTGSTLDLRYDYGQFYASKSFFDDAKNRRVLWAWVPETDSQADDIEKGWAGLQSFPRALWID RNGKQLIQWPVEEIEELRQNQVNLQNKNLKPGSVLEIHGIAASQADVTISFKLEGLKEAEVLDTTLVDPQALCNERGASS RGALGPFGLLAMASKDLKEQSAIFFRVFQNQLGRYSVLMCSDLSRSTVRSNIDTTSYGAFVDIDPRSEEISLRNLIDHSI IESFGAGGKTCITSRIYPKFVNNEEAHLFVFNNGTQNVKISEMSAWSMKNAKFVVDQSVKSAA ; _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 GLN n 1 2 GLN n 1 3 ILE n 1 4 GLU n 1 5 GLN n 1 6 PRO n 1 7 TYR n 1 8 ARG n 1 9 THR n 1 10 GLY n 1 11 TYR n 1 12 HIS n 1 13 PHE n 1 14 GLN n 1 15 PRO n 1 16 PRO n 1 17 SER n 1 18 ASN n 1 19 TRP n 1 20 MET n 1 21 ASN n 1 22 ASP n 1 23 PRO n 1 24 ASN n 1 25 GLY n 1 26 PRO n 1 27 MET n 1 28 LEU n 1 29 TYR n 1 30 GLN n 1 31 GLY n 1 32 VAL n 1 33 TYR n 1 34 HIS n 1 35 PHE n 1 36 PHE n 1 37 TYR n 1 38 GLN n 1 39 TYR n 1 40 ASN n 1 41 PRO n 1 42 TYR n 1 43 ALA n 1 44 ALA n 1 45 THR n 1 46 PHE n 1 47 GLY n 1 48 ASP n 1 49 VAL n 1 50 ILE n 1 51 ILE n 1 52 TRP n 1 53 GLY n 1 54 HIS n 1 55 ALA n 1 56 VAL n 1 57 SER n 1 58 TYR n 1 59 ASP n 1 60 LEU n 1 61 VAL n 1 62 ASN n 1 63 TRP n 1 64 ILE n 1 65 HIS n 1 66 LEU n 1 67 ASP n 1 68 PRO n 1 69 ALA n 1 70 ILE n 1 71 TYR n 1 72 PRO n 1 73 THR n 1 74 GLN n 1 75 GLU n 1 76 ALA n 1 77 ASP n 1 78 SER n 1 79 LYS n 1 80 SER n 1 81 CYS n 1 82 TRP n 1 83 SER n 1 84 GLY n 1 85 SER n 1 86 ALA n 1 87 THR n 1 88 ILE n 1 89 LEU n 1 90 PRO n 1 91 GLY n 1 92 ASN n 1 93 ILE n 1 94 PRO n 1 95 ALA n 1 96 MET n 1 97 LEU n 1 98 TYR n 1 99 THR n 1 100 GLY n 1 101 SER n 1 102 ASP n 1 103 SER n 1 104 LYS n 1 105 SER n 1 106 ARG n 1 107 GLN n 1 108 VAL n 1 109 GLN n 1 110 ASP n 1 111 LEU n 1 112 ALA n 1 113 TRP n 1 114 PRO n 1 115 LYS n 1 116 ASN n 1 117 LEU n 1 118 SER n 1 119 ASP n 1 120 PRO n 1 121 PHE n 1 122 LEU n 1 123 ARG n 1 124 GLU n 1 125 TRP n 1 126 VAL n 1 127 LYS n 1 128 HIS n 1 129 PRO n 1 130 LYS n 1 131 ASN n 1 132 PRO n 1 133 LEU n 1 134 ILE n 1 135 THR n 1 136 PRO n 1 137 PRO n 1 138 GLU n 1 139 GLY n 1 140 VAL n 1 141 LYS n 1 142 ASP n 1 143 ASP n 1 144 CYS n 1 145 PHE n 1 146 ARG n 1 147 ASP n 1 148 PRO n 1 149 SER n 1 150 THR n 1 151 ALA n 1 152 TRP n 1 153 LEU n 1 154 GLY n 1 155 PRO n 1 156 ASP n 1 157 GLY n 1 158 VAL n 1 159 TRP n 1 160 ARG n 1 161 ILE n 1 162 VAL n 1 163 VAL n 1 164 GLY n 1 165 GLY n 1 166 ASP n 1 167 ARG n 1 168 ASP n 1 169 ASN n 1 170 ASN n 1 171 GLY n 1 172 MET n 1 173 ALA n 1 174 PHE n 1 175 LEU n 1 176 TYR n 1 177 GLN n 1 178 SER n 1 179 THR n 1 180 ASP n 1 181 PHE n 1 182 VAL n 1 183 ASN n 1 184 TRP n 1 185 LYS n 1 186 ARG n 1 187 TYR n 1 188 ASP n 1 189 GLN n 1 190 PRO n 1 191 LEU n 1 192 SER n 1 193 SER n 1 194 ALA n 1 195 ASP n 1 196 ALA n 1 197 THR n 1 198 GLY n 1 199 THR n 1 200 TRP n 1 201 GLU n 1 202 CYS n 1 203 PRO n 1 204 ASP n 1 205 PHE n 1 206 TYR n 1 207 PRO n 1 208 VAL n 1 209 PRO n 1 210 LEU n 1 211 ASN n 1 212 SER n 1 213 THR n 1 214 ASN n 1 215 GLY n 1 216 LEU n 1 217 ASP n 1 218 THR n 1 219 SER n 1 220 VAL n 1 221 TYR n 1 222 GLY n 1 223 GLY n 1 224 SER n 1 225 VAL n 1 226 ARG n 1 227 HIS n 1 228 VAL n 1 229 MET n 1 230 LYS n 1 231 ALA n 1 232 GLY n 1 233 PHE n 1 234 GLU n 1 235 GLY n 1 236 HIS n 1 237 ASP n 1 238 TRP n 1 239 TYR n 1 240 THR n 1 241 ILE n 1 242 GLY n 1 243 THR n 1 244 TYR n 1 245 SER n 1 246 PRO n 1 247 ASP n 1 248 ARG n 1 249 GLU n 1 250 ASN n 1 251 PHE n 1 252 LEU n 1 253 PRO n 1 254 GLN n 1 255 ASN n 1 256 GLY n 1 257 LEU n 1 258 SER n 1 259 LEU n 1 260 THR n 1 261 GLY n 1 262 SER n 1 263 THR n 1 264 LEU n 1 265 ASP n 1 266 LEU n 1 267 ARG n 1 268 TYR n 1 269 ASP n 1 270 TYR n 1 271 GLY n 1 272 GLN n 1 273 PHE n 1 274 TYR n 1 275 ALA n 1 276 SER n 1 277 LYS n 1 278 SER n 1 279 PHE n 1 280 PHE n 1 281 ASP n 1 282 ASP n 1 283 ALA n 1 284 LYS n 1 285 ASN n 1 286 ARG n 1 287 ARG n 1 288 VAL n 1 289 LEU n 1 290 TRP n 1 291 ALA n 1 292 TRP n 1 293 VAL n 1 294 PRO n 1 295 GLU n 1 296 THR n 1 297 ASP n 1 298 SER n 1 299 GLN n 1 300 ALA n 1 301 ASP n 1 302 ASP n 1 303 ILE n 1 304 GLU n 1 305 LYS n 1 306 GLY n 1 307 TRP n 1 308 ALA n 1 309 GLY n 1 310 LEU n 1 311 GLN n 1 312 SER n 1 313 PHE n 1 314 PRO n 1 315 ARG n 1 316 ALA n 1 317 LEU n 1 318 TRP n 1 319 ILE n 1 320 ASP n 1 321 ARG n 1 322 ASN n 1 323 GLY n 1 324 LYS n 1 325 GLN n 1 326 LEU n 1 327 ILE n 1 328 GLN n 1 329 TRP n 1 330 PRO n 1 331 VAL n 1 332 GLU n 1 333 GLU n 1 334 ILE n 1 335 GLU n 1 336 GLU n 1 337 LEU n 1 338 ARG n 1 339 GLN n 1 340 ASN n 1 341 GLN n 1 342 VAL n 1 343 ASN n 1 344 LEU n 1 345 GLN n 1 346 ASN n 1 347 LYS n 1 348 ASN n 1 349 LEU n 1 350 LYS n 1 351 PRO n 1 352 GLY n 1 353 SER n 1 354 VAL n 1 355 LEU n 1 356 GLU n 1 357 ILE n 1 358 HIS n 1 359 GLY n 1 360 ILE n 1 361 ALA n 1 362 ALA n 1 363 SER n 1 364 GLN n 1 365 ALA n 1 366 ASP n 1 367 VAL n 1 368 THR n 1 369 ILE n 1 370 SER n 1 371 PHE n 1 372 LYS n 1 373 LEU n 1 374 GLU n 1 375 GLY n 1 376 LEU n 1 377 LYS n 1 378 GLU n 1 379 ALA n 1 380 GLU n 1 381 VAL n 1 382 LEU n 1 383 ASP n 1 384 THR n 1 385 THR n 1 386 LEU n 1 387 VAL n 1 388 ASP n 1 389 PRO n 1 390 GLN n 1 391 ALA n 1 392 LEU n 1 393 CYS n 1 394 ASN n 1 395 GLU n 1 396 ARG n 1 397 GLY n 1 398 ALA n 1 399 SER n 1 400 SER n 1 401 ARG n 1 402 GLY n 1 403 ALA n 1 404 LEU n 1 405 GLY n 1 406 PRO n 1 407 PHE n 1 408 GLY n 1 409 LEU n 1 410 LEU n 1 411 ALA n 1 412 MET n 1 413 ALA n 1 414 SER n 1 415 LYS n 1 416 ASP n 1 417 LEU n 1 418 LYS n 1 419 GLU n 1 420 GLN n 1 421 SER n 1 422 ALA n 1 423 ILE n 1 424 PHE n 1 425 PHE n 1 426 ARG n 1 427 VAL n 1 428 PHE n 1 429 GLN n 1 430 ASN n 1 431 GLN n 1 432 LEU n 1 433 GLY n 1 434 ARG n 1 435 TYR n 1 436 SER n 1 437 VAL n 1 438 LEU n 1 439 MET n 1 440 CYS n 1 441 SER n 1 442 ASP n 1 443 LEU n 1 444 SER n 1 445 ARG n 1 446 SER n 1 447 THR n 1 448 VAL n 1 449 ARG n 1 450 SER n 1 451 ASN n 1 452 ILE n 1 453 ASP n 1 454 THR n 1 455 THR n 1 456 SER n 1 457 TYR n 1 458 GLY n 1 459 ALA n 1 460 PHE n 1 461 VAL n 1 462 ASP n 1 463 ILE n 1 464 ASP n 1 465 PRO n 1 466 ARG n 1 467 SER n 1 468 GLU n 1 469 GLU n 1 470 ILE n 1 471 SER n 1 472 LEU n 1 473 ARG n 1 474 ASN n 1 475 LEU n 1 476 ILE n 1 477 ASP n 1 478 HIS n 1 479 SER n 1 480 ILE n 1 481 ILE n 1 482 GLU n 1 483 SER n 1 484 PHE n 1 485 GLY n 1 486 ALA n 1 487 GLY n 1 488 GLY n 1 489 LYS n 1 490 THR n 1 491 CYS n 1 492 ILE n 1 493 THR n 1 494 SER n 1 495 ARG n 1 496 ILE n 1 497 TYR n 1 498 PRO n 1 499 LYS n 1 500 PHE n 1 501 VAL n 1 502 ASN n 1 503 ASN n 1 504 GLU n 1 505 GLU n 1 506 ALA n 1 507 HIS n 1 508 LEU n 1 509 PHE n 1 510 VAL n 1 511 PHE n 1 512 ASN n 1 513 ASN n 1 514 GLY n 1 515 THR n 1 516 GLN n 1 517 ASN n 1 518 VAL n 1 519 LYS n 1 520 ILE n 1 521 SER n 1 522 GLU n 1 523 MET n 1 524 SER n 1 525 ALA n 1 526 TRP n 1 527 SER n 1 528 MET n 1 529 LYS n 1 530 ASN n 1 531 ALA n 1 532 LYS n 1 533 PHE n 1 534 VAL n 1 535 VAL n 1 536 ASP n 1 537 GLN n 1 538 SER n 1 539 VAL n 1 540 LYS n 1 541 SER n 1 542 ALA n 1 543 ALA 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 chicory _entity_src_gen.gene_src_genus Cichorium _entity_src_gen.pdbx_gene_src_gene '1-feh IIa' _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Cichorium intybus' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 13427 _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 'Pichia pastoris' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 4922 _entity_src_gen.host_org_genus Pichia _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code Q93X60_CICIN _struct_ref.pdbx_db_accession Q93X60 _struct_ref.entity_id 1 _struct_ref.pdbx_align_begin 39 _struct_ref.pdbx_seq_one_letter_code ? _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 2AEY _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 543 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession Q93X60 _struct_ref_seq.db_align_beg 39 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 581 _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 543 # 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 DQQ D-saccharide . 2,5-DIDEOXY-2,5-IMINO-D-MANNITOL ? 'C6 H13 N O4' 163.172 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MAN D-saccharide . ALPHA-D-MANNOSE ? 'C6 H12 O6' 180.156 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 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 2AEY _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 7.2 _exptl_crystal.density_percent_sol 82 _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 277 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 7.0 _exptl_crystal_grow.pdbx_details 'sodium potassium phosphate, potassium phosphate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K' _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 CCD _diffrn_detector.type MARRESEARCH _diffrn_detector.pdbx_collection_date 2005-02-07 _diffrn_detector.details 'bent mirror' # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'triangular monochromator' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.000 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'EMBL/DESY, HAMBURG BEAMLINE BW7A' _diffrn_source.pdbx_synchrotron_site 'EMBL/DESY, Hamburg' _diffrn_source.pdbx_synchrotron_beamline BW7A _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.000 # _reflns.entry_id 2AEY _reflns.observed_criterion_sigma_I 2.0 _reflns.observed_criterion_sigma_F 1.41 _reflns.d_resolution_low 30 _reflns.d_resolution_high 3.25 _reflns.number_obs 21485 _reflns.number_all 27928 _reflns.percent_possible_obs 76.2 _reflns.pdbx_Rmerge_I_obs 0.187 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI ? _reflns.B_iso_Wilson_estimate . _reflns.pdbx_redundancy 3.4 _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 3.25 _reflns_shell.d_res_low 3.31 _reflns_shell.percent_possible_all 99.2 _reflns_shell.Rmerge_I_obs 0.426 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy ? _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _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 2AEY _refine.ls_number_reflns_obs 26142 _refine.ls_number_reflns_all 26142 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.0 _refine.pdbx_data_cutoff_high_absF 106827.10 _refine.pdbx_data_cutoff_low_absF 0.000000 _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 29.70 _refine.ls_d_res_high 3.27 _refine.ls_percent_reflns_obs 92.7 _refine.ls_R_factor_obs 0.217 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.217 _refine.ls_R_factor_R_free 0.257 _refine.ls_R_factor_R_free_error 0.007 _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 4.9 _refine.ls_number_reflns_R_free 1273 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean 8.3 _refine.aniso_B[1][1] 9.61 _refine.aniso_B[2][2] 9.61 _refine.aniso_B[3][3] -19.22 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] 0.00 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_details 'FLAT MODEL' _refine.solvent_model_param_ksol 0.274 _refine.solvent_model_param_bsol 10 _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details ? _refine.pdbx_starting_model 'PDB ENTRY 1ST8' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model RESTRAINED _refine.pdbx_stereochemistry_target_values 'Engh & Huber' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML ? _refine.overall_SU_B ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_Cruickshank_DPI ? _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_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_analyze.entry_id 2AEY _refine_analyze.Luzzati_coordinate_error_obs 0.36 _refine_analyze.Luzzati_sigma_a_obs 0.51 _refine_analyze.Luzzati_d_res_low_obs 5.00 _refine_analyze.Luzzati_coordinate_error_free 0.44 _refine_analyze.Luzzati_sigma_a_free 0.60 _refine_analyze.Luzzati_d_res_low_free ? _refine_analyze.number_disordered_residues ? _refine_analyze.occupancy_sum_hydrogen ? _refine_analyze.occupancy_sum_non_hydrogen ? _refine_analyze.pdbx_Luzzati_d_res_high_obs ? _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 4274 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 78 _refine_hist.number_atoms_solvent 10 _refine_hist.number_atoms_total 4362 _refine_hist.d_res_high 3.27 _refine_hist.d_res_low 29.70 # 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_refine_id _refine_ls_restr.pdbx_restraint_function c_bond_d 0.009 ? ? ? 'X-RAY DIFFRACTION' ? c_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? c_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? c_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? c_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? c_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? c_angle_deg 1.4 ? ? ? 'X-RAY DIFFRACTION' ? c_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION' ? c_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION' ? c_dihedral_angle_d 25.4 ? ? ? 'X-RAY DIFFRACTION' ? c_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? c_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? c_improper_angle_d 1.03 ? ? ? 'X-RAY DIFFRACTION' ? c_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? c_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? c_mcbond_it 1.10 1.50 ? ? 'X-RAY DIFFRACTION' ? c_mcangle_it 1.92 2.00 ? ? 'X-RAY DIFFRACTION' ? c_scbond_it 1.66 2.00 ? ? 'X-RAY DIFFRACTION' ? c_scangle_it 2.75 2.50 ? ? 'X-RAY DIFFRACTION' ? # _refine_ls_shell.pdbx_total_number_of_bins_used 6 _refine_ls_shell.d_res_high 3.25 _refine_ls_shell.d_res_low 3.45 _refine_ls_shell.number_reflns_R_work 3435 _refine_ls_shell.R_factor_R_work 0.285 _refine_ls_shell.percent_reflns_obs 76.8 _refine_ls_shell.R_factor_R_free 0.348 _refine_ls_shell.R_factor_R_free_error 0.027 _refine_ls_shell.percent_reflns_R_free 4.6 _refine_ls_shell.number_reflns_R_free 166 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' # loop_ _pdbx_xplor_file.serial_no _pdbx_xplor_file.param_file _pdbx_xplor_file.topol_file _pdbx_xplor_file.pdbx_refine_id 1 protein_rep.param protein.top 'X-RAY DIFFRACTION' 2 water_rep.param water.top 'X-RAY DIFFRACTION' 3 carbohydrate.param carbohydrate.top 'X-RAY DIFFRACTION' 4 DIM2.param DIM2.top 'X-RAY DIFFRACTION' 5 gol.param gol.top 'X-RAY DIFFRACTION' # _struct.entry_id 2AEY _struct.title 'Crystal structure of fructan 1-exohydrolase IIa from Cichorium intybus in complex with 2,5 dideoxy-2,5-immino-D-mannitol' _struct.pdbx_descriptor 'fructan 1-exohydrolase IIa (E.C.3.2.1.153)' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 2AEY _struct_keywords.pdbx_keywords HYDROLASE _struct_keywords.text 'five fold beta propeller, HYDROLASE' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 2 ? D N N 3 ? E N N 2 ? F N N 2 ? G N N 4 ? H N N 5 ? # _struct_biol.id 1 # 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 GLN A 74 ? SER A 78 ? GLN A 74 SER A 78 5 ? 5 HELX_P HELX_P2 2 PRO A 246 ? GLU A 249 ? PRO A 246 GLU A 249 5 ? 4 HELX_P HELX_P3 3 SER A 298 ? GLY A 306 ? SER A 298 GLY A 306 1 ? 9 HELX_P HELX_P4 4 GLU A 332 ? GLU A 336 ? GLU A 332 GLU A 336 5 ? 5 HELX_P HELX_P5 5 GLY A 375 ? ALA A 379 ? GLY A 375 ALA A 379 5 ? 5 HELX_P HELX_P6 6 ASP A 388 ? ARG A 396 ? ASP A 388 ARG A 396 1 ? 9 HELX_P HELX_P7 7 LEU A 443 ? SER A 446 ? LEU A 443 SER A 446 5 ? 4 HELX_P HELX_P8 8 LYS A 499 ? ASN A 503 ? LYS A 499 ASN A 503 5 ? 5 # _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 disulf1 disulf ? ? A CYS 393 SG ? ? ? 1_555 A CYS 440 SG ? ? A CYS 393 A CYS 440 1_555 ? ? ? ? ? ? ? 2.037 ? covale1 covale ? ? A ASN 116 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 116 A NAG 680 1_555 ? ? ? ? ? ? ? 1.457 ? covale2 covale ? ? A ASN 513 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 513 A NAG 650 1_555 ? ? ? ? ? ? ? 1.458 ? covale3 covale ? ? B NAG . O4 ? ? ? 1_555 C NAG . C1 ? ? A NAG 650 A NAG 660 1_555 ? ? ? ? ? ? ? 1.399 ? covale4 covale ? ? C NAG . O4 ? ? ? 1_555 D MAN . C1 ? ? A NAG 660 A MAN 670 1_555 ? ? ? ? ? ? ? 1.398 ? covale5 covale ? ? E NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? A NAG 680 A NAG 690 1_555 ? ? ? ? ? ? ? 1.395 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 ASN 131 A . ? ASN 131 A PRO 132 A ? PRO 132 A 1 0.15 2 GLY 405 A . ? GLY 405 A PRO 406 A ? PRO 406 A 1 0.72 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 6 ? B ? 4 ? C ? 3 ? D ? 4 ? E ? 4 ? F ? 4 ? G ? 3 ? H ? 4 ? I ? 3 ? J ? 6 ? K ? 5 ? L ? 6 ? # 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 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel A 5 6 ? parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel J 3 4 ? anti-parallel J 4 5 ? anti-parallel J 5 6 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel K 4 5 ? parallel L 1 2 ? anti-parallel L 2 3 ? anti-parallel L 3 4 ? anti-parallel L 4 5 ? anti-parallel L 5 6 ? 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 TRP A 307 ? ALA A 308 ? TRP A 307 ALA A 308 A 2 ASN A 18 ? TYR A 29 ? ASN A 18 TYR A 29 A 3 VAL A 32 ? ASN A 40 ? VAL A 32 ASN A 40 A 4 ILE A 51 ? SER A 57 ? ILE A 51 SER A 57 A 5 TRP A 63 ? LEU A 66 ? TRP A 63 LEU A 66 A 6 PHE A 533 ? VAL A 535 ? PHE A 533 VAL A 535 B 1 SER A 80 ? LEU A 89 ? SER A 80 LEU A 89 B 2 ILE A 93 ? SER A 101 ? ILE A 93 SER A 101 B 3 GLN A 107 ? PRO A 114 ? GLN A 107 PRO A 114 B 4 TRP A 125 ? LYS A 127 ? TRP A 125 LYS A 127 C 1 PHE A 145 ? ARG A 146 ? PHE A 145 ARG A 146 C 2 TRP A 159 ? GLY A 165 ? TRP A 159 GLY A 165 C 3 TRP A 152 ? LEU A 153 ? TRP A 152 LEU A 153 D 1 PHE A 145 ? ARG A 146 ? PHE A 145 ARG A 146 D 2 TRP A 159 ? GLY A 165 ? TRP A 159 GLY A 165 D 3 MET A 172 ? SER A 178 ? MET A 172 SER A 178 D 4 LYS A 185 ? SER A 193 ? LYS A 185 SER A 193 E 1 GLU A 201 ? PRO A 209 ? GLU A 201 PRO A 209 E 2 VAL A 225 ? PHE A 233 ? VAL A 225 PHE A 233 E 3 HIS A 236 ? SER A 245 ? HIS A 236 SER A 245 E 4 ASN A 250 ? PRO A 253 ? ASN A 250 PRO A 253 F 1 GLU A 201 ? PRO A 209 ? GLU A 201 PRO A 209 F 2 VAL A 225 ? PHE A 233 ? VAL A 225 PHE A 233 F 3 HIS A 236 ? SER A 245 ? HIS A 236 SER A 245 F 4 LEU A 266 ? ARG A 267 ? LEU A 266 ARG A 267 G 1 TYR A 274 ? ASP A 281 ? TYR A 274 ASP A 281 G 2 ARG A 286 ? VAL A 293 ? ARG A 286 VAL A 293 G 3 LEU A 310 ? GLN A 311 ? LEU A 310 GLN A 311 H 1 TYR A 274 ? ASP A 281 ? TYR A 274 ASP A 281 H 2 ARG A 286 ? VAL A 293 ? ARG A 286 VAL A 293 H 3 ARG A 315 ? ILE A 319 ? ARG A 315 ILE A 319 H 4 LEU A 326 ? PRO A 330 ? LEU A 326 PRO A 330 I 1 ARG A 338 ? VAL A 342 ? ARG A 338 VAL A 342 I 2 VAL A 518 ? MET A 528 ? VAL A 518 MET A 528 I 3 GLN A 345 ? LEU A 349 ? GLN A 345 LEU A 349 J 1 ARG A 338 ? VAL A 342 ? ARG A 338 VAL A 342 J 2 VAL A 518 ? MET A 528 ? VAL A 518 MET A 528 J 3 GLN A 364 ? LYS A 372 ? GLN A 364 LYS A 372 J 4 ILE A 470 ? ASP A 477 ? ILE A 470 ASP A 477 J 5 ILE A 480 ? GLY A 485 ? ILE A 480 GLY A 485 J 6 THR A 490 ? ARG A 495 ? THR A 490 ARG A 495 K 1 SER A 353 ? GLU A 356 ? SER A 353 GLU A 356 K 2 HIS A 507 ? ASN A 512 ? HIS A 507 ASN A 512 K 3 LEU A 404 ? ALA A 413 ? LEU A 404 ALA A 413 K 4 SER A 421 ? GLN A 429 ? SER A 421 GLN A 429 K 5 GLU A 380 ? VAL A 381 ? GLU A 380 VAL A 381 L 1 SER A 353 ? GLU A 356 ? SER A 353 GLU A 356 L 2 HIS A 507 ? ASN A 512 ? HIS A 507 ASN A 512 L 3 LEU A 404 ? ALA A 413 ? LEU A 404 ALA A 413 L 4 SER A 421 ? GLN A 429 ? SER A 421 GLN A 429 L 5 TYR A 435 ? ASP A 442 ? TYR A 435 ASP A 442 L 6 TYR A 457 ? VAL A 461 ? TYR A 457 VAL A 461 # 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 O ALA A 308 ? O ALA A 308 N ASN A 18 ? N ASN A 18 A 2 3 N ASN A 24 ? N ASN A 24 O PHE A 36 ? O PHE A 36 A 3 4 N TYR A 37 ? N TYR A 37 O GLY A 53 ? O GLY A 53 A 4 5 N HIS A 54 ? N HIS A 54 O LEU A 66 ? O LEU A 66 A 5 6 N HIS A 65 ? N HIS A 65 O VAL A 534 ? O VAL A 534 B 1 2 N THR A 87 ? N THR A 87 O ALA A 95 ? O ALA A 95 B 2 3 N TYR A 98 ? N TYR A 98 O ASP A 110 ? O ASP A 110 B 3 4 N TRP A 113 ? N TRP A 113 O VAL A 126 ? O VAL A 126 C 1 2 N ARG A 146 ? N ARG A 146 O GLY A 164 ? O GLY A 164 C 2 3 O ARG A 160 ? O ARG A 160 N TRP A 152 ? N TRP A 152 D 1 2 N ARG A 146 ? N ARG A 146 O GLY A 164 ? O GLY A 164 D 2 3 N TRP A 159 ? N TRP A 159 O SER A 178 ? O SER A 178 D 3 4 N LEU A 175 ? N LEU A 175 O TYR A 187 ? O TYR A 187 E 1 2 N VAL A 208 ? N VAL A 208 O ARG A 226 ? O ARG A 226 E 2 3 N ALA A 231 ? N ALA A 231 O TRP A 238 ? O TRP A 238 E 3 4 N THR A 243 ? N THR A 243 O LEU A 252 ? O LEU A 252 F 1 2 N VAL A 208 ? N VAL A 208 O ARG A 226 ? O ARG A 226 F 2 3 N ALA A 231 ? N ALA A 231 O TRP A 238 ? O TRP A 238 F 3 4 N TYR A 239 ? N TYR A 239 O LEU A 266 ? O LEU A 266 G 1 2 N LYS A 277 ? N LYS A 277 O TRP A 290 ? O TRP A 290 G 2 3 N VAL A 293 ? N VAL A 293 O LEU A 310 ? O LEU A 310 H 1 2 N LYS A 277 ? N LYS A 277 O TRP A 290 ? O TRP A 290 H 2 3 N ARG A 287 ? N ARG A 287 O LEU A 317 ? O LEU A 317 H 3 4 N TRP A 318 ? N TRP A 318 O ILE A 327 ? O ILE A 327 I 1 2 N GLN A 339 ? N GLN A 339 O SER A 527 ? O SER A 527 I 2 3 O VAL A 518 ? O VAL A 518 N LEU A 349 ? N LEU A 349 J 1 2 N GLN A 339 ? N GLN A 339 O SER A 527 ? O SER A 527 J 2 3 O SER A 524 ? O SER A 524 N THR A 368 ? N THR A 368 J 3 4 N ALA A 365 ? N ALA A 365 O ILE A 476 ? O ILE A 476 J 4 5 N ARG A 473 ? N ARG A 473 O PHE A 484 ? O PHE A 484 J 5 6 N SER A 483 ? N SER A 483 O ILE A 492 ? O ILE A 492 K 1 2 N LEU A 355 ? N LEU A 355 O VAL A 510 ? O VAL A 510 K 2 3 O PHE A 509 ? O PHE A 509 N LEU A 410 ? N LEU A 410 K 3 4 N LEU A 409 ? N LEU A 409 O ILE A 423 ? O ILE A 423 K 4 5 O GLN A 429 ? O GLN A 429 N GLU A 380 ? N GLU A 380 L 1 2 N LEU A 355 ? N LEU A 355 O VAL A 510 ? O VAL A 510 L 2 3 O PHE A 509 ? O PHE A 509 N LEU A 410 ? N LEU A 410 L 3 4 N LEU A 409 ? N LEU A 409 O ILE A 423 ? O ILE A 423 L 4 5 N PHE A 428 ? N PHE A 428 O SER A 436 ? O SER A 436 L 5 6 N MET A 439 ? N MET A 439 O ALA A 459 ? O ALA A 459 # 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 ? ? ? ? 6 'BINDING SITE FOR RESIDUE NAG A 650' AC2 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 660' AC3 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE MAN A 670' AC4 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 680' AC5 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 690' AC6 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE DQQ A 801' # 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 6 ALA A 398 ? ALA A 398 . ? 1_555 ? 2 AC1 6 SER A 399 ? SER A 399 . ? 1_555 ? 3 AC1 6 GLN A 420 ? GLN A 420 . ? 1_555 ? 4 AC1 6 ARG A 445 ? ARG A 445 . ? 1_555 ? 5 AC1 6 ASN A 513 ? ASN A 513 . ? 1_555 ? 6 AC1 6 NAG C . ? NAG A 660 . ? 1_555 ? 7 AC2 2 NAG B . ? NAG A 650 . ? 1_555 ? 8 AC2 2 MAN D . ? MAN A 670 . ? 1_555 ? 9 AC3 1 NAG C . ? NAG A 660 . ? 1_555 ? 10 AC4 3 ASN A 116 ? ASN A 116 . ? 1_555 ? 11 AC4 3 ASP A 119 ? ASP A 119 . ? 1_555 ? 12 AC4 3 NAG F . ? NAG A 690 . ? 1_555 ? 13 AC5 2 NAG E . ? NAG A 680 . ? 1_555 ? 14 AC5 2 HOH H . ? HOH A 1003 . ? 1_555 ? 15 AC6 9 ASN A 21 ? ASN A 21 . ? 1_555 ? 16 AC6 9 ASP A 22 ? ASP A 22 . ? 1_555 ? 17 AC6 9 GLN A 38 ? GLN A 38 . ? 1_555 ? 18 AC6 9 PHE A 46 ? PHE A 46 . ? 1_555 ? 19 AC6 9 TRP A 82 ? TRP A 82 . ? 1_555 ? 20 AC6 9 SER A 83 ? SER A 83 . ? 1_555 ? 21 AC6 9 ARG A 146 ? ARG A 146 . ? 1_555 ? 22 AC6 9 ASP A 147 ? ASP A 147 . ? 1_555 ? 23 AC6 9 GLU A 201 ? GLU A 201 . ? 1_555 ? # _database_PDB_matrix.entry_id 2AEY _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 2AEY _atom_sites.fract_transf_matrix[1][1] 0.007201 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.007201 _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] 0.005481 _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 N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . GLN A 1 2 ? 43.320 65.524 -13.427 1.00 38.42 ? 2 GLN A N 1 ATOM 2 C CA . GLN A 1 2 ? 42.064 66.270 -13.090 1.00 38.42 ? 2 GLN A CA 1 ATOM 3 C C . GLN A 1 2 ? 40.787 65.496 -13.485 1.00 37.81 ? 2 GLN A C 1 ATOM 4 O O . GLN A 1 2 ? 40.765 64.778 -14.497 1.00 37.31 ? 2 GLN A O 1 ATOM 5 C CB . GLN A 1 2 ? 42.081 67.640 -13.777 1.00 39.76 ? 2 GLN A CB 1 ATOM 6 C CG . GLN A 1 2 ? 41.807 68.821 -12.849 1.00 40.04 ? 2 GLN A CG 1 ATOM 7 C CD . GLN A 1 2 ? 40.449 68.737 -12.164 1.00 40.03 ? 2 GLN A CD 1 ATOM 8 O OE1 . GLN A 1 2 ? 40.212 67.855 -11.340 1.00 39.87 ? 2 GLN A OE1 1 ATOM 9 N NE2 . GLN A 1 2 ? 39.551 69.660 -12.505 1.00 39.89 ? 2 GLN A NE2 1 ATOM 10 N N . ILE A 1 3 ? 39.731 65.662 -12.679 1.00 36.95 ? 3 ILE A N 1 ATOM 11 C CA . ILE A 1 3 ? 38.437 64.980 -12.879 1.00 35.64 ? 3 ILE A CA 1 ATOM 12 C C . ILE A 1 3 ? 37.228 65.924 -12.876 1.00 34.12 ? 3 ILE A C 1 ATOM 13 O O . ILE A 1 3 ? 37.041 66.705 -11.934 1.00 33.47 ? 3 ILE A O 1 ATOM 14 C CB . ILE A 1 3 ? 38.181 63.933 -11.767 1.00 35.91 ? 3 ILE A CB 1 ATOM 15 C CG1 . ILE A 1 3 ? 39.348 62.944 -11.695 1.00 36.53 ? 3 ILE A CG1 1 ATOM 16 C CG2 . ILE A 1 3 ? 36.864 63.218 -12.029 1.00 35.52 ? 3 ILE A CG2 1 ATOM 17 C CD1 . ILE A 1 3 ? 39.278 61.988 -10.521 1.00 37.23 ? 3 ILE A CD1 1 ATOM 18 N N . GLU A 1 4 ? 36.392 65.826 -13.908 1.00 32.47 ? 4 GLU A N 1 ATOM 19 C CA . GLU A 1 4 ? 35.211 66.686 -14.005 1.00 31.53 ? 4 GLU A CA 1 ATOM 20 C C . GLU A 1 4 ? 33.921 66.010 -13.559 1.00 28.72 ? 4 GLU A C 1 ATOM 21 O O . GLU A 1 4 ? 33.759 64.796 -13.721 1.00 29.23 ? 4 GLU A O 1 ATOM 22 C CB . GLU A 1 4 ? 35.049 67.219 -15.434 1.00 33.54 ? 4 GLU A CB 1 ATOM 23 C CG . GLU A 1 4 ? 36.078 68.291 -15.802 1.00 37.01 ? 4 GLU A CG 1 ATOM 24 C CD . GLU A 1 4 ? 35.798 68.951 -17.149 1.00 39.96 ? 4 GLU A CD 1 ATOM 25 O OE1 . GLU A 1 4 ? 35.842 68.244 -18.188 1.00 40.92 ? 4 GLU A OE1 1 ATOM 26 O OE2 . GLU A 1 4 ? 35.532 70.180 -17.164 1.00 41.06 ? 4 GLU A OE2 1 ATOM 27 N N . GLN A 1 5 ? 33.011 66.810 -13.002 1.00 24.76 ? 5 GLN A N 1 ATOM 28 C CA . GLN A 1 5 ? 31.728 66.312 -12.511 1.00 21.57 ? 5 GLN A CA 1 ATOM 29 C C . GLN A 1 5 ? 31.938 65.179 -11.514 1.00 18.11 ? 5 GLN A C 1 ATOM 30 O O . GLN A 1 5 ? 31.358 64.105 -11.640 1.00 19.71 ? 5 GLN A O 1 ATOM 31 C CB . GLN A 1 5 ? 30.866 65.818 -13.678 1.00 21.58 ? 5 GLN A CB 1 ATOM 32 C CG . GLN A 1 5 ? 30.124 66.921 -14.419 1.00 21.52 ? 5 GLN A CG 1 ATOM 33 C CD . GLN A 1 5 ? 29.298 67.794 -13.481 1.00 21.94 ? 5 GLN A CD 1 ATOM 34 O OE1 . GLN A 1 5 ? 29.125 67.473 -12.296 1.00 22.42 ? 5 GLN A OE1 1 ATOM 35 N NE2 . GLN A 1 5 ? 28.783 68.903 -14.006 1.00 21.32 ? 5 GLN A NE2 1 ATOM 36 N N . PRO A 1 6 ? 32.761 65.418 -10.493 1.00 15.08 ? 6 PRO A N 1 ATOM 37 C CA . PRO A 1 6 ? 33.090 64.447 -9.450 1.00 14.10 ? 6 PRO A CA 1 ATOM 38 C C . PRO A 1 6 ? 31.948 64.036 -8.519 1.00 12.15 ? 6 PRO A C 1 ATOM 39 O O . PRO A 1 6 ? 32.100 63.122 -7.701 1.00 12.06 ? 6 PRO A O 1 ATOM 40 C CB . PRO A 1 6 ? 34.204 65.150 -8.697 1.00 13.57 ? 6 PRO A CB 1 ATOM 41 C CG . PRO A 1 6 ? 33.754 66.573 -8.740 1.00 13.99 ? 6 PRO A CG 1 ATOM 42 C CD . PRO A 1 6 ? 33.345 66.733 -10.182 1.00 14.96 ? 6 PRO A CD 1 ATOM 43 N N . TYR A 1 7 ? 30.806 64.700 -8.628 1.00 10.94 ? 7 TYR A N 1 ATOM 44 C CA . TYR A 1 7 ? 29.705 64.364 -7.742 1.00 9.10 ? 7 TYR A CA 1 ATOM 45 C C . TYR A 1 7 ? 28.543 63.594 -8.370 1.00 7.81 ? 7 TYR A C 1 ATOM 46 O O . TYR A 1 7 ? 27.693 63.064 -7.651 1.00 7.84 ? 7 TYR A O 1 ATOM 47 C CB . TYR A 1 7 ? 29.204 65.634 -7.067 1.00 8.19 ? 7 TYR A CB 1 ATOM 48 C CG . TYR A 1 7 ? 30.248 66.279 -6.196 1.00 8.32 ? 7 TYR A CG 1 ATOM 49 C CD1 . TYR A 1 7 ? 30.829 65.578 -5.147 1.00 9.81 ? 7 TYR A CD1 1 ATOM 50 C CD2 . TYR A 1 7 ? 30.649 67.594 -6.407 1.00 10.17 ? 7 TYR A CD2 1 ATOM 51 C CE1 . TYR A 1 7 ? 31.790 66.172 -4.318 1.00 9.69 ? 7 TYR A CE1 1 ATOM 52 C CE2 . TYR A 1 7 ? 31.610 68.200 -5.583 1.00 10.61 ? 7 TYR A CE2 1 ATOM 53 C CZ . TYR A 1 7 ? 32.173 67.478 -4.540 1.00 9.21 ? 7 TYR A CZ 1 ATOM 54 O OH . TYR A 1 7 ? 33.110 68.062 -3.719 1.00 9.06 ? 7 TYR A OH 1 ATOM 55 N N . ARG A 1 8 ? 28.488 63.522 -9.695 1.00 5.79 ? 8 ARG A N 1 ATOM 56 C CA . ARG A 1 8 ? 27.402 62.780 -10.312 1.00 4.31 ? 8 ARG A CA 1 ATOM 57 C C . ARG A 1 8 ? 27.594 61.311 -9.991 1.00 3.68 ? 8 ARG A C 1 ATOM 58 O O . ARG A 1 8 ? 28.723 60.808 -9.962 1.00 3.12 ? 8 ARG A O 1 ATOM 59 C CB . ARG A 1 8 ? 27.388 62.973 -11.823 1.00 5.75 ? 8 ARG A CB 1 ATOM 60 C CG . ARG A 1 8 ? 26.996 64.364 -12.283 1.00 7.00 ? 8 ARG A CG 1 ATOM 61 C CD . ARG A 1 8 ? 26.926 64.420 -13.808 1.00 8.92 ? 8 ARG A CD 1 ATOM 62 N NE . ARG A 1 8 ? 25.755 63.734 -14.343 1.00 9.58 ? 8 ARG A NE 1 ATOM 63 C CZ . ARG A 1 8 ? 24.508 64.163 -14.173 1.00 10.88 ? 8 ARG A CZ 1 ATOM 64 N NH1 . ARG A 1 8 ? 24.278 65.272 -13.481 1.00 11.35 ? 8 ARG A NH1 1 ATOM 65 N NH2 . ARG A 1 8 ? 23.491 63.493 -14.700 1.00 11.12 ? 8 ARG A NH2 1 ATOM 66 N N . THR A 1 9 ? 26.485 60.626 -9.748 1.00 3.15 ? 9 THR A N 1 ATOM 67 C CA . THR A 1 9 ? 26.526 59.215 -9.415 1.00 3.72 ? 9 THR A CA 1 ATOM 68 C C . THR A 1 9 ? 26.780 58.340 -10.637 1.00 4.39 ? 9 THR A C 1 ATOM 69 O O . THR A 1 9 ? 26.662 58.787 -11.784 1.00 4.69 ? 9 THR A O 1 ATOM 70 C CB . THR A 1 9 ? 25.219 58.770 -8.796 1.00 3.31 ? 9 THR A CB 1 ATOM 71 O OG1 . THR A 1 9 ? 24.238 58.618 -9.829 1.00 5.81 ? 9 THR A OG1 1 ATOM 72 C CG2 . THR A 1 9 ? 24.747 59.800 -7.806 1.00 0.96 ? 9 THR A CG2 1 ATOM 73 N N . GLY A 1 10 ? 27.117 57.082 -10.374 1.00 4.24 ? 10 GLY A N 1 ATOM 74 C CA . GLY A 1 10 ? 27.390 56.148 -11.444 1.00 4.10 ? 10 GLY A CA 1 ATOM 75 C C . GLY A 1 10 ? 26.242 55.194 -11.672 1.00 4.28 ? 10 GLY A C 1 ATOM 76 O O . GLY A 1 10 ? 25.960 54.814 -12.811 1.00 5.05 ? 10 GLY A O 1 ATOM 77 N N . TYR A 1 11 ? 25.572 54.792 -10.599 1.00 3.58 ? 11 TYR A N 1 ATOM 78 C CA . TYR A 1 11 ? 24.461 53.881 -10.767 1.00 2.50 ? 11 TYR A CA 1 ATOM 79 C C . TYR A 1 11 ? 23.162 54.349 -10.136 1.00 1.91 ? 11 TYR A C 1 ATOM 80 O O . TYR A 1 11 ? 22.209 53.583 -10.044 1.00 2.44 ? 11 TYR A O 1 ATOM 81 C CB . TYR A 1 11 ? 24.833 52.483 -10.277 1.00 1.70 ? 11 TYR A CB 1 ATOM 82 C CG . TYR A 1 11 ? 25.250 52.400 -8.836 1.00 1.13 ? 11 TYR A CG 1 ATOM 83 C CD1 . TYR A 1 11 ? 24.324 52.520 -7.816 1.00 1.33 ? 11 TYR A CD1 1 ATOM 84 C CD2 . TYR A 1 11 ? 26.571 52.181 -8.496 1.00 0.96 ? 11 TYR A CD2 1 ATOM 85 C CE1 . TYR A 1 11 ? 24.709 52.422 -6.493 1.00 1.22 ? 11 TYR A CE1 1 ATOM 86 C CE2 . TYR A 1 11 ? 26.965 52.081 -7.183 1.00 0.96 ? 11 TYR A CE2 1 ATOM 87 C CZ . TYR A 1 11 ? 26.034 52.204 -6.182 1.00 0.96 ? 11 TYR A CZ 1 ATOM 88 O OH . TYR A 1 11 ? 26.436 52.131 -4.866 1.00 1.06 ? 11 TYR A OH 1 ATOM 89 N N . HIS A 1 12 ? 23.114 55.602 -9.705 1.00 0.96 ? 12 HIS A N 1 ATOM 90 C CA . HIS A 1 12 ? 21.881 56.131 -9.150 1.00 0.96 ? 12 HIS A CA 1 ATOM 91 C C . HIS A 1 12 ? 21.198 56.962 -10.229 1.00 1.05 ? 12 HIS A C 1 ATOM 92 O O . HIS A 1 12 ? 21.863 57.669 -10.982 1.00 1.86 ? 12 HIS A O 1 ATOM 93 C CB . HIS A 1 12 ? 22.154 57.006 -7.943 1.00 1.07 ? 12 HIS A CB 1 ATOM 94 C CG . HIS A 1 12 ? 22.339 56.247 -6.671 1.00 0.96 ? 12 HIS A CG 1 ATOM 95 N ND1 . HIS A 1 12 ? 23.512 55.598 -6.355 1.00 0.96 ? 12 HIS A ND1 1 ATOM 96 C CD2 . HIS A 1 12 ? 21.513 56.074 -5.613 1.00 0.96 ? 12 HIS A CD2 1 ATOM 97 C CE1 . HIS A 1 12 ? 23.402 55.063 -5.153 1.00 0.96 ? 12 HIS A CE1 1 ATOM 98 N NE2 . HIS A 1 12 ? 22.199 55.337 -4.682 1.00 0.96 ? 12 HIS A NE2 1 ATOM 99 N N . PHE A 1 13 ? 19.874 56.874 -10.304 1.00 0.96 ? 13 PHE A N 1 ATOM 100 C CA . PHE A 1 13 ? 19.119 57.611 -11.305 1.00 0.96 ? 13 PHE A CA 1 ATOM 101 C C . PHE A 1 13 ? 19.166 59.105 -11.080 1.00 1.50 ? 13 PHE A C 1 ATOM 102 O O . PHE A 1 13 ? 18.986 59.567 -9.959 1.00 3.73 ? 13 PHE A O 1 ATOM 103 C CB . PHE A 1 13 ? 17.654 57.197 -11.290 1.00 0.96 ? 13 PHE A CB 1 ATOM 104 C CG . PHE A 1 13 ? 16.802 57.993 -12.228 1.00 0.96 ? 13 PHE A CG 1 ATOM 105 C CD1 . PHE A 1 13 ? 16.616 57.577 -13.539 1.00 0.96 ? 13 PHE A CD1 1 ATOM 106 C CD2 . PHE A 1 13 ? 16.244 59.196 -11.826 1.00 0.96 ? 13 PHE A CD2 1 ATOM 107 C CE1 . PHE A 1 13 ? 15.892 58.347 -14.436 1.00 0.96 ? 13 PHE A CE1 1 ATOM 108 C CE2 . PHE A 1 13 ? 15.521 59.972 -12.715 1.00 0.96 ? 13 PHE A CE2 1 ATOM 109 C CZ . PHE A 1 13 ? 15.346 59.545 -14.024 1.00 0.96 ? 13 PHE A CZ 1 ATOM 110 N N . GLN A 1 14 ? 19.381 59.857 -12.154 1.00 1.83 ? 14 GLN A N 1 ATOM 111 C CA . GLN A 1 14 ? 19.410 61.316 -12.102 1.00 1.77 ? 14 GLN A CA 1 ATOM 112 C C . GLN A 1 14 ? 19.469 61.869 -13.530 1.00 2.37 ? 14 GLN A C 1 ATOM 113 O O . GLN A 1 14 ? 20.198 61.356 -14.382 1.00 2.91 ? 14 GLN A O 1 ATOM 114 C CB . GLN A 1 14 ? 20.597 61.807 -11.266 1.00 0.96 ? 14 GLN A CB 1 ATOM 115 C CG . GLN A 1 14 ? 21.893 62.031 -12.016 1.00 1.46 ? 14 GLN A CG 1 ATOM 116 C CD . GLN A 1 14 ? 23.066 62.307 -11.085 1.00 0.96 ? 14 GLN A CD 1 ATOM 117 O OE1 . GLN A 1 14 ? 23.653 61.382 -10.529 1.00 0.96 ? 14 GLN A OE1 1 ATOM 118 N NE2 . GLN A 1 14 ? 23.403 63.583 -10.905 1.00 0.96 ? 14 GLN A NE2 1 ATOM 119 N N . PRO A 1 15 ? 18.685 62.923 -13.811 1.00 2.27 ? 15 PRO A N 1 ATOM 120 C CA . PRO A 1 15 ? 18.638 63.542 -15.136 1.00 2.58 ? 15 PRO A CA 1 ATOM 121 C C . PRO A 1 15 ? 19.968 64.130 -15.552 1.00 2.09 ? 15 PRO A C 1 ATOM 122 O O . PRO A 1 15 ? 20.791 64.493 -14.709 1.00 1.98 ? 15 PRO A O 1 ATOM 123 C CB . PRO A 1 15 ? 17.555 64.596 -14.982 1.00 2.06 ? 15 PRO A CB 1 ATOM 124 C CG . PRO A 1 15 ? 17.739 65.033 -13.586 1.00 3.37 ? 15 PRO A CG 1 ATOM 125 C CD . PRO A 1 15 ? 17.936 63.735 -12.836 1.00 3.53 ? 15 PRO A CD 1 ATOM 126 N N . PRO A 1 16 ? 20.193 64.228 -16.868 1.00 1.71 ? 16 PRO A N 1 ATOM 127 C CA . PRO A 1 16 ? 21.394 64.752 -17.517 1.00 2.89 ? 16 PRO A CA 1 ATOM 128 C C . PRO A 1 16 ? 21.925 66.001 -16.846 1.00 2.99 ? 16 PRO A C 1 ATOM 129 O O . PRO A 1 16 ? 23.143 66.169 -16.676 1.00 2.15 ? 16 PRO A O 1 ATOM 130 C CB . PRO A 1 16 ? 20.911 65.016 -18.931 1.00 3.07 ? 16 PRO A CB 1 ATOM 131 C CG . PRO A 1 16 ? 19.963 63.886 -19.152 1.00 2.57 ? 16 PRO A CG 1 ATOM 132 C CD . PRO A 1 16 ? 19.173 63.891 -17.875 1.00 2.47 ? 16 PRO A CD 1 ATOM 133 N N . SER A 1 17 ? 20.991 66.870 -16.467 1.00 3.30 ? 17 SER A N 1 ATOM 134 C CA . SER A 1 17 ? 21.315 68.124 -15.805 1.00 4.08 ? 17 SER A CA 1 ATOM 135 C C . SER A 1 17 ? 20.052 68.770 -15.265 1.00 4.28 ? 17 SER A C 1 ATOM 136 O O . SER A 1 17 ? 18.944 68.308 -15.546 1.00 4.53 ? 17 SER A O 1 ATOM 137 C CB . SER A 1 17 ? 21.972 69.080 -16.789 1.00 4.41 ? 17 SER A CB 1 ATOM 138 O OG . SER A 1 17 ? 21.139 69.238 -17.921 1.00 5.92 ? 17 SER A OG 1 ATOM 139 N N . ASN A 1 18 ? 20.245 69.840 -14.493 1.00 4.89 ? 18 ASN A N 1 ATOM 140 C CA . ASN A 1 18 ? 19.179 70.634 -13.887 1.00 5.22 ? 18 ASN A CA 1 ATOM 141 C C . ASN A 1 18 ? 18.622 70.094 -12.590 1.00 3.94 ? 18 ASN A C 1 ATOM 142 O O . ASN A 1 18 ? 19.211 69.215 -11.975 1.00 4.42 ? 18 ASN A O 1 ATOM 143 C CB . ASN A 1 18 ? 18.059 70.872 -14.897 1.00 9.07 ? 18 ASN A CB 1 ATOM 144 C CG . ASN A 1 18 ? 18.492 71.798 -16.029 1.00 13.15 ? 18 ASN A CG 1 ATOM 145 O OD1 . ASN A 1 18 ? 19.628 71.716 -16.519 1.00 16.41 ? 18 ASN A OD1 1 ATOM 146 N ND2 . ASN A 1 18 ? 17.589 72.681 -16.454 1.00 15.26 ? 18 ASN A ND2 1 ATOM 147 N N . TRP A 1 19 ? 17.483 70.624 -12.170 1.00 3.10 ? 19 TRP A N 1 ATOM 148 C CA . TRP A 1 19 ? 16.875 70.231 -10.901 1.00 2.84 ? 19 TRP A CA 1 ATOM 149 C C . TRP A 1 19 ? 15.845 69.130 -10.927 1.00 2.87 ? 19 TRP A C 1 ATOM 150 O O . TRP A 1 19 ? 15.039 69.032 -11.847 1.00 4.81 ? 19 TRP A O 1 ATOM 151 C CB . TRP A 1 19 ? 16.268 71.462 -10.236 1.00 2.24 ? 19 TRP A CB 1 ATOM 152 C CG . TRP A 1 19 ? 15.264 71.176 -9.181 1.00 0.96 ? 19 TRP A CG 1 ATOM 153 C CD1 . TRP A 1 19 ? 13.995 70.723 -9.359 1.00 0.96 ? 19 TRP A CD1 1 ATOM 154 C CD2 . TRP A 1 19 ? 15.424 71.385 -7.784 1.00 0.96 ? 19 TRP A CD2 1 ATOM 155 N NE1 . TRP A 1 19 ? 13.347 70.643 -8.157 1.00 0.96 ? 19 TRP A NE1 1 ATOM 156 C CE2 . TRP A 1 19 ? 14.205 71.045 -7.169 1.00 1.49 ? 19 TRP A CE2 1 ATOM 157 C CE3 . TRP A 1 19 ? 16.484 71.828 -6.986 1.00 0.96 ? 19 TRP A CE3 1 ATOM 158 C CZ2 . TRP A 1 19 ? 14.012 71.133 -5.790 1.00 3.18 ? 19 TRP A CZ2 1 ATOM 159 C CZ3 . TRP A 1 19 ? 16.298 71.914 -5.618 1.00 1.42 ? 19 TRP A CZ3 1 ATOM 160 C CH2 . TRP A 1 19 ? 15.068 71.569 -5.031 1.00 3.65 ? 19 TRP A CH2 1 ATOM 161 N N . MET A 1 20 ? 15.847 68.328 -9.872 1.00 2.45 ? 20 MET A N 1 ATOM 162 C CA . MET A 1 20 ? 14.907 67.228 -9.750 1.00 1.94 ? 20 MET A CA 1 ATOM 163 C C . MET A 1 20 ? 14.542 66.984 -8.290 1.00 2.10 ? 20 MET A C 1 ATOM 164 O O . MET A 1 20 ? 15.353 67.250 -7.393 1.00 3.37 ? 20 MET A O 1 ATOM 165 C CB . MET A 1 20 ? 15.527 65.965 -10.332 1.00 0.96 ? 20 MET A CB 1 ATOM 166 C CG . MET A 1 20 ? 14.730 64.717 -10.043 1.00 2.42 ? 20 MET A CG 1 ATOM 167 S SD . MET A 1 20 ? 15.542 63.194 -10.580 1.00 4.69 ? 20 MET A SD 1 ATOM 168 C CE . MET A 1 20 ? 16.415 62.732 -9.086 1.00 6.34 ? 20 MET A CE 1 ATOM 169 N N . ASN A 1 21 ? 13.321 66.508 -8.043 1.00 0.96 ? 21 ASN A N 1 ATOM 170 C CA . ASN A 1 21 ? 12.906 66.184 -6.680 1.00 0.96 ? 21 ASN A CA 1 ATOM 171 C C . ASN A 1 21 ? 11.905 65.031 -6.644 1.00 1.75 ? 21 ASN A C 1 ATOM 172 O O . ASN A 1 21 ? 12.159 63.971 -7.220 1.00 1.16 ? 21 ASN A O 1 ATOM 173 C CB . ASN A 1 21 ? 12.385 67.428 -5.915 1.00 0.96 ? 21 ASN A CB 1 ATOM 174 C CG . ASN A 1 21 ? 11.327 68.211 -6.668 1.00 0.96 ? 21 ASN A CG 1 ATOM 175 O OD1 . ASN A 1 21 ? 11.323 68.239 -7.888 1.00 2.71 ? 21 ASN A OD1 1 ATOM 176 N ND2 . ASN A 1 21 ? 10.443 68.884 -5.932 1.00 0.96 ? 21 ASN A ND2 1 ATOM 177 N N . ASP A 1 22 ? 10.782 65.228 -5.962 1.00 3.36 ? 22 ASP A N 1 ATOM 178 C CA . ASP A 1 22 ? 9.741 64.202 -5.835 1.00 3.00 ? 22 ASP A CA 1 ATOM 179 C C . ASP A 1 22 ? 9.677 63.190 -6.992 1.00 2.86 ? 22 ASP A C 1 ATOM 180 O O . ASP A 1 22 ? 9.471 63.570 -8.145 1.00 4.50 ? 22 ASP A O 1 ATOM 181 C CB . ASP A 1 22 ? 8.370 64.878 -5.704 1.00 1.97 ? 22 ASP A CB 1 ATOM 182 C CG . ASP A 1 22 ? 8.287 65.834 -4.523 1.00 1.65 ? 22 ASP A CG 1 ATOM 183 O OD1 . ASP A 1 22 ? 9.219 66.635 -4.314 1.00 1.79 ? 22 ASP A OD1 1 ATOM 184 O OD2 . ASP A 1 22 ? 7.268 65.801 -3.812 1.00 0.96 ? 22 ASP A OD2 1 ATOM 185 N N . PRO A 1 23 ? 9.885 61.893 -6.711 1.00 2.11 ? 23 PRO A N 1 ATOM 186 C CA . PRO A 1 23 ? 9.807 60.915 -7.798 1.00 2.42 ? 23 PRO A CA 1 ATOM 187 C C . PRO A 1 23 ? 8.315 60.845 -8.100 1.00 3.17 ? 23 PRO A C 1 ATOM 188 O O . PRO A 1 23 ? 7.513 61.090 -7.197 1.00 4.98 ? 23 PRO A O 1 ATOM 189 C CB . PRO A 1 23 ? 10.329 59.648 -7.146 1.00 0.96 ? 23 PRO A CB 1 ATOM 190 C CG . PRO A 1 23 ? 9.891 59.805 -5.753 1.00 0.96 ? 23 PRO A CG 1 ATOM 191 C CD . PRO A 1 23 ? 10.240 61.230 -5.451 1.00 1.68 ? 23 PRO A CD 1 ATOM 192 N N . ASN A 1 24 ? 7.929 60.521 -9.334 1.00 3.10 ? 24 ASN A N 1 ATOM 193 C CA . ASN A 1 24 ? 6.505 60.494 -9.681 1.00 2.17 ? 24 ASN A CA 1 ATOM 194 C C . ASN A 1 24 ? 5.950 59.276 -10.408 1.00 2.03 ? 24 ASN A C 1 ATOM 195 O O . ASN A 1 24 ? 6.659 58.561 -11.114 1.00 1.65 ? 24 ASN A O 1 ATOM 196 C CB . ASN A 1 24 ? 6.152 61.727 -10.510 1.00 2.01 ? 24 ASN A CB 1 ATOM 197 C CG . ASN A 1 24 ? 6.151 63.006 -9.702 1.00 1.43 ? 24 ASN A CG 1 ATOM 198 O OD1 . ASN A 1 24 ? 6.232 64.095 -10.264 1.00 1.76 ? 24 ASN A OD1 1 ATOM 199 N ND2 . ASN A 1 24 ? 6.039 62.887 -8.386 1.00 0.96 ? 24 ASN A ND2 1 ATOM 200 N N . GLY A 1 25 ? 4.645 59.090 -10.238 1.00 2.11 ? 25 GLY A N 1 ATOM 201 C CA . GLY A 1 25 ? 3.918 57.996 -10.853 1.00 1.89 ? 25 GLY A CA 1 ATOM 202 C C . GLY A 1 25 ? 4.745 56.836 -11.352 1.00 1.27 ? 25 GLY A C 1 ATOM 203 O O . GLY A 1 25 ? 4.841 56.625 -12.552 1.00 1.60 ? 25 GLY A O 1 ATOM 204 N N . PRO A 1 26 ? 5.372 56.073 -10.459 1.00 0.96 ? 26 PRO A N 1 ATOM 205 C CA . PRO A 1 26 ? 6.175 54.938 -10.898 1.00 0.96 ? 26 PRO A CA 1 ATOM 206 C C . PRO A 1 26 ? 5.192 53.834 -11.199 1.00 1.73 ? 26 PRO A C 1 ATOM 207 O O . PRO A 1 26 ? 4.124 53.779 -10.583 1.00 1.98 ? 26 PRO A O 1 ATOM 208 C CB . PRO A 1 26 ? 7.005 54.602 -9.678 1.00 0.96 ? 26 PRO A CB 1 ATOM 209 C CG . PRO A 1 26 ? 7.008 55.851 -8.904 1.00 0.96 ? 26 PRO A CG 1 ATOM 210 C CD . PRO A 1 26 ? 5.618 56.352 -9.046 1.00 0.96 ? 26 PRO A CD 1 ATOM 211 N N . MET A 1 27 ? 5.548 52.953 -12.131 1.00 2.88 ? 27 MET A N 1 ATOM 212 C CA . MET A 1 27 ? 4.668 51.854 -12.506 1.00 3.08 ? 27 MET A CA 1 ATOM 213 C C . MET A 1 27 ? 5.332 50.860 -13.433 1.00 3.10 ? 27 MET A C 1 ATOM 214 O O . MET A 1 27 ? 6.377 51.140 -14.020 1.00 2.67 ? 27 MET A O 1 ATOM 215 C CB . MET A 1 27 ? 3.451 52.402 -13.228 1.00 3.08 ? 27 MET A CB 1 ATOM 216 C CG . MET A 1 27 ? 3.791 53.005 -14.574 1.00 1.17 ? 27 MET A CG 1 ATOM 217 S SD . MET A 1 27 ? 2.294 53.391 -15.477 1.00 1.31 ? 27 MET A SD 1 ATOM 218 C CE . MET A 1 27 ? 2.784 54.849 -16.424 1.00 1.63 ? 27 MET A CE 1 ATOM 219 N N . LEU A 1 28 ? 4.704 49.698 -13.569 1.00 3.43 ? 28 LEU A N 1 ATOM 220 C CA . LEU A 1 28 ? 5.192 48.671 -14.479 1.00 3.96 ? 28 LEU A CA 1 ATOM 221 C C . LEU A 1 28 ? 4.086 48.405 -15.493 1.00 4.70 ? 28 LEU A C 1 ATOM 222 O O . LEU A 1 28 ? 3.083 47.762 -15.172 1.00 6.69 ? 28 LEU A O 1 ATOM 223 C CB . LEU A 1 28 ? 5.522 47.385 -13.728 1.00 4.05 ? 28 LEU A CB 1 ATOM 224 C CG . LEU A 1 28 ? 5.950 46.215 -14.622 1.00 4.37 ? 28 LEU A CG 1 ATOM 225 C CD1 . LEU A 1 28 ? 7.056 46.652 -15.560 1.00 3.75 ? 28 LEU A CD1 1 ATOM 226 C CD2 . LEU A 1 28 ? 6.410 45.058 -13.765 1.00 4.94 ? 28 LEU A CD2 1 ATOM 227 N N . TYR A 1 29 ? 4.263 48.903 -16.713 1.00 4.29 ? 29 TYR A N 1 ATOM 228 C CA . TYR A 1 29 ? 3.257 48.721 -17.755 1.00 5.29 ? 29 TYR A CA 1 ATOM 229 C C . TYR A 1 29 ? 3.822 48.030 -18.986 1.00 5.83 ? 29 TYR A C 1 ATOM 230 O O . TYR A 1 29 ? 4.800 48.491 -19.584 1.00 5.94 ? 29 TYR A O 1 ATOM 231 C CB . TYR A 1 29 ? 2.660 50.074 -18.163 1.00 5.35 ? 29 TYR A CB 1 ATOM 232 C CG . TYR A 1 29 ? 1.499 49.984 -19.133 1.00 3.71 ? 29 TYR A CG 1 ATOM 233 C CD1 . TYR A 1 29 ? 0.226 49.632 -18.695 1.00 2.99 ? 29 TYR A CD1 1 ATOM 234 C CD2 . TYR A 1 29 ? 1.682 50.228 -20.489 1.00 3.66 ? 29 TYR A CD2 1 ATOM 235 C CE1 . TYR A 1 29 ? -0.831 49.521 -19.577 1.00 3.04 ? 29 TYR A CE1 1 ATOM 236 C CE2 . TYR A 1 29 ? 0.630 50.121 -21.383 1.00 3.81 ? 29 TYR A CE2 1 ATOM 237 C CZ . TYR A 1 29 ? -0.624 49.765 -20.921 1.00 3.72 ? 29 TYR A CZ 1 ATOM 238 O OH . TYR A 1 29 ? -1.662 49.636 -21.813 1.00 4.34 ? 29 TYR A OH 1 ATOM 239 N N . GLN A 1 30 ? 3.186 46.926 -19.359 1.00 6.48 ? 30 GLN A N 1 ATOM 240 C CA . GLN A 1 30 ? 3.599 46.148 -20.514 1.00 7.45 ? 30 GLN A CA 1 ATOM 241 C C . GLN A 1 30 ? 5.090 45.832 -20.560 1.00 6.29 ? 30 GLN A C 1 ATOM 242 O O . GLN A 1 30 ? 5.771 46.133 -21.542 1.00 5.85 ? 30 GLN A O 1 ATOM 243 C CB . GLN A 1 30 ? 3.186 46.858 -21.802 1.00 9.86 ? 30 GLN A CB 1 ATOM 244 C CG . GLN A 1 30 ? 1.696 46.773 -22.111 1.00 14.25 ? 30 GLN A CG 1 ATOM 245 C CD . GLN A 1 30 ? 1.202 45.338 -22.227 1.00 16.37 ? 30 GLN A CD 1 ATOM 246 O OE1 . GLN A 1 30 ? 1.000 44.653 -21.219 1.00 18.64 ? 30 GLN A OE1 1 ATOM 247 N NE2 . GLN A 1 30 ? 1.018 44.871 -23.461 1.00 16.44 ? 30 GLN A NE2 1 ATOM 248 N N . GLY A 1 31 ? 5.588 45.226 -19.489 1.00 5.43 ? 31 GLY A N 1 ATOM 249 C CA . GLY A 1 31 ? 6.986 44.840 -19.432 1.00 4.59 ? 31 GLY A CA 1 ATOM 250 C C . GLY A 1 31 ? 8.021 45.936 -19.279 1.00 3.59 ? 31 GLY A C 1 ATOM 251 O O . GLY A 1 31 ? 9.222 45.648 -19.238 1.00 4.01 ? 31 GLY A O 1 ATOM 252 N N . VAL A 1 32 ? 7.580 47.185 -19.192 1.00 2.18 ? 32 VAL A N 1 ATOM 253 C CA . VAL A 1 32 ? 8.513 48.290 -19.044 1.00 2.03 ? 32 VAL A CA 1 ATOM 254 C C . VAL A 1 32 ? 8.320 49.041 -17.748 1.00 2.19 ? 32 VAL A C 1 ATOM 255 O O . VAL A 1 32 ? 7.193 49.259 -17.312 1.00 3.41 ? 32 VAL A O 1 ATOM 256 C CB . VAL A 1 32 ? 8.363 49.291 -20.179 1.00 1.96 ? 32 VAL A CB 1 ATOM 257 C CG1 . VAL A 1 32 ? 9.071 50.576 -19.833 1.00 2.70 ? 32 VAL A CG1 1 ATOM 258 C CG2 . VAL A 1 32 ? 8.941 48.718 -21.437 1.00 4.23 ? 32 VAL A CG2 1 ATOM 259 N N . TYR A 1 33 ? 9.424 49.437 -17.128 1.00 2.62 ? 33 TYR A N 1 ATOM 260 C CA . TYR A 1 33 ? 9.350 50.203 -15.895 1.00 2.70 ? 33 TYR A CA 1 ATOM 261 C C . TYR A 1 33 ? 9.344 51.677 -16.270 1.00 3.32 ? 33 TYR A C 1 ATOM 262 O O . TYR A 1 33 ? 10.175 52.144 -17.055 1.00 3.17 ? 33 TYR A O 1 ATOM 263 C CB . TYR A 1 33 ? 10.547 49.909 -14.993 1.00 1.99 ? 33 TYR A CB 1 ATOM 264 C CG . TYR A 1 33 ? 10.491 48.558 -14.328 1.00 1.44 ? 33 TYR A CG 1 ATOM 265 C CD1 . TYR A 1 33 ? 9.597 48.308 -13.286 1.00 1.25 ? 33 TYR A CD1 1 ATOM 266 C CD2 . TYR A 1 33 ? 11.289 47.509 -14.775 1.00 1.04 ? 33 TYR A CD2 1 ATOM 267 C CE1 . TYR A 1 33 ? 9.494 47.046 -12.713 1.00 0.96 ? 33 TYR A CE1 1 ATOM 268 C CE2 . TYR A 1 33 ? 11.189 46.243 -14.206 1.00 0.96 ? 33 TYR A CE2 1 ATOM 269 C CZ . TYR A 1 33 ? 10.287 46.023 -13.183 1.00 0.96 ? 33 TYR A CZ 1 ATOM 270 O OH . TYR A 1 33 ? 10.155 44.769 -12.664 1.00 1.08 ? 33 TYR A OH 1 ATOM 271 N N . HIS A 1 34 ? 8.386 52.402 -15.713 1.00 3.67 ? 34 HIS A N 1 ATOM 272 C CA . HIS A 1 34 ? 8.258 53.826 -15.964 1.00 3.67 ? 34 HIS A CA 1 ATOM 273 C C . HIS A 1 34 ? 8.616 54.619 -14.709 1.00 3.62 ? 34 HIS A C 1 ATOM 274 O O . HIS A 1 34 ? 8.269 54.220 -13.594 1.00 4.61 ? 34 HIS A O 1 ATOM 275 C CB . HIS A 1 34 ? 6.824 54.148 -16.378 1.00 3.58 ? 34 HIS A CB 1 ATOM 276 C CG . HIS A 1 34 ? 6.518 53.816 -17.801 1.00 2.83 ? 34 HIS A CG 1 ATOM 277 N ND1 . HIS A 1 34 ? 6.883 54.634 -18.846 1.00 2.92 ? 34 HIS A ND1 1 ATOM 278 C CD2 . HIS A 1 34 ? 5.900 52.748 -18.354 1.00 3.15 ? 34 HIS A CD2 1 ATOM 279 C CE1 . HIS A 1 34 ? 6.500 54.083 -19.985 1.00 3.25 ? 34 HIS A CE1 1 ATOM 280 N NE2 . HIS A 1 34 ? 5.901 52.938 -19.714 1.00 3.19 ? 34 HIS A NE2 1 ATOM 281 N N . PHE A 1 35 ? 9.335 55.723 -14.887 1.00 2.54 ? 35 PHE A N 1 ATOM 282 C CA . PHE A 1 35 ? 9.690 56.582 -13.768 1.00 1.19 ? 35 PHE A CA 1 ATOM 283 C C . PHE A 1 35 ? 9.505 58.023 -14.208 1.00 1.75 ? 35 PHE A C 1 ATOM 284 O O . PHE A 1 35 ? 9.838 58.385 -15.343 1.00 1.61 ? 35 PHE A O 1 ATOM 285 C CB . PHE A 1 35 ? 11.134 56.377 -13.324 1.00 0.96 ? 35 PHE A CB 1 ATOM 286 C CG . PHE A 1 35 ? 11.538 57.274 -12.194 1.00 0.96 ? 35 PHE A CG 1 ATOM 287 C CD1 . PHE A 1 35 ? 11.068 57.045 -10.914 1.00 0.96 ? 35 PHE A CD1 1 ATOM 288 C CD2 . PHE A 1 35 ? 12.328 58.393 -12.428 1.00 0.96 ? 35 PHE A CD2 1 ATOM 289 C CE1 . PHE A 1 35 ? 11.374 57.917 -9.887 1.00 1.11 ? 35 PHE A CE1 1 ATOM 290 C CE2 . PHE A 1 35 ? 12.639 59.274 -11.409 1.00 0.96 ? 35 PHE A CE2 1 ATOM 291 C CZ . PHE A 1 35 ? 12.163 59.040 -10.135 1.00 1.24 ? 35 PHE A CZ 1 ATOM 292 N N . PHE A 1 36 ? 8.962 58.837 -13.308 1.00 1.62 ? 36 PHE A N 1 ATOM 293 C CA . PHE A 1 36 ? 8.722 60.243 -13.584 1.00 0.96 ? 36 PHE A CA 1 ATOM 294 C C . PHE A 1 36 ? 9.259 61.011 -12.404 1.00 0.96 ? 36 PHE A C 1 ATOM 295 O O . PHE A 1 36 ? 9.295 60.496 -11.293 1.00 0.97 ? 36 PHE A O 1 ATOM 296 C CB . PHE A 1 36 ? 7.227 60.494 -13.727 1.00 1.55 ? 36 PHE A CB 1 ATOM 297 C CG . PHE A 1 36 ? 6.584 59.715 -14.836 1.00 2.44 ? 36 PHE A CG 1 ATOM 298 C CD1 . PHE A 1 36 ? 6.623 60.181 -16.147 1.00 3.64 ? 36 PHE A CD1 1 ATOM 299 C CD2 . PHE A 1 36 ? 5.953 58.506 -14.577 1.00 2.58 ? 36 PHE A CD2 1 ATOM 300 C CE1 . PHE A 1 36 ? 6.038 59.449 -17.186 1.00 3.84 ? 36 PHE A CE1 1 ATOM 301 C CE2 . PHE A 1 36 ? 5.368 57.766 -15.609 1.00 3.08 ? 36 PHE A CE2 1 ATOM 302 C CZ . PHE A 1 36 ? 5.411 58.239 -16.914 1.00 3.07 ? 36 PHE A CZ 1 ATOM 303 N N . TYR A 1 37 ? 9.674 62.246 -12.640 1.00 0.96 ? 37 TYR A N 1 ATOM 304 C CA . TYR A 1 37 ? 10.214 63.066 -11.567 1.00 1.50 ? 37 TYR A CA 1 ATOM 305 C C . TYR A 1 37 ? 9.916 64.551 -11.730 1.00 2.09 ? 37 TYR A C 1 ATOM 306 O O . TYR A 1 37 ? 9.864 65.054 -12.851 1.00 3.60 ? 37 TYR A O 1 ATOM 307 C CB . TYR A 1 37 ? 11.727 62.873 -11.496 1.00 1.99 ? 37 TYR A CB 1 ATOM 308 C CG . TYR A 1 37 ? 12.440 63.007 -12.820 1.00 0.96 ? 37 TYR A CG 1 ATOM 309 C CD1 . TYR A 1 37 ? 12.614 61.915 -13.644 1.00 0.96 ? 37 TYR A CD1 1 ATOM 310 C CD2 . TYR A 1 37 ? 12.944 64.228 -13.240 1.00 0.96 ? 37 TYR A CD2 1 ATOM 311 C CE1 . TYR A 1 37 ? 13.279 62.033 -14.865 1.00 3.18 ? 37 TYR A CE1 1 ATOM 312 C CE2 . TYR A 1 37 ? 13.606 64.361 -14.458 1.00 0.96 ? 37 TYR A CE2 1 ATOM 313 C CZ . TYR A 1 37 ? 13.772 63.261 -15.275 1.00 1.83 ? 37 TYR A CZ 1 ATOM 314 O OH . TYR A 1 37 ? 14.377 63.388 -16.516 1.00 1.14 ? 37 TYR A OH 1 ATOM 315 N N . GLN A 1 38 ? 9.724 65.260 -10.618 1.00 1.91 ? 38 GLN A N 1 ATOM 316 C CA . GLN A 1 38 ? 9.473 66.700 -10.689 1.00 1.09 ? 38 GLN A CA 1 ATOM 317 C C . GLN A 1 38 ? 10.726 67.300 -11.316 1.00 0.96 ? 38 GLN A C 1 ATOM 318 O O . GLN A 1 38 ? 11.841 67.065 -10.852 1.00 0.96 ? 38 GLN A O 1 ATOM 319 C CB . GLN A 1 38 ? 9.237 67.282 -9.294 1.00 0.96 ? 38 GLN A CB 1 ATOM 320 C CG . GLN A 1 38 ? 7.916 66.880 -8.641 1.00 0.96 ? 38 GLN A CG 1 ATOM 321 C CD . GLN A 1 38 ? 6.707 67.452 -9.351 1.00 0.96 ? 38 GLN A CD 1 ATOM 322 O OE1 . GLN A 1 38 ? 6.520 68.663 -9.407 1.00 0.96 ? 38 GLN A OE1 1 ATOM 323 N NE2 . GLN A 1 38 ? 5.879 66.579 -9.897 1.00 1.38 ? 38 GLN A NE2 1 ATOM 324 N N . TYR A 1 39 ? 10.537 68.082 -12.369 1.00 1.53 ? 39 TYR A N 1 ATOM 325 C CA . TYR A 1 39 ? 11.662 68.656 -13.092 1.00 2.17 ? 39 TYR A CA 1 ATOM 326 C C . TYR A 1 39 ? 11.507 70.141 -13.410 1.00 3.11 ? 39 TYR A C 1 ATOM 327 O O . TYR A 1 39 ? 10.410 70.621 -13.714 1.00 2.55 ? 39 TYR A O 1 ATOM 328 C CB . TYR A 1 39 ? 11.833 67.870 -14.397 1.00 1.60 ? 39 TYR A CB 1 ATOM 329 C CG . TYR A 1 39 ? 13.033 68.218 -15.247 1.00 0.96 ? 39 TYR A CG 1 ATOM 330 C CD1 . TYR A 1 39 ? 12.953 68.157 -16.629 1.00 0.96 ? 39 TYR A CD1 1 ATOM 331 C CD2 . TYR A 1 39 ? 14.259 68.543 -14.680 1.00 1.16 ? 39 TYR A CD2 1 ATOM 332 C CE1 . TYR A 1 39 ? 14.052 68.409 -17.431 1.00 1.45 ? 39 TYR A CE1 1 ATOM 333 C CE2 . TYR A 1 39 ? 15.374 68.795 -15.479 1.00 1.58 ? 39 TYR A CE2 1 ATOM 334 C CZ . TYR A 1 39 ? 15.258 68.727 -16.855 1.00 1.38 ? 39 TYR A CZ 1 ATOM 335 O OH . TYR A 1 39 ? 16.342 68.976 -17.666 1.00 1.98 ? 39 TYR A OH 1 ATOM 336 N N . ASN A 1 40 ? 12.622 70.858 -13.326 1.00 4.16 ? 40 ASN A N 1 ATOM 337 C CA . ASN A 1 40 ? 12.663 72.278 -13.654 1.00 5.84 ? 40 ASN A CA 1 ATOM 338 C C . ASN A 1 40 ? 13.558 72.383 -14.875 1.00 6.41 ? 40 ASN A C 1 ATOM 339 O O . ASN A 1 40 ? 14.764 72.567 -14.768 1.00 5.96 ? 40 ASN A O 1 ATOM 340 C CB . ASN A 1 40 ? 13.253 73.105 -12.510 1.00 6.83 ? 40 ASN A CB 1 ATOM 341 C CG . ASN A 1 40 ? 13.563 74.536 -12.929 1.00 7.36 ? 40 ASN A CG 1 ATOM 342 O OD1 . ASN A 1 40 ? 13.013 75.040 -13.912 1.00 8.24 ? 40 ASN A OD1 1 ATOM 343 N ND2 . ASN A 1 40 ? 14.436 75.198 -12.181 1.00 6.61 ? 40 ASN A ND2 1 ATOM 344 N N . PRO A 1 41 ? 12.967 72.278 -16.061 1.00 7.55 ? 41 PRO A N 1 ATOM 345 C CA . PRO A 1 41 ? 13.701 72.346 -17.320 1.00 8.18 ? 41 PRO A CA 1 ATOM 346 C C . PRO A 1 41 ? 14.502 73.620 -17.542 1.00 8.65 ? 41 PRO A C 1 ATOM 347 O O . PRO A 1 41 ? 15.174 73.747 -18.561 1.00 8.43 ? 41 PRO A O 1 ATOM 348 C CB . PRO A 1 41 ? 12.593 72.185 -18.354 1.00 8.41 ? 41 PRO A CB 1 ATOM 349 C CG . PRO A 1 41 ? 11.478 72.948 -17.725 1.00 7.80 ? 41 PRO A CG 1 ATOM 350 C CD . PRO A 1 41 ? 11.520 72.407 -16.305 1.00 8.32 ? 41 PRO A CD 1 ATOM 351 N N . TYR A 1 42 ? 14.462 74.556 -16.603 1.00 9.46 ? 42 TYR A N 1 ATOM 352 C CA . TYR A 1 42 ? 15.181 75.802 -16.830 1.00 11.42 ? 42 TYR A CA 1 ATOM 353 C C . TYR A 1 42 ? 16.403 76.142 -15.969 1.00 12.43 ? 42 TYR A C 1 ATOM 354 O O . TYR A 1 42 ? 17.247 76.932 -16.402 1.00 14.48 ? 42 TYR A O 1 ATOM 355 C CB . TYR A 1 42 ? 14.181 76.962 -16.804 1.00 12.12 ? 42 TYR A CB 1 ATOM 356 C CG . TYR A 1 42 ? 13.070 76.813 -17.827 1.00 12.82 ? 42 TYR A CG 1 ATOM 357 C CD1 . TYR A 1 42 ? 11.734 76.956 -17.462 1.00 13.22 ? 42 TYR A CD1 1 ATOM 358 C CD2 . TYR A 1 42 ? 13.357 76.521 -19.158 1.00 13.95 ? 42 TYR A CD2 1 ATOM 359 C CE1 . TYR A 1 42 ? 10.710 76.808 -18.395 1.00 14.02 ? 42 TYR A CE1 1 ATOM 360 C CE2 . TYR A 1 42 ? 12.340 76.373 -20.103 1.00 14.96 ? 42 TYR A CE2 1 ATOM 361 C CZ . TYR A 1 42 ? 11.018 76.517 -19.714 1.00 15.11 ? 42 TYR A CZ 1 ATOM 362 O OH . TYR A 1 42 ? 10.008 76.361 -20.646 1.00 16.70 ? 42 TYR A OH 1 ATOM 363 N N . ALA A 1 43 ? 16.515 75.560 -14.773 1.00 11.83 ? 43 ALA A N 1 ATOM 364 C CA . ALA A 1 43 ? 17.662 75.839 -13.899 1.00 10.29 ? 43 ALA A CA 1 ATOM 365 C C . ALA A 1 43 ? 18.097 74.659 -13.021 1.00 9.21 ? 43 ALA A C 1 ATOM 366 O O . ALA A 1 43 ? 17.637 73.531 -13.194 1.00 10.25 ? 43 ALA A O 1 ATOM 367 C CB . ALA A 1 43 ? 17.355 77.043 -13.024 1.00 11.19 ? 43 ALA A CB 1 ATOM 368 N N . ALA A 1 44 ? 18.997 74.920 -12.082 1.00 7.10 ? 44 ALA A N 1 ATOM 369 C CA . ALA A 1 44 ? 19.464 73.872 -11.190 1.00 5.00 ? 44 ALA A CA 1 ATOM 370 C C . ALA A 1 44 ? 18.927 74.162 -9.808 1.00 4.93 ? 44 ALA A C 1 ATOM 371 O O . ALA A 1 44 ? 19.550 73.841 -8.797 1.00 4.60 ? 44 ALA A O 1 ATOM 372 C CB . ALA A 1 44 ? 20.970 73.837 -11.163 1.00 5.46 ? 44 ALA A CB 1 ATOM 373 N N . THR A 1 45 ? 17.758 74.784 -9.773 1.00 5.18 ? 45 THR A N 1 ATOM 374 C CA . THR A 1 45 ? 17.116 75.134 -8.518 1.00 6.80 ? 45 THR A CA 1 ATOM 375 C C . THR A 1 45 ? 15.639 75.089 -8.735 1.00 6.17 ? 45 THR A C 1 ATOM 376 O O . THR A 1 45 ? 15.180 75.214 -9.859 1.00 4.81 ? 45 THR A O 1 ATOM 377 C CB . THR A 1 45 ? 17.432 76.557 -8.103 1.00 9.13 ? 45 THR A CB 1 ATOM 378 O OG1 . THR A 1 45 ? 17.056 77.446 -9.170 1.00 9.41 ? 45 THR A OG1 1 ATOM 379 C CG2 . THR A 1 45 ? 18.915 76.704 -7.775 1.00 10.54 ? 45 THR A CG2 1 ATOM 380 N N . PHE A 1 46 ? 14.888 74.938 -7.657 1.00 7.26 ? 46 PHE A N 1 ATOM 381 C CA . PHE A 1 46 ? 13.446 74.900 -7.786 1.00 9.50 ? 46 PHE A CA 1 ATOM 382 C C . PHE A 1 46 ? 13.015 76.148 -8.544 1.00 11.08 ? 46 PHE A C 1 ATOM 383 O O . PHE A 1 46 ? 13.697 77.174 -8.483 1.00 10.81 ? 46 PHE A O 1 ATOM 384 C CB . PHE A 1 46 ? 12.790 74.886 -6.424 1.00 9.76 ? 46 PHE A CB 1 ATOM 385 C CG . PHE A 1 46 ? 11.414 74.331 -6.441 1.00 9.14 ? 46 PHE A CG 1 ATOM 386 C CD1 . PHE A 1 46 ? 11.211 72.969 -6.574 1.00 10.28 ? 46 PHE A CD1 1 ATOM 387 C CD2 . PHE A 1 46 ? 10.318 75.165 -6.322 1.00 9.10 ? 46 PHE A CD2 1 ATOM 388 C CE1 . PHE A 1 46 ? 9.930 72.440 -6.584 1.00 11.71 ? 46 PHE A CE1 1 ATOM 389 C CE2 . PHE A 1 46 ? 9.032 74.650 -6.331 1.00 10.16 ? 46 PHE A CE2 1 ATOM 390 C CZ . PHE A 1 46 ? 8.835 73.285 -6.462 1.00 10.72 ? 46 PHE A CZ 1 ATOM 391 N N . GLY A 1 47 ? 11.888 76.057 -9.253 1.00 12.74 ? 47 GLY A N 1 ATOM 392 C CA . GLY A 1 47 ? 11.403 77.183 -10.042 1.00 14.66 ? 47 GLY A CA 1 ATOM 393 C C . GLY A 1 47 ? 9.893 77.324 -10.117 1.00 15.28 ? 47 GLY A C 1 ATOM 394 O O . GLY A 1 47 ? 9.158 76.513 -9.553 1.00 16.80 ? 47 GLY A O 1 ATOM 395 N N . ASP A 1 48 ? 9.422 78.345 -10.828 1.00 14.80 ? 48 ASP A N 1 ATOM 396 C CA . ASP A 1 48 ? 7.986 78.587 -10.931 1.00 13.94 ? 48 ASP A CA 1 ATOM 397 C C . ASP A 1 48 ? 7.323 77.711 -11.967 1.00 12.04 ? 48 ASP A C 1 ATOM 398 O O . ASP A 1 48 ? 6.100 77.749 -12.131 1.00 11.78 ? 48 ASP A O 1 ATOM 399 C CB . ASP A 1 48 ? 7.721 80.042 -11.282 1.00 16.07 ? 48 ASP A CB 1 ATOM 400 C CG . ASP A 1 48 ? 8.464 80.993 -10.382 1.00 18.84 ? 48 ASP A CG 1 ATOM 401 O OD1 . ASP A 1 48 ? 8.176 81.006 -9.159 1.00 18.28 ? 48 ASP A OD1 1 ATOM 402 O OD2 . ASP A 1 48 ? 9.339 81.722 -10.907 1.00 20.89 ? 48 ASP A OD2 1 ATOM 403 N N . VAL A 1 49 ? 8.132 76.931 -12.671 1.00 9.52 ? 49 VAL A N 1 ATOM 404 C CA . VAL A 1 49 ? 7.608 76.055 -13.696 1.00 8.36 ? 49 VAL A CA 1 ATOM 405 C C . VAL A 1 49 ? 8.188 74.678 -13.509 1.00 8.00 ? 49 VAL A C 1 ATOM 406 O O . VAL A 1 49 ? 9.381 74.484 -13.711 1.00 9.15 ? 49 VAL A O 1 ATOM 407 C CB . VAL A 1 49 ? 7.990 76.548 -15.084 1.00 7.22 ? 49 VAL A CB 1 ATOM 408 C CG1 . VAL A 1 49 ? 7.346 75.690 -16.131 1.00 6.56 ? 49 VAL A CG1 1 ATOM 409 C CG2 . VAL A 1 49 ? 7.554 77.974 -15.258 1.00 9.68 ? 49 VAL A CG2 1 ATOM 410 N N . ILE A 1 50 ? 7.344 73.721 -13.135 1.00 7.34 ? 50 ILE A N 1 ATOM 411 C CA . ILE A 1 50 ? 7.793 72.351 -12.918 1.00 6.70 ? 50 ILE A CA 1 ATOM 412 C C . ILE A 1 50 ? 7.035 71.331 -13.753 1.00 5.07 ? 50 ILE A C 1 ATOM 413 O O . ILE A 1 50 ? 5.816 71.222 -13.651 1.00 6.10 ? 50 ILE A O 1 ATOM 414 C CB . ILE A 1 50 ? 7.617 71.949 -11.466 1.00 6.56 ? 50 ILE A CB 1 ATOM 415 C CG1 . ILE A 1 50 ? 8.351 72.938 -10.566 1.00 7.91 ? 50 ILE A CG1 1 ATOM 416 C CG2 . ILE A 1 50 ? 8.107 70.530 -11.273 1.00 7.15 ? 50 ILE A CG2 1 ATOM 417 C CD1 . ILE A 1 50 ? 9.846 72.991 -10.807 1.00 8.55 ? 50 ILE A CD1 1 ATOM 418 N N . ILE A 1 51 ? 7.751 70.565 -14.561 1.00 3.01 ? 51 ILE A N 1 ATOM 419 C CA . ILE A 1 51 ? 7.100 69.558 -15.374 1.00 1.84 ? 51 ILE A CA 1 ATOM 420 C C . ILE A 1 51 ? 7.479 68.177 -14.891 1.00 2.01 ? 51 ILE A C 1 ATOM 421 O O . ILE A 1 51 ? 8.264 68.035 -13.956 1.00 3.30 ? 51 ILE A O 1 ATOM 422 C CB . ILE A 1 51 ? 7.495 69.693 -16.829 1.00 0.96 ? 51 ILE A CB 1 ATOM 423 C CG1 . ILE A 1 51 ? 9.015 69.645 -16.961 1.00 0.96 ? 51 ILE A CG1 1 ATOM 424 C CG2 . ILE A 1 51 ? 6.936 70.974 -17.375 1.00 1.00 ? 51 ILE A CG2 1 ATOM 425 C CD1 . ILE A 1 51 ? 9.517 69.857 -18.374 1.00 0.96 ? 51 ILE A CD1 1 ATOM 426 N N . TRP A 1 52 ? 6.915 67.160 -15.529 1.00 1.64 ? 52 TRP A N 1 ATOM 427 C CA . TRP A 1 52 ? 7.187 65.781 -15.171 1.00 0.96 ? 52 TRP A CA 1 ATOM 428 C C . TRP A 1 52 ? 8.248 65.170 -16.058 1.00 0.96 ? 52 TRP A C 1 ATOM 429 O O . TRP A 1 52 ? 8.043 64.990 -17.253 1.00 0.96 ? 52 TRP A O 1 ATOM 430 C CB . TRP A 1 52 ? 5.912 64.959 -15.283 1.00 0.96 ? 52 TRP A CB 1 ATOM 431 C CG . TRP A 1 52 ? 5.055 65.027 -14.087 1.00 0.96 ? 52 TRP A CG 1 ATOM 432 C CD1 . TRP A 1 52 ? 4.800 66.119 -13.320 1.00 0.97 ? 52 TRP A CD1 1 ATOM 433 C CD2 . TRP A 1 52 ? 4.319 63.955 -13.514 1.00 0.96 ? 52 TRP A CD2 1 ATOM 434 N NE1 . TRP A 1 52 ? 3.948 65.795 -12.298 1.00 0.96 ? 52 TRP A NE1 1 ATOM 435 C CE2 . TRP A 1 52 ? 3.637 64.468 -12.395 1.00 0.96 ? 52 TRP A CE2 1 ATOM 436 C CE3 . TRP A 1 52 ? 4.169 62.603 -13.837 1.00 0.96 ? 52 TRP A CE3 1 ATOM 437 C CZ2 . TRP A 1 52 ? 2.818 63.681 -11.594 1.00 1.13 ? 52 TRP A CZ2 1 ATOM 438 C CZ3 . TRP A 1 52 ? 3.355 61.814 -13.042 1.00 1.14 ? 52 TRP A CZ3 1 ATOM 439 C CH2 . TRP A 1 52 ? 2.688 62.357 -11.929 1.00 1.77 ? 52 TRP A CH2 1 ATOM 440 N N . GLY A 1 53 ? 9.396 64.865 -15.476 1.00 0.96 ? 53 GLY A N 1 ATOM 441 C CA . GLY A 1 53 ? 10.447 64.241 -16.255 1.00 1.70 ? 53 GLY A CA 1 ATOM 442 C C . GLY A 1 53 ? 9.999 62.825 -16.562 1.00 2.06 ? 53 GLY A C 1 ATOM 443 O O . GLY A 1 53 ? 9.145 62.281 -15.856 1.00 2.43 ? 53 GLY A O 1 ATOM 444 N N . HIS A 1 54 ? 10.582 62.213 -17.587 1.00 2.06 ? 54 HIS A N 1 ATOM 445 C CA . HIS A 1 54 ? 10.194 60.862 -17.979 1.00 1.97 ? 54 HIS A CA 1 ATOM 446 C C . HIS A 1 54 ? 11.422 60.049 -18.390 1.00 2.93 ? 54 HIS A C 1 ATOM 447 O O . HIS A 1 54 ? 12.366 60.577 -18.979 1.00 3.35 ? 54 HIS A O 1 ATOM 448 C CB . HIS A 1 54 ? 9.182 60.978 -19.128 1.00 1.41 ? 54 HIS A CB 1 ATOM 449 C CG . HIS A 1 54 ? 8.482 59.704 -19.480 1.00 0.96 ? 54 HIS A CG 1 ATOM 450 N ND1 . HIS A 1 54 ? 8.411 58.624 -18.629 1.00 2.01 ? 54 HIS A ND1 1 ATOM 451 C CD2 . HIS A 1 54 ? 7.797 59.351 -20.593 1.00 0.96 ? 54 HIS A CD2 1 ATOM 452 C CE1 . HIS A 1 54 ? 7.717 57.657 -19.203 1.00 0.96 ? 54 HIS A CE1 1 ATOM 453 N NE2 . HIS A 1 54 ? 7.333 58.073 -20.395 1.00 0.96 ? 54 HIS A NE2 1 ATOM 454 N N . ALA A 1 55 ? 11.415 58.766 -18.051 1.00 4.08 ? 55 ALA A N 1 ATOM 455 C CA . ALA A 1 55 ? 12.518 57.868 -18.393 1.00 4.49 ? 55 ALA A CA 1 ATOM 456 C C . ALA A 1 55 ? 12.078 56.419 -18.204 1.00 3.98 ? 55 ALA A C 1 ATOM 457 O O . ALA A 1 55 ? 11.310 56.114 -17.295 1.00 4.32 ? 55 ALA A O 1 ATOM 458 C CB . ALA A 1 55 ? 13.732 58.168 -17.520 1.00 5.68 ? 55 ALA A CB 1 ATOM 459 N N . VAL A 1 56 ? 12.561 55.528 -19.062 1.00 3.20 ? 56 VAL A N 1 ATOM 460 C CA . VAL A 1 56 ? 12.187 54.124 -18.968 1.00 2.84 ? 56 VAL A CA 1 ATOM 461 C C . VAL A 1 56 ? 13.340 53.165 -18.737 1.00 2.46 ? 56 VAL A C 1 ATOM 462 O O . VAL A 1 56 ? 14.496 53.472 -19.046 1.00 2.76 ? 56 VAL A O 1 ATOM 463 C CB . VAL A 1 56 ? 11.447 53.676 -20.216 1.00 2.78 ? 56 VAL A CB 1 ATOM 464 C CG1 . VAL A 1 56 ? 9.971 53.649 -19.939 1.00 5.03 ? 56 VAL A CG1 1 ATOM 465 C CG2 . VAL A 1 56 ? 11.738 54.626 -21.347 1.00 2.55 ? 56 VAL A CG2 1 ATOM 466 N N . SER A 1 57 ? 13.009 51.998 -18.192 1.00 0.96 ? 57 SER A N 1 ATOM 467 C CA . SER A 1 57 ? 14.003 50.980 -17.903 1.00 1.70 ? 57 SER A CA 1 ATOM 468 C C . SER A 1 57 ? 13.403 49.590 -17.986 1.00 2.07 ? 57 SER A C 1 ATOM 469 O O . SER A 1 57 ? 12.224 49.399 -17.708 1.00 2.04 ? 57 SER A O 1 ATOM 470 C CB . SER A 1 57 ? 14.568 51.195 -16.503 1.00 1.23 ? 57 SER A CB 1 ATOM 471 O OG . SER A 1 57 ? 15.493 50.177 -16.171 1.00 2.11 ? 57 SER A OG 1 ATOM 472 N N . TYR A 1 58 ? 14.213 48.616 -18.377 1.00 3.10 ? 58 TYR A N 1 ATOM 473 C CA . TYR A 1 58 ? 13.731 47.242 -18.451 1.00 5.11 ? 58 TYR A CA 1 ATOM 474 C C . TYR A 1 58 ? 14.132 46.491 -17.179 1.00 5.07 ? 58 TYR A C 1 ATOM 475 O O . TYR A 1 58 ? 13.778 45.321 -17.006 1.00 5.54 ? 58 TYR A O 1 ATOM 476 C CB . TYR A 1 58 ? 14.323 46.514 -19.666 1.00 6.60 ? 58 TYR A CB 1 ATOM 477 C CG . TYR A 1 58 ? 13.762 46.943 -21.004 1.00 10.40 ? 58 TYR A CG 1 ATOM 478 C CD1 . TYR A 1 58 ? 12.400 46.818 -21.285 1.00 12.73 ? 58 TYR A CD1 1 ATOM 479 C CD2 . TYR A 1 58 ? 14.591 47.479 -21.996 1.00 12.04 ? 58 TYR A CD2 1 ATOM 480 C CE1 . TYR A 1 58 ? 11.871 47.222 -22.523 1.00 14.28 ? 58 TYR A CE1 1 ATOM 481 C CE2 . TYR A 1 58 ? 14.075 47.888 -23.236 1.00 13.57 ? 58 TYR A CE2 1 ATOM 482 C CZ . TYR A 1 58 ? 12.713 47.759 -23.490 1.00 14.90 ? 58 TYR A CZ 1 ATOM 483 O OH . TYR A 1 58 ? 12.184 48.189 -24.691 1.00 15.97 ? 58 TYR A OH 1 ATOM 484 N N . ASP A 1 59 ? 14.854 47.172 -16.286 1.00 3.97 ? 59 ASP A N 1 ATOM 485 C CA . ASP A 1 59 ? 15.338 46.550 -15.055 1.00 3.13 ? 59 ASP A CA 1 ATOM 486 C C . ASP A 1 59 ? 15.576 47.485 -13.857 1.00 4.08 ? 59 ASP A C 1 ATOM 487 O O . ASP A 1 59 ? 16.293 47.125 -12.922 1.00 3.92 ? 59 ASP A O 1 ATOM 488 C CB . ASP A 1 59 ? 16.639 45.830 -15.357 1.00 2.70 ? 59 ASP A CB 1 ATOM 489 C CG . ASP A 1 59 ? 17.639 46.728 -16.051 1.00 2.99 ? 59 ASP A CG 1 ATOM 490 O OD1 . ASP A 1 59 ? 17.824 47.873 -15.588 1.00 4.42 ? 59 ASP A OD1 1 ATOM 491 O OD2 . ASP A 1 59 ? 18.242 46.297 -17.055 1.00 4.72 ? 59 ASP A OD2 1 ATOM 492 N N . LEU A 1 60 ? 14.989 48.678 -13.881 1.00 3.98 ? 60 LEU A N 1 ATOM 493 C CA . LEU A 1 60 ? 15.153 49.631 -12.787 1.00 2.02 ? 60 LEU A CA 1 ATOM 494 C C . LEU A 1 60 ? 16.599 50.075 -12.562 1.00 1.59 ? 60 LEU A C 1 ATOM 495 O O . LEU A 1 60 ? 16.873 50.859 -11.653 1.00 2.14 ? 60 LEU A O 1 ATOM 496 C CB . LEU A 1 60 ? 14.585 49.049 -11.485 1.00 0.96 ? 60 LEU A CB 1 ATOM 497 C CG . LEU A 1 60 ? 13.067 49.092 -11.279 1.00 0.96 ? 60 LEU A CG 1 ATOM 498 C CD1 . LEU A 1 60 ? 12.493 47.712 -11.345 1.00 0.96 ? 60 LEU A CD1 1 ATOM 499 C CD2 . LEU A 1 60 ? 12.760 49.679 -9.930 1.00 0.96 ? 60 LEU A CD2 1 ATOM 500 N N . VAL A 1 61 ? 17.528 49.605 -13.387 1.00 1.34 ? 61 VAL A N 1 ATOM 501 C CA . VAL A 1 61 ? 18.928 49.991 -13.209 1.00 3.00 ? 61 VAL A CA 1 ATOM 502 C C . VAL A 1 61 ? 19.477 50.850 -14.333 1.00 3.82 ? 61 VAL A C 1 ATOM 503 O O . VAL A 1 61 ? 20.070 51.902 -14.081 1.00 3.35 ? 61 VAL A O 1 ATOM 504 C CB . VAL A 1 61 ? 19.854 48.761 -13.080 1.00 3.27 ? 61 VAL A CB 1 ATOM 505 C CG1 . VAL A 1 61 ? 21.296 49.221 -12.908 1.00 1.65 ? 61 VAL A CG1 1 ATOM 506 C CG2 . VAL A 1 61 ? 19.420 47.901 -11.905 1.00 3.18 ? 61 VAL A CG2 1 ATOM 507 N N . ASN A 1 62 ? 19.290 50.367 -15.563 1.00 5.05 ? 62 ASN A N 1 ATOM 508 C CA . ASN A 1 62 ? 19.746 51.027 -16.790 1.00 5.71 ? 62 ASN A CA 1 ATOM 509 C C . ASN A 1 62 ? 18.567 51.760 -17.417 1.00 4.52 ? 62 ASN A C 1 ATOM 510 O O . ASN A 1 62 ? 17.581 51.133 -17.819 1.00 5.17 ? 62 ASN A O 1 ATOM 511 C CB . ASN A 1 62 ? 20.271 49.986 -17.783 1.00 8.51 ? 62 ASN A CB 1 ATOM 512 C CG . ASN A 1 62 ? 21.333 49.087 -17.182 1.00 10.73 ? 62 ASN A CG 1 ATOM 513 O OD1 . ASN A 1 62 ? 22.426 49.544 -16.832 1.00 12.74 ? 62 ASN A OD1 1 ATOM 514 N ND2 . ASN A 1 62 ? 21.017 47.799 -17.054 1.00 11.27 ? 62 ASN A ND2 1 ATOM 515 N N . TRP A 1 63 ? 18.685 53.076 -17.542 1.00 2.21 ? 63 TRP A N 1 ATOM 516 C CA . TRP A 1 63 ? 17.594 53.874 -18.070 1.00 1.25 ? 63 TRP A CA 1 ATOM 517 C C . TRP A 1 63 ? 17.753 54.549 -19.406 1.00 0.96 ? 63 TRP A C 1 ATOM 518 O O . TRP A 1 63 ? 18.836 54.593 -19.973 1.00 1.20 ? 63 TRP A O 1 ATOM 519 C CB . TRP A 1 63 ? 17.238 54.942 -17.063 1.00 1.45 ? 63 TRP A CB 1 ATOM 520 C CG . TRP A 1 63 ? 16.860 54.394 -15.772 1.00 0.96 ? 63 TRP A CG 1 ATOM 521 C CD1 . TRP A 1 63 ? 17.688 53.971 -14.790 1.00 0.96 ? 63 TRP A CD1 1 ATOM 522 C CD2 . TRP A 1 63 ? 15.533 54.181 -15.308 1.00 1.33 ? 63 TRP A CD2 1 ATOM 523 N NE1 . TRP A 1 63 ? 16.959 53.506 -13.728 1.00 2.54 ? 63 TRP A NE1 1 ATOM 524 C CE2 . TRP A 1 63 ? 15.627 53.625 -14.023 1.00 1.86 ? 63 TRP A CE2 1 ATOM 525 C CE3 . TRP A 1 63 ? 14.268 54.408 -15.857 1.00 2.09 ? 63 TRP A CE3 1 ATOM 526 C CZ2 . TRP A 1 63 ? 14.504 53.288 -13.274 1.00 2.59 ? 63 TRP A CZ2 1 ATOM 527 C CZ3 . TRP A 1 63 ? 13.155 54.074 -15.117 1.00 2.54 ? 63 TRP A CZ3 1 ATOM 528 C CH2 . TRP A 1 63 ? 13.279 53.521 -13.836 1.00 2.45 ? 63 TRP A CH2 1 ATOM 529 N N . ILE A 1 64 ? 16.636 55.093 -19.883 1.00 1.03 ? 64 ILE A N 1 ATOM 530 C CA . ILE A 1 64 ? 16.571 55.831 -21.138 1.00 1.49 ? 64 ILE A CA 1 ATOM 531 C C . ILE A 1 64 ? 15.737 57.094 -20.921 1.00 2.73 ? 64 ILE A C 1 ATOM 532 O O . ILE A 1 64 ? 14.529 57.013 -20.698 1.00 3.05 ? 64 ILE A O 1 ATOM 533 C CB . ILE A 1 64 ? 15.892 55.044 -22.234 1.00 0.96 ? 64 ILE A CB 1 ATOM 534 C CG1 . ILE A 1 64 ? 16.687 53.792 -22.559 1.00 1.00 ? 64 ILE A CG1 1 ATOM 535 C CG2 . ILE A 1 64 ? 15.769 55.905 -23.447 1.00 0.96 ? 64 ILE A CG2 1 ATOM 536 C CD1 . ILE A 1 64 ? 16.085 52.987 -23.679 1.00 2.43 ? 64 ILE A CD1 1 ATOM 537 N N . HIS A 1 65 ? 16.376 58.258 -20.987 1.00 2.91 ? 65 HIS A N 1 ATOM 538 C CA . HIS A 1 65 ? 15.675 59.516 -20.776 1.00 2.90 ? 65 HIS A CA 1 ATOM 539 C C . HIS A 1 65 ? 14.785 59.843 -21.963 1.00 3.88 ? 65 HIS A C 1 ATOM 540 O O . HIS A 1 65 ? 15.225 59.760 -23.103 1.00 4.76 ? 65 HIS A O 1 ATOM 541 C CB . HIS A 1 65 ? 16.676 60.653 -20.586 1.00 2.58 ? 65 HIS A CB 1 ATOM 542 C CG . HIS A 1 65 ? 17.574 60.489 -19.402 1.00 0.96 ? 65 HIS A CG 1 ATOM 543 N ND1 . HIS A 1 65 ? 17.095 60.335 -18.120 1.00 1.19 ? 65 HIS A ND1 1 ATOM 544 C CD2 . HIS A 1 65 ? 18.925 60.496 -19.303 1.00 0.96 ? 65 HIS A CD2 1 ATOM 545 C CE1 . HIS A 1 65 ? 18.114 60.254 -17.281 1.00 2.31 ? 65 HIS A CE1 1 ATOM 546 N NE2 . HIS A 1 65 ? 19.236 60.350 -17.973 1.00 0.96 ? 65 HIS A NE2 1 ATOM 547 N N . LEU A 1 66 ? 13.538 60.223 -21.691 1.00 4.73 ? 66 LEU A N 1 ATOM 548 C CA . LEU A 1 66 ? 12.588 60.582 -22.746 1.00 5.34 ? 66 LEU A CA 1 ATOM 549 C C . LEU A 1 66 ? 12.193 62.050 -22.596 1.00 6.28 ? 66 LEU A C 1 ATOM 550 O O . LEU A 1 66 ? 12.594 62.710 -21.640 1.00 6.25 ? 66 LEU A O 1 ATOM 551 C CB . LEU A 1 66 ? 11.330 59.713 -22.643 1.00 4.31 ? 66 LEU A CB 1 ATOM 552 C CG . LEU A 1 66 ? 11.475 58.186 -22.632 1.00 3.84 ? 66 LEU A CG 1 ATOM 553 C CD1 . LEU A 1 66 ? 10.112 57.545 -22.521 1.00 3.44 ? 66 LEU A CD1 1 ATOM 554 C CD2 . LEU A 1 66 ? 12.151 57.712 -23.894 1.00 2.94 ? 66 LEU A CD2 1 ATOM 555 N N . ASP A 1 67 ? 11.416 62.572 -23.540 1.00 7.60 ? 67 ASP A N 1 ATOM 556 C CA . ASP A 1 67 ? 10.964 63.960 -23.427 1.00 8.41 ? 67 ASP A CA 1 ATOM 557 C C . ASP A 1 67 ? 10.015 64.022 -22.243 1.00 7.13 ? 67 ASP A C 1 ATOM 558 O O . ASP A 1 67 ? 9.356 63.036 -21.919 1.00 7.67 ? 67 ASP A O 1 ATOM 559 C CB . ASP A 1 67 ? 10.189 64.406 -24.670 1.00 11.49 ? 67 ASP A CB 1 ATOM 560 C CG . ASP A 1 67 ? 11.083 64.680 -25.848 1.00 14.35 ? 67 ASP A CG 1 ATOM 561 O OD1 . ASP A 1 67 ? 12.124 65.353 -25.644 1.00 17.24 ? 67 ASP A OD1 1 ATOM 562 O OD2 . ASP A 1 67 ? 10.734 64.239 -26.969 1.00 13.92 ? 67 ASP A OD2 1 ATOM 563 N N . PRO A 1 68 ? 9.914 65.185 -21.594 1.00 5.97 ? 68 PRO A N 1 ATOM 564 C CA . PRO A 1 68 ? 9.010 65.305 -20.446 1.00 5.23 ? 68 PRO A CA 1 ATOM 565 C C . PRO A 1 68 ? 7.596 64.846 -20.839 1.00 4.98 ? 68 PRO A C 1 ATOM 566 O O . PRO A 1 68 ? 7.124 65.122 -21.941 1.00 5.45 ? 68 PRO A O 1 ATOM 567 C CB . PRO A 1 68 ? 9.105 66.784 -20.092 1.00 4.82 ? 68 PRO A CB 1 ATOM 568 C CG . PRO A 1 68 ? 9.390 67.422 -21.414 1.00 6.25 ? 68 PRO A CG 1 ATOM 569 C CD . PRO A 1 68 ? 10.406 66.500 -22.024 1.00 5.74 ? 68 PRO A CD 1 ATOM 570 N N . ALA A 1 69 ? 6.934 64.133 -19.937 1.00 4.46 ? 69 ALA A N 1 ATOM 571 C CA . ALA A 1 69 ? 5.612 63.585 -20.207 1.00 3.86 ? 69 ALA A CA 1 ATOM 572 C C . ALA A 1 69 ? 4.479 64.539 -19.946 1.00 4.02 ? 69 ALA A C 1 ATOM 573 O O . ALA A 1 69 ? 3.806 64.983 -20.871 1.00 5.34 ? 69 ALA A O 1 ATOM 574 C CB . ALA A 1 69 ? 5.404 62.321 -19.395 1.00 3.51 ? 69 ALA A CB 1 ATOM 575 N N . ILE A 1 70 ? 4.252 64.832 -18.675 1.00 4.14 ? 70 ILE A N 1 ATOM 576 C CA . ILE A 1 70 ? 3.182 65.732 -18.288 1.00 4.06 ? 70 ILE A CA 1 ATOM 577 C C . ILE A 1 70 ? 3.698 67.129 -18.033 1.00 4.27 ? 70 ILE A C 1 ATOM 578 O O . ILE A 1 70 ? 4.491 67.347 -17.130 1.00 3.66 ? 70 ILE A O 1 ATOM 579 C CB . ILE A 1 70 ? 2.474 65.223 -17.030 1.00 3.81 ? 70 ILE A CB 1 ATOM 580 C CG1 . ILE A 1 70 ? 1.762 63.910 -17.363 1.00 3.82 ? 70 ILE A CG1 1 ATOM 581 C CG2 . ILE A 1 70 ? 1.514 66.275 -16.500 1.00 1.91 ? 70 ILE A CG2 1 ATOM 582 C CD1 . ILE A 1 70 ? 0.883 63.380 -16.255 1.00 4.83 ? 70 ILE A CD1 1 ATOM 583 N N . TYR A 1 71 ? 3.247 68.071 -18.846 1.00 6.16 ? 71 TYR A N 1 ATOM 584 C CA . TYR A 1 71 ? 3.649 69.463 -18.708 1.00 7.39 ? 71 TYR A CA 1 ATOM 585 C C . TYR A 1 71 ? 2.393 70.300 -18.826 1.00 8.19 ? 71 TYR A C 1 ATOM 586 O O . TYR A 1 71 ? 1.400 69.850 -19.401 1.00 9.33 ? 71 TYR A O 1 ATOM 587 C CB . TYR A 1 71 ? 4.642 69.832 -19.804 1.00 8.34 ? 71 TYR A CB 1 ATOM 588 C CG . TYR A 1 71 ? 4.243 69.345 -21.174 1.00 10.36 ? 71 TYR A CG 1 ATOM 589 C CD1 . TYR A 1 71 ? 3.454 70.123 -22.012 1.00 10.20 ? 71 TYR A CD1 1 ATOM 590 C CD2 . TYR A 1 71 ? 4.672 68.104 -21.639 1.00 11.63 ? 71 TYR A CD2 1 ATOM 591 C CE1 . TYR A 1 71 ? 3.110 69.678 -23.284 1.00 11.86 ? 71 TYR A CE1 1 ATOM 592 C CE2 . TYR A 1 71 ? 4.329 67.649 -22.909 1.00 12.95 ? 71 TYR A CE2 1 ATOM 593 C CZ . TYR A 1 71 ? 3.551 68.442 -23.727 1.00 12.58 ? 71 TYR A CZ 1 ATOM 594 O OH . TYR A 1 71 ? 3.226 68.005 -24.992 1.00 15.05 ? 71 TYR A OH 1 ATOM 595 N N . PRO A 1 72 ? 2.411 71.522 -18.274 1.00 7.93 ? 72 PRO A N 1 ATOM 596 C CA . PRO A 1 72 ? 1.257 72.425 -18.318 1.00 8.02 ? 72 PRO A CA 1 ATOM 597 C C . PRO A 1 72 ? 0.769 72.707 -19.741 1.00 9.43 ? 72 PRO A C 1 ATOM 598 O O . PRO A 1 72 ? 1.521 73.208 -20.588 1.00 8.85 ? 72 PRO A O 1 ATOM 599 C CB . PRO A 1 72 ? 1.776 73.674 -17.611 1.00 6.81 ? 72 PRO A CB 1 ATOM 600 C CG . PRO A 1 72 ? 3.224 73.662 -17.948 1.00 7.24 ? 72 PRO A CG 1 ATOM 601 C CD . PRO A 1 72 ? 3.586 72.216 -17.726 1.00 7.43 ? 72 PRO A CD 1 ATOM 602 N N . THR A 1 73 ? -0.493 72.365 -19.999 1.00 10.69 ? 73 THR A N 1 ATOM 603 C CA . THR A 1 73 ? -1.087 72.578 -21.317 1.00 11.65 ? 73 THR A CA 1 ATOM 604 C C . THR A 1 73 ? -2.449 73.233 -21.186 1.00 11.85 ? 73 THR A C 1 ATOM 605 O O . THR A 1 73 ? -2.885 73.963 -22.074 1.00 12.73 ? 73 THR A O 1 ATOM 606 C CB . THR A 1 73 ? -1.291 71.254 -22.099 1.00 11.89 ? 73 THR A CB 1 ATOM 607 O OG1 . THR A 1 73 ? -2.449 70.571 -21.600 1.00 11.55 ? 73 THR A OG1 1 ATOM 608 C CG2 . THR A 1 73 ? -0.076 70.356 -21.956 1.00 12.75 ? 73 THR A CG2 1 ATOM 609 N N . GLN A 1 74 ? -3.137 72.964 -20.089 1.00 11.00 ? 74 GLN A N 1 ATOM 610 C CA . GLN A 1 74 ? -4.445 73.558 -19.918 1.00 11.88 ? 74 GLN A CA 1 ATOM 611 C C . GLN A 1 74 ? -4.509 74.379 -18.651 1.00 11.74 ? 74 GLN A C 1 ATOM 612 O O . GLN A 1 74 ? -3.642 74.271 -17.791 1.00 12.54 ? 74 GLN A O 1 ATOM 613 C CB . GLN A 1 74 ? -5.528 72.473 -19.929 1.00 12.99 ? 74 GLN A CB 1 ATOM 614 C CG . GLN A 1 74 ? -5.406 71.427 -18.844 1.00 12.61 ? 74 GLN A CG 1 ATOM 615 C CD . GLN A 1 74 ? -6.269 70.209 -19.118 1.00 12.68 ? 74 GLN A CD 1 ATOM 616 O OE1 . GLN A 1 74 ? -6.525 69.405 -18.222 1.00 12.54 ? 74 GLN A OE1 1 ATOM 617 N NE2 . GLN A 1 74 ? -6.714 70.061 -20.364 1.00 13.03 ? 74 GLN A NE2 1 ATOM 618 N N . GLU A 1 75 ? -5.540 75.206 -18.546 1.00 11.49 ? 75 GLU A N 1 ATOM 619 C CA . GLU A 1 75 ? -5.706 76.072 -17.394 1.00 10.99 ? 75 GLU A CA 1 ATOM 620 C C . GLU A 1 75 ? -5.457 75.332 -16.098 1.00 10.84 ? 75 GLU A C 1 ATOM 621 O O . GLU A 1 75 ? -4.671 75.777 -15.265 1.00 12.30 ? 75 GLU A O 1 ATOM 622 C CB . GLU A 1 75 ? -7.114 76.659 -17.383 1.00 11.94 ? 75 GLU A CB 1 ATOM 623 C CG . GLU A 1 75 ? -7.342 77.772 -16.359 1.00 12.83 ? 75 GLU A CG 1 ATOM 624 C CD . GLU A 1 75 ? -7.559 77.266 -14.937 1.00 13.25 ? 75 GLU A CD 1 ATOM 625 O OE1 . GLU A 1 75 ? -8.269 76.248 -14.763 1.00 14.10 ? 75 GLU A OE1 1 ATOM 626 O OE2 . GLU A 1 75 ? -7.037 77.901 -13.991 1.00 12.08 ? 75 GLU A OE2 1 ATOM 627 N N . ALA A 1 76 ? -6.118 74.194 -15.935 1.00 9.70 ? 76 ALA A N 1 ATOM 628 C CA . ALA A 1 76 ? -5.982 73.407 -14.717 1.00 8.65 ? 76 ALA A CA 1 ATOM 629 C C . ALA A 1 76 ? -4.554 73.156 -14.242 1.00 8.03 ? 76 ALA A C 1 ATOM 630 O O . ALA A 1 76 ? -4.360 72.593 -13.171 1.00 7.37 ? 76 ALA A O 1 ATOM 631 C CB . ALA A 1 76 ? -6.703 72.080 -14.878 1.00 9.15 ? 76 ALA A CB 1 ATOM 632 N N . ASP A 1 77 ? -3.556 73.561 -15.017 1.00 7.55 ? 77 ASP A N 1 ATOM 633 C CA . ASP A 1 77 ? -2.187 73.334 -14.595 1.00 8.28 ? 77 ASP A CA 1 ATOM 634 C C . ASP A 1 77 ? -1.207 74.256 -15.297 1.00 8.57 ? 77 ASP A C 1 ATOM 635 O O . ASP A 1 77 ? -0.051 73.911 -15.529 1.00 9.11 ? 77 ASP A O 1 ATOM 636 C CB . ASP A 1 77 ? -1.818 71.872 -14.843 1.00 9.85 ? 77 ASP A CB 1 ATOM 637 C CG . ASP A 1 77 ? -1.740 71.525 -16.318 1.00 12.11 ? 77 ASP A CG 1 ATOM 638 O OD1 . ASP A 1 77 ? -1.918 72.433 -17.160 1.00 14.31 ? 77 ASP A OD1 1 ATOM 639 O OD2 . ASP A 1 77 ? -1.490 70.341 -16.637 1.00 12.12 ? 77 ASP A OD2 1 ATOM 640 N N . SER A 1 78 ? -1.671 75.451 -15.607 1.00 9.48 ? 78 SER A N 1 ATOM 641 C CA . SER A 1 78 ? -0.859 76.423 -16.318 1.00 12.09 ? 78 SER A CA 1 ATOM 642 C C . SER A 1 78 ? 0.446 76.895 -15.660 1.00 12.94 ? 78 SER A C 1 ATOM 643 O O . SER A 1 78 ? 1.405 77.248 -16.359 1.00 12.96 ? 78 SER A O 1 ATOM 644 C CB . SER A 1 78 ? -1.738 77.626 -16.645 1.00 13.17 ? 78 SER A CB 1 ATOM 645 O OG . SER A 1 78 ? -2.556 77.952 -15.534 1.00 14.45 ? 78 SER A OG 1 ATOM 646 N N . LYS A 1 79 ? 0.489 76.907 -14.330 1.00 13.31 ? 79 LYS A N 1 ATOM 647 C CA . LYS A 1 79 ? 1.681 77.370 -13.620 1.00 13.61 ? 79 LYS A CA 1 ATOM 648 C C . LYS A 1 79 ? 2.751 76.298 -13.409 1.00 12.64 ? 79 LYS A C 1 ATOM 649 O O . LYS A 1 79 ? 3.947 76.602 -13.390 1.00 13.55 ? 79 LYS A O 1 ATOM 650 C CB . LYS A 1 79 ? 1.290 77.950 -12.261 1.00 15.20 ? 79 LYS A CB 1 ATOM 651 C CG . LYS A 1 79 ? 0.419 79.185 -12.321 1.00 16.45 ? 79 LYS A CG 1 ATOM 652 C CD . LYS A 1 79 ? 1.159 80.327 -12.968 1.00 20.53 ? 79 LYS A CD 1 ATOM 653 C CE . LYS A 1 79 ? 0.593 81.662 -12.504 1.00 23.93 ? 79 LYS A CE 1 ATOM 654 N NZ . LYS A 1 79 ? -0.860 81.826 -12.813 1.00 25.41 ? 79 LYS A NZ 1 ATOM 655 N N . SER A 1 80 ? 2.315 75.053 -13.241 1.00 9.95 ? 80 SER A N 1 ATOM 656 C CA . SER A 1 80 ? 3.221 73.932 -13.019 1.00 7.23 ? 80 SER A CA 1 ATOM 657 C C . SER A 1 80 ? 2.433 72.637 -12.868 1.00 6.03 ? 80 SER A C 1 ATOM 658 O O . SER A 1 80 ? 1.237 72.647 -12.551 1.00 5.03 ? 80 SER A O 1 ATOM 659 C CB . SER A 1 80 ? 4.055 74.143 -11.742 1.00 7.34 ? 80 SER A CB 1 ATOM 660 O OG . SER A 1 80 ? 5.189 74.966 -11.950 1.00 7.70 ? 80 SER A OG 1 ATOM 661 N N . CYS A 1 81 ? 3.115 71.521 -13.097 1.00 4.21 ? 81 CYS A N 1 ATOM 662 C CA . CYS A 1 81 ? 2.515 70.208 -12.945 1.00 2.06 ? 81 CYS A CA 1 ATOM 663 C C . CYS A 1 81 ? 3.251 69.585 -11.781 1.00 1.45 ? 81 CYS A C 1 ATOM 664 O O . CYS A 1 81 ? 4.388 69.150 -11.912 1.00 0.96 ? 81 CYS A O 1 ATOM 665 C CB . CYS A 1 81 ? 2.717 69.367 -14.200 1.00 1.11 ? 81 CYS A CB 1 ATOM 666 S SG . CYS A 1 81 ? 1.728 69.885 -15.597 1.00 0.96 ? 81 CYS A SG 1 ATOM 667 N N . TRP A 1 82 ? 2.609 69.566 -10.626 1.00 2.25 ? 82 TRP A N 1 ATOM 668 C CA . TRP A 1 82 ? 3.251 69.010 -9.462 1.00 3.15 ? 82 TRP A CA 1 ATOM 669 C C . TRP A 1 82 ? 3.008 67.519 -9.283 1.00 2.92 ? 82 TRP A C 1 ATOM 670 O O . TRP A 1 82 ? 2.329 66.889 -10.086 1.00 1.87 ? 82 TRP A O 1 ATOM 671 C CB . TRP A 1 82 ? 2.857 69.816 -8.228 1.00 5.91 ? 82 TRP A CB 1 ATOM 672 C CG . TRP A 1 82 ? 3.516 71.185 -8.216 1.00 9.79 ? 82 TRP A CG 1 ATOM 673 C CD1 . TRP A 1 82 ? 4.770 71.494 -8.679 1.00 11.64 ? 82 TRP A CD1 1 ATOM 674 C CD2 . TRP A 1 82 ? 3.011 72.389 -7.612 1.00 10.88 ? 82 TRP A CD2 1 ATOM 675 N NE1 . TRP A 1 82 ? 5.076 72.807 -8.390 1.00 12.61 ? 82 TRP A NE1 1 ATOM 676 C CE2 . TRP A 1 82 ? 4.016 73.376 -7.735 1.00 11.40 ? 82 TRP A CE2 1 ATOM 677 C CE3 . TRP A 1 82 ? 1.810 72.726 -6.975 1.00 11.81 ? 82 TRP A CE3 1 ATOM 678 C CZ2 . TRP A 1 82 ? 3.856 74.673 -7.240 1.00 12.27 ? 82 TRP A CZ2 1 ATOM 679 C CZ3 . TRP A 1 82 ? 1.653 74.023 -6.482 1.00 12.78 ? 82 TRP A CZ3 1 ATOM 680 C CH2 . TRP A 1 82 ? 2.673 74.976 -6.618 1.00 12.47 ? 82 TRP A CH2 1 ATOM 681 N N . SER A 1 83 ? 3.588 66.966 -8.227 1.00 3.00 ? 83 SER A N 1 ATOM 682 C CA . SER A 1 83 ? 3.529 65.539 -7.939 1.00 4.03 ? 83 SER A CA 1 ATOM 683 C C . SER A 1 83 ? 2.194 64.806 -8.051 1.00 4.48 ? 83 SER A C 1 ATOM 684 O O . SER A 1 83 ? 1.132 65.400 -7.882 1.00 6.01 ? 83 SER A O 1 ATOM 685 C CB . SER A 1 83 ? 4.151 65.296 -6.570 1.00 4.46 ? 83 SER A CB 1 ATOM 686 O OG . SER A 1 83 ? 5.524 65.652 -6.598 1.00 5.51 ? 83 SER A OG 1 ATOM 687 N N . GLY A 1 84 ? 2.272 63.504 -8.341 1.00 3.85 ? 84 GLY A N 1 ATOM 688 C CA . GLY A 1 84 ? 1.086 62.675 -8.488 1.00 3.65 ? 84 GLY A CA 1 ATOM 689 C C . GLY A 1 84 ? 1.424 61.191 -8.513 1.00 3.35 ? 84 GLY A C 1 ATOM 690 O O . GLY A 1 84 ? 2.579 60.822 -8.383 1.00 3.55 ? 84 GLY A O 1 ATOM 691 N N . SER A 1 85 ? 0.422 60.337 -8.690 1.00 3.12 ? 85 SER A N 1 ATOM 692 C CA . SER A 1 85 ? 0.634 58.894 -8.718 1.00 2.63 ? 85 SER A CA 1 ATOM 693 C C . SER A 1 85 ? 0.049 58.257 -9.980 1.00 2.51 ? 85 SER A C 1 ATOM 694 O O . SER A 1 85 ? -0.647 58.908 -10.754 1.00 2.66 ? 85 SER A O 1 ATOM 695 C CB . SER A 1 85 ? -0.025 58.253 -7.495 1.00 3.39 ? 85 SER A CB 1 ATOM 696 O OG . SER A 1 85 ? 0.429 58.834 -6.289 1.00 4.40 ? 85 SER A OG 1 ATOM 697 N N . ALA A 1 86 ? 0.319 56.973 -10.176 1.00 2.38 ? 86 ALA A N 1 ATOM 698 C CA . ALA A 1 86 ? -0.202 56.273 -11.341 1.00 1.53 ? 86 ALA A CA 1 ATOM 699 C C . ALA A 1 86 ? -0.990 55.030 -10.931 1.00 1.69 ? 86 ALA A C 1 ATOM 700 O O . ALA A 1 86 ? -0.602 54.324 -10.002 1.00 0.96 ? 86 ALA A O 1 ATOM 701 C CB . ALA A 1 86 ? 0.938 55.895 -12.259 1.00 1.89 ? 86 ALA A CB 1 ATOM 702 N N . THR A 1 87 ? -2.087 54.768 -11.639 1.00 2.49 ? 87 THR A N 1 ATOM 703 C CA . THR A 1 87 ? -2.962 53.624 -11.367 1.00 3.80 ? 87 THR A CA 1 ATOM 704 C C . THR A 1 87 ? -3.395 52.917 -12.652 1.00 5.41 ? 87 THR A C 1 ATOM 705 O O . THR A 1 87 ? -4.028 53.539 -13.502 1.00 6.32 ? 87 THR A O 1 ATOM 706 C CB . THR A 1 87 ? -4.246 54.087 -10.686 1.00 2.92 ? 87 THR A CB 1 ATOM 707 O OG1 . THR A 1 87 ? -3.924 54.950 -9.592 1.00 4.08 ? 87 THR A OG1 1 ATOM 708 C CG2 . THR A 1 87 ? -5.035 52.897 -10.189 1.00 3.61 ? 87 THR A CG2 1 ATOM 709 N N . ILE A 1 88 ? -3.079 51.632 -12.812 1.00 7.39 ? 88 ILE A N 1 ATOM 710 C CA . ILE A 1 88 ? -3.507 50.930 -14.028 1.00 8.81 ? 88 ILE A CA 1 ATOM 711 C C . ILE A 1 88 ? -4.907 50.373 -13.780 1.00 7.88 ? 88 ILE A C 1 ATOM 712 O O . ILE A 1 88 ? -5.107 49.454 -12.984 1.00 7.64 ? 88 ILE A O 1 ATOM 713 C CB . ILE A 1 88 ? -2.530 49.778 -14.441 1.00 11.43 ? 88 ILE A CB 1 ATOM 714 C CG1 . ILE A 1 88 ? -2.467 48.691 -13.354 1.00 17.07 ? 88 ILE A CG1 1 ATOM 715 C CG2 . ILE A 1 88 ? -1.134 50.340 -14.682 1.00 10.69 ? 88 ILE A CG2 1 ATOM 716 C CD1 . ILE A 1 88 ? -1.636 47.431 -13.746 1.00 19.01 ? 88 ILE A CD1 1 ATOM 717 N N . LEU A 1 89 ? -5.880 50.962 -14.455 1.00 7.07 ? 89 LEU A N 1 ATOM 718 C CA . LEU A 1 89 ? -7.266 50.564 -14.296 1.00 6.51 ? 89 LEU A CA 1 ATOM 719 C C . LEU A 1 89 ? -7.562 49.311 -15.077 1.00 6.87 ? 89 LEU A C 1 ATOM 720 O O . LEU A 1 89 ? -6.824 48.961 -15.985 1.00 8.09 ? 89 LEU A O 1 ATOM 721 C CB . LEU A 1 89 ? -8.164 51.679 -14.796 1.00 6.04 ? 89 LEU A CB 1 ATOM 722 C CG . LEU A 1 89 ? -7.743 53.044 -14.267 1.00 5.74 ? 89 LEU A CG 1 ATOM 723 C CD1 . LEU A 1 89 ? -8.677 54.110 -14.815 1.00 5.70 ? 89 LEU A CD1 1 ATOM 724 C CD2 . LEU A 1 89 ? -7.765 53.029 -12.738 1.00 6.43 ? 89 LEU A CD2 1 ATOM 725 N N . PRO A 1 90 ? -8.650 48.612 -14.733 1.00 7.16 ? 90 PRO A N 1 ATOM 726 C CA . PRO A 1 90 ? -9.010 47.385 -15.453 1.00 7.42 ? 90 PRO A CA 1 ATOM 727 C C . PRO A 1 90 ? -9.197 47.732 -16.928 1.00 7.12 ? 90 PRO A C 1 ATOM 728 O O . PRO A 1 90 ? -9.950 48.639 -17.271 1.00 7.63 ? 90 PRO A O 1 ATOM 729 C CB . PRO A 1 90 ? -10.313 46.962 -14.782 1.00 8.40 ? 90 PRO A CB 1 ATOM 730 C CG . PRO A 1 90 ? -10.135 47.455 -13.384 1.00 8.63 ? 90 PRO A CG 1 ATOM 731 C CD . PRO A 1 90 ? -9.550 48.833 -13.591 1.00 7.66 ? 90 PRO A CD 1 ATOM 732 N N . GLY A 1 91 ? -8.513 47.007 -17.796 1.00 6.68 ? 91 GLY A N 1 ATOM 733 C CA . GLY A 1 91 ? -8.594 47.307 -19.210 1.00 6.61 ? 91 GLY A CA 1 ATOM 734 C C . GLY A 1 91 ? -7.182 47.621 -19.662 1.00 7.06 ? 91 GLY A C 1 ATOM 735 O O . GLY A 1 91 ? -6.920 47.890 -20.835 1.00 7.97 ? 91 GLY A O 1 ATOM 736 N N . ASN A 1 92 ? -6.267 47.595 -18.698 1.00 6.73 ? 92 ASN A N 1 ATOM 737 C CA . ASN A 1 92 ? -4.853 47.837 -18.941 1.00 5.76 ? 92 ASN A CA 1 ATOM 738 C C . ASN A 1 92 ? -4.530 49.247 -19.421 1.00 4.32 ? 92 ASN A C 1 ATOM 739 O O . ASN A 1 92 ? -3.668 49.447 -20.268 1.00 3.47 ? 92 ASN A O 1 ATOM 740 C CB . ASN A 1 92 ? -4.332 46.809 -19.938 1.00 7.23 ? 92 ASN A CB 1 ATOM 741 C CG . ASN A 1 92 ? -2.898 46.448 -19.687 1.00 8.69 ? 92 ASN A CG 1 ATOM 742 O OD1 . ASN A 1 92 ? -2.476 46.328 -18.538 1.00 8.78 ? 92 ASN A OD1 1 ATOM 743 N ND2 . ASN A 1 92 ? -2.136 46.254 -20.760 1.00 10.04 ? 92 ASN A ND2 1 ATOM 744 N N . ILE A 1 93 ? -5.230 50.222 -18.859 1.00 3.48 ? 93 ILE A N 1 ATOM 745 C CA . ILE A 1 93 ? -5.031 51.622 -19.195 1.00 3.30 ? 93 ILE A CA 1 ATOM 746 C C . ILE A 1 93 ? -4.532 52.367 -17.956 1.00 2.72 ? 93 ILE A C 1 ATOM 747 O O . ILE A 1 93 ? -5.237 52.444 -16.941 1.00 2.25 ? 93 ILE A O 1 ATOM 748 C CB . ILE A 1 93 ? -6.357 52.266 -19.684 1.00 3.50 ? 93 ILE A CB 1 ATOM 749 C CG1 . ILE A 1 93 ? -6.299 53.788 -19.559 1.00 2.59 ? 93 ILE A CG1 1 ATOM 750 C CG2 . ILE A 1 93 ? -7.511 51.770 -18.849 1.00 4.40 ? 93 ILE A CG2 1 ATOM 751 C CD1 . ILE A 1 93 ? -5.191 54.420 -20.344 1.00 3.36 ? 93 ILE A CD1 1 ATOM 752 N N . PRO A 1 94 ? -3.299 52.908 -18.013 1.00 1.78 ? 94 PRO A N 1 ATOM 753 C CA . PRO A 1 94 ? -2.748 53.641 -16.873 1.00 1.26 ? 94 PRO A CA 1 ATOM 754 C C . PRO A 1 94 ? -3.346 55.037 -16.727 1.00 0.96 ? 94 PRO A C 1 ATOM 755 O O . PRO A 1 94 ? -3.483 55.762 -17.704 1.00 0.96 ? 94 PRO A O 1 ATOM 756 C CB . PRO A 1 94 ? -1.252 53.670 -17.180 1.00 0.96 ? 94 PRO A CB 1 ATOM 757 C CG . PRO A 1 94 ? -1.213 53.697 -18.632 1.00 0.96 ? 94 PRO A CG 1 ATOM 758 C CD . PRO A 1 94 ? -2.258 52.693 -19.032 1.00 0.96 ? 94 PRO A CD 1 ATOM 759 N N . ALA A 1 95 ? -3.718 55.400 -15.506 1.00 0.96 ? 95 ALA A N 1 ATOM 760 C CA . ALA A 1 95 ? -4.283 56.717 -15.234 1.00 0.96 ? 95 ALA A CA 1 ATOM 761 C C . ALA A 1 95 ? -3.321 57.500 -14.351 1.00 1.01 ? 95 ALA A C 1 ATOM 762 O O . ALA A 1 95 ? -2.792 56.975 -13.371 1.00 1.78 ? 95 ALA A O 1 ATOM 763 C CB . ALA A 1 95 ? -5.631 56.585 -14.536 1.00 0.96 ? 95 ALA A CB 1 ATOM 764 N N . MET A 1 96 ? -3.091 58.759 -14.690 1.00 0.98 ? 96 MET A N 1 ATOM 765 C CA . MET A 1 96 ? -2.185 59.577 -13.904 1.00 0.96 ? 96 MET A CA 1 ATOM 766 C C . MET A 1 96 ? -2.973 60.680 -13.219 1.00 0.96 ? 96 MET A C 1 ATOM 767 O O . MET A 1 96 ? -3.656 61.462 -13.875 1.00 1.97 ? 96 MET A O 1 ATOM 768 C CB . MET A 1 96 ? -1.111 60.187 -14.808 1.00 0.96 ? 96 MET A CB 1 ATOM 769 C CG . MET A 1 96 ? 0.194 60.523 -14.111 1.00 0.96 ? 96 MET A CG 1 ATOM 770 S SD . MET A 1 96 ? 1.044 59.068 -13.454 1.00 0.96 ? 96 MET A SD 1 ATOM 771 C CE . MET A 1 96 ? 2.049 58.572 -14.814 1.00 0.96 ? 96 MET A CE 1 ATOM 772 N N . LEU A 1 97 ? -2.911 60.716 -11.894 1.00 1.03 ? 97 LEU A N 1 ATOM 773 C CA . LEU A 1 97 ? -3.582 61.753 -11.131 1.00 0.96 ? 97 LEU A CA 1 ATOM 774 C C . LEU A 1 97 ? -2.478 62.600 -10.531 1.00 0.96 ? 97 LEU A C 1 ATOM 775 O O . LEU A 1 97 ? -1.561 62.080 -9.910 1.00 0.96 ? 97 LEU A O 1 ATOM 776 C CB . LEU A 1 97 ? -4.451 61.146 -10.032 1.00 0.96 ? 97 LEU A CB 1 ATOM 777 C CG . LEU A 1 97 ? -5.811 60.653 -10.521 1.00 0.96 ? 97 LEU A CG 1 ATOM 778 C CD1 . LEU A 1 97 ? -6.668 60.161 -9.368 1.00 0.96 ? 97 LEU A CD1 1 ATOM 779 C CD2 . LEU A 1 97 ? -6.499 61.794 -11.220 1.00 0.96 ? 97 LEU A CD2 1 ATOM 780 N N . TYR A 1 98 ? -2.546 63.907 -10.728 1.00 0.96 ? 98 TYR A N 1 ATOM 781 C CA . TYR A 1 98 ? -1.509 64.766 -10.201 1.00 0.96 ? 98 TYR A CA 1 ATOM 782 C C . TYR A 1 98 ? -2.022 66.145 -9.831 1.00 0.96 ? 98 TYR A C 1 ATOM 783 O O . TYR A 1 98 ? -3.058 66.593 -10.308 1.00 1.57 ? 98 TYR A O 1 ATOM 784 C CB . TYR A 1 98 ? -0.418 64.895 -11.232 1.00 0.96 ? 98 TYR A CB 1 ATOM 785 C CG . TYR A 1 98 ? -0.869 65.682 -12.416 1.00 0.96 ? 98 TYR A CG 1 ATOM 786 C CD1 . TYR A 1 98 ? -0.728 67.055 -12.444 1.00 1.42 ? 98 TYR A CD1 1 ATOM 787 C CD2 . TYR A 1 98 ? -1.431 65.055 -13.516 1.00 0.96 ? 98 TYR A CD2 1 ATOM 788 C CE1 . TYR A 1 98 ? -1.126 67.791 -13.542 1.00 2.43 ? 98 TYR A CE1 1 ATOM 789 C CE2 . TYR A 1 98 ? -1.837 65.779 -14.623 1.00 1.41 ? 98 TYR A CE2 1 ATOM 790 C CZ . TYR A 1 98 ? -1.679 67.152 -14.631 1.00 2.18 ? 98 TYR A CZ 1 ATOM 791 O OH . TYR A 1 98 ? -2.065 67.901 -15.723 1.00 1.74 ? 98 TYR A OH 1 ATOM 792 N N . THR A 1 99 ? -1.268 66.827 -8.986 1.00 1.01 ? 99 THR A N 1 ATOM 793 C CA . THR A 1 99 ? -1.650 68.143 -8.538 1.00 1.26 ? 99 THR A CA 1 ATOM 794 C C . THR A 1 99 ? -1.145 69.225 -9.452 1.00 2.23 ? 99 THR A C 1 ATOM 795 O O . THR A 1 99 ? 0.040 69.274 -9.767 1.00 2.83 ? 99 THR A O 1 ATOM 796 C CB . THR A 1 99 ? -1.106 68.419 -7.151 1.00 0.96 ? 99 THR A CB 1 ATOM 797 O OG1 . THR A 1 99 ? -1.738 67.548 -6.208 1.00 1.74 ? 99 THR A OG1 1 ATOM 798 C CG2 . THR A 1 99 ? -1.371 69.851 -6.767 1.00 1.04 ? 99 THR A CG2 1 ATOM 799 N N . GLY A 1 100 ? -2.050 70.105 -9.865 1.00 3.34 ? 100 GLY A N 1 ATOM 800 C CA . GLY A 1 100 ? -1.660 71.200 -10.732 1.00 4.32 ? 100 GLY A CA 1 ATOM 801 C C . GLY A 1 100 ? -1.858 72.554 -10.070 1.00 5.52 ? 100 GLY A C 1 ATOM 802 O O . GLY A 1 100 ? -2.625 72.685 -9.107 1.00 4.13 ? 100 GLY A O 1 ATOM 803 N N . SER A 1 101 ? -1.156 73.558 -10.592 1.00 6.61 ? 101 SER A N 1 ATOM 804 C CA . SER A 1 101 ? -1.236 74.931 -10.092 1.00 7.95 ? 101 SER A CA 1 ATOM 805 C C . SER A 1 101 ? -1.936 75.722 -11.189 1.00 8.63 ? 101 SER A C 1 ATOM 806 O O . SER A 1 101 ? -1.312 76.085 -12.187 1.00 8.36 ? 101 SER A O 1 ATOM 807 C CB . SER A 1 101 ? 0.171 75.489 -9.867 1.00 8.95 ? 101 SER A CB 1 ATOM 808 O OG . SER A 1 101 ? 0.165 76.578 -8.957 1.00 12.02 ? 101 SER A OG 1 ATOM 809 N N . ASP A 1 102 ? -3.230 75.980 -11.009 1.00 10.24 ? 102 ASP A N 1 ATOM 810 C CA . ASP A 1 102 ? -4.012 76.691 -12.017 1.00 12.18 ? 102 ASP A CA 1 ATOM 811 C C . ASP A 1 102 ? -3.781 78.194 -12.070 1.00 14.42 ? 102 ASP A C 1 ATOM 812 O O . ASP A 1 102 ? -3.175 78.774 -11.172 1.00 14.37 ? 102 ASP A O 1 ATOM 813 C CB . ASP A 1 102 ? -5.507 76.423 -11.825 1.00 9.91 ? 102 ASP A CB 1 ATOM 814 C CG . ASP A 1 102 ? -6.042 76.994 -10.528 1.00 8.80 ? 102 ASP A CG 1 ATOM 815 O OD1 . ASP A 1 102 ? -5.343 77.828 -9.905 1.00 6.25 ? 102 ASP A OD1 1 ATOM 816 O OD2 . ASP A 1 102 ? -7.172 76.615 -10.141 1.00 8.05 ? 102 ASP A OD2 1 ATOM 817 N N . SER A 1 103 ? -4.288 78.808 -13.137 1.00 17.52 ? 103 SER A N 1 ATOM 818 C CA . SER A 1 103 ? -4.161 80.243 -13.377 1.00 21.12 ? 103 SER A CA 1 ATOM 819 C C . SER A 1 103 ? -4.380 81.114 -12.139 1.00 22.44 ? 103 SER A C 1 ATOM 820 O O . SER A 1 103 ? -3.733 82.157 -11.988 1.00 24.08 ? 103 SER A O 1 ATOM 821 C CB . SER A 1 103 ? -5.130 80.672 -14.484 1.00 22.22 ? 103 SER A CB 1 ATOM 822 O OG . SER A 1 103 ? -6.471 80.365 -14.139 1.00 24.61 ? 103 SER A OG 1 ATOM 823 N N . LYS A 1 104 ? -5.294 80.706 -11.261 1.00 23.15 ? 104 LYS A N 1 ATOM 824 C CA . LYS A 1 104 ? -5.545 81.477 -10.048 1.00 23.34 ? 104 LYS A CA 1 ATOM 825 C C . LYS A 1 104 ? -4.545 81.075 -8.961 1.00 21.34 ? 104 LYS A C 1 ATOM 826 O O . LYS A 1 104 ? -4.659 81.480 -7.802 1.00 22.26 ? 104 LYS A O 1 ATOM 827 C CB . LYS A 1 104 ? -6.997 81.294 -9.562 1.00 25.71 ? 104 LYS A CB 1 ATOM 828 C CG . LYS A 1 104 ? -8.042 82.055 -10.400 1.00 28.62 ? 104 LYS A CG 1 ATOM 829 C CD . LYS A 1 104 ? -9.334 82.345 -9.599 1.00 30.84 ? 104 LYS A CD 1 ATOM 830 C CE . LYS A 1 104 ? -10.306 83.282 -10.364 1.00 31.40 ? 104 LYS A CE 1 ATOM 831 N NZ . LYS A 1 104 ? -11.449 83.805 -9.527 1.00 29.29 ? 104 LYS A NZ 1 ATOM 832 N N . SER A 1 105 ? -3.566 80.269 -9.357 1.00 18.69 ? 105 SER A N 1 ATOM 833 C CA . SER A 1 105 ? -2.501 79.825 -8.469 1.00 16.51 ? 105 SER A CA 1 ATOM 834 C C . SER A 1 105 ? -2.894 78.880 -7.347 1.00 13.73 ? 105 SER A C 1 ATOM 835 O O . SER A 1 105 ? -2.238 78.849 -6.310 1.00 12.89 ? 105 SER A O 1 ATOM 836 C CB . SER A 1 105 ? -1.795 81.042 -7.875 1.00 17.78 ? 105 SER A CB 1 ATOM 837 O OG . SER A 1 105 ? -1.303 81.887 -8.903 1.00 21.93 ? 105 SER A OG 1 ATOM 838 N N . ARG A 1 106 ? -3.949 78.101 -7.543 1.00 11.49 ? 106 ARG A N 1 ATOM 839 C CA . ARG A 1 106 ? -4.359 77.168 -6.510 1.00 9.50 ? 106 ARG A CA 1 ATOM 840 C C . ARG A 1 106 ? -4.016 75.729 -6.880 1.00 7.98 ? 106 ARG A C 1 ATOM 841 O O . ARG A 1 106 ? -3.898 75.388 -8.056 1.00 8.53 ? 106 ARG A O 1 ATOM 842 C CB . ARG A 1 106 ? -5.854 77.312 -6.222 1.00 10.13 ? 106 ARG A CB 1 ATOM 843 C CG . ARG A 1 106 ? -6.788 77.126 -7.397 1.00 12.23 ? 106 ARG A CG 1 ATOM 844 C CD . ARG A 1 106 ? -8.221 77.306 -6.919 1.00 15.57 ? 106 ARG A CD 1 ATOM 845 N NE . ARG A 1 106 ? -9.234 76.966 -7.915 1.00 18.99 ? 106 ARG A NE 1 ATOM 846 C CZ . ARG A 1 106 ? -10.499 76.685 -7.604 1.00 21.63 ? 106 ARG A CZ 1 ATOM 847 N NH1 . ARG A 1 106 ? -10.882 76.708 -6.326 1.00 22.92 ? 106 ARG A NH1 1 ATOM 848 N NH2 . ARG A 1 106 ? -11.380 76.381 -8.555 1.00 21.79 ? 106 ARG A NH2 1 ATOM 849 N N . GLN A 1 107 ? -3.850 74.888 -5.865 1.00 5.90 ? 107 GLN A N 1 ATOM 850 C CA . GLN A 1 107 ? -3.500 73.489 -6.070 1.00 4.30 ? 107 GLN A CA 1 ATOM 851 C C . GLN A 1 107 ? -4.743 72.613 -6.278 1.00 3.14 ? 107 GLN A C 1 ATOM 852 O O . GLN A 1 107 ? -5.627 72.577 -5.427 1.00 1.91 ? 107 GLN A O 1 ATOM 853 C CB . GLN A 1 107 ? -2.691 72.991 -4.864 1.00 4.29 ? 107 GLN A CB 1 ATOM 854 C CG . GLN A 1 107 ? -1.566 73.943 -4.422 1.00 3.73 ? 107 GLN A CG 1 ATOM 855 C CD . GLN A 1 107 ? -0.723 73.370 -3.296 1.00 3.88 ? 107 GLN A CD 1 ATOM 856 O OE1 . GLN A 1 107 ? -1.223 72.632 -2.445 1.00 3.75 ? 107 GLN A OE1 1 ATOM 857 N NE2 . GLN A 1 107 ? 0.560 73.720 -3.275 1.00 4.01 ? 107 GLN A NE2 1 ATOM 858 N N . VAL A 1 108 ? -4.801 71.907 -7.409 1.00 2.86 ? 108 VAL A N 1 ATOM 859 C CA . VAL A 1 108 ? -5.940 71.040 -7.736 1.00 2.43 ? 108 VAL A CA 1 ATOM 860 C C . VAL A 1 108 ? -5.510 69.673 -8.264 1.00 2.43 ? 108 VAL A C 1 ATOM 861 O O . VAL A 1 108 ? -4.350 69.470 -8.631 1.00 2.27 ? 108 VAL A O 1 ATOM 862 C CB . VAL A 1 108 ? -6.801 71.671 -8.812 1.00 1.88 ? 108 VAL A CB 1 ATOM 863 C CG1 . VAL A 1 108 ? -7.153 73.079 -8.430 1.00 3.00 ? 108 VAL A CG1 1 ATOM 864 C CG2 . VAL A 1 108 ? -6.047 71.671 -10.120 1.00 3.23 ? 108 VAL A CG2 1 ATOM 865 N N . GLN A 1 109 ? -6.462 68.750 -8.348 1.00 2.80 ? 109 GLN A N 1 ATOM 866 C CA . GLN A 1 109 ? -6.169 67.400 -8.831 1.00 4.35 ? 109 GLN A CA 1 ATOM 867 C C . GLN A 1 109 ? -6.554 67.150 -10.279 1.00 4.92 ? 109 GLN A C 1 ATOM 868 O O . GLN A 1 109 ? -7.715 67.295 -10.656 1.00 6.15 ? 109 GLN A O 1 ATOM 869 C CB . GLN A 1 109 ? -6.853 66.388 -7.926 1.00 4.26 ? 109 GLN A CB 1 ATOM 870 C CG . GLN A 1 109 ? -6.670 66.763 -6.483 1.00 5.46 ? 109 GLN A CG 1 ATOM 871 C CD . GLN A 1 109 ? -5.266 67.272 -6.205 1.00 5.22 ? 109 GLN A CD 1 ATOM 872 O OE1 . GLN A 1 109 ? -5.052 68.046 -5.277 1.00 6.20 ? 109 GLN A OE1 1 ATOM 873 N NE2 . GLN A 1 109 ? -4.300 66.831 -7.007 1.00 4.93 ? 109 GLN A NE2 1 ATOM 874 N N . ASP A 1 110 ? -5.568 66.756 -11.080 1.00 4.80 ? 110 ASP A N 1 ATOM 875 C CA . ASP A 1 110 ? -5.772 66.508 -12.502 1.00 4.27 ? 110 ASP A CA 1 ATOM 876 C C . ASP A 1 110 ? -5.574 65.060 -12.928 1.00 3.12 ? 110 ASP A C 1 ATOM 877 O O . ASP A 1 110 ? -4.838 64.298 -12.301 1.00 2.77 ? 110 ASP A O 1 ATOM 878 C CB . ASP A 1 110 ? -4.842 67.409 -13.310 1.00 6.28 ? 110 ASP A CB 1 ATOM 879 C CG . ASP A 1 110 ? -5.214 68.873 -13.201 1.00 7.26 ? 110 ASP A CG 1 ATOM 880 O OD1 . ASP A 1 110 ? -4.360 69.732 -13.500 1.00 8.13 ? 110 ASP A OD1 1 ATOM 881 O OD2 . ASP A 1 110 ? -6.369 69.162 -12.831 1.00 8.64 ? 110 ASP A OD2 1 ATOM 882 N N . LEU A 1 111 ? -6.233 64.697 -14.020 1.00 1.86 ? 111 LEU A N 1 ATOM 883 C CA . LEU A 1 111 ? -6.164 63.345 -14.532 1.00 1.36 ? 111 LEU A CA 1 ATOM 884 C C . LEU A 1 111 ? -5.641 63.375 -15.948 1.00 0.96 ? 111 LEU A C 1 ATOM 885 O O . LEU A 1 111 ? -5.933 64.303 -16.690 1.00 0.96 ? 111 LEU A O 1 ATOM 886 C CB . LEU A 1 111 ? -7.564 62.724 -14.496 1.00 0.96 ? 111 LEU A CB 1 ATOM 887 C CG . LEU A 1 111 ? -7.797 61.239 -14.793 1.00 0.96 ? 111 LEU A CG 1 ATOM 888 C CD1 . LEU A 1 111 ? -8.595 61.122 -16.065 1.00 0.96 ? 111 LEU A CD1 1 ATOM 889 C CD2 . LEU A 1 111 ? -6.483 60.480 -14.886 1.00 0.96 ? 111 LEU A CD2 1 ATOM 890 N N . ALA A 1 112 ? -4.862 62.366 -16.315 1.00 0.96 ? 112 ALA A N 1 ATOM 891 C CA . ALA A 1 112 ? -4.308 62.263 -17.662 1.00 1.13 ? 112 ALA A CA 1 ATOM 892 C C . ALA A 1 112 ? -3.990 60.804 -17.940 1.00 1.46 ? 112 ALA A C 1 ATOM 893 O O . ALA A 1 112 ? -3.913 60.003 -17.012 1.00 1.98 ? 112 ALA A O 1 ATOM 894 C CB . ALA A 1 112 ? -3.046 63.096 -17.783 1.00 0.96 ? 112 ALA A CB 1 ATOM 895 N N . TRP A 1 113 ? -3.814 60.453 -19.211 1.00 1.64 ? 113 TRP A N 1 ATOM 896 C CA . TRP A 1 113 ? -3.488 59.077 -19.563 1.00 1.20 ? 113 TRP A CA 1 ATOM 897 C C . TRP A 1 113 ? -2.766 58.977 -20.893 1.00 1.18 ? 113 TRP A C 1 ATOM 898 O O . TRP A 1 113 ? -2.887 59.851 -21.750 1.00 1.36 ? 113 TRP A O 1 ATOM 899 C CB . TRP A 1 113 ? -4.750 58.216 -19.562 1.00 0.96 ? 113 TRP A CB 1 ATOM 900 C CG . TRP A 1 113 ? -5.759 58.570 -20.585 1.00 0.96 ? 113 TRP A CG 1 ATOM 901 C CD1 . TRP A 1 113 ? -5.860 58.051 -21.826 1.00 1.35 ? 113 TRP A CD1 1 ATOM 902 C CD2 . TRP A 1 113 ? -6.831 59.507 -20.452 1.00 0.96 ? 113 TRP A CD2 1 ATOM 903 N NE1 . TRP A 1 113 ? -6.929 58.596 -22.485 1.00 1.37 ? 113 TRP A NE1 1 ATOM 904 C CE2 . TRP A 1 113 ? -7.544 59.498 -21.663 1.00 0.96 ? 113 TRP A CE2 1 ATOM 905 C CE3 . TRP A 1 113 ? -7.258 60.354 -19.427 1.00 2.20 ? 113 TRP A CE3 1 ATOM 906 C CZ2 . TRP A 1 113 ? -8.664 60.304 -21.887 1.00 0.96 ? 113 TRP A CZ2 1 ATOM 907 C CZ3 . TRP A 1 113 ? -8.378 61.162 -19.650 1.00 2.39 ? 113 TRP A CZ3 1 ATOM 908 C CH2 . TRP A 1 113 ? -9.065 61.126 -20.874 1.00 0.97 ? 113 TRP A CH2 1 ATOM 909 N N . PRO A 1 114 ? -1.986 57.907 -21.077 1.00 1.00 ? 114 PRO A N 1 ATOM 910 C CA . PRO A 1 114 ? -1.250 57.742 -22.328 1.00 1.64 ? 114 PRO A CA 1 ATOM 911 C C . PRO A 1 114 ? -2.143 57.885 -23.546 1.00 2.72 ? 114 PRO A C 1 ATOM 912 O O . PRO A 1 114 ? -3.298 57.469 -23.539 1.00 2.38 ? 114 PRO A O 1 ATOM 913 C CB . PRO A 1 114 ? -0.621 56.356 -22.182 1.00 1.45 ? 114 PRO A CB 1 ATOM 914 C CG . PRO A 1 114 ? -1.540 55.661 -21.245 1.00 1.73 ? 114 PRO A CG 1 ATOM 915 C CD . PRO A 1 114 ? -1.857 56.710 -20.233 1.00 0.96 ? 114 PRO A CD 1 ATOM 916 N N . LYS A 1 115 ? -1.590 58.472 -24.596 1.00 3.99 ? 115 LYS A N 1 ATOM 917 C CA . LYS A 1 115 ? -2.335 58.727 -25.820 1.00 6.02 ? 115 LYS A CA 1 ATOM 918 C C . LYS A 1 115 ? -2.062 57.751 -26.974 1.00 7.72 ? 115 LYS A C 1 ATOM 919 O O . LYS A 1 115 ? -2.829 57.696 -27.931 1.00 9.41 ? 115 LYS A O 1 ATOM 920 C CB . LYS A 1 115 ? -2.044 60.178 -26.237 1.00 5.85 ? 115 LYS A CB 1 ATOM 921 C CG . LYS A 1 115 ? -2.602 60.655 -27.558 1.00 6.31 ? 115 LYS A CG 1 ATOM 922 C CD . LYS A 1 115 ? -2.245 62.122 -27.766 1.00 7.16 ? 115 LYS A CD 1 ATOM 923 C CE . LYS A 1 115 ? -2.399 62.530 -29.229 1.00 10.62 ? 115 LYS A CE 1 ATOM 924 N NZ . LYS A 1 115 ? -1.933 63.937 -29.513 1.00 12.35 ? 115 LYS A NZ 1 ATOM 925 N N . ASN A 1 116 ? -0.990 56.968 -26.876 1.00 9.20 ? 116 ASN A N 1 ATOM 926 C CA . ASN A 1 116 ? -0.618 56.019 -27.933 1.00 9.80 ? 116 ASN A CA 1 ATOM 927 C C . ASN A 1 116 ? -0.186 54.681 -27.314 1.00 8.40 ? 116 ASN A C 1 ATOM 928 O O . ASN A 1 116 ? 0.959 54.277 -27.463 1.00 8.81 ? 116 ASN A O 1 ATOM 929 C CB . ASN A 1 116 ? 0.531 56.635 -28.763 1.00 13.64 ? 116 ASN A CB 1 ATOM 930 C CG . ASN A 1 116 ? 0.956 55.773 -29.953 1.00 18.22 ? 116 ASN A CG 1 ATOM 931 O OD1 . ASN A 1 116 ? 0.335 54.751 -30.245 1.00 20.10 ? 116 ASN A OD1 1 ATOM 932 N ND2 . ASN A 1 116 ? 2.016 56.209 -30.643 1.00 22.35 ? 116 ASN A ND2 1 ATOM 933 N N . LEU A 1 117 ? -1.099 53.996 -26.629 1.00 6.24 ? 117 LEU A N 1 ATOM 934 C CA . LEU A 1 117 ? -0.780 52.720 -25.987 1.00 5.08 ? 117 LEU A CA 1 ATOM 935 C C . LEU A 1 117 ? 0.001 51.725 -26.842 1.00 6.14 ? 117 LEU A C 1 ATOM 936 O O . LEU A 1 117 ? 0.384 50.657 -26.365 1.00 7.17 ? 117 LEU A O 1 ATOM 937 C CB . LEU A 1 117 ? -2.050 52.043 -25.489 1.00 3.46 ? 117 LEU A CB 1 ATOM 938 C CG . LEU A 1 117 ? -2.784 52.688 -24.320 1.00 2.55 ? 117 LEU A CG 1 ATOM 939 C CD1 . LEU A 1 117 ? -4.100 51.966 -24.091 1.00 1.81 ? 117 LEU A CD1 1 ATOM 940 C CD2 . LEU A 1 117 ? -1.920 52.630 -23.084 1.00 1.80 ? 117 LEU A CD2 1 ATOM 941 N N . SER A 1 118 ? 0.220 52.061 -28.107 1.00 7.45 ? 118 SER A N 1 ATOM 942 C CA . SER A 1 118 ? 0.986 51.208 -29.015 1.00 8.59 ? 118 SER A CA 1 ATOM 943 C C . SER A 1 118 ? 2.459 51.348 -28.624 1.00 8.13 ? 118 SER A C 1 ATOM 944 O O . SER A 1 118 ? 3.242 50.400 -28.686 1.00 7.60 ? 118 SER A O 1 ATOM 945 C CB . SER A 1 118 ? 0.811 51.692 -30.459 1.00 10.22 ? 118 SER A CB 1 ATOM 946 O OG . SER A 1 118 ? -0.552 51.955 -30.764 1.00 13.61 ? 118 SER A OG 1 ATOM 947 N N . ASP A 1 119 ? 2.798 52.568 -28.218 1.00 8.27 ? 119 ASP A N 1 ATOM 948 C CA . ASP A 1 119 ? 4.135 52.984 -27.800 1.00 8.03 ? 119 ASP A CA 1 ATOM 949 C C . ASP A 1 119 ? 4.588 52.365 -26.478 1.00 6.49 ? 119 ASP A C 1 ATOM 950 O O . ASP A 1 119 ? 3.997 52.601 -25.426 1.00 6.30 ? 119 ASP A O 1 ATOM 951 C CB . ASP A 1 119 ? 4.151 54.521 -27.717 1.00 9.64 ? 119 ASP A CB 1 ATOM 952 C CG . ASP A 1 119 ? 5.461 55.084 -27.216 1.00 10.26 ? 119 ASP A CG 1 ATOM 953 O OD1 . ASP A 1 119 ? 6.540 54.665 -27.686 1.00 12.13 ? 119 ASP A OD1 1 ATOM 954 O OD2 . ASP A 1 119 ? 5.398 55.979 -26.353 1.00 11.85 ? 119 ASP A OD2 1 ATOM 955 N N . PRO A 1 120 ? 5.653 51.559 -26.525 1.00 5.60 ? 120 PRO A N 1 ATOM 956 C CA . PRO A 1 120 ? 6.228 50.878 -25.368 1.00 4.51 ? 120 PRO A CA 1 ATOM 957 C C . PRO A 1 120 ? 6.636 51.837 -24.288 1.00 3.80 ? 120 PRO A C 1 ATOM 958 O O . PRO A 1 120 ? 6.611 51.493 -23.106 1.00 4.49 ? 120 PRO A O 1 ATOM 959 C CB . PRO A 1 120 ? 7.439 50.168 -25.952 1.00 6.00 ? 120 PRO A CB 1 ATOM 960 C CG . PRO A 1 120 ? 7.003 49.851 -27.328 1.00 7.63 ? 120 PRO A CG 1 ATOM 961 C CD . PRO A 1 120 ? 6.341 51.145 -27.757 1.00 6.84 ? 120 PRO A CD 1 ATOM 962 N N . PHE A 1 121 ? 7.001 53.046 -24.702 1.00 3.50 ? 121 PHE A N 1 ATOM 963 C CA . PHE A 1 121 ? 7.458 54.063 -23.769 1.00 3.13 ? 121 PHE A CA 1 ATOM 964 C C . PHE A 1 121 ? 6.485 55.179 -23.360 1.00 3.18 ? 121 PHE A C 1 ATOM 965 O O . PHE A 1 121 ? 6.884 56.114 -22.671 1.00 3.48 ? 121 PHE A O 1 ATOM 966 C CB . PHE A 1 121 ? 8.745 54.689 -24.311 1.00 3.82 ? 121 PHE A CB 1 ATOM 967 C CG . PHE A 1 121 ? 9.863 53.701 -24.522 1.00 4.35 ? 121 PHE A CG 1 ATOM 968 C CD1 . PHE A 1 121 ? 10.056 52.644 -23.644 1.00 4.57 ? 121 PHE A CD1 1 ATOM 969 C CD2 . PHE A 1 121 ? 10.748 53.855 -25.578 1.00 4.63 ? 121 PHE A CD2 1 ATOM 970 C CE1 . PHE A 1 121 ? 11.114 51.760 -23.817 1.00 4.89 ? 121 PHE A CE1 1 ATOM 971 C CE2 . PHE A 1 121 ? 11.809 52.974 -25.756 1.00 5.28 ? 121 PHE A CE2 1 ATOM 972 C CZ . PHE A 1 121 ? 11.992 51.927 -24.875 1.00 5.05 ? 121 PHE A CZ 1 ATOM 973 N N . LEU A 1 122 ? 5.219 55.087 -23.755 1.00 3.37 ? 122 LEU A N 1 ATOM 974 C CA . LEU A 1 122 ? 4.242 56.121 -23.409 1.00 2.99 ? 122 LEU A CA 1 ATOM 975 C C . LEU A 1 122 ? 4.864 57.510 -23.464 1.00 3.51 ? 122 LEU A C 1 ATOM 976 O O . LEU A 1 122 ? 4.892 58.211 -22.461 1.00 3.03 ? 122 LEU A O 1 ATOM 977 C CB . LEU A 1 122 ? 3.708 55.901 -22.003 1.00 2.76 ? 122 LEU A CB 1 ATOM 978 C CG . LEU A 1 122 ? 3.249 54.499 -21.641 1.00 3.22 ? 122 LEU A CG 1 ATOM 979 C CD1 . LEU A 1 122 ? 2.462 54.561 -20.345 1.00 4.45 ? 122 LEU A CD1 1 ATOM 980 C CD2 . LEU A 1 122 ? 2.392 53.939 -22.746 1.00 4.45 ? 122 LEU A CD2 1 ATOM 981 N N . ARG A 1 123 ? 5.368 57.907 -24.627 1.00 5.53 ? 123 ARG A N 1 ATOM 982 C CA . ARG A 1 123 ? 5.996 59.213 -24.767 1.00 6.43 ? 123 ARG A CA 1 ATOM 983 C C . ARG A 1 123 ? 4.968 60.319 -24.635 1.00 7.02 ? 123 ARG A C 1 ATOM 984 O O . ARG A 1 123 ? 5.150 61.234 -23.841 1.00 7.49 ? 123 ARG A O 1 ATOM 985 C CB . ARG A 1 123 ? 6.699 59.339 -26.121 1.00 7.07 ? 123 ARG A CB 1 ATOM 986 C CG . ARG A 1 123 ? 7.866 58.391 -26.341 1.00 9.22 ? 123 ARG A CG 1 ATOM 987 C CD . ARG A 1 123 ? 8.185 58.322 -27.831 1.00 15.22 ? 123 ARG A CD 1 ATOM 988 N NE . ARG A 1 123 ? 9.012 57.172 -28.214 1.00 20.02 ? 123 ARG A NE 1 ATOM 989 C CZ . ARG A 1 123 ? 10.338 57.121 -28.102 1.00 22.09 ? 123 ARG A CZ 1 ATOM 990 N NH1 . ARG A 1 123 ? 11.008 58.164 -27.610 1.00 21.80 ? 123 ARG A NH1 1 ATOM 991 N NH2 . ARG A 1 123 ? 10.994 56.030 -28.494 1.00 22.72 ? 123 ARG A NH2 1 ATOM 992 N N . GLU A 1 124 ? 3.886 60.218 -25.405 1.00 7.89 ? 124 GLU A N 1 ATOM 993 C CA . GLU A 1 124 ? 2.833 61.227 -25.399 1.00 9.13 ? 124 GLU A CA 1 ATOM 994 C C . GLU A 1 124 ? 1.683 60.933 -24.451 1.00 8.42 ? 124 GLU A C 1 ATOM 995 O O . GLU A 1 124 ? 1.188 59.805 -24.394 1.00 8.32 ? 124 GLU A O 1 ATOM 996 C CB . GLU A 1 124 ? 2.249 61.386 -26.796 1.00 12.77 ? 124 GLU A CB 1 ATOM 997 C CG . GLU A 1 124 ? 3.239 61.695 -27.905 1.00 18.97 ? 124 GLU A CG 1 ATOM 998 C CD . GLU A 1 124 ? 3.904 63.049 -27.757 1.00 22.43 ? 124 GLU A CD 1 ATOM 999 O OE1 . GLU A 1 124 ? 3.206 64.029 -27.399 1.00 24.56 ? 124 GLU A OE1 1 ATOM 1000 O OE2 . GLU A 1 124 ? 5.126 63.129 -28.023 1.00 24.62 ? 124 GLU A OE2 1 ATOM 1001 N N . TRP A 1 125 ? 1.244 61.977 -23.743 1.00 8.16 ? 125 TRP A N 1 ATOM 1002 C CA . TRP A 1 125 ? 0.131 61.906 -22.781 1.00 6.30 ? 125 TRP A CA 1 ATOM 1003 C C . TRP A 1 125 ? -0.940 62.971 -23.032 1.00 5.55 ? 125 TRP A C 1 ATOM 1004 O O . TRP A 1 125 ? -0.641 64.058 -23.548 1.00 5.57 ? 125 TRP A O 1 ATOM 1005 C CB . TRP A 1 125 ? 0.648 62.086 -21.356 1.00 4.64 ? 125 TRP A CB 1 ATOM 1006 C CG . TRP A 1 125 ? 1.456 60.961 -20.893 1.00 2.22 ? 125 TRP A CG 1 ATOM 1007 C CD1 . TRP A 1 125 ? 2.693 60.606 -21.328 1.00 1.20 ? 125 TRP A CD1 1 ATOM 1008 C CD2 . TRP A 1 125 ? 1.068 59.990 -19.931 1.00 0.96 ? 125 TRP A CD2 1 ATOM 1009 N NE1 . TRP A 1 125 ? 3.102 59.462 -20.694 1.00 1.10 ? 125 TRP A NE1 1 ATOM 1010 C CE2 . TRP A 1 125 ? 2.119 59.060 -19.832 1.00 0.96 ? 125 TRP A CE2 1 ATOM 1011 C CE3 . TRP A 1 125 ? -0.072 59.810 -19.147 1.00 0.96 ? 125 TRP A CE3 1 ATOM 1012 C CZ2 . TRP A 1 125 ? 2.068 57.970 -18.980 1.00 0.96 ? 125 TRP A CZ2 1 ATOM 1013 C CZ3 . TRP A 1 125 ? -0.123 58.730 -18.303 1.00 1.30 ? 125 TRP A CZ3 1 ATOM 1014 C CH2 . TRP A 1 125 ? 0.942 57.817 -18.225 1.00 1.30 ? 125 TRP A CH2 1 ATOM 1015 N N . VAL A 1 126 ? -2.177 62.669 -22.639 1.00 3.86 ? 126 VAL A N 1 ATOM 1016 C CA . VAL A 1 126 ? -3.277 63.611 -22.822 1.00 2.63 ? 126 VAL A CA 1 ATOM 1017 C C . VAL A 1 126 ? -4.090 63.851 -21.551 1.00 2.72 ? 126 VAL A C 1 ATOM 1018 O O . VAL A 1 126 ? -4.339 62.916 -20.785 1.00 1.41 ? 126 VAL A O 1 ATOM 1019 C CB . VAL A 1 126 ? -4.228 63.124 -23.883 1.00 1.26 ? 126 VAL A CB 1 ATOM 1020 C CG1 . VAL A 1 126 ? -4.795 61.799 -23.468 1.00 0.96 ? 126 VAL A CG1 1 ATOM 1021 C CG2 . VAL A 1 126 ? -5.324 64.147 -24.081 1.00 3.79 ? 126 VAL A CG2 1 ATOM 1022 N N . LYS A 1 127 ? -4.514 65.100 -21.337 1.00 2.86 ? 127 LYS A N 1 ATOM 1023 C CA . LYS A 1 127 ? -5.294 65.454 -20.146 1.00 1.81 ? 127 LYS A CA 1 ATOM 1024 C C . LYS A 1 127 ? -6.783 65.259 -20.393 1.00 1.32 ? 127 LYS A C 1 ATOM 1025 O O . LYS A 1 127 ? -7.242 65.325 -21.526 1.00 0.96 ? 127 LYS A O 1 ATOM 1026 C CB . LYS A 1 127 ? -5.085 66.922 -19.743 1.00 0.96 ? 127 LYS A CB 1 ATOM 1027 C CG . LYS A 1 127 ? -3.722 67.516 -20.020 1.00 0.96 ? 127 LYS A CG 1 ATOM 1028 C CD . LYS A 1 127 ? -2.656 67.047 -19.066 1.00 0.96 ? 127 LYS A CD 1 ATOM 1029 C CE . LYS A 1 127 ? -1.310 67.714 -19.382 1.00 1.06 ? 127 LYS A CE 1 ATOM 1030 N NZ . LYS A 1 127 ? -1.315 69.197 -19.175 1.00 0.96 ? 127 LYS A NZ 1 ATOM 1031 N N . HIS A 1 128 ? -7.530 65.025 -19.320 1.00 2.27 ? 128 HIS A N 1 ATOM 1032 C CA . HIS A 1 128 ? -8.977 64.865 -19.408 1.00 4.06 ? 128 HIS A CA 1 ATOM 1033 C C . HIS A 1 128 ? -9.568 66.255 -19.667 1.00 5.36 ? 128 HIS A C 1 ATOM 1034 O O . HIS A 1 128 ? -8.929 67.269 -19.388 1.00 7.66 ? 128 HIS A O 1 ATOM 1035 C CB . HIS A 1 128 ? -9.530 64.318 -18.100 1.00 3.25 ? 128 HIS A CB 1 ATOM 1036 C CG . HIS A 1 128 ? -11.005 64.077 -18.130 1.00 4.63 ? 128 HIS A CG 1 ATOM 1037 N ND1 . HIS A 1 128 ? -11.557 62.875 -18.518 1.00 4.68 ? 128 HIS A ND1 1 ATOM 1038 C CD2 . HIS A 1 128 ? -12.046 64.891 -17.836 1.00 4.91 ? 128 HIS A CD2 1 ATOM 1039 C CE1 . HIS A 1 128 ? -12.874 62.957 -18.457 1.00 4.68 ? 128 HIS A CE1 1 ATOM 1040 N NE2 . HIS A 1 128 ? -13.196 64.170 -18.046 1.00 5.69 ? 128 HIS A NE2 1 ATOM 1041 N N . PRO A 1 129 ? -10.794 66.330 -20.198 1.00 5.73 ? 129 PRO A N 1 ATOM 1042 C CA . PRO A 1 129 ? -11.298 67.685 -20.428 1.00 5.89 ? 129 PRO A CA 1 ATOM 1043 C C . PRO A 1 129 ? -11.906 68.382 -19.214 1.00 6.70 ? 129 PRO A C 1 ATOM 1044 O O . PRO A 1 129 ? -11.879 69.607 -19.129 1.00 6.73 ? 129 PRO A O 1 ATOM 1045 C CB . PRO A 1 129 ? -12.320 67.489 -21.546 1.00 5.30 ? 129 PRO A CB 1 ATOM 1046 C CG . PRO A 1 129 ? -11.866 66.227 -22.225 1.00 5.00 ? 129 PRO A CG 1 ATOM 1047 C CD . PRO A 1 129 ? -11.508 65.367 -21.050 1.00 5.58 ? 129 PRO A CD 1 ATOM 1048 N N . LYS A 1 130 ? -12.450 67.619 -18.274 1.00 7.28 ? 130 LYS A N 1 ATOM 1049 C CA . LYS A 1 130 ? -13.074 68.230 -17.105 1.00 8.80 ? 130 LYS A CA 1 ATOM 1050 C C . LYS A 1 130 ? -12.098 68.675 -16.013 1.00 8.37 ? 130 LYS A C 1 ATOM 1051 O O . LYS A 1 130 ? -12.516 69.099 -14.930 1.00 7.97 ? 130 LYS A O 1 ATOM 1052 C CB . LYS A 1 130 ? -14.126 67.286 -16.519 1.00 10.76 ? 130 LYS A CB 1 ATOM 1053 C CG . LYS A 1 130 ? -15.284 66.991 -17.465 1.00 14.92 ? 130 LYS A CG 1 ATOM 1054 C CD . LYS A 1 130 ? -16.451 66.330 -16.725 1.00 20.60 ? 130 LYS A CD 1 ATOM 1055 C CE . LYS A 1 130 ? -17.617 65.961 -17.660 1.00 23.56 ? 130 LYS A CE 1 ATOM 1056 N NZ . LYS A 1 130 ? -17.302 64.840 -18.611 1.00 24.71 ? 130 LYS A NZ 1 ATOM 1057 N N . ASN A 1 131 ? -10.802 68.583 -16.304 1.00 8.10 ? 131 ASN A N 1 ATOM 1058 C CA . ASN A 1 131 ? -9.766 68.992 -15.357 1.00 8.49 ? 131 ASN A CA 1 ATOM 1059 C C . ASN A 1 131 ? -9.982 70.442 -14.919 1.00 8.44 ? 131 ASN A C 1 ATOM 1060 O O . ASN A 1 131 ? -10.232 71.320 -15.754 1.00 9.56 ? 131 ASN A O 1 ATOM 1061 C CB . ASN A 1 131 ? -8.390 68.864 -16.012 1.00 8.75 ? 131 ASN A CB 1 ATOM 1062 C CG . ASN A 1 131 ? -7.782 67.494 -15.836 1.00 9.40 ? 131 ASN A CG 1 ATOM 1063 O OD1 . ASN A 1 131 ? -7.102 66.992 -16.724 1.00 10.69 ? 131 ASN A OD1 1 ATOM 1064 N ND2 . ASN A 1 131 ? -8.004 66.887 -14.677 1.00 10.57 ? 131 ASN A ND2 1 ATOM 1065 N N . PRO A 1 132 ? -9.855 70.728 -13.614 1.00 8.09 ? 132 PRO A N 1 ATOM 1066 C CA . PRO A 1 132 ? -9.528 69.855 -12.484 1.00 8.05 ? 132 PRO A CA 1 ATOM 1067 C C . PRO A 1 132 ? -10.667 68.938 -12.073 1.00 7.98 ? 132 PRO A C 1 ATOM 1068 O O . PRO A 1 132 ? -11.841 69.317 -12.148 1.00 9.14 ? 132 PRO A O 1 ATOM 1069 C CB . PRO A 1 132 ? -9.189 70.843 -11.384 1.00 8.29 ? 132 PRO A CB 1 ATOM 1070 C CG . PRO A 1 132 ? -10.171 71.932 -11.649 1.00 8.97 ? 132 PRO A CG 1 ATOM 1071 C CD . PRO A 1 132 ? -10.078 72.107 -13.146 1.00 8.55 ? 132 PRO A CD 1 ATOM 1072 N N . LEU A 1 133 ? -10.302 67.738 -11.623 1.00 6.91 ? 133 LEU A N 1 ATOM 1073 C CA . LEU A 1 133 ? -11.262 66.732 -11.186 1.00 5.48 ? 133 LEU A CA 1 ATOM 1074 C C . LEU A 1 133 ? -11.614 66.910 -9.730 1.00 5.44 ? 133 LEU A C 1 ATOM 1075 O O . LEU A 1 133 ? -12.671 66.478 -9.279 1.00 6.11 ? 133 LEU A O 1 ATOM 1076 C CB . LEU A 1 133 ? -10.701 65.329 -11.376 1.00 3.24 ? 133 LEU A CB 1 ATOM 1077 C CG . LEU A 1 133 ? -11.143 64.575 -12.623 1.00 2.62 ? 133 LEU A CG 1 ATOM 1078 C CD1 . LEU A 1 133 ? -10.561 65.224 -13.848 1.00 2.03 ? 133 LEU A CD1 1 ATOM 1079 C CD2 . LEU A 1 133 ? -10.693 63.124 -12.515 1.00 2.90 ? 133 LEU A CD2 1 ATOM 1080 N N . ILE A 1 134 ? -10.711 67.535 -8.990 1.00 5.77 ? 134 ILE A N 1 ATOM 1081 C CA . ILE A 1 134 ? -10.935 67.767 -7.579 1.00 6.38 ? 134 ILE A CA 1 ATOM 1082 C C . ILE A 1 134 ? -10.290 69.069 -7.163 1.00 8.30 ? 134 ILE A C 1 ATOM 1083 O O . ILE A 1 134 ? -9.164 69.381 -7.563 1.00 9.58 ? 134 ILE A O 1 ATOM 1084 C CB . ILE A 1 134 ? -10.354 66.647 -6.741 1.00 4.15 ? 134 ILE A CB 1 ATOM 1085 C CG1 . ILE A 1 134 ? -10.999 65.326 -7.137 1.00 3.14 ? 134 ILE A CG1 1 ATOM 1086 C CG2 . ILE A 1 134 ? -10.597 66.929 -5.289 1.00 3.85 ? 134 ILE A CG2 1 ATOM 1087 C CD1 . ILE A 1 134 ? -10.455 64.135 -6.413 1.00 3.51 ? 134 ILE A CD1 1 ATOM 1088 N N . THR A 1 135 ? -11.021 69.828 -6.356 1.00 10.01 ? 135 THR A N 1 ATOM 1089 C CA . THR A 1 135 ? -10.551 71.112 -5.864 1.00 11.74 ? 135 THR A CA 1 ATOM 1090 C C . THR A 1 135 ? -10.562 71.118 -4.342 1.00 11.65 ? 135 THR A C 1 ATOM 1091 O O . THR A 1 135 ? -11.290 70.346 -3.709 1.00 11.69 ? 135 THR A O 1 ATOM 1092 C CB . THR A 1 135 ? -11.451 72.238 -6.343 1.00 12.37 ? 135 THR A CB 1 ATOM 1093 O OG1 . THR A 1 135 ? -12.761 72.069 -5.778 1.00 15.82 ? 135 THR A OG1 1 ATOM 1094 C CG2 . THR A 1 135 ? -11.543 72.220 -7.850 1.00 12.73 ? 135 THR A CG2 1 ATOM 1095 N N . PRO A 1 136 ? -9.761 72.004 -3.737 1.00 11.44 ? 136 PRO A N 1 ATOM 1096 C CA . PRO A 1 136 ? -9.676 72.113 -2.287 1.00 12.30 ? 136 PRO A CA 1 ATOM 1097 C C . PRO A 1 136 ? -11.050 72.020 -1.665 1.00 14.49 ? 136 PRO A C 1 ATOM 1098 O O . PRO A 1 136 ? -12.025 72.544 -2.211 1.00 14.29 ? 136 PRO A O 1 ATOM 1099 C CB . PRO A 1 136 ? -9.047 73.479 -2.094 1.00 11.65 ? 136 PRO A CB 1 ATOM 1100 C CG . PRO A 1 136 ? -8.112 73.551 -3.238 1.00 10.82 ? 136 PRO A CG 1 ATOM 1101 C CD . PRO A 1 136 ? -8.974 73.069 -4.376 1.00 11.53 ? 136 PRO A CD 1 ATOM 1102 N N . PRO A 1 137 ? -11.146 71.330 -0.520 1.00 16.66 ? 137 PRO A N 1 ATOM 1103 C CA . PRO A 1 137 ? -12.395 71.139 0.221 1.00 18.26 ? 137 PRO A CA 1 ATOM 1104 C C . PRO A 1 137 ? -12.853 72.447 0.834 1.00 20.92 ? 137 PRO A C 1 ATOM 1105 O O . PRO A 1 137 ? -12.312 73.514 0.526 1.00 20.89 ? 137 PRO A O 1 ATOM 1106 C CB . PRO A 1 137 ? -12.017 70.116 1.289 1.00 18.35 ? 137 PRO A CB 1 ATOM 1107 C CG . PRO A 1 137 ? -10.872 69.375 0.674 1.00 18.33 ? 137 PRO A CG 1 ATOM 1108 C CD . PRO A 1 137 ? -10.079 70.488 0.043 1.00 17.07 ? 137 PRO A CD 1 ATOM 1109 N N . GLU A 1 138 ? -13.843 72.352 1.715 1.00 23.80 ? 138 GLU A N 1 ATOM 1110 C CA . GLU A 1 138 ? -14.392 73.526 2.375 1.00 25.97 ? 138 GLU A CA 1 ATOM 1111 C C . GLU A 1 138 ? -13.317 74.411 2.989 1.00 25.48 ? 138 GLU A C 1 ATOM 1112 O O . GLU A 1 138 ? -12.770 75.288 2.315 1.00 27.78 ? 138 GLU A O 1 ATOM 1113 C CB . GLU A 1 138 ? -15.392 73.117 3.461 1.00 30.02 ? 138 GLU A CB 1 ATOM 1114 C CG . GLU A 1 138 ? -16.046 74.310 4.195 1.00 34.42 ? 138 GLU A CG 1 ATOM 1115 C CD . GLU A 1 138 ? -17.062 75.082 3.334 1.00 36.66 ? 138 GLU A CD 1 ATOM 1116 O OE1 . GLU A 1 138 ? -18.284 74.784 3.428 1.00 36.28 ? 138 GLU A OE1 1 ATOM 1117 O OE2 . GLU A 1 138 ? -16.630 75.981 2.563 1.00 37.69 ? 138 GLU A OE2 1 ATOM 1118 N N . GLY A 1 139 ? -13.012 74.183 4.262 1.00 22.58 ? 139 GLY A N 1 ATOM 1119 C CA . GLY A 1 139 ? -12.019 75.005 4.925 1.00 20.59 ? 139 GLY A CA 1 ATOM 1120 C C . GLY A 1 139 ? -10.583 74.619 4.647 1.00 19.14 ? 139 GLY A C 1 ATOM 1121 O O . GLY A 1 139 ? -9.881 74.190 5.558 1.00 20.38 ? 139 GLY A O 1 ATOM 1122 N N . VAL A 1 140 ? -10.136 74.774 3.405 1.00 17.31 ? 140 VAL A N 1 ATOM 1123 C CA . VAL A 1 140 ? -8.766 74.424 3.045 1.00 15.91 ? 140 VAL A CA 1 ATOM 1124 C C . VAL A 1 140 ? -8.124 75.471 2.127 1.00 15.52 ? 140 VAL A C 1 ATOM 1125 O O . VAL A 1 140 ? -8.704 75.862 1.108 1.00 16.46 ? 140 VAL A O 1 ATOM 1126 C CB . VAL A 1 140 ? -8.719 73.044 2.350 1.00 15.76 ? 140 VAL A CB 1 ATOM 1127 C CG1 . VAL A 1 140 ? -7.277 72.668 2.044 1.00 16.00 ? 140 VAL A CG1 1 ATOM 1128 C CG2 . VAL A 1 140 ? -9.372 71.986 3.235 1.00 14.04 ? 140 VAL A CG2 1 ATOM 1129 N N . LYS A 1 141 ? -6.925 75.923 2.487 1.00 14.27 ? 141 LYS A N 1 ATOM 1130 C CA . LYS A 1 141 ? -6.240 76.928 1.685 1.00 13.99 ? 141 LYS A CA 1 ATOM 1131 C C . LYS A 1 141 ? -5.716 76.377 0.357 1.00 12.31 ? 141 LYS A C 1 ATOM 1132 O O . LYS A 1 141 ? -5.139 75.298 0.289 1.00 12.07 ? 141 LYS A O 1 ATOM 1133 C CB . LYS A 1 141 ? -5.100 77.576 2.491 1.00 16.12 ? 141 LYS A CB 1 ATOM 1134 C CG . LYS A 1 141 ? -5.586 78.537 3.574 1.00 18.77 ? 141 LYS A CG 1 ATOM 1135 C CD . LYS A 1 141 ? -4.441 79.286 4.255 1.00 21.69 ? 141 LYS A CD 1 ATOM 1136 C CE . LYS A 1 141 ? -4.960 80.424 5.154 1.00 23.74 ? 141 LYS A CE 1 ATOM 1137 N NZ . LYS A 1 141 ? -5.593 81.561 4.383 1.00 25.42 ? 141 LYS A NZ 1 ATOM 1138 N N . ASP A 1 142 ? -5.924 77.152 -0.695 1.00 10.62 ? 142 ASP A N 1 ATOM 1139 C CA . ASP A 1 142 ? -5.523 76.802 -2.045 1.00 9.42 ? 142 ASP A CA 1 ATOM 1140 C C . ASP A 1 142 ? -4.073 76.400 -2.282 1.00 9.08 ? 142 ASP A C 1 ATOM 1141 O O . ASP A 1 142 ? -3.658 76.261 -3.426 1.00 9.85 ? 142 ASP A O 1 ATOM 1142 C CB . ASP A 1 142 ? -5.894 77.958 -2.966 1.00 10.53 ? 142 ASP A CB 1 ATOM 1143 C CG . ASP A 1 142 ? -7.377 78.248 -2.943 1.00 11.88 ? 142 ASP A CG 1 ATOM 1144 O OD1 . ASP A 1 142 ? -7.961 78.237 -1.834 1.00 13.20 ? 142 ASP A OD1 1 ATOM 1145 O OD2 . ASP A 1 142 ? -7.962 78.481 -4.022 1.00 13.19 ? 142 ASP A OD2 1 ATOM 1146 N N . ASP A 1 143 ? -3.293 76.217 -1.228 1.00 9.35 ? 143 ASP A N 1 ATOM 1147 C CA . ASP A 1 143 ? -1.903 75.808 -1.401 1.00 10.65 ? 143 ASP A CA 1 ATOM 1148 C C . ASP A 1 143 ? -1.603 74.761 -0.360 1.00 10.61 ? 143 ASP A C 1 ATOM 1149 O O . ASP A 1 143 ? -0.452 74.553 0.024 1.00 11.81 ? 143 ASP A O 1 ATOM 1150 C CB . ASP A 1 143 ? -0.956 76.988 -1.226 1.00 13.17 ? 143 ASP A CB 1 ATOM 1151 C CG . ASP A 1 143 ? -1.294 77.818 -0.011 1.00 16.65 ? 143 ASP A CG 1 ATOM 1152 O OD1 . ASP A 1 143 ? -1.439 77.236 1.084 1.00 17.60 ? 143 ASP A OD1 1 ATOM 1153 O OD2 . ASP A 1 143 ? -1.418 79.055 -0.150 1.00 20.09 ? 143 ASP A OD2 1 ATOM 1154 N N . CYS A 1 144 ? -2.664 74.111 0.097 1.00 10.10 ? 144 CYS A N 1 ATOM 1155 C CA . CYS A 1 144 ? -2.570 73.065 1.100 1.00 10.12 ? 144 CYS A CA 1 ATOM 1156 C C . CYS A 1 144 ? -3.443 71.884 0.691 1.00 7.85 ? 144 CYS A C 1 ATOM 1157 O O . CYS A 1 144 ? -4.251 71.391 1.475 1.00 8.43 ? 144 CYS A O 1 ATOM 1158 C CB . CYS A 1 144 ? -3.022 73.598 2.464 1.00 11.38 ? 144 CYS A CB 1 ATOM 1159 S SG . CYS A 1 144 ? -1.822 74.689 3.260 1.00 19.76 ? 144 CYS A SG 1 ATOM 1160 N N . PHE A 1 145 ? -3.267 71.417 -0.534 1.00 5.09 ? 145 PHE A N 1 ATOM 1161 C CA . PHE A 1 145 ? -4.076 70.315 -1.006 1.00 3.31 ? 145 PHE A CA 1 ATOM 1162 C C . PHE A 1 145 ? -3.362 69.693 -2.183 1.00 3.72 ? 145 PHE A C 1 ATOM 1163 O O . PHE A 1 145 ? -3.463 70.204 -3.296 1.00 4.09 ? 145 PHE A O 1 ATOM 1164 C CB . PHE A 1 145 ? -5.419 70.865 -1.440 1.00 1.18 ? 145 PHE A CB 1 ATOM 1165 C CG . PHE A 1 145 ? -6.406 69.823 -1.820 1.00 0.96 ? 145 PHE A CG 1 ATOM 1166 C CD1 . PHE A 1 145 ? -6.804 68.866 -0.906 1.00 0.96 ? 145 PHE A CD1 1 ATOM 1167 C CD2 . PHE A 1 145 ? -7.000 69.845 -3.065 1.00 0.96 ? 145 PHE A CD2 1 ATOM 1168 C CE1 . PHE A 1 145 ? -7.784 67.954 -1.225 1.00 0.96 ? 145 PHE A CE1 1 ATOM 1169 C CE2 . PHE A 1 145 ? -7.980 68.939 -3.396 1.00 0.96 ? 145 PHE A CE2 1 ATOM 1170 C CZ . PHE A 1 145 ? -8.377 67.991 -2.472 1.00 0.96 ? 145 PHE A CZ 1 ATOM 1171 N N . ARG A 1 146 ? -2.640 68.597 -1.960 1.00 2.95 ? 146 ARG A N 1 ATOM 1172 C CA . ARG A 1 146 ? -1.917 67.985 -3.066 1.00 2.93 ? 146 ARG A CA 1 ATOM 1173 C C . ARG A 1 146 ? -1.360 66.580 -2.863 1.00 2.70 ? 146 ARG A C 1 ATOM 1174 O O . ARG A 1 146 ? -1.601 65.925 -1.851 1.00 3.51 ? 146 ARG A O 1 ATOM 1175 C CB . ARG A 1 146 ? -0.769 68.894 -3.468 1.00 2.37 ? 146 ARG A CB 1 ATOM 1176 C CG . ARG A 1 146 ? 0.169 69.170 -2.336 1.00 2.48 ? 146 ARG A CG 1 ATOM 1177 C CD . ARG A 1 146 ? 1.463 69.806 -2.801 1.00 4.65 ? 146 ARG A CD 1 ATOM 1178 N NE . ARG A 1 146 ? 2.262 70.206 -1.652 1.00 6.13 ? 146 ARG A NE 1 ATOM 1179 C CZ . ARG A 1 146 ? 1.843 71.063 -0.725 1.00 6.51 ? 146 ARG A CZ 1 ATOM 1180 N NH1 . ARG A 1 146 ? 0.638 71.613 -0.820 1.00 5.64 ? 146 ARG A NH1 1 ATOM 1181 N NH2 . ARG A 1 146 ? 2.619 71.351 0.311 1.00 6.86 ? 146 ARG A NH2 1 ATOM 1182 N N . ASP A 1 147 ? -0.623 66.134 -3.873 1.00 2.32 ? 147 ASP A N 1 ATOM 1183 C CA . ASP A 1 147 ? 0.036 64.838 -3.893 1.00 2.45 ? 147 ASP A CA 1 ATOM 1184 C C . ASP A 1 147 ? -0.842 63.583 -3.791 1.00 3.08 ? 147 ASP A C 1 ATOM 1185 O O . ASP A 1 147 ? -0.600 62.709 -2.943 1.00 4.78 ? 147 ASP A O 1 ATOM 1186 C CB . ASP A 1 147 ? 1.112 64.814 -2.811 1.00 0.96 ? 147 ASP A CB 1 ATOM 1187 C CG . ASP A 1 147 ? 2.011 66.033 -2.864 1.00 0.96 ? 147 ASP A CG 1 ATOM 1188 O OD1 . ASP A 1 147 ? 2.225 66.586 -3.960 1.00 0.96 ? 147 ASP A OD1 1 ATOM 1189 O OD2 . ASP A 1 147 ? 2.522 66.436 -1.805 1.00 1.57 ? 147 ASP A OD2 1 ATOM 1190 N N . PRO A 1 148 ? -1.839 63.455 -4.692 1.00 2.58 ? 148 PRO A N 1 ATOM 1191 C CA . PRO A 1 148 ? -2.784 62.331 -4.765 1.00 1.83 ? 148 PRO A CA 1 ATOM 1192 C C . PRO A 1 148 ? -2.055 61.000 -4.877 1.00 0.96 ? 148 PRO A C 1 ATOM 1193 O O . PRO A 1 148 ? -1.000 60.911 -5.491 1.00 0.96 ? 148 PRO A O 1 ATOM 1194 C CB . PRO A 1 148 ? -3.598 62.649 -6.009 1.00 1.55 ? 148 PRO A CB 1 ATOM 1195 C CG . PRO A 1 148 ? -2.609 63.344 -6.869 1.00 2.56 ? 148 PRO A CG 1 ATOM 1196 C CD . PRO A 1 148 ? -1.944 64.286 -5.902 1.00 2.39 ? 148 PRO A CD 1 ATOM 1197 N N . SER A 1 149 ? -2.642 59.962 -4.305 1.00 0.96 ? 149 SER A N 1 ATOM 1198 C CA . SER A 1 149 ? -2.018 58.650 -4.288 1.00 0.96 ? 149 SER A CA 1 ATOM 1199 C C . SER A 1 149 ? -2.497 57.703 -5.341 1.00 1.37 ? 149 SER A C 1 ATOM 1200 O O . SER A 1 149 ? -3.445 57.977 -6.061 1.00 2.11 ? 149 SER A O 1 ATOM 1201 C CB . SER A 1 149 ? -2.301 57.978 -2.965 1.00 1.46 ? 149 SER A CB 1 ATOM 1202 O OG . SER A 1 149 ? -3.685 57.681 -2.882 1.00 0.96 ? 149 SER A OG 1 ATOM 1203 N N . THR A 1 150 ? -1.834 56.558 -5.400 1.00 2.29 ? 150 THR A N 1 ATOM 1204 C CA . THR A 1 150 ? -2.239 55.508 -6.314 1.00 2.74 ? 150 THR A CA 1 ATOM 1205 C C . THR A 1 150 ? -3.570 55.059 -5.720 1.00 2.41 ? 150 THR A C 1 ATOM 1206 O O . THR A 1 150 ? -3.689 54.898 -4.501 1.00 2.27 ? 150 THR A O 1 ATOM 1207 C CB . THR A 1 150 ? -1.246 54.340 -6.283 1.00 2.91 ? 150 THR A CB 1 ATOM 1208 O OG1 . THR A 1 150 ? -0.026 54.744 -6.914 1.00 5.55 ? 150 THR A OG1 1 ATOM 1209 C CG2 . THR A 1 150 ? -1.810 53.128 -6.989 1.00 1.45 ? 150 THR A CG2 1 ATOM 1210 N N . ALA A 1 151 ? -4.565 54.878 -6.579 1.00 2.18 ? 151 ALA A N 1 ATOM 1211 C CA . ALA A 1 151 ? -5.901 54.470 -6.163 1.00 1.76 ? 151 ALA A CA 1 ATOM 1212 C C . ALA A 1 151 ? -6.025 52.980 -5.894 1.00 1.82 ? 151 ALA A C 1 ATOM 1213 O O . ALA A 1 151 ? -5.225 52.179 -6.385 1.00 2.16 ? 151 ALA A O 1 ATOM 1214 C CB . ALA A 1 151 ? -6.893 54.860 -7.222 1.00 1.70 ? 151 ALA A CB 1 ATOM 1215 N N . TRP A 1 152 ? -7.031 52.612 -5.106 1.00 1.65 ? 152 TRP A N 1 ATOM 1216 C CA . TRP A 1 152 ? -7.272 51.208 -4.812 1.00 2.10 ? 152 TRP A CA 1 ATOM 1217 C C . TRP A 1 152 ? -8.749 50.889 -4.940 1.00 2.81 ? 152 TRP A C 1 ATOM 1218 O O . TRP A 1 152 ? -9.604 51.673 -4.530 1.00 3.06 ? 152 TRP A O 1 ATOM 1219 C CB . TRP A 1 152 ? -6.723 50.821 -3.431 1.00 2.18 ? 152 TRP A CB 1 ATOM 1220 C CG . TRP A 1 152 ? -7.308 51.506 -2.227 1.00 1.81 ? 152 TRP A CG 1 ATOM 1221 C CD1 . TRP A 1 152 ? -8.330 51.056 -1.437 1.00 0.96 ? 152 TRP A CD1 1 ATOM 1222 C CD2 . TRP A 1 152 ? -6.854 52.726 -1.636 1.00 1.20 ? 152 TRP A CD2 1 ATOM 1223 N NE1 . TRP A 1 152 ? -8.532 51.919 -0.388 1.00 0.96 ? 152 TRP A NE1 1 ATOM 1224 C CE2 . TRP A 1 152 ? -7.640 52.953 -0.489 1.00 1.25 ? 152 TRP A CE2 1 ATOM 1225 C CE3 . TRP A 1 152 ? -5.860 53.650 -1.967 1.00 1.57 ? 152 TRP A CE3 1 ATOM 1226 C CZ2 . TRP A 1 152 ? -7.460 54.066 0.326 1.00 1.76 ? 152 TRP A CZ2 1 ATOM 1227 C CZ3 . TRP A 1 152 ? -5.683 54.753 -1.158 1.00 2.09 ? 152 TRP A CZ3 1 ATOM 1228 C CH2 . TRP A 1 152 ? -6.479 54.953 -0.026 1.00 2.10 ? 152 TRP A CH2 1 ATOM 1229 N N . LEU A 1 153 ? -9.039 49.742 -5.547 1.00 4.14 ? 153 LEU A N 1 ATOM 1230 C CA . LEU A 1 153 ? -10.414 49.323 -5.776 1.00 5.33 ? 153 LEU A CA 1 ATOM 1231 C C . LEU A 1 153 ? -10.934 48.435 -4.664 1.00 6.25 ? 153 LEU A C 1 ATOM 1232 O O . LEU A 1 153 ? -10.342 47.400 -4.348 1.00 7.24 ? 153 LEU A O 1 ATOM 1233 C CB . LEU A 1 153 ? -10.528 48.580 -7.106 1.00 5.17 ? 153 LEU A CB 1 ATOM 1234 C CG . LEU A 1 153 ? -11.954 48.444 -7.645 1.00 5.18 ? 153 LEU A CG 1 ATOM 1235 C CD1 . LEU A 1 153 ? -12.527 49.834 -7.854 1.00 5.09 ? 153 LEU A CD1 1 ATOM 1236 C CD2 . LEU A 1 153 ? -11.963 47.666 -8.954 1.00 3.92 ? 153 LEU A CD2 1 ATOM 1237 N N . GLY A 1 154 ? -12.054 48.854 -4.085 1.00 6.44 ? 154 GLY A N 1 ATOM 1238 C CA . GLY A 1 154 ? -12.670 48.113 -3.004 1.00 5.95 ? 154 GLY A CA 1 ATOM 1239 C C . GLY A 1 154 ? -13.515 46.952 -3.482 1.00 6.69 ? 154 GLY A C 1 ATOM 1240 O O . GLY A 1 154 ? -13.939 46.902 -4.637 1.00 5.47 ? 154 GLY A O 1 ATOM 1241 N N . PRO A 1 155 ? -13.799 46.000 -2.592 1.00 8.11 ? 155 PRO A N 1 ATOM 1242 C CA . PRO A 1 155 ? -14.603 44.831 -2.951 1.00 9.74 ? 155 PRO A CA 1 ATOM 1243 C C . PRO A 1 155 ? -15.979 45.219 -3.485 1.00 11.20 ? 155 PRO A C 1 ATOM 1244 O O . PRO A 1 155 ? -16.620 44.444 -4.207 1.00 11.33 ? 155 PRO A O 1 ATOM 1245 C CB . PRO A 1 155 ? -14.677 44.064 -1.637 1.00 10.09 ? 155 PRO A CB 1 ATOM 1246 C CG . PRO A 1 155 ? -14.702 45.181 -0.612 1.00 9.15 ? 155 PRO A CG 1 ATOM 1247 C CD . PRO A 1 155 ? -13.629 46.101 -1.131 1.00 8.58 ? 155 PRO A CD 1 ATOM 1248 N N . ASP A 1 156 ? -16.411 46.428 -3.128 1.00 11.96 ? 156 ASP A N 1 ATOM 1249 C CA . ASP A 1 156 ? -17.711 46.950 -3.537 1.00 12.85 ? 156 ASP A CA 1 ATOM 1250 C C . ASP A 1 156 ? -17.683 47.602 -4.914 1.00 12.69 ? 156 ASP A C 1 ATOM 1251 O O . ASP A 1 156 ? -18.716 48.063 -5.410 1.00 12.43 ? 156 ASP A O 1 ATOM 1252 C CB . ASP A 1 156 ? -18.204 47.971 -2.524 1.00 14.29 ? 156 ASP A CB 1 ATOM 1253 C CG . ASP A 1 156 ? -17.244 49.122 -2.358 1.00 15.21 ? 156 ASP A CG 1 ATOM 1254 O OD1 . ASP A 1 156 ? -16.464 49.371 -3.297 1.00 15.81 ? 156 ASP A OD1 1 ATOM 1255 O OD2 . ASP A 1 156 ? -17.277 49.783 -1.299 1.00 17.90 ? 156 ASP A OD2 1 ATOM 1256 N N . GLY A 1 157 ? -16.496 47.659 -5.514 1.00 12.31 ? 157 GLY A N 1 ATOM 1257 C CA . GLY A 1 157 ? -16.356 48.244 -6.837 1.00 11.54 ? 157 GLY A CA 1 ATOM 1258 C C . GLY A 1 157 ? -16.045 49.730 -6.904 1.00 10.64 ? 157 GLY A C 1 ATOM 1259 O O . GLY A 1 157 ? -15.937 50.294 -7.993 1.00 12.20 ? 157 GLY A O 1 ATOM 1260 N N . VAL A 1 158 ? -15.892 50.370 -5.754 1.00 9.37 ? 158 VAL A N 1 ATOM 1261 C CA . VAL A 1 158 ? -15.593 51.791 -5.718 1.00 9.05 ? 158 VAL A CA 1 ATOM 1262 C C . VAL A 1 158 ? -14.095 51.994 -5.507 1.00 8.43 ? 158 VAL A C 1 ATOM 1263 O O . VAL A 1 158 ? -13.447 51.189 -4.838 1.00 8.07 ? 158 VAL A O 1 ATOM 1264 C CB . VAL A 1 158 ? -16.363 52.467 -4.575 1.00 10.01 ? 158 VAL A CB 1 ATOM 1265 C CG1 . VAL A 1 158 ? -16.372 53.976 -4.767 1.00 11.58 ? 158 VAL A CG1 1 ATOM 1266 C CG2 . VAL A 1 158 ? -17.782 51.919 -4.519 1.00 11.28 ? 158 VAL A CG2 1 ATOM 1267 N N . TRP A 1 159 ? -13.541 53.059 -6.084 1.00 7.62 ? 159 TRP A N 1 ATOM 1268 C CA . TRP A 1 159 ? -12.115 53.340 -5.925 1.00 7.17 ? 159 TRP A CA 1 ATOM 1269 C C . TRP A 1 159 ? -11.862 54.219 -4.704 1.00 7.14 ? 159 TRP A C 1 ATOM 1270 O O . TRP A 1 159 ? -12.793 54.801 -4.145 1.00 7.50 ? 159 TRP A O 1 ATOM 1271 C CB . TRP A 1 159 ? -11.554 54.063 -7.144 1.00 6.74 ? 159 TRP A CB 1 ATOM 1272 C CG . TRP A 1 159 ? -11.510 53.282 -8.421 1.00 6.57 ? 159 TRP A CG 1 ATOM 1273 C CD1 . TRP A 1 159 ? -12.397 53.358 -9.453 1.00 6.77 ? 159 TRP A CD1 1 ATOM 1274 C CD2 . TRP A 1 159 ? -10.466 52.402 -8.856 1.00 5.50 ? 159 TRP A CD2 1 ATOM 1275 N NE1 . TRP A 1 159 ? -11.962 52.594 -10.508 1.00 7.38 ? 159 TRP A NE1 1 ATOM 1276 C CE2 . TRP A 1 159 ? -10.780 51.996 -10.164 1.00 5.43 ? 159 TRP A CE2 1 ATOM 1277 C CE3 . TRP A 1 159 ? -9.295 51.921 -8.266 1.00 5.45 ? 159 TRP A CE3 1 ATOM 1278 C CZ2 . TRP A 1 159 ? -9.964 51.133 -10.893 1.00 5.70 ? 159 TRP A CZ2 1 ATOM 1279 C CZ3 . TRP A 1 159 ? -8.486 51.063 -8.994 1.00 3.74 ? 159 TRP A CZ3 1 ATOM 1280 C CH2 . TRP A 1 159 ? -8.823 50.679 -10.291 1.00 3.76 ? 159 TRP A CH2 1 ATOM 1281 N N . ARG A 1 160 ? -10.596 54.325 -4.309 1.00 6.45 ? 160 ARG A N 1 ATOM 1282 C CA . ARG A 1 160 ? -10.197 55.137 -3.160 1.00 5.60 ? 160 ARG A CA 1 ATOM 1283 C C . ARG A 1 160 ? -8.815 55.734 -3.377 1.00 5.58 ? 160 ARG A C 1 ATOM 1284 O O . ARG A 1 160 ? -7.901 55.037 -3.822 1.00 6.61 ? 160 ARG A O 1 ATOM 1285 C CB . ARG A 1 160 ? -10.121 54.287 -1.889 1.00 5.93 ? 160 ARG A CB 1 ATOM 1286 C CG . ARG A 1 160 ? -11.386 54.137 -1.073 1.00 6.83 ? 160 ARG A CG 1 ATOM 1287 C CD . ARG A 1 160 ? -12.291 53.063 -1.628 1.00 8.53 ? 160 ARG A CD 1 ATOM 1288 N NE . ARG A 1 160 ? -13.285 52.628 -0.649 1.00 9.12 ? 160 ARG A NE 1 ATOM 1289 C CZ . ARG A 1 160 ? -14.241 51.738 -0.901 1.00 8.87 ? 160 ARG A CZ 1 ATOM 1290 N NH1 . ARG A 1 160 ? -14.333 51.193 -2.109 1.00 7.08 ? 160 ARG A NH1 1 ATOM 1291 N NH2 . ARG A 1 160 ? -15.096 51.388 0.057 1.00 8.88 ? 160 ARG A NH2 1 ATOM 1292 N N . ILE A 1 161 ? -8.654 57.014 -3.064 1.00 4.02 ? 161 ILE A N 1 ATOM 1293 C CA . ILE A 1 161 ? -7.345 57.650 -3.178 1.00 3.06 ? 161 ILE A CA 1 ATOM 1294 C C . ILE A 1 161 ? -7.227 58.623 -2.037 1.00 2.67 ? 161 ILE A C 1 ATOM 1295 O O . ILE A 1 161 ? -8.194 58.885 -1.345 1.00 3.69 ? 161 ILE A O 1 ATOM 1296 C CB . ILE A 1 161 ? -7.173 58.481 -4.461 1.00 1.85 ? 161 ILE A CB 1 ATOM 1297 C CG1 . ILE A 1 161 ? -8.179 59.620 -4.464 1.00 1.09 ? 161 ILE A CG1 1 ATOM 1298 C CG2 . ILE A 1 161 ? -7.306 57.613 -5.680 1.00 1.18 ? 161 ILE A CG2 1 ATOM 1299 C CD1 . ILE A 1 161 ? -8.018 60.530 -5.639 1.00 1.87 ? 161 ILE A CD1 1 ATOM 1300 N N . VAL A 1 162 ? -6.040 59.159 -1.827 1.00 2.51 ? 162 VAL A N 1 ATOM 1301 C CA . VAL A 1 162 ? -5.891 60.152 -0.786 1.00 2.23 ? 162 VAL A CA 1 ATOM 1302 C C . VAL A 1 162 ? -5.111 61.329 -1.328 1.00 2.52 ? 162 VAL A C 1 ATOM 1303 O O . VAL A 1 162 ? -4.332 61.198 -2.273 1.00 2.59 ? 162 VAL A O 1 ATOM 1304 C CB . VAL A 1 162 ? -5.190 59.600 0.456 1.00 1.06 ? 162 VAL A CB 1 ATOM 1305 C CG1 . VAL A 1 162 ? -6.152 58.766 1.245 1.00 1.88 ? 162 VAL A CG1 1 ATOM 1306 C CG2 . VAL A 1 162 ? -4.004 58.778 0.055 1.00 1.99 ? 162 VAL A CG2 1 ATOM 1307 N N . VAL A 1 163 ? -5.354 62.492 -0.743 1.00 1.96 ? 163 VAL A N 1 ATOM 1308 C CA . VAL A 1 163 ? -4.664 63.693 -1.154 1.00 1.85 ? 163 VAL A CA 1 ATOM 1309 C C . VAL A 1 163 ? -4.112 64.329 0.105 1.00 2.51 ? 163 VAL A C 1 ATOM 1310 O O . VAL A 1 163 ? -4.767 64.330 1.146 1.00 1.85 ? 163 VAL A O 1 ATOM 1311 C CB . VAL A 1 163 ? -5.613 64.673 -1.832 1.00 1.57 ? 163 VAL A CB 1 ATOM 1312 C CG1 . VAL A 1 163 ? -4.826 65.857 -2.363 1.00 1.74 ? 163 VAL A CG1 1 ATOM 1313 C CG2 . VAL A 1 163 ? -6.373 63.978 -2.941 1.00 0.96 ? 163 VAL A CG2 1 ATOM 1314 N N . GLY A 1 164 ? -2.901 64.859 0.015 1.00 3.81 ? 164 GLY A N 1 ATOM 1315 C CA . GLY A 1 164 ? -2.304 65.479 1.176 1.00 5.86 ? 164 GLY A CA 1 ATOM 1316 C C . GLY A 1 164 ? -2.872 66.854 1.448 1.00 7.68 ? 164 GLY A C 1 ATOM 1317 O O . GLY A 1 164 ? -3.789 67.314 0.766 1.00 7.10 ? 164 GLY A O 1 ATOM 1318 N N . GLY A 1 165 ? -2.312 67.513 2.457 1.00 10.16 ? 165 GLY A N 1 ATOM 1319 C CA . GLY A 1 165 ? -2.752 68.845 2.819 1.00 12.58 ? 165 GLY A CA 1 ATOM 1320 C C . GLY A 1 165 ? -3.024 68.944 4.302 1.00 14.73 ? 165 GLY A C 1 ATOM 1321 O O . GLY A 1 165 ? -2.795 67.992 5.053 1.00 15.48 ? 165 GLY A O 1 ATOM 1322 N N . ASP A 1 166 ? -3.512 70.102 4.731 1.00 16.18 ? 166 ASP A N 1 ATOM 1323 C CA . ASP A 1 166 ? -3.830 70.300 6.136 1.00 17.07 ? 166 ASP A CA 1 ATOM 1324 C C . ASP A 1 166 ? -5.128 71.072 6.316 1.00 16.78 ? 166 ASP A C 1 ATOM 1325 O O . ASP A 1 166 ? -5.638 71.701 5.379 1.00 16.09 ? 166 ASP A O 1 ATOM 1326 C CB . ASP A 1 166 ? -2.675 71.021 6.869 1.00 18.97 ? 166 ASP A CB 1 ATOM 1327 C CG . ASP A 1 166 ? -2.401 72.442 6.339 1.00 20.92 ? 166 ASP A CG 1 ATOM 1328 O OD1 . ASP A 1 166 ? -3.261 73.342 6.507 1.00 22.24 ? 166 ASP A OD1 1 ATOM 1329 O OD2 . ASP A 1 166 ? -1.308 72.658 5.764 1.00 21.47 ? 166 ASP A OD2 1 ATOM 1330 N N . ARG A 1 167 ? -5.667 70.993 7.526 1.00 16.22 ? 167 ARG A N 1 ATOM 1331 C CA . ARG A 1 167 ? -6.884 71.703 7.874 1.00 16.60 ? 167 ARG A CA 1 ATOM 1332 C C . ARG A 1 167 ? -6.583 72.423 9.182 1.00 16.80 ? 167 ARG A C 1 ATOM 1333 O O . ARG A 1 167 ? -6.625 71.826 10.260 1.00 17.20 ? 167 ARG A O 1 ATOM 1334 C CB . ARG A 1 167 ? -8.054 70.730 8.060 1.00 16.39 ? 167 ARG A CB 1 ATOM 1335 C CG . ARG A 1 167 ? -9.409 71.429 8.207 1.00 17.33 ? 167 ARG A CG 1 ATOM 1336 C CD . ARG A 1 167 ? -10.508 70.463 8.629 1.00 18.75 ? 167 ARG A CD 1 ATOM 1337 N NE . ARG A 1 167 ? -10.897 69.542 7.565 1.00 19.36 ? 167 ARG A NE 1 ATOM 1338 C CZ . ARG A 1 167 ? -11.590 69.896 6.487 1.00 19.76 ? 167 ARG A CZ 1 ATOM 1339 N NH1 . ARG A 1 167 ? -11.973 71.153 6.319 1.00 19.79 ? 167 ARG A NH1 1 ATOM 1340 N NH2 . ARG A 1 167 ? -11.910 68.986 5.582 1.00 21.31 ? 167 ARG A NH2 1 ATOM 1341 N N . ASP A 1 168 ? -6.268 73.708 9.084 1.00 17.18 ? 168 ASP A N 1 ATOM 1342 C CA . ASP A 1 168 ? -5.937 74.486 10.269 1.00 18.01 ? 168 ASP A CA 1 ATOM 1343 C C . ASP A 1 168 ? -4.647 73.922 10.857 1.00 16.31 ? 168 ASP A C 1 ATOM 1344 O O . ASP A 1 168 ? -4.504 73.747 12.066 1.00 14.54 ? 168 ASP A O 1 ATOM 1345 C CB . ASP A 1 168 ? -7.076 74.430 11.299 1.00 21.39 ? 168 ASP A CB 1 ATOM 1346 C CG . ASP A 1 168 ? -8.374 75.063 10.784 1.00 24.94 ? 168 ASP A CG 1 ATOM 1347 O OD1 . ASP A 1 168 ? -8.325 76.184 10.212 1.00 26.53 ? 168 ASP A OD1 1 ATOM 1348 O OD2 . ASP A 1 168 ? -9.444 74.436 10.966 1.00 25.95 ? 168 ASP A OD2 1 ATOM 1349 N N . ASN A 1 169 ? -3.717 73.633 9.956 1.00 16.15 ? 169 ASN A N 1 ATOM 1350 C CA . ASN A 1 169 ? -2.405 73.111 10.296 1.00 16.17 ? 169 ASN A CA 1 ATOM 1351 C C . ASN A 1 169 ? -2.412 71.747 10.982 1.00 15.55 ? 169 ASN A C 1 ATOM 1352 O O . ASN A 1 169 ? -1.595 71.485 11.863 1.00 16.57 ? 169 ASN A O 1 ATOM 1353 C CB . ASN A 1 169 ? -1.649 74.121 11.163 1.00 17.54 ? 169 ASN A CB 1 ATOM 1354 C CG . ASN A 1 169 ? -0.148 73.867 11.181 1.00 19.32 ? 169 ASN A CG 1 ATOM 1355 O OD1 . ASN A 1 169 ? 0.522 73.963 10.146 1.00 19.75 ? 169 ASN A OD1 1 ATOM 1356 N ND2 . ASN A 1 169 ? 0.388 73.539 12.361 1.00 19.73 ? 169 ASN A ND2 1 ATOM 1357 N N . ASN A 1 170 ? -3.326 70.875 10.582 1.00 13.85 ? 170 ASN A N 1 ATOM 1358 C CA . ASN A 1 170 ? -3.378 69.538 11.149 1.00 13.07 ? 170 ASN A CA 1 ATOM 1359 C C . ASN A 1 170 ? -3.314 68.553 9.982 1.00 13.12 ? 170 ASN A C 1 ATOM 1360 O O . ASN A 1 170 ? -4.345 68.151 9.453 1.00 14.90 ? 170 ASN A O 1 ATOM 1361 C CB . ASN A 1 170 ? -4.672 69.342 11.942 1.00 14.22 ? 170 ASN A CB 1 ATOM 1362 C CG . ASN A 1 170 ? -4.681 70.108 13.258 1.00 15.96 ? 170 ASN A CG 1 ATOM 1363 O OD1 . ASN A 1 170 ? -3.802 69.928 14.107 1.00 16.65 ? 170 ASN A OD1 1 ATOM 1364 N ND2 . ASN A 1 170 ? -5.688 70.958 13.440 1.00 17.55 ? 170 ASN A ND2 1 ATOM 1365 N N . GLY A 1 171 ? -2.097 68.179 9.583 1.00 12.58 ? 171 GLY A N 1 ATOM 1366 C CA . GLY A 1 171 ? -1.882 67.262 8.465 1.00 10.78 ? 171 GLY A CA 1 ATOM 1367 C C . GLY A 1 171 ? -2.916 66.172 8.236 1.00 9.94 ? 171 GLY A C 1 ATOM 1368 O O . GLY A 1 171 ? -3.246 65.417 9.155 1.00 10.25 ? 171 GLY A O 1 ATOM 1369 N N . MET A 1 172 ? -3.409 66.062 7.005 1.00 8.45 ? 172 MET A N 1 ATOM 1370 C CA . MET A 1 172 ? -4.422 65.064 6.718 1.00 8.17 ? 172 MET A CA 1 ATOM 1371 C C . MET A 1 172 ? -4.308 64.285 5.423 1.00 8.19 ? 172 MET A C 1 ATOM 1372 O O . MET A 1 172 ? -3.644 64.694 4.470 1.00 8.26 ? 172 MET A O 1 ATOM 1373 C CB . MET A 1 172 ? -5.794 65.707 6.724 1.00 9.91 ? 172 MET A CB 1 ATOM 1374 C CG . MET A 1 172 ? -6.097 66.517 7.927 1.00 12.88 ? 172 MET A CG 1 ATOM 1375 S SD . MET A 1 172 ? -7.856 66.684 8.057 1.00 17.58 ? 172 MET A SD 1 ATOM 1376 C CE . MET A 1 172 ? -8.070 66.170 9.801 1.00 18.46 ? 172 MET A CE 1 ATOM 1377 N N . ALA A 1 173 ? -5.014 63.158 5.408 1.00 8.15 ? 173 ALA A N 1 ATOM 1378 C CA . ALA A 1 173 ? -5.094 62.266 4.260 1.00 7.34 ? 173 ALA A CA 1 ATOM 1379 C C . ALA A 1 173 ? -6.537 62.328 3.774 1.00 6.54 ? 173 ALA A C 1 ATOM 1380 O O . ALA A 1 173 ? -7.369 61.499 4.150 1.00 5.41 ? 173 ALA A O 1 ATOM 1381 C CB . ALA A 1 173 ? -4.749 60.843 4.676 1.00 9.32 ? 173 ALA A CB 1 ATOM 1382 N N . PHE A 1 174 ? -6.841 63.335 2.965 1.00 5.68 ? 174 PHE A N 1 ATOM 1383 C CA . PHE A 1 174 ? -8.185 63.488 2.443 1.00 4.51 ? 174 PHE A CA 1 ATOM 1384 C C . PHE A 1 174 ? -8.466 62.291 1.572 1.00 3.97 ? 174 PHE A C 1 ATOM 1385 O O . PHE A 1 174 ? -7.658 61.909 0.727 1.00 4.36 ? 174 PHE A O 1 ATOM 1386 C CB . PHE A 1 174 ? -8.307 64.775 1.637 1.00 4.18 ? 174 PHE A CB 1 ATOM 1387 C CG . PHE A 1 174 ? -8.095 66.003 2.453 1.00 5.09 ? 174 PHE A CG 1 ATOM 1388 C CD1 . PHE A 1 174 ? -8.993 66.344 3.456 1.00 5.57 ? 174 PHE A CD1 1 ATOM 1389 C CD2 . PHE A 1 174 ? -6.973 66.797 2.257 1.00 5.68 ? 174 PHE A CD2 1 ATOM 1390 C CE1 . PHE A 1 174 ? -8.776 67.458 4.254 1.00 7.02 ? 174 PHE A CE1 1 ATOM 1391 C CE2 . PHE A 1 174 ? -6.743 67.911 3.048 1.00 6.70 ? 174 PHE A CE2 1 ATOM 1392 C CZ . PHE A 1 174 ? -7.646 68.245 4.050 1.00 7.37 ? 174 PHE A CZ 1 ATOM 1393 N N . LEU A 1 175 ? -9.621 61.692 1.802 1.00 3.41 ? 175 LEU A N 1 ATOM 1394 C CA . LEU A 1 175 ? -10.025 60.520 1.071 1.00 1.60 ? 175 LEU A CA 1 ATOM 1395 C C . LEU A 1 175 ? -11.185 60.834 0.166 1.00 1.29 ? 175 LEU A C 1 ATOM 1396 O O . LEU A 1 175 ? -12.173 61.405 0.599 1.00 1.62 ? 175 LEU A O 1 ATOM 1397 C CB . LEU A 1 175 ? -10.419 59.438 2.063 1.00 2.27 ? 175 LEU A CB 1 ATOM 1398 C CG . LEU A 1 175 ? -11.089 58.189 1.521 1.00 2.97 ? 175 LEU A CG 1 ATOM 1399 C CD1 . LEU A 1 175 ? -10.270 57.648 0.378 1.00 6.08 ? 175 LEU A CD1 1 ATOM 1400 C CD2 . LEU A 1 175 ? -11.218 57.159 2.632 1.00 3.30 ? 175 LEU A CD2 1 ATOM 1401 N N . TYR A 1 176 ? -11.049 60.474 -1.099 1.00 2.12 ? 176 TYR A N 1 ATOM 1402 C CA . TYR A 1 176 ? -12.100 60.679 -2.080 1.00 3.91 ? 176 TYR A CA 1 ATOM 1403 C C . TYR A 1 176 ? -12.415 59.322 -2.674 1.00 6.44 ? 176 TYR A C 1 ATOM 1404 O O . TYR A 1 176 ? -11.563 58.425 -2.664 1.00 7.60 ? 176 TYR A O 1 ATOM 1405 C CB . TYR A 1 176 ? -11.622 61.590 -3.196 1.00 2.82 ? 176 TYR A CB 1 ATOM 1406 C CG . TYR A 1 176 ? -11.430 63.009 -2.777 1.00 4.07 ? 176 TYR A CG 1 ATOM 1407 C CD1 . TYR A 1 176 ? -10.481 63.355 -1.826 1.00 5.10 ? 176 TYR A CD1 1 ATOM 1408 C CD2 . TYR A 1 176 ? -12.208 64.015 -3.323 1.00 4.65 ? 176 TYR A CD2 1 ATOM 1409 C CE1 . TYR A 1 176 ? -10.317 64.676 -1.432 1.00 5.99 ? 176 TYR A CE1 1 ATOM 1410 C CE2 . TYR A 1 176 ? -12.054 65.328 -2.935 1.00 5.93 ? 176 TYR A CE2 1 ATOM 1411 C CZ . TYR A 1 176 ? -11.112 65.653 -1.994 1.00 5.80 ? 176 TYR A CZ 1 ATOM 1412 O OH . TYR A 1 176 ? -10.981 66.962 -1.623 1.00 7.64 ? 176 TYR A OH 1 ATOM 1413 N N . GLN A 1 177 ? -13.630 59.160 -3.184 1.00 8.42 ? 177 GLN A N 1 ATOM 1414 C CA . GLN A 1 177 ? -13.997 57.898 -3.805 1.00 11.36 ? 177 GLN A CA 1 ATOM 1415 C C . GLN A 1 177 ? -14.667 58.135 -5.151 1.00 12.53 ? 177 GLN A C 1 ATOM 1416 O O . GLN A 1 177 ? -15.215 59.216 -5.396 1.00 14.12 ? 177 GLN A O 1 ATOM 1417 C CB . GLN A 1 177 ? -14.893 57.072 -2.875 1.00 12.92 ? 177 GLN A CB 1 ATOM 1418 C CG . GLN A 1 177 ? -15.820 57.878 -1.981 1.00 18.78 ? 177 GLN A CG 1 ATOM 1419 C CD . GLN A 1 177 ? -16.517 57.012 -0.928 1.00 22.26 ? 177 GLN A CD 1 ATOM 1420 O OE1 . GLN A 1 177 ? -15.863 56.374 -0.091 1.00 22.62 ? 177 GLN A OE1 1 ATOM 1421 N NE2 . GLN A 1 177 ? -17.850 56.987 -0.969 1.00 24.36 ? 177 GLN A NE2 1 ATOM 1422 N N . SER A 1 178 ? -14.589 57.137 -6.032 1.00 12.67 ? 178 SER A N 1 ATOM 1423 C CA . SER A 1 178 ? -15.191 57.227 -7.358 1.00 12.91 ? 178 SER A CA 1 ATOM 1424 C C . SER A 1 178 ? -15.380 55.853 -7.991 1.00 12.85 ? 178 SER A C 1 ATOM 1425 O O . SER A 1 178 ? -14.746 54.877 -7.572 1.00 12.61 ? 178 SER A O 1 ATOM 1426 C CB . SER A 1 178 ? -14.327 58.089 -8.276 1.00 13.56 ? 178 SER A CB 1 ATOM 1427 O OG . SER A 1 178 ? -14.897 58.165 -9.574 1.00 16.54 ? 178 SER A OG 1 ATOM 1428 N N . THR A 1 179 ? -16.249 55.794 -9.006 1.00 12.78 ? 179 THR A N 1 ATOM 1429 C CA . THR A 1 179 ? -16.551 54.554 -9.726 1.00 12.20 ? 179 THR A CA 1 ATOM 1430 C C . THR A 1 179 ? -16.003 54.523 -11.151 1.00 11.26 ? 179 THR A C 1 ATOM 1431 O O . THR A 1 179 ? -15.725 53.448 -11.689 1.00 11.78 ? 179 THR A O 1 ATOM 1432 C CB . THR A 1 179 ? -18.065 54.302 -9.792 1.00 11.99 ? 179 THR A CB 1 ATOM 1433 O OG1 . THR A 1 179 ? -18.747 55.550 -9.958 1.00 13.04 ? 179 THR A OG1 1 ATOM 1434 C CG2 . THR A 1 179 ? -18.547 53.618 -8.528 1.00 12.41 ? 179 THR A CG2 1 ATOM 1435 N N . ASP A 1 180 ? -15.859 55.692 -11.770 1.00 10.34 ? 180 ASP A N 1 ATOM 1436 C CA . ASP A 1 180 ? -15.321 55.752 -13.125 1.00 9.56 ? 180 ASP A CA 1 ATOM 1437 C C . ASP A 1 180 ? -13.882 56.261 -13.149 1.00 8.13 ? 180 ASP A C 1 ATOM 1438 O O . ASP A 1 180 ? -13.149 56.006 -14.095 1.00 8.26 ? 180 ASP A O 1 ATOM 1439 C CB . ASP A 1 180 ? -16.193 56.633 -14.031 1.00 9.27 ? 180 ASP A CB 1 ATOM 1440 C CG . ASP A 1 180 ? -16.498 57.986 -13.422 1.00 10.45 ? 180 ASP A CG 1 ATOM 1441 O OD1 . ASP A 1 180 ? -15.612 58.570 -12.762 1.00 10.02 ? 180 ASP A OD1 1 ATOM 1442 O OD2 . ASP A 1 180 ? -17.630 58.476 -13.620 1.00 11.86 ? 180 ASP A OD2 1 ATOM 1443 N N . PHE A 1 181 ? -13.490 56.968 -12.097 1.00 6.74 ? 181 PHE A N 1 ATOM 1444 C CA . PHE A 1 181 ? -12.154 57.537 -11.964 1.00 6.24 ? 181 PHE A CA 1 ATOM 1445 C C . PHE A 1 181 ? -12.114 58.946 -12.517 1.00 7.38 ? 181 PHE A C 1 ATOM 1446 O O . PHE A 1 181 ? -11.038 59.519 -12.700 1.00 7.39 ? 181 PHE A O 1 ATOM 1447 C CB . PHE A 1 181 ? -11.100 56.704 -12.688 1.00 4.85 ? 181 PHE A CB 1 ATOM 1448 C CG . PHE A 1 181 ? -9.772 56.687 -11.995 1.00 3.24 ? 181 PHE A CG 1 ATOM 1449 C CD1 . PHE A 1 181 ? -9.575 55.883 -10.874 1.00 2.30 ? 181 PHE A CD1 1 ATOM 1450 C CD2 . PHE A 1 181 ? -8.726 57.483 -12.443 1.00 2.80 ? 181 PHE A CD2 1 ATOM 1451 C CE1 . PHE A 1 181 ? -8.370 55.865 -10.209 1.00 0.96 ? 181 PHE A CE1 1 ATOM 1452 C CE2 . PHE A 1 181 ? -7.504 57.475 -11.780 1.00 2.92 ? 181 PHE A CE2 1 ATOM 1453 C CZ . PHE A 1 181 ? -7.328 56.661 -10.658 1.00 1.79 ? 181 PHE A CZ 1 ATOM 1454 N N . VAL A 1 182 ? -13.291 59.503 -12.779 1.00 8.51 ? 182 VAL A N 1 ATOM 1455 C CA . VAL A 1 182 ? -13.390 60.854 -13.299 1.00 9.94 ? 182 VAL A CA 1 ATOM 1456 C C . VAL A 1 182 ? -14.213 61.730 -12.363 1.00 12.00 ? 182 VAL A C 1 ATOM 1457 O O . VAL A 1 182 ? -13.839 62.863 -12.078 1.00 12.64 ? 182 VAL A O 1 ATOM 1458 C CB . VAL A 1 182 ? -14.023 60.848 -14.680 1.00 8.94 ? 182 VAL A CB 1 ATOM 1459 C CG1 . VAL A 1 182 ? -13.836 62.189 -15.346 1.00 8.47 ? 182 VAL A CG1 1 ATOM 1460 C CG2 . VAL A 1 182 ? -13.386 59.766 -15.510 1.00 9.98 ? 182 VAL A CG2 1 ATOM 1461 N N . ASN A 1 183 ? -15.335 61.208 -11.883 1.00 14.68 ? 183 ASN A N 1 ATOM 1462 C CA . ASN A 1 183 ? -16.181 61.959 -10.953 1.00 17.50 ? 183 ASN A CA 1 ATOM 1463 C C . ASN A 1 183 ? -15.806 61.537 -9.531 1.00 16.52 ? 183 ASN A C 1 ATOM 1464 O O . ASN A 1 183 ? -16.081 60.407 -9.138 1.00 18.09 ? 183 ASN A O 1 ATOM 1465 C CB . ASN A 1 183 ? -17.670 61.646 -11.196 1.00 21.75 ? 183 ASN A CB 1 ATOM 1466 C CG . ASN A 1 183 ? -18.185 62.181 -12.538 1.00 26.12 ? 183 ASN A CG 1 ATOM 1467 O OD1 . ASN A 1 183 ? -18.380 63.389 -12.705 1.00 29.17 ? 183 ASN A OD1 1 ATOM 1468 N ND2 . ASN A 1 183 ? -18.408 61.277 -13.498 1.00 26.92 ? 183 ASN A ND2 1 ATOM 1469 N N . TRP A 1 184 ? -15.180 62.423 -8.759 1.00 14.12 ? 184 TRP A N 1 ATOM 1470 C CA . TRP A 1 184 ? -14.804 62.068 -7.391 1.00 11.61 ? 184 TRP A CA 1 ATOM 1471 C C . TRP A 1 184 ? -15.557 62.879 -6.347 1.00 12.62 ? 184 TRP A C 1 ATOM 1472 O O . TRP A 1 184 ? -15.927 64.026 -6.600 1.00 13.43 ? 184 TRP A O 1 ATOM 1473 C CB . TRP A 1 184 ? -13.315 62.282 -7.172 1.00 8.09 ? 184 TRP A CB 1 ATOM 1474 C CG . TRP A 1 184 ? -12.461 61.606 -8.149 1.00 3.95 ? 184 TRP A CG 1 ATOM 1475 C CD1 . TRP A 1 184 ? -12.191 62.011 -9.417 1.00 4.30 ? 184 TRP A CD1 1 ATOM 1476 C CD2 . TRP A 1 184 ? -11.729 60.402 -7.944 1.00 2.89 ? 184 TRP A CD2 1 ATOM 1477 N NE1 . TRP A 1 184 ? -11.323 61.135 -10.022 1.00 4.00 ? 184 TRP A NE1 1 ATOM 1478 C CE2 . TRP A 1 184 ? -11.023 60.134 -9.135 1.00 3.89 ? 184 TRP A CE2 1 ATOM 1479 C CE3 . TRP A 1 184 ? -11.597 59.518 -6.868 1.00 1.48 ? 184 TRP A CE3 1 ATOM 1480 C CZ2 . TRP A 1 184 ? -10.194 59.014 -9.281 1.00 3.29 ? 184 TRP A CZ2 1 ATOM 1481 C CZ3 . TRP A 1 184 ? -10.777 58.408 -7.011 1.00 0.96 ? 184 TRP A CZ3 1 ATOM 1482 C CH2 . TRP A 1 184 ? -10.085 58.166 -8.209 1.00 1.72 ? 184 TRP A CH2 1 ATOM 1483 N N . LYS A 1 185 ? -15.757 62.293 -5.168 1.00 13.69 ? 185 LYS A N 1 ATOM 1484 C CA . LYS A 1 185 ? -16.462 62.974 -4.075 1.00 16.60 ? 185 LYS A CA 1 ATOM 1485 C C . LYS A 1 185 ? -15.742 62.826 -2.728 1.00 16.76 ? 185 LYS A C 1 ATOM 1486 O O . LYS A 1 185 ? -15.576 61.706 -2.234 1.00 16.73 ? 185 LYS A O 1 ATOM 1487 C CB . LYS A 1 185 ? -17.891 62.430 -3.963 1.00 18.81 ? 185 LYS A CB 1 ATOM 1488 C CG . LYS A 1 185 ? -17.969 60.908 -3.989 1.00 22.34 ? 185 LYS A CG 1 ATOM 1489 C CD . LYS A 1 185 ? -19.385 60.418 -4.287 1.00 25.70 ? 185 LYS A CD 1 ATOM 1490 C CE . LYS A 1 185 ? -19.901 60.915 -5.659 1.00 27.38 ? 185 LYS A CE 1 ATOM 1491 N NZ . LYS A 1 185 ? -19.115 60.408 -6.832 1.00 26.93 ? 185 LYS A NZ 1 ATOM 1492 N N . ARG A 1 186 ? -15.324 63.946 -2.129 1.00 17.13 ? 186 ARG A N 1 ATOM 1493 C CA . ARG A 1 186 ? -14.612 63.874 -0.852 1.00 17.35 ? 186 ARG A CA 1 ATOM 1494 C C . ARG A 1 186 ? -15.421 63.047 0.125 1.00 15.90 ? 186 ARG A C 1 ATOM 1495 O O . ARG A 1 186 ? -16.642 63.153 0.183 1.00 15.41 ? 186 ARG A O 1 ATOM 1496 C CB . ARG A 1 186 ? -14.329 65.273 -0.237 1.00 20.03 ? 186 ARG A CB 1 ATOM 1497 C CG . ARG A 1 186 ? -15.537 66.053 0.405 1.00 24.74 ? 186 ARG A CG 1 ATOM 1498 C CD . ARG A 1 186 ? -15.061 67.203 1.374 1.00 25.63 ? 186 ARG A CD 1 ATOM 1499 N NE . ARG A 1 186 ? -16.075 68.207 1.767 1.00 26.13 ? 186 ARG A NE 1 ATOM 1500 C CZ . ARG A 1 186 ? -16.515 69.222 1.006 1.00 25.55 ? 186 ARG A CZ 1 ATOM 1501 N NH1 . ARG A 1 186 ? -16.055 69.412 -0.229 1.00 24.02 ? 186 ARG A NH1 1 ATOM 1502 N NH2 . ARG A 1 186 ? -17.407 70.081 1.494 1.00 23.57 ? 186 ARG A NH2 1 ATOM 1503 N N . TYR A 1 187 ? -14.739 62.191 0.870 1.00 15.17 ? 187 TYR A N 1 ATOM 1504 C CA . TYR A 1 187 ? -15.414 61.378 1.859 1.00 13.72 ? 187 TYR A CA 1 ATOM 1505 C C . TYR A 1 187 ? -15.586 62.306 3.044 1.00 14.93 ? 187 TYR A C 1 ATOM 1506 O O . TYR A 1 187 ? -14.897 63.322 3.150 1.00 15.52 ? 187 TYR A O 1 ATOM 1507 C CB . TYR A 1 187 ? -14.556 60.190 2.264 1.00 10.50 ? 187 TYR A CB 1 ATOM 1508 C CG . TYR A 1 187 ? -15.266 59.234 3.185 1.00 7.30 ? 187 TYR A CG 1 ATOM 1509 C CD1 . TYR A 1 187 ? -16.294 58.422 2.718 1.00 6.71 ? 187 TYR A CD1 1 ATOM 1510 C CD2 . TYR A 1 187 ? -14.929 59.156 4.535 1.00 6.24 ? 187 TYR A CD2 1 ATOM 1511 C CE1 . TYR A 1 187 ? -16.971 57.552 3.579 1.00 5.53 ? 187 TYR A CE1 1 ATOM 1512 C CE2 . TYR A 1 187 ? -15.599 58.293 5.404 1.00 5.07 ? 187 TYR A CE2 1 ATOM 1513 C CZ . TYR A 1 187 ? -16.619 57.497 4.918 1.00 4.73 ? 187 TYR A CZ 1 ATOM 1514 O OH . TYR A 1 187 ? -17.297 56.659 5.773 1.00 4.62 ? 187 TYR A OH 1 ATOM 1515 N N . ASP A 1 188 ? -16.501 61.948 3.932 1.00 16.86 ? 188 ASP A N 1 ATOM 1516 C CA . ASP A 1 188 ? -16.805 62.740 5.124 1.00 19.29 ? 188 ASP A CA 1 ATOM 1517 C C . ASP A 1 188 ? -15.614 63.001 6.081 1.00 17.98 ? 188 ASP A C 1 ATOM 1518 O O . ASP A 1 188 ? -15.425 64.124 6.555 1.00 18.04 ? 188 ASP A O 1 ATOM 1519 C CB . ASP A 1 188 ? -17.965 62.056 5.870 1.00 23.22 ? 188 ASP A CB 1 ATOM 1520 C CG . ASP A 1 188 ? -18.464 62.866 7.059 1.00 27.13 ? 188 ASP A CG 1 ATOM 1521 O OD1 . ASP A 1 188 ? -18.764 64.072 6.867 1.00 28.72 ? 188 ASP A OD1 1 ATOM 1522 O OD2 . ASP A 1 188 ? -18.562 62.291 8.176 1.00 28.36 ? 188 ASP A OD2 1 ATOM 1523 N N . GLN A 1 189 ? -14.823 61.967 6.358 1.00 16.90 ? 189 GLN A N 1 ATOM 1524 C CA . GLN A 1 189 ? -13.667 62.064 7.249 1.00 15.20 ? 189 GLN A CA 1 ATOM 1525 C C . GLN A 1 189 ? -12.372 61.822 6.484 1.00 13.01 ? 189 GLN A C 1 ATOM 1526 O O . GLN A 1 189 ? -12.392 61.468 5.310 1.00 14.34 ? 189 GLN A O 1 ATOM 1527 C CB . GLN A 1 189 ? -13.788 61.021 8.358 1.00 17.63 ? 189 GLN A CB 1 ATOM 1528 C CG . GLN A 1 189 ? -14.988 61.231 9.268 1.00 22.75 ? 189 GLN A CG 1 ATOM 1529 C CD . GLN A 1 189 ? -14.840 62.459 10.156 1.00 25.75 ? 189 GLN A CD 1 ATOM 1530 O OE1 . GLN A 1 189 ? -14.086 62.449 11.138 1.00 27.36 ? 189 GLN A OE1 1 ATOM 1531 N NE2 . GLN A 1 189 ? -15.551 63.531 9.807 1.00 26.92 ? 189 GLN A NE2 1 ATOM 1532 N N . PRO A 1 190 ? -11.223 62.053 7.126 1.00 10.46 ? 190 PRO A N 1 ATOM 1533 C CA . PRO A 1 190 ? -9.967 61.814 6.413 1.00 9.83 ? 190 PRO A CA 1 ATOM 1534 C C . PRO A 1 190 ? -9.624 60.353 6.650 1.00 8.98 ? 190 PRO A C 1 ATOM 1535 O O . PRO A 1 190 ? -10.210 59.721 7.534 1.00 9.41 ? 190 PRO A O 1 ATOM 1536 C CB . PRO A 1 190 ? -8.985 62.746 7.114 1.00 8.91 ? 190 PRO A CB 1 ATOM 1537 C CG . PRO A 1 190 ? -9.862 63.813 7.683 1.00 9.16 ? 190 PRO A CG 1 ATOM 1538 C CD . PRO A 1 190 ? -11.002 63.000 8.225 1.00 10.37 ? 190 PRO A CD 1 ATOM 1539 N N . LEU A 1 191 ? -8.695 59.807 5.873 1.00 7.74 ? 191 LEU A N 1 ATOM 1540 C CA . LEU A 1 191 ? -8.329 58.414 6.069 1.00 6.54 ? 191 LEU A CA 1 ATOM 1541 C C . LEU A 1 191 ? -7.577 58.327 7.385 1.00 6.61 ? 191 LEU A C 1 ATOM 1542 O O . LEU A 1 191 ? -7.770 57.402 8.181 1.00 6.11 ? 191 LEU A O 1 ATOM 1543 C CB . LEU A 1 191 ? -7.453 57.917 4.926 1.00 4.50 ? 191 LEU A CB 1 ATOM 1544 C CG . LEU A 1 191 ? -7.121 56.435 5.081 1.00 4.16 ? 191 LEU A CG 1 ATOM 1545 C CD1 . LEU A 1 191 ? -8.393 55.634 5.329 1.00 3.04 ? 191 LEU A CD1 1 ATOM 1546 C CD2 . LEU A 1 191 ? -6.416 55.945 3.843 1.00 3.67 ? 191 LEU A CD2 1 ATOM 1547 N N . SER A 1 192 ? -6.727 59.319 7.608 1.00 7.09 ? 192 SER A N 1 ATOM 1548 C CA . SER A 1 192 ? -5.945 59.401 8.824 1.00 8.43 ? 192 SER A CA 1 ATOM 1549 C C . SER A 1 192 ? -5.362 60.805 8.896 1.00 9.27 ? 192 SER A C 1 ATOM 1550 O O . SER A 1 192 ? -5.400 61.538 7.905 1.00 9.65 ? 192 SER A O 1 ATOM 1551 C CB . SER A 1 192 ? -4.831 58.370 8.800 1.00 8.56 ? 192 SER A CB 1 ATOM 1552 O OG . SER A 1 192 ? -4.296 58.223 10.095 1.00 11.12 ? 192 SER A OG 1 ATOM 1553 N N . SER A 1 193 ? -4.820 61.184 10.052 1.00 9.92 ? 193 SER A N 1 ATOM 1554 C CA . SER A 1 193 ? -4.265 62.527 10.208 1.00 10.51 ? 193 SER A CA 1 ATOM 1555 C C . SER A 1 193 ? -3.563 62.735 11.539 1.00 10.68 ? 193 SER A C 1 ATOM 1556 O O . SER A 1 193 ? -3.651 61.898 12.437 1.00 12.20 ? 193 SER A O 1 ATOM 1557 C CB . SER A 1 193 ? -5.385 63.542 10.108 1.00 11.13 ? 193 SER A CB 1 ATOM 1558 O OG . SER A 1 193 ? -6.309 63.311 11.158 1.00 12.37 ? 193 SER A OG 1 ATOM 1559 N N . ALA A 1 194 ? -2.877 63.867 11.665 1.00 10.57 ? 194 ALA A N 1 ATOM 1560 C CA . ALA A 1 194 ? -2.170 64.200 12.899 1.00 11.84 ? 194 ALA A CA 1 ATOM 1561 C C . ALA A 1 194 ? -2.316 65.687 13.152 1.00 12.11 ? 194 ALA A C 1 ATOM 1562 O O . ALA A 1 194 ? -2.681 66.430 12.245 1.00 11.66 ? 194 ALA A O 1 ATOM 1563 C CB . ALA A 1 194 ? -0.693 63.829 12.788 1.00 11.61 ? 194 ALA A CB 1 ATOM 1564 N N . ASP A 1 195 ? -2.027 66.119 14.378 1.00 12.86 ? 195 ASP A N 1 ATOM 1565 C CA . ASP A 1 195 ? -2.144 67.532 14.734 1.00 14.25 ? 195 ASP A CA 1 ATOM 1566 C C . ASP A 1 195 ? -0.816 68.290 14.644 1.00 13.56 ? 195 ASP A C 1 ATOM 1567 O O . ASP A 1 195 ? 0.261 67.701 14.750 1.00 13.74 ? 195 ASP A O 1 ATOM 1568 C CB . ASP A 1 195 ? -2.723 67.682 16.152 1.00 17.39 ? 195 ASP A CB 1 ATOM 1569 C CG . ASP A 1 195 ? -4.132 67.095 16.288 1.00 20.49 ? 195 ASP A CG 1 ATOM 1570 O OD1 . ASP A 1 195 ? -4.720 67.172 17.399 1.00 20.47 ? 195 ASP A OD1 1 ATOM 1571 O OD2 . ASP A 1 195 ? -4.645 66.555 15.281 1.00 22.51 ? 195 ASP A OD2 1 ATOM 1572 N N . ALA A 1 196 ? -0.917 69.602 14.447 1.00 12.63 ? 196 ALA A N 1 ATOM 1573 C CA . ALA A 1 196 ? 0.232 70.502 14.347 1.00 12.08 ? 196 ALA A CA 1 ATOM 1574 C C . ALA A 1 196 ? 1.396 69.983 13.523 1.00 12.16 ? 196 ALA A C 1 ATOM 1575 O O . ALA A 1 196 ? 2.548 70.282 13.848 1.00 14.58 ? 196 ALA A O 1 ATOM 1576 C CB . ALA A 1 196 ? 0.731 70.863 15.737 1.00 11.34 ? 196 ALA A CB 1 ATOM 1577 N N . THR A 1 197 ? 1.124 69.223 12.463 1.00 10.68 ? 197 THR A N 1 ATOM 1578 C CA . THR A 1 197 ? 2.215 68.690 11.648 1.00 9.58 ? 197 THR A CA 1 ATOM 1579 C C . THR A 1 197 ? 2.384 69.419 10.320 1.00 9.51 ? 197 THR A C 1 ATOM 1580 O O . THR A 1 197 ? 3.416 69.282 9.653 1.00 10.13 ? 197 THR A O 1 ATOM 1581 C CB . THR A 1 197 ? 2.039 67.169 11.368 1.00 8.53 ? 197 THR A CB 1 ATOM 1582 O OG1 . THR A 1 197 ? 0.845 66.949 10.614 1.00 8.95 ? 197 THR A OG1 1 ATOM 1583 C CG2 . THR A 1 197 ? 1.951 66.390 12.665 1.00 7.83 ? 197 THR A CG2 1 ATOM 1584 N N . GLY A 1 198 ? 1.379 70.199 9.938 1.00 8.74 ? 198 GLY A N 1 ATOM 1585 C CA . GLY A 1 198 ? 1.467 70.925 8.684 1.00 9.84 ? 198 GLY A CA 1 ATOM 1586 C C . GLY A 1 198 ? 1.211 70.032 7.486 1.00 10.52 ? 198 GLY A C 1 ATOM 1587 O O . GLY A 1 198 ? 1.184 68.811 7.608 1.00 10.39 ? 198 GLY A O 1 ATOM 1588 N N . THR A 1 199 ? 1.016 70.645 6.324 1.00 11.79 ? 199 THR A N 1 ATOM 1589 C CA . THR A 1 199 ? 0.746 69.910 5.092 1.00 13.29 ? 199 THR A CA 1 ATOM 1590 C C . THR A 1 199 ? 1.415 68.540 5.022 1.00 11.52 ? 199 THR A C 1 ATOM 1591 O O . THR A 1 199 ? 2.632 68.422 5.209 1.00 11.72 ? 199 THR A O 1 ATOM 1592 C CB . THR A 1 199 ? 1.202 70.715 3.859 1.00 16.24 ? 199 THR A CB 1 ATOM 1593 O OG1 . THR A 1 199 ? 2.215 71.659 4.249 1.00 21.36 ? 199 THR A OG1 1 ATOM 1594 C CG2 . THR A 1 199 ? 0.033 71.440 3.232 1.00 17.49 ? 199 THR A CG2 1 ATOM 1595 N N . TRP A 1 200 ? 0.605 67.512 4.765 1.00 8.93 ? 200 TRP A N 1 ATOM 1596 C CA . TRP A 1 200 ? 1.089 66.138 4.622 1.00 5.73 ? 200 TRP A CA 1 ATOM 1597 C C . TRP A 1 200 ? 1.394 65.975 3.141 1.00 4.72 ? 200 TRP A C 1 ATOM 1598 O O . TRP A 1 200 ? 0.493 66.028 2.311 1.00 3.32 ? 200 TRP A O 1 ATOM 1599 C CB . TRP A 1 200 ? 0.003 65.144 5.020 1.00 4.23 ? 200 TRP A CB 1 ATOM 1600 C CG . TRP A 1 200 ? 0.063 64.681 6.437 1.00 3.10 ? 200 TRP A CG 1 ATOM 1601 C CD1 . TRP A 1 200 ? 0.603 65.344 7.495 1.00 3.35 ? 200 TRP A CD1 1 ATOM 1602 C CD2 . TRP A 1 200 ? -0.494 63.469 6.965 1.00 2.50 ? 200 TRP A CD2 1 ATOM 1603 N NE1 . TRP A 1 200 ? 0.417 64.623 8.652 1.00 2.64 ? 200 TRP A NE1 1 ATOM 1604 C CE2 . TRP A 1 200 ? -0.254 63.468 8.352 1.00 1.89 ? 200 TRP A CE2 1 ATOM 1605 C CE3 . TRP A 1 200 ? -1.175 62.385 6.398 1.00 3.04 ? 200 TRP A CE3 1 ATOM 1606 C CZ2 . TRP A 1 200 ? -0.671 62.425 9.184 1.00 2.00 ? 200 TRP A CZ2 1 ATOM 1607 C CZ3 . TRP A 1 200 ? -1.591 61.341 7.230 1.00 2.61 ? 200 TRP A CZ3 1 ATOM 1608 C CH2 . TRP A 1 200 ? -1.336 61.372 8.605 1.00 2.03 ? 200 TRP A CH2 1 ATOM 1609 N N . GLU A 1 201 ? 2.656 65.765 2.803 1.00 4.08 ? 201 GLU A N 1 ATOM 1610 C CA . GLU A 1 201 ? 3.010 65.647 1.403 1.00 4.71 ? 201 GLU A CA 1 ATOM 1611 C C . GLU A 1 201 ? 3.249 64.234 0.881 1.00 4.07 ? 201 GLU A C 1 ATOM 1612 O O . GLU A 1 201 ? 3.776 63.372 1.585 1.00 4.29 ? 201 GLU A O 1 ATOM 1613 C CB . GLU A 1 201 ? 4.233 66.516 1.126 1.00 6.28 ? 201 GLU A CB 1 ATOM 1614 C CG . GLU A 1 201 ? 3.971 67.991 1.278 1.00 8.05 ? 201 GLU A CG 1 ATOM 1615 C CD . GLU A 1 201 ? 5.235 68.814 1.186 1.00 10.22 ? 201 GLU A CD 1 ATOM 1616 O OE1 . GLU A 1 201 ? 5.129 70.046 1.007 1.00 12.50 ? 201 GLU A OE1 1 ATOM 1617 O OE2 . GLU A 1 201 ? 6.335 68.233 1.300 1.00 10.42 ? 201 GLU A OE2 1 ATOM 1618 N N . CYS A 1 202 ? 2.850 64.017 -0.369 1.00 2.40 ? 202 CYS A N 1 ATOM 1619 C CA . CYS A 1 202 ? 3.019 62.742 -1.038 1.00 1.13 ? 202 CYS A CA 1 ATOM 1620 C C . CYS A 1 202 ? 2.563 61.546 -0.237 1.00 1.29 ? 202 CYS A C 1 ATOM 1621 O O . CYS A 1 202 ? 3.311 60.582 -0.072 1.00 3.02 ? 202 CYS A O 1 ATOM 1622 C CB . CYS A 1 202 ? 4.474 62.558 -1.411 1.00 0.96 ? 202 CYS A CB 1 ATOM 1623 S SG . CYS A 1 202 ? 5.007 63.737 -2.597 1.00 0.96 ? 202 CYS A SG 1 ATOM 1624 N N . PRO A 1 203 ? 1.320 61.574 0.247 1.00 1.07 ? 203 PRO A N 1 ATOM 1625 C CA . PRO A 1 203 ? 0.774 60.469 1.037 1.00 0.96 ? 203 PRO A CA 1 ATOM 1626 C C . PRO A 1 203 ? 1.007 59.172 0.286 1.00 1.48 ? 203 PRO A C 1 ATOM 1627 O O . PRO A 1 203 ? 1.268 59.191 -0.916 1.00 4.12 ? 203 PRO A O 1 ATOM 1628 C CB . PRO A 1 203 ? -0.711 60.789 1.102 1.00 0.96 ? 203 PRO A CB 1 ATOM 1629 C CG . PRO A 1 203 ? -0.777 62.261 0.860 1.00 0.96 ? 203 PRO A CG 1 ATOM 1630 C CD . PRO A 1 203 ? 0.252 62.485 -0.186 1.00 1.24 ? 203 PRO A CD 1 ATOM 1631 N N . ASP A 1 204 ? 0.916 58.052 0.983 1.00 0.96 ? 204 ASP A N 1 ATOM 1632 C CA . ASP A 1 204 ? 1.088 56.749 0.355 1.00 0.96 ? 204 ASP A CA 1 ATOM 1633 C C . ASP A 1 204 ? 0.354 55.791 1.277 1.00 0.96 ? 204 ASP A C 1 ATOM 1634 O O . ASP A 1 204 ? 0.485 55.855 2.499 1.00 1.30 ? 204 ASP A O 1 ATOM 1635 C CB . ASP A 1 204 ? 2.574 56.388 0.233 1.00 1.13 ? 204 ASP A CB 1 ATOM 1636 C CG . ASP A 1 204 ? 2.854 55.356 -0.865 1.00 0.96 ? 204 ASP A CG 1 ATOM 1637 O OD1 . ASP A 1 204 ? 1.912 54.938 -1.562 1.00 0.96 ? 204 ASP A OD1 1 ATOM 1638 O OD2 . ASP A 1 204 ? 4.029 54.960 -1.037 1.00 1.77 ? 204 ASP A OD2 1 ATOM 1639 N N . PHE A 1 205 ? -0.427 54.903 0.688 1.00 0.97 ? 205 PHE A N 1 ATOM 1640 C CA . PHE A 1 205 ? -1.240 53.985 1.459 1.00 1.39 ? 205 PHE A CA 1 ATOM 1641 C C . PHE A 1 205 ? -1.329 52.673 0.715 1.00 1.39 ? 205 PHE A C 1 ATOM 1642 O O . PHE A 1 205 ? -1.984 52.595 -0.320 1.00 2.11 ? 205 PHE A O 1 ATOM 1643 C CB . PHE A 1 205 ? -2.627 54.590 1.594 1.00 1.73 ? 205 PHE A CB 1 ATOM 1644 C CG . PHE A 1 205 ? -3.518 53.857 2.522 1.00 2.27 ? 205 PHE A CG 1 ATOM 1645 C CD1 . PHE A 1 205 ? -3.319 53.928 3.894 1.00 2.60 ? 205 PHE A CD1 1 ATOM 1646 C CD2 . PHE A 1 205 ? -4.581 53.118 2.034 1.00 3.16 ? 205 PHE A CD2 1 ATOM 1647 C CE1 . PHE A 1 205 ? -4.170 53.278 4.767 1.00 2.01 ? 205 PHE A CE1 1 ATOM 1648 C CE2 . PHE A 1 205 ? -5.439 52.462 2.898 1.00 4.14 ? 205 PHE A CE2 1 ATOM 1649 C CZ . PHE A 1 205 ? -5.234 52.543 4.269 1.00 3.36 ? 205 PHE A CZ 1 ATOM 1650 N N . TYR A 1 206 ? -0.681 51.644 1.239 1.00 1.04 ? 206 TYR A N 1 ATOM 1651 C CA . TYR A 1 206 ? -0.690 50.346 0.584 1.00 0.96 ? 206 TYR A CA 1 ATOM 1652 C C . TYR A 1 206 ? -0.736 49.197 1.572 1.00 1.01 ? 206 TYR A C 1 ATOM 1653 O O . TYR A 1 206 ? -0.532 49.373 2.769 1.00 1.81 ? 206 TYR A O 1 ATOM 1654 C CB . TYR A 1 206 ? 0.554 50.209 -0.297 1.00 0.96 ? 206 TYR A CB 1 ATOM 1655 C CG . TYR A 1 206 ? 1.843 50.495 0.433 1.00 0.96 ? 206 TYR A CG 1 ATOM 1656 C CD1 . TYR A 1 206 ? 2.454 49.523 1.213 1.00 0.96 ? 206 TYR A CD1 1 ATOM 1657 C CD2 . TYR A 1 206 ? 2.399 51.766 0.418 1.00 0.96 ? 206 TYR A CD2 1 ATOM 1658 C CE1 . TYR A 1 206 ? 3.590 49.814 1.974 1.00 1.61 ? 206 TYR A CE1 1 ATOM 1659 C CE2 . TYR A 1 206 ? 3.527 52.069 1.171 1.00 1.16 ? 206 TYR A CE2 1 ATOM 1660 C CZ . TYR A 1 206 ? 4.116 51.092 1.951 1.00 1.06 ? 206 TYR A CZ 1 ATOM 1661 O OH . TYR A 1 206 ? 5.203 51.409 2.735 1.00 0.96 ? 206 TYR A OH 1 ATOM 1662 N N . PRO A 1 207 ? -1.015 47.995 1.075 1.00 0.96 ? 207 PRO A N 1 ATOM 1663 C CA . PRO A 1 207 ? -1.088 46.801 1.910 1.00 0.96 ? 207 PRO A CA 1 ATOM 1664 C C . PRO A 1 207 ? 0.194 45.969 1.880 1.00 0.96 ? 207 PRO A C 1 ATOM 1665 O O . PRO A 1 207 ? 0.832 45.834 0.842 1.00 0.96 ? 207 PRO A O 1 ATOM 1666 C CB . PRO A 1 207 ? -2.249 46.057 1.291 1.00 1.35 ? 207 PRO A CB 1 ATOM 1667 C CG . PRO A 1 207 ? -2.008 46.304 -0.173 1.00 0.96 ? 207 PRO A CG 1 ATOM 1668 C CD . PRO A 1 207 ? -1.722 47.782 -0.199 1.00 0.96 ? 207 PRO A CD 1 ATOM 1669 N N . VAL A 1 208 ? 0.573 45.418 3.025 1.00 0.96 ? 208 VAL A N 1 ATOM 1670 C CA . VAL A 1 208 ? 1.752 44.568 3.097 1.00 0.96 ? 208 VAL A CA 1 ATOM 1671 C C . VAL A 1 208 ? 1.268 43.194 3.539 1.00 1.62 ? 208 VAL A C 1 ATOM 1672 O O . VAL A 1 208 ? 0.486 43.067 4.482 1.00 2.61 ? 208 VAL A O 1 ATOM 1673 C CB . VAL A 1 208 ? 2.783 45.094 4.100 1.00 0.96 ? 208 VAL A CB 1 ATOM 1674 C CG1 . VAL A 1 208 ? 3.311 46.425 3.636 1.00 0.96 ? 208 VAL A CG1 1 ATOM 1675 C CG2 . VAL A 1 208 ? 2.165 45.213 5.472 1.00 0.96 ? 208 VAL A CG2 1 ATOM 1676 N N . PRO A 1 209 ? 1.720 42.142 2.855 1.00 1.94 ? 209 PRO A N 1 ATOM 1677 C CA . PRO A 1 209 ? 1.321 40.778 3.180 1.00 3.35 ? 209 PRO A CA 1 ATOM 1678 C C . PRO A 1 209 ? 2.037 40.295 4.415 1.00 5.28 ? 209 PRO A C 1 ATOM 1679 O O . PRO A 1 209 ? 3.266 40.324 4.464 1.00 6.20 ? 209 PRO A O 1 ATOM 1680 C CB . PRO A 1 209 ? 1.765 40.010 1.958 1.00 2.24 ? 209 PRO A CB 1 ATOM 1681 C CG . PRO A 1 209 ? 3.073 40.659 1.690 1.00 1.98 ? 209 PRO A CG 1 ATOM 1682 C CD . PRO A 1 209 ? 2.752 42.135 1.809 1.00 1.59 ? 209 PRO A CD 1 ATOM 1683 N N . LEU A 1 210 ? 1.276 39.844 5.404 1.00 7.33 ? 210 LEU A N 1 ATOM 1684 C CA . LEU A 1 210 ? 1.859 39.334 6.636 1.00 10.36 ? 210 LEU A CA 1 ATOM 1685 C C . LEU A 1 210 ? 2.646 38.048 6.405 1.00 13.17 ? 210 LEU A C 1 ATOM 1686 O O . LEU A 1 210 ? 2.314 37.255 5.520 1.00 15.33 ? 210 LEU A O 1 ATOM 1687 C CB . LEU A 1 210 ? 0.763 39.080 7.657 1.00 9.69 ? 210 LEU A CB 1 ATOM 1688 C CG . LEU A 1 210 ? 0.359 40.336 8.407 1.00 9.99 ? 210 LEU A CG 1 ATOM 1689 C CD1 . LEU A 1 210 ? -0.992 40.139 9.056 1.00 12.15 ? 210 LEU A CD1 1 ATOM 1690 C CD2 . LEU A 1 210 ? 1.424 40.652 9.433 1.00 10.07 ? 210 LEU A CD2 1 ATOM 1691 N N . ASN A 1 211 ? 3.681 37.843 7.217 1.00 15.61 ? 211 ASN A N 1 ATOM 1692 C CA . ASN A 1 211 ? 4.540 36.663 7.120 1.00 18.08 ? 211 ASN A CA 1 ATOM 1693 C C . ASN A 1 211 ? 4.785 36.267 5.657 1.00 17.44 ? 211 ASN A C 1 ATOM 1694 O O . ASN A 1 211 ? 4.330 35.219 5.172 1.00 16.40 ? 211 ASN A O 1 ATOM 1695 C CB . ASN A 1 211 ? 3.935 35.493 7.912 1.00 21.00 ? 211 ASN A CB 1 ATOM 1696 C CG . ASN A 1 211 ? 5.000 34.532 8.447 1.00 24.88 ? 211 ASN A CG 1 ATOM 1697 O OD1 . ASN A 1 211 ? 5.565 33.713 7.700 1.00 25.82 ? 211 ASN A OD1 1 ATOM 1698 N ND2 . ASN A 1 211 ? 5.291 34.642 9.749 1.00 26.12 ? 211 ASN A ND2 1 ATOM 1699 N N . SER A 1 212 ? 5.506 37.149 4.973 1.00 17.00 ? 212 SER A N 1 ATOM 1700 C CA . SER A 1 212 ? 5.875 36.996 3.571 1.00 17.08 ? 212 SER A CA 1 ATOM 1701 C C . SER A 1 212 ? 6.996 38.011 3.384 1.00 15.98 ? 212 SER A C 1 ATOM 1702 O O . SER A 1 212 ? 7.336 38.720 4.331 1.00 17.45 ? 212 SER A O 1 ATOM 1703 C CB . SER A 1 212 ? 4.688 37.353 2.666 1.00 17.58 ? 212 SER A CB 1 ATOM 1704 O OG . SER A 1 212 ? 4.954 37.042 1.302 1.00 20.67 ? 212 SER A OG 1 ATOM 1705 N N . THR A 1 213 ? 7.585 38.083 2.195 1.00 13.99 ? 213 THR A N 1 ATOM 1706 C CA . THR A 1 213 ? 8.639 39.067 1.960 1.00 12.76 ? 213 THR A CA 1 ATOM 1707 C C . THR A 1 213 ? 8.459 39.714 0.598 1.00 12.83 ? 213 THR A C 1 ATOM 1708 O O . THR A 1 213 ? 9.423 40.193 -0.002 1.00 13.73 ? 213 THR A O 1 ATOM 1709 C CB . THR A 1 213 ? 10.042 38.441 2.008 1.00 11.82 ? 213 THR A CB 1 ATOM 1710 O OG1 . THR A 1 213 ? 10.235 37.600 0.862 1.00 12.64 ? 213 THR A OG1 1 ATOM 1711 C CG2 . THR A 1 213 ? 10.215 37.630 3.273 1.00 10.12 ? 213 THR A CG2 1 ATOM 1712 N N . ASN A 1 214 ? 7.222 39.726 0.110 1.00 12.65 ? 214 ASN A N 1 ATOM 1713 C CA . ASN A 1 214 ? 6.925 40.312 -1.188 1.00 13.60 ? 214 ASN A CA 1 ATOM 1714 C C . ASN A 1 214 ? 5.882 41.410 -1.037 1.00 12.83 ? 214 ASN A C 1 ATOM 1715 O O . ASN A 1 214 ? 5.543 41.797 0.076 1.00 13.94 ? 214 ASN A O 1 ATOM 1716 C CB . ASN A 1 214 ? 6.402 39.236 -2.136 1.00 17.43 ? 214 ASN A CB 1 ATOM 1717 C CG . ASN A 1 214 ? 7.158 37.922 -2.008 1.00 19.90 ? 214 ASN A CG 1 ATOM 1718 O OD1 . ASN A 1 214 ? 6.747 37.032 -1.258 1.00 22.00 ? 214 ASN A OD1 1 ATOM 1719 N ND2 . ASN A 1 214 ? 8.273 37.797 -2.734 1.00 21.22 ? 214 ASN A ND2 1 ATOM 1720 N N . GLY A 1 215 ? 5.377 41.922 -2.153 1.00 11.52 ? 215 GLY A N 1 ATOM 1721 C CA . GLY A 1 215 ? 4.367 42.962 -2.074 1.00 10.46 ? 215 GLY A CA 1 ATOM 1722 C C . GLY A 1 215 ? 3.030 42.442 -2.563 1.00 9.49 ? 215 GLY A C 1 ATOM 1723 O O . GLY A 1 215 ? 2.920 41.268 -2.919 1.00 10.31 ? 215 GLY A O 1 ATOM 1724 N N . LEU A 1 216 ? 2.017 43.304 -2.581 1.00 8.02 ? 216 LEU A N 1 ATOM 1725 C CA . LEU A 1 216 ? 0.685 42.918 -3.045 1.00 6.54 ? 216 LEU A CA 1 ATOM 1726 C C . LEU A 1 216 ? 0.152 44.041 -3.897 1.00 6.61 ? 216 LEU A C 1 ATOM 1727 O O . LEU A 1 216 ? 0.680 45.141 -3.862 1.00 7.11 ? 216 LEU A O 1 ATOM 1728 C CB . LEU A 1 216 ? -0.264 42.737 -1.865 1.00 4.32 ? 216 LEU A CB 1 ATOM 1729 C CG . LEU A 1 216 ? 0.167 41.853 -0.705 1.00 2.48 ? 216 LEU A CG 1 ATOM 1730 C CD1 . LEU A 1 216 ? -0.942 41.769 0.314 1.00 1.70 ? 216 LEU A CD1 1 ATOM 1731 C CD2 . LEU A 1 216 ? 0.495 40.486 -1.224 1.00 4.01 ? 216 LEU A CD2 1 ATOM 1732 N N . ASP A 1 217 ? -0.889 43.780 -4.672 1.00 8.09 ? 217 ASP A N 1 ATOM 1733 C CA . ASP A 1 217 ? -1.456 44.858 -5.458 1.00 9.81 ? 217 ASP A CA 1 ATOM 1734 C C . ASP A 1 217 ? -2.240 45.722 -4.488 1.00 9.57 ? 217 ASP A C 1 ATOM 1735 O O . ASP A 1 217 ? -3.010 45.220 -3.676 1.00 10.06 ? 217 ASP A O 1 ATOM 1736 C CB . ASP A 1 217 ? -2.410 44.349 -6.527 1.00 12.67 ? 217 ASP A CB 1 ATOM 1737 C CG . ASP A 1 217 ? -3.049 45.481 -7.297 1.00 16.03 ? 217 ASP A CG 1 ATOM 1738 O OD1 . ASP A 1 217 ? -2.293 46.238 -7.952 1.00 18.00 ? 217 ASP A OD1 1 ATOM 1739 O OD2 . ASP A 1 217 ? -4.293 45.624 -7.235 1.00 17.44 ? 217 ASP A OD2 1 ATOM 1740 N N . THR A 1 218 ? -2.034 47.025 -4.574 1.00 8.97 ? 218 THR A N 1 ATOM 1741 C CA . THR A 1 218 ? -2.714 47.971 -3.711 1.00 7.97 ? 218 THR A CA 1 ATOM 1742 C C . THR A 1 218 ? -4.131 47.550 -3.326 1.00 7.07 ? 218 THR A C 1 ATOM 1743 O O . THR A 1 218 ? -4.487 47.513 -2.150 1.00 7.58 ? 218 THR A O 1 ATOM 1744 C CB . THR A 1 218 ? -2.812 49.308 -4.405 1.00 7.88 ? 218 THR A CB 1 ATOM 1745 O OG1 . THR A 1 218 ? -1.622 49.521 -5.177 1.00 10.08 ? 218 THR A OG1 1 ATOM 1746 C CG2 . THR A 1 218 ? -2.978 50.407 -3.390 1.00 7.29 ? 218 THR A CG2 1 ATOM 1747 N N . SER A 1 219 ? -4.934 47.228 -4.332 1.00 6.24 ? 219 SER A N 1 ATOM 1748 C CA . SER A 1 219 ? -6.326 46.850 -4.132 1.00 5.58 ? 219 SER A CA 1 ATOM 1749 C C . SER A 1 219 ? -6.582 45.640 -3.235 1.00 5.83 ? 219 SER A C 1 ATOM 1750 O O . SER A 1 219 ? -7.735 45.326 -2.939 1.00 6.75 ? 219 SER A O 1 ATOM 1751 C CB . SER A 1 219 ? -6.969 46.619 -5.488 1.00 4.97 ? 219 SER A CB 1 ATOM 1752 O OG . SER A 1 219 ? -6.351 47.448 -6.451 1.00 5.71 ? 219 SER A OG 1 ATOM 1753 N N . VAL A 1 220 ? -5.527 44.956 -2.803 1.00 6.08 ? 220 VAL A N 1 ATOM 1754 C CA . VAL A 1 220 ? -5.697 43.790 -1.939 1.00 6.67 ? 220 VAL A CA 1 ATOM 1755 C C . VAL A 1 220 ? -6.070 44.206 -0.525 1.00 9.95 ? 220 VAL A C 1 ATOM 1756 O O . VAL A 1 220 ? -5.741 45.308 -0.075 1.00 10.97 ? 220 VAL A O 1 ATOM 1757 C CB . VAL A 1 220 ? -4.422 42.941 -1.874 1.00 3.18 ? 220 VAL A CB 1 ATOM 1758 C CG1 . VAL A 1 220 ? -4.542 41.904 -0.797 1.00 0.96 ? 220 VAL A CG1 1 ATOM 1759 C CG2 . VAL A 1 220 ? -4.200 42.259 -3.191 1.00 3.33 ? 220 VAL A CG2 1 ATOM 1760 N N . TYR A 1 221 ? -6.776 43.315 0.164 1.00 12.84 ? 221 TYR A N 1 ATOM 1761 C CA . TYR A 1 221 ? -7.216 43.543 1.536 1.00 15.76 ? 221 TYR A CA 1 ATOM 1762 C C . TYR A 1 221 ? -7.499 42.158 2.106 1.00 16.00 ? 221 TYR A C 1 ATOM 1763 O O . TYR A 1 221 ? -7.707 41.196 1.352 1.00 16.29 ? 221 TYR A O 1 ATOM 1764 C CB . TYR A 1 221 ? -8.495 44.385 1.560 1.00 18.20 ? 221 TYR A CB 1 ATOM 1765 C CG . TYR A 1 221 ? -9.663 43.669 0.927 1.00 23.33 ? 221 TYR A CG 1 ATOM 1766 C CD1 . TYR A 1 221 ? -10.816 43.366 1.668 1.00 25.22 ? 221 TYR A CD1 1 ATOM 1767 C CD2 . TYR A 1 221 ? -9.590 43.218 -0.401 1.00 25.49 ? 221 TYR A CD2 1 ATOM 1768 C CE1 . TYR A 1 221 ? -11.872 42.615 1.099 1.00 27.10 ? 221 TYR A CE1 1 ATOM 1769 C CE2 . TYR A 1 221 ? -10.632 42.471 -0.979 1.00 27.64 ? 221 TYR A CE2 1 ATOM 1770 C CZ . TYR A 1 221 ? -11.768 42.169 -0.226 1.00 27.74 ? 221 TYR A CZ 1 ATOM 1771 O OH . TYR A 1 221 ? -12.771 41.405 -0.795 1.00 27.06 ? 221 TYR A OH 1 ATOM 1772 N N . GLY A 1 222 ? -7.502 42.052 3.429 1.00 16.05 ? 222 GLY A N 1 ATOM 1773 C CA . GLY A 1 222 ? -7.754 40.766 4.048 1.00 16.20 ? 222 GLY A CA 1 ATOM 1774 C C . GLY A 1 222 ? -7.350 40.741 5.505 1.00 16.52 ? 222 GLY A C 1 ATOM 1775 O O . GLY A 1 222 ? -6.893 41.747 6.056 1.00 16.24 ? 222 GLY A O 1 ATOM 1776 N N . GLY A 1 223 ? -7.521 39.585 6.134 1.00 17.00 ? 223 GLY A N 1 ATOM 1777 C CA . GLY A 1 223 ? -7.173 39.456 7.536 1.00 17.74 ? 223 GLY A CA 1 ATOM 1778 C C . GLY A 1 223 ? -5.706 39.125 7.732 1.00 17.51 ? 223 GLY A C 1 ATOM 1779 O O . GLY A 1 223 ? -5.148 39.299 8.822 1.00 18.33 ? 223 GLY A O 1 ATOM 1780 N N . SER A 1 224 ? -5.083 38.638 6.667 1.00 16.35 ? 224 SER A N 1 ATOM 1781 C CA . SER A 1 224 ? -3.675 38.283 6.708 1.00 15.46 ? 224 SER A CA 1 ATOM 1782 C C . SER A 1 224 ? -2.867 39.388 6.020 1.00 13.45 ? 224 SER A C 1 ATOM 1783 O O . SER A 1 224 ? -1.806 39.151 5.430 1.00 13.54 ? 224 SER A O 1 ATOM 1784 C CB . SER A 1 224 ? -3.478 36.935 6.012 1.00 16.79 ? 224 SER A CB 1 ATOM 1785 O OG . SER A 1 224 ? -4.215 36.894 4.801 1.00 19.11 ? 224 SER A OG 1 ATOM 1786 N N . VAL A 1 225 ? -3.382 40.606 6.121 1.00 10.80 ? 225 VAL A N 1 ATOM 1787 C CA . VAL A 1 225 ? -2.752 41.762 5.511 1.00 8.12 ? 225 VAL A CA 1 ATOM 1788 C C . VAL A 1 225 ? -2.855 42.974 6.405 1.00 6.87 ? 225 VAL A C 1 ATOM 1789 O O . VAL A 1 225 ? -3.807 43.117 7.176 1.00 7.14 ? 225 VAL A O 1 ATOM 1790 C CB . VAL A 1 225 ? -3.440 42.121 4.207 1.00 7.50 ? 225 VAL A CB 1 ATOM 1791 C CG1 . VAL A 1 225 ? -2.825 43.365 3.624 1.00 7.93 ? 225 VAL A CG1 1 ATOM 1792 C CG2 . VAL A 1 225 ? -3.346 40.968 3.253 1.00 8.57 ? 225 VAL A CG2 1 ATOM 1793 N N . ARG A 1 226 ? -1.875 43.855 6.290 1.00 5.03 ? 226 ARG A N 1 ATOM 1794 C CA . ARG A 1 226 ? -1.888 45.073 7.070 1.00 4.05 ? 226 ARG A CA 1 ATOM 1795 C C . ARG A 1 226 ? -1.621 46.236 6.133 1.00 2.95 ? 226 ARG A C 1 ATOM 1796 O O . ARG A 1 226 ? -1.113 46.055 5.026 1.00 0.96 ? 226 ARG A O 1 ATOM 1797 C CB . ARG A 1 226 ? -0.844 45.005 8.178 1.00 3.62 ? 226 ARG A CB 1 ATOM 1798 C CG . ARG A 1 226 ? -1.154 43.963 9.231 1.00 4.77 ? 226 ARG A CG 1 ATOM 1799 C CD . ARG A 1 226 ? -2.279 44.413 10.154 1.00 7.72 ? 226 ARG A CD 1 ATOM 1800 N NE . ARG A 1 226 ? -2.631 43.388 11.143 1.00 11.91 ? 226 ARG A NE 1 ATOM 1801 C CZ . ARG A 1 226 ? -3.389 42.320 10.887 1.00 13.14 ? 226 ARG A CZ 1 ATOM 1802 N NH1 . ARG A 1 226 ? -3.888 42.127 9.670 1.00 13.47 ? 226 ARG A NH1 1 ATOM 1803 N NH2 . ARG A 1 226 ? -3.643 41.434 11.843 1.00 12.87 ? 226 ARG A NH2 1 ATOM 1804 N N . HIS A 1 227 ? -1.989 47.430 6.574 1.00 3.07 ? 227 HIS A N 1 ATOM 1805 C CA . HIS A 1 227 ? -1.795 48.614 5.765 1.00 4.06 ? 227 HIS A CA 1 ATOM 1806 C C . HIS A 1 227 ? -0.801 49.617 6.342 1.00 3.25 ? 227 HIS A C 1 ATOM 1807 O O . HIS A 1 227 ? -0.760 49.868 7.550 1.00 3.33 ? 227 HIS A O 1 ATOM 1808 C CB . HIS A 1 227 ? -3.137 49.308 5.527 1.00 6.01 ? 227 HIS A CB 1 ATOM 1809 C CG . HIS A 1 227 ? -3.922 48.740 4.385 1.00 8.61 ? 227 HIS A CG 1 ATOM 1810 N ND1 . HIS A 1 227 ? -4.521 47.501 4.435 1.00 9.65 ? 227 HIS A ND1 1 ATOM 1811 C CD2 . HIS A 1 227 ? -4.192 49.242 3.154 1.00 9.00 ? 227 HIS A CD2 1 ATOM 1812 C CE1 . HIS A 1 227 ? -5.127 47.262 3.284 1.00 10.23 ? 227 HIS A CE1 1 ATOM 1813 N NE2 . HIS A 1 227 ? -4.942 48.302 2.490 1.00 9.59 ? 227 HIS A NE2 1 ATOM 1814 N N . VAL A 1 228 ? -0.004 50.190 5.449 1.00 1.34 ? 228 VAL A N 1 ATOM 1815 C CA . VAL A 1 228 ? 0.989 51.179 5.813 1.00 0.96 ? 228 VAL A CA 1 ATOM 1816 C C . VAL A 1 228 ? 0.416 52.520 5.437 1.00 1.14 ? 228 VAL A C 1 ATOM 1817 O O . VAL A 1 228 ? 0.048 52.721 4.286 1.00 2.83 ? 228 VAL A O 1 ATOM 1818 C CB . VAL A 1 228 ? 2.285 51.000 4.998 1.00 1.11 ? 228 VAL A CB 1 ATOM 1819 C CG1 . VAL A 1 228 ? 3.193 52.197 5.195 1.00 0.96 ? 228 VAL A CG1 1 ATOM 1820 C CG2 . VAL A 1 228 ? 2.999 49.727 5.407 1.00 1.43 ? 228 VAL A CG2 1 ATOM 1821 N N . MET A 1 229 ? 0.320 53.432 6.393 1.00 0.96 ? 229 MET A N 1 ATOM 1822 C CA . MET A 1 229 ? -0.178 54.774 6.104 1.00 0.96 ? 229 MET A CA 1 ATOM 1823 C C . MET A 1 229 ? 1.069 55.636 6.178 1.00 0.96 ? 229 MET A C 1 ATOM 1824 O O . MET A 1 229 ? 1.616 55.816 7.259 1.00 1.24 ? 229 MET A O 1 ATOM 1825 C CB . MET A 1 229 ? -1.199 55.199 7.167 1.00 0.96 ? 229 MET A CB 1 ATOM 1826 C CG . MET A 1 229 ? -1.648 56.662 7.133 1.00 1.06 ? 229 MET A CG 1 ATOM 1827 S SD . MET A 1 229 ? -2.579 57.177 5.677 1.00 0.98 ? 229 MET A SD 1 ATOM 1828 C CE . MET A 1 229 ? -1.319 57.834 4.704 1.00 1.97 ? 229 MET A CE 1 ATOM 1829 N N . LYS A 1 230 ? 1.535 56.147 5.041 1.00 0.96 ? 230 LYS A N 1 ATOM 1830 C CA . LYS A 1 230 ? 2.754 56.965 5.020 1.00 1.43 ? 230 LYS A CA 1 ATOM 1831 C C . LYS A 1 230 ? 2.497 58.418 4.660 1.00 2.29 ? 230 LYS A C 1 ATOM 1832 O O . LYS A 1 230 ? 1.566 58.727 3.912 1.00 3.49 ? 230 LYS A O 1 ATOM 1833 C CB . LYS A 1 230 ? 3.775 56.369 4.038 1.00 0.96 ? 230 LYS A CB 1 ATOM 1834 C CG . LYS A 1 230 ? 5.009 57.227 3.751 1.00 0.96 ? 230 LYS A CG 1 ATOM 1835 C CD . LYS A 1 230 ? 4.767 58.225 2.623 1.00 1.05 ? 230 LYS A CD 1 ATOM 1836 C CE . LYS A 1 230 ? 6.039 58.959 2.220 1.00 0.96 ? 230 LYS A CE 1 ATOM 1837 N NZ . LYS A 1 230 ? 5.854 59.844 1.035 1.00 0.96 ? 230 LYS A NZ 1 ATOM 1838 N N . ALA A 1 231 ? 3.332 59.311 5.185 1.00 1.64 ? 231 ALA A N 1 ATOM 1839 C CA . ALA A 1 231 ? 3.180 60.728 4.901 1.00 0.96 ? 231 ALA A CA 1 ATOM 1840 C C . ALA A 1 231 ? 4.416 61.532 5.221 1.00 0.96 ? 231 ALA A C 1 ATOM 1841 O O . ALA A 1 231 ? 5.153 61.234 6.150 1.00 0.96 ? 231 ALA A O 1 ATOM 1842 C CB . ALA A 1 231 ? 2.002 61.282 5.659 1.00 0.96 ? 231 ALA A CB 1 ATOM 1843 N N . GLY A 1 232 ? 4.638 62.569 4.437 1.00 2.60 ? 232 GLY A N 1 ATOM 1844 C CA . GLY A 1 232 ? 5.798 63.397 4.668 1.00 4.84 ? 232 GLY A CA 1 ATOM 1845 C C . GLY A 1 232 ? 5.410 64.682 5.357 1.00 5.85 ? 232 GLY A C 1 ATOM 1846 O O . GLY A 1 232 ? 4.358 65.257 5.069 1.00 7.09 ? 232 GLY A O 1 ATOM 1847 N N . PHE A 1 233 ? 6.254 65.123 6.282 1.00 5.36 ? 233 PHE A N 1 ATOM 1848 C CA . PHE A 1 233 ? 6.015 66.359 6.993 1.00 5.30 ? 233 PHE A CA 1 ATOM 1849 C C . PHE A 1 233 ? 7.130 66.650 7.965 1.00 5.69 ? 233 PHE A C 1 ATOM 1850 O O . PHE A 1 233 ? 7.668 65.756 8.606 1.00 3.64 ? 233 PHE A O 1 ATOM 1851 C CB . PHE A 1 233 ? 4.666 66.321 7.696 1.00 5.28 ? 233 PHE A CB 1 ATOM 1852 C CG . PHE A 1 233 ? 4.517 65.204 8.667 1.00 5.47 ? 233 PHE A CG 1 ATOM 1853 C CD1 . PHE A 1 233 ? 4.848 65.386 10.002 1.00 5.82 ? 233 PHE A CD1 1 ATOM 1854 C CD2 . PHE A 1 233 ? 4.005 63.979 8.261 1.00 5.66 ? 233 PHE A CD2 1 ATOM 1855 C CE1 . PHE A 1 233 ? 4.665 64.366 10.925 1.00 5.21 ? 233 PHE A CE1 1 ATOM 1856 C CE2 . PHE A 1 233 ? 3.818 62.948 9.177 1.00 5.60 ? 233 PHE A CE2 1 ATOM 1857 C CZ . PHE A 1 233 ? 4.148 63.145 10.511 1.00 6.06 ? 233 PHE A CZ 1 ATOM 1858 N N . GLU A 1 234 ? 7.464 67.929 8.051 1.00 7.99 ? 234 GLU A N 1 ATOM 1859 C CA . GLU A 1 234 ? 8.546 68.420 8.887 1.00 9.78 ? 234 GLU A CA 1 ATOM 1860 C C . GLU A 1 234 ? 9.857 67.982 8.225 1.00 9.65 ? 234 GLU A C 1 ATOM 1861 O O . GLU A 1 234 ? 10.856 67.706 8.888 1.00 11.01 ? 234 GLU A O 1 ATOM 1862 C CB . GLU A 1 234 ? 8.425 67.887 10.321 1.00 10.76 ? 234 GLU A CB 1 ATOM 1863 C CG . GLU A 1 234 ? 7.037 68.109 10.927 1.00 14.82 ? 234 GLU A CG 1 ATOM 1864 C CD . GLU A 1 234 ? 6.965 67.867 12.446 1.00 18.00 ? 234 GLU A CD 1 ATOM 1865 O OE1 . GLU A 1 234 ? 7.897 67.233 13.012 1.00 19.82 ? 234 GLU A OE1 1 ATOM 1866 O OE2 . GLU A 1 234 ? 5.960 68.309 13.069 1.00 17.36 ? 234 GLU A OE2 1 ATOM 1867 N N . GLY A 1 235 ? 9.835 67.922 6.897 1.00 8.86 ? 235 GLY A N 1 ATOM 1868 C CA . GLY A 1 235 ? 11.021 67.545 6.148 1.00 8.18 ? 235 GLY A CA 1 ATOM 1869 C C . GLY A 1 235 ? 11.383 66.073 6.139 1.00 6.89 ? 235 GLY A C 1 ATOM 1870 O O . GLY A 1 235 ? 12.447 65.708 5.639 1.00 7.24 ? 235 GLY A O 1 ATOM 1871 N N . HIS A 1 236 ? 10.496 65.230 6.658 1.00 5.39 ? 236 HIS A N 1 ATOM 1872 C CA . HIS A 1 236 ? 10.747 63.797 6.719 1.00 4.49 ? 236 HIS A CA 1 ATOM 1873 C C . HIS A 1 236 ? 9.542 62.951 6.318 1.00 3.87 ? 236 HIS A C 1 ATOM 1874 O O . HIS A 1 236 ? 8.403 63.396 6.416 1.00 3.96 ? 236 HIS A O 1 ATOM 1875 C CB . HIS A 1 236 ? 11.168 63.441 8.134 1.00 5.24 ? 236 HIS A CB 1 ATOM 1876 C CG . HIS A 1 236 ? 12.475 64.043 8.541 1.00 6.10 ? 236 HIS A CG 1 ATOM 1877 N ND1 . HIS A 1 236 ? 12.801 64.294 9.857 1.00 6.26 ? 236 HIS A ND1 1 ATOM 1878 C CD2 . HIS A 1 236 ? 13.563 64.388 7.812 1.00 6.85 ? 236 HIS A CD2 1 ATOM 1879 C CE1 . HIS A 1 236 ? 14.033 64.765 9.920 1.00 7.82 ? 236 HIS A CE1 1 ATOM 1880 N NE2 . HIS A 1 236 ? 14.518 64.832 8.693 1.00 7.95 ? 236 HIS A NE2 1 ATOM 1881 N N . ASP A 1 237 ? 9.796 61.730 5.861 1.00 3.04 ? 237 ASP A N 1 ATOM 1882 C CA . ASP A 1 237 ? 8.713 60.837 5.464 1.00 2.94 ? 237 ASP A CA 1 ATOM 1883 C C . ASP A 1 237 ? 8.494 59.794 6.559 1.00 2.31 ? 237 ASP A C 1 ATOM 1884 O O . ASP A 1 237 ? 9.398 59.031 6.895 1.00 2.53 ? 237 ASP A O 1 ATOM 1885 C CB . ASP A 1 237 ? 9.036 60.123 4.140 1.00 5.23 ? 237 ASP A CB 1 ATOM 1886 C CG . ASP A 1 237 ? 8.837 61.008 2.906 1.00 6.45 ? 237 ASP A CG 1 ATOM 1887 O OD1 . ASP A 1 237 ? 7.887 61.821 2.859 1.00 8.71 ? 237 ASP A OD1 1 ATOM 1888 O OD2 . ASP A 1 237 ? 9.626 60.864 1.953 1.00 7.85 ? 237 ASP A OD2 1 ATOM 1889 N N . TRP A 1 238 ? 7.282 59.747 7.098 1.00 1.24 ? 238 TRP A N 1 ATOM 1890 C CA . TRP A 1 238 ? 6.957 58.817 8.173 1.00 0.96 ? 238 TRP A CA 1 ATOM 1891 C C . TRP A 1 238 ? 5.896 57.808 7.770 1.00 1.09 ? 238 TRP A C 1 ATOM 1892 O O . TRP A 1 238 ? 5.165 57.999 6.795 1.00 1.29 ? 238 TRP A O 1 ATOM 1893 C CB . TRP A 1 238 ? 6.441 59.592 9.385 1.00 0.96 ? 238 TRP A CB 1 ATOM 1894 C CG . TRP A 1 238 ? 7.106 60.920 9.569 1.00 1.86 ? 238 TRP A CG 1 ATOM 1895 C CD1 . TRP A 1 238 ? 6.990 62.015 8.764 1.00 1.78 ? 238 TRP A CD1 1 ATOM 1896 C CD2 . TRP A 1 238 ? 8.045 61.273 10.590 1.00 2.25 ? 238 TRP A CD2 1 ATOM 1897 N NE1 . TRP A 1 238 ? 7.802 63.025 9.216 1.00 1.62 ? 238 TRP A NE1 1 ATOM 1898 C CE2 . TRP A 1 238 ? 8.461 62.595 10.336 1.00 1.94 ? 238 TRP A CE2 1 ATOM 1899 C CE3 . TRP A 1 238 ? 8.578 60.596 11.695 1.00 2.77 ? 238 TRP A CE3 1 ATOM 1900 C CZ2 . TRP A 1 238 ? 9.386 63.253 11.143 1.00 3.20 ? 238 TRP A CZ2 1 ATOM 1901 C CZ3 . TRP A 1 238 ? 9.497 61.250 12.498 1.00 3.41 ? 238 TRP A CZ3 1 ATOM 1902 C CH2 . TRP A 1 238 ? 9.892 62.566 12.217 1.00 4.23 ? 238 TRP A CH2 1 ATOM 1903 N N . TYR A 1 239 ? 5.804 56.727 8.529 1.00 1.55 ? 239 TYR A N 1 ATOM 1904 C CA . TYR A 1 239 ? 4.798 55.725 8.242 1.00 1.30 ? 239 TYR A CA 1 ATOM 1905 C C . TYR A 1 239 ? 4.337 55.059 9.513 1.00 1.48 ? 239 TYR A C 1 ATOM 1906 O O . TYR A 1 239 ? 4.917 55.245 10.579 1.00 1.26 ? 239 TYR A O 1 ATOM 1907 C CB . TYR A 1 239 ? 5.312 54.682 7.244 1.00 0.96 ? 239 TYR A CB 1 ATOM 1908 C CG . TYR A 1 239 ? 6.333 53.717 7.773 1.00 0.96 ? 239 TYR A CG 1 ATOM 1909 C CD1 . TYR A 1 239 ? 5.949 52.611 8.508 1.00 0.96 ? 239 TYR A CD1 1 ATOM 1910 C CD2 . TYR A 1 239 ? 7.681 53.887 7.497 1.00 1.08 ? 239 TYR A CD2 1 ATOM 1911 C CE1 . TYR A 1 239 ? 6.885 51.685 8.956 1.00 1.25 ? 239 TYR A CE1 1 ATOM 1912 C CE2 . TYR A 1 239 ? 8.627 52.976 7.935 1.00 1.74 ? 239 TYR A CE2 1 ATOM 1913 C CZ . TYR A 1 239 ? 8.224 51.871 8.666 1.00 1.87 ? 239 TYR A CZ 1 ATOM 1914 O OH . TYR A 1 239 ? 9.165 50.961 9.100 1.00 0.96 ? 239 TYR A OH 1 ATOM 1915 N N . THR A 1 240 ? 3.276 54.282 9.387 1.00 1.54 ? 240 THR A N 1 ATOM 1916 C CA . THR A 1 240 ? 2.698 53.595 10.514 1.00 1.39 ? 240 THR A CA 1 ATOM 1917 C C . THR A 1 240 ? 1.916 52.402 10.010 1.00 1.40 ? 240 THR A C 1 ATOM 1918 O O . THR A 1 240 ? 1.136 52.518 9.065 1.00 2.25 ? 240 THR A O 1 ATOM 1919 C CB . THR A 1 240 ? 1.763 54.529 11.263 1.00 0.96 ? 240 THR A CB 1 ATOM 1920 O OG1 . THR A 1 240 ? 0.933 53.768 12.145 1.00 3.16 ? 240 THR A OG1 1 ATOM 1921 C CG2 . THR A 1 240 ? 0.907 55.304 10.282 1.00 0.96 ? 240 THR A CG2 1 ATOM 1922 N N . ILE A 1 241 ? 2.140 51.253 10.637 1.00 1.59 ? 241 ILE A N 1 ATOM 1923 C CA . ILE A 1 241 ? 1.457 50.021 10.267 1.00 2.51 ? 241 ILE A CA 1 ATOM 1924 C C . ILE A 1 241 ? 0.141 49.936 11.024 1.00 4.73 ? 241 ILE A C 1 ATOM 1925 O O . ILE A 1 241 ? 0.106 50.167 12.238 1.00 7.19 ? 241 ILE A O 1 ATOM 1926 C CB . ILE A 1 241 ? 2.302 48.806 10.636 1.00 1.56 ? 241 ILE A CB 1 ATOM 1927 C CG1 . ILE A 1 241 ? 3.643 48.882 9.912 1.00 0.96 ? 241 ILE A CG1 1 ATOM 1928 C CG2 . ILE A 1 241 ? 1.549 47.529 10.310 1.00 0.96 ? 241 ILE A CG2 1 ATOM 1929 C CD1 . ILE A 1 241 ? 4.651 47.871 10.391 1.00 1.10 ? 241 ILE A CD1 1 ATOM 1930 N N . GLY A 1 242 ? -0.935 49.606 10.315 1.00 5.21 ? 242 GLY A N 1 ATOM 1931 C CA . GLY A 1 242 ? -2.233 49.506 10.958 1.00 6.33 ? 242 GLY A CA 1 ATOM 1932 C C . GLY A 1 242 ? -3.175 48.562 10.238 1.00 7.16 ? 242 GLY A C 1 ATOM 1933 O O . GLY A 1 242 ? -2.741 47.771 9.396 1.00 7.93 ? 242 GLY A O 1 ATOM 1934 N N . THR A 1 243 ? -4.461 48.649 10.577 1.00 6.92 ? 243 THR A N 1 ATOM 1935 C CA . THR A 1 243 ? -5.501 47.817 9.978 1.00 6.49 ? 243 THR A CA 1 ATOM 1936 C C . THR A 1 243 ? -6.490 48.685 9.216 1.00 7.60 ? 243 THR A C 1 ATOM 1937 O O . THR A 1 243 ? -6.888 49.737 9.704 1.00 7.96 ? 243 THR A O 1 ATOM 1938 C CB . THR A 1 243 ? -6.265 47.058 11.053 1.00 6.29 ? 243 THR A CB 1 ATOM 1939 O OG1 . THR A 1 243 ? -5.403 46.086 11.654 1.00 7.35 ? 243 THR A OG1 1 ATOM 1940 C CG2 . THR A 1 243 ? -7.476 46.381 10.461 1.00 6.25 ? 243 THR A CG2 1 ATOM 1941 N N . TYR A 1 244 ? -6.896 48.237 8.031 1.00 9.15 ? 244 TYR A N 1 ATOM 1942 C CA . TYR A 1 244 ? -7.836 48.992 7.196 1.00 10.46 ? 244 TYR A CA 1 ATOM 1943 C C . TYR A 1 244 ? -9.169 48.274 7.027 1.00 14.02 ? 244 TYR A C 1 ATOM 1944 O O . TYR A 1 244 ? -9.212 47.064 6.826 1.00 15.22 ? 244 TYR A O 1 ATOM 1945 C CB . TYR A 1 244 ? -7.211 49.228 5.830 1.00 9.12 ? 244 TYR A CB 1 ATOM 1946 C CG . TYR A 1 244 ? -8.101 49.909 4.831 1.00 8.28 ? 244 TYR A CG 1 ATOM 1947 C CD1 . TYR A 1 244 ? -8.629 51.168 5.080 1.00 8.76 ? 244 TYR A CD1 1 ATOM 1948 C CD2 . TYR A 1 244 ? -8.383 49.308 3.610 1.00 9.14 ? 244 TYR A CD2 1 ATOM 1949 C CE1 . TYR A 1 244 ? -9.418 51.821 4.126 1.00 9.44 ? 244 TYR A CE1 1 ATOM 1950 C CE2 . TYR A 1 244 ? -9.169 49.948 2.650 1.00 9.75 ? 244 TYR A CE2 1 ATOM 1951 C CZ . TYR A 1 244 ? -9.682 51.203 2.912 1.00 9.53 ? 244 TYR A CZ 1 ATOM 1952 O OH . TYR A 1 244 ? -10.442 51.837 1.954 1.00 9.70 ? 244 TYR A OH 1 ATOM 1953 N N . SER A 1 245 ? -10.260 49.026 7.097 1.00 17.42 ? 245 SER A N 1 ATOM 1954 C CA . SER A 1 245 ? -11.598 48.452 6.962 1.00 19.82 ? 245 SER A CA 1 ATOM 1955 C C . SER A 1 245 ? -12.428 49.270 5.983 1.00 22.52 ? 245 SER A C 1 ATOM 1956 O O . SER A 1 245 ? -13.152 50.183 6.373 1.00 23.12 ? 245 SER A O 1 ATOM 1957 C CB . SER A 1 245 ? -12.276 48.421 8.328 1.00 22.39 ? 245 SER A CB 1 ATOM 1958 O OG . SER A 1 245 ? -11.937 49.587 9.066 1.00 24.09 ? 245 SER A OG 1 ATOM 1959 N N . PRO A 1 246 ? -12.350 48.930 4.695 1.00 25.65 ? 246 PRO A N 1 ATOM 1960 C CA . PRO A 1 246 ? -13.073 49.620 3.627 1.00 23.87 ? 246 PRO A CA 1 ATOM 1961 C C . PRO A 1 246 ? -14.501 50.044 3.971 1.00 27.94 ? 246 PRO A C 1 ATOM 1962 O O . PRO A 1 246 ? -14.901 51.181 3.702 1.00 28.91 ? 246 PRO A O 1 ATOM 1963 C CB . PRO A 1 246 ? -13.048 48.607 2.486 1.00 25.80 ? 246 PRO A CB 1 ATOM 1964 C CG . PRO A 1 246 ? -11.788 47.856 2.721 1.00 24.72 ? 246 PRO A CG 1 ATOM 1965 C CD . PRO A 1 246 ? -11.812 47.647 4.210 1.00 23.89 ? 246 PRO A CD 1 ATOM 1966 N N . ASP A 1 247 ? -15.258 49.122 4.566 1.00 30.92 ? 247 ASP A N 1 ATOM 1967 C CA . ASP A 1 247 ? -16.666 49.346 4.915 1.00 31.86 ? 247 ASP A CA 1 ATOM 1968 C C . ASP A 1 247 ? -16.998 50.636 5.660 1.00 32.35 ? 247 ASP A C 1 ATOM 1969 O O . ASP A 1 247 ? -18.153 51.077 5.655 1.00 33.58 ? 247 ASP A O 1 ATOM 1970 C CB . ASP A 1 247 ? -17.208 48.151 5.715 1.00 34.30 ? 247 ASP A CB 1 ATOM 1971 C CG . ASP A 1 247 ? -17.059 46.821 4.967 1.00 36.88 ? 247 ASP A CG 1 ATOM 1972 O OD1 . ASP A 1 247 ? -17.460 46.748 3.778 1.00 37.54 ? 247 ASP A OD1 1 ATOM 1973 O OD2 . ASP A 1 247 ? -16.548 45.846 5.575 1.00 37.26 ? 247 ASP A OD2 1 ATOM 1974 N N . ARG A 1 248 ? -15.999 51.239 6.299 1.00 30.49 ? 248 ARG A N 1 ATOM 1975 C CA . ARG A 1 248 ? -16.215 52.472 7.040 1.00 28.59 ? 248 ARG A CA 1 ATOM 1976 C C . ARG A 1 248 ? -15.061 53.443 6.815 1.00 25.96 ? 248 ARG A C 1 ATOM 1977 O O . ARG A 1 248 ? -14.998 54.504 7.439 1.00 26.06 ? 248 ARG A O 1 ATOM 1978 C CB . ARG A 1 248 ? -16.365 52.154 8.531 1.00 30.81 ? 248 ARG A CB 1 ATOM 1979 C CG . ARG A 1 248 ? -16.015 50.706 8.893 1.00 35.08 ? 248 ARG A CG 1 ATOM 1980 C CD . ARG A 1 248 ? -15.672 50.549 10.386 1.00 39.66 ? 248 ARG A CD 1 ATOM 1981 N NE . ARG A 1 248 ? -15.019 49.267 10.687 1.00 42.11 ? 248 ARG A NE 1 ATOM 1982 C CZ . ARG A 1 248 ? -14.365 48.998 11.819 1.00 42.93 ? 248 ARG A CZ 1 ATOM 1983 N NH1 . ARG A 1 248 ? -14.268 49.920 12.773 1.00 42.73 ? 248 ARG A NH1 1 ATOM 1984 N NH2 . ARG A 1 248 ? -13.803 47.806 11.993 1.00 42.96 ? 248 ARG A NH2 1 ATOM 1985 N N . GLU A 1 249 ? -14.168 53.083 5.895 1.00 23.71 ? 249 GLU A N 1 ATOM 1986 C CA . GLU A 1 249 ? -12.996 53.899 5.582 1.00 21.43 ? 249 GLU A CA 1 ATOM 1987 C C . GLU A 1 249 ? -12.348 54.299 6.899 1.00 20.52 ? 249 GLU A C 1 ATOM 1988 O O . GLU A 1 249 ? -12.193 55.487 7.207 1.00 20.99 ? 249 GLU A O 1 ATOM 1989 C CB . GLU A 1 249 ? -13.380 55.160 4.808 1.00 19.88 ? 249 GLU A CB 1 ATOM 1990 C CG . GLU A 1 249 ? -14.146 54.926 3.518 1.00 20.42 ? 249 GLU A CG 1 ATOM 1991 C CD . GLU A 1 249 ? -13.436 54.005 2.542 1.00 19.92 ? 249 GLU A CD 1 ATOM 1992 O OE1 . GLU A 1 249 ? -12.197 53.882 2.628 1.00 19.15 ? 249 GLU A OE1 1 ATOM 1993 O OE2 . GLU A 1 249 ? -14.127 53.418 1.678 1.00 20.51 ? 249 GLU A OE2 1 ATOM 1994 N N . ASN A 1 250 ? -11.981 53.290 7.678 1.00 18.77 ? 250 ASN A N 1 ATOM 1995 C CA . ASN A 1 250 ? -11.363 53.514 8.966 1.00 17.43 ? 250 ASN A CA 1 ATOM 1996 C C . ASN A 1 250 ? -9.977 52.887 9.006 1.00 15.60 ? 250 ASN A C 1 ATOM 1997 O O . ASN A 1 250 ? -9.797 51.742 8.586 1.00 15.39 ? 250 ASN A O 1 ATOM 1998 C CB . ASN A 1 250 ? -12.238 52.908 10.061 1.00 19.36 ? 250 ASN A CB 1 ATOM 1999 C CG . ASN A 1 250 ? -11.534 52.847 11.395 1.00 22.26 ? 250 ASN A CG 1 ATOM 2000 O OD1 . ASN A 1 250 ? -11.304 53.876 12.037 1.00 24.95 ? 250 ASN A OD1 1 ATOM 2001 N ND2 . ASN A 1 250 ? -11.172 51.636 11.820 1.00 22.48 ? 250 ASN A ND2 1 ATOM 2002 N N . PHE A 1 251 ? -9.002 53.647 9.502 1.00 13.29 ? 251 PHE A N 1 ATOM 2003 C CA . PHE A 1 251 ? -7.628 53.165 9.625 1.00 11.03 ? 251 PHE A CA 1 ATOM 2004 C C . PHE A 1 251 ? -7.217 53.154 11.093 1.00 10.65 ? 251 PHE A C 1 ATOM 2005 O O . PHE A 1 251 ? -7.082 54.214 11.701 1.00 11.85 ? 251 PHE A O 1 ATOM 2006 C CB . PHE A 1 251 ? -6.670 54.067 8.860 1.00 9.18 ? 251 PHE A CB 1 ATOM 2007 C CG . PHE A 1 251 ? -5.237 53.644 8.970 1.00 6.90 ? 251 PHE A CG 1 ATOM 2008 C CD1 . PHE A 1 251 ? -4.820 52.423 8.454 1.00 6.31 ? 251 PHE A CD1 1 ATOM 2009 C CD2 . PHE A 1 251 ? -4.307 54.451 9.602 1.00 6.73 ? 251 PHE A CD2 1 ATOM 2010 C CE1 . PHE A 1 251 ? -3.494 52.007 8.566 1.00 5.02 ? 251 PHE A CE1 1 ATOM 2011 C CE2 . PHE A 1 251 ? -2.978 54.043 9.720 1.00 7.03 ? 251 PHE A CE2 1 ATOM 2012 C CZ . PHE A 1 251 ? -2.573 52.815 9.198 1.00 5.92 ? 251 PHE A CZ 1 ATOM 2013 N N . LEU A 1 252 ? -7.013 51.965 11.656 1.00 9.68 ? 252 LEU A N 1 ATOM 2014 C CA . LEU A 1 252 ? -6.633 51.843 13.058 1.00 8.72 ? 252 LEU A CA 1 ATOM 2015 C C . LEU A 1 252 ? -5.181 51.426 13.202 1.00 7.82 ? 252 LEU A C 1 ATOM 2016 O O . LEU A 1 252 ? -4.828 50.269 12.966 1.00 6.84 ? 252 LEU A O 1 ATOM 2017 C CB . LEU A 1 252 ? -7.512 50.812 13.755 1.00 11.71 ? 252 LEU A CB 1 ATOM 2018 C CG . LEU A 1 252 ? -7.926 51.114 15.201 1.00 14.65 ? 252 LEU A CG 1 ATOM 2019 C CD1 . LEU A 1 252 ? -8.246 49.793 15.902 1.00 15.94 ? 252 LEU A CD1 1 ATOM 2020 C CD2 . LEU A 1 252 ? -6.817 51.851 15.948 1.00 15.58 ? 252 LEU A CD2 1 ATOM 2021 N N . PRO A 1 253 ? -4.323 52.365 13.626 1.00 7.77 ? 253 PRO A N 1 ATOM 2022 C CA . PRO A 1 253 ? -2.885 52.153 13.821 1.00 8.21 ? 253 PRO A CA 1 ATOM 2023 C C . PRO A 1 253 ? -2.623 50.955 14.703 1.00 8.42 ? 253 PRO A C 1 ATOM 2024 O O . PRO A 1 253 ? -3.391 50.679 15.616 1.00 9.69 ? 253 PRO A O 1 ATOM 2025 C CB . PRO A 1 253 ? -2.427 53.446 14.496 1.00 7.73 ? 253 PRO A CB 1 ATOM 2026 C CG . PRO A 1 253 ? -3.405 54.458 14.023 1.00 8.13 ? 253 PRO A CG 1 ATOM 2027 C CD . PRO A 1 253 ? -4.713 53.697 14.112 1.00 8.42 ? 253 PRO A CD 1 ATOM 2028 N N . GLN A 1 254 ? -1.533 50.251 14.448 1.00 8.72 ? 254 GLN A N 1 ATOM 2029 C CA . GLN A 1 254 ? -1.209 49.098 15.264 1.00 9.88 ? 254 GLN A CA 1 ATOM 2030 C C . GLN A 1 254 ? -0.779 49.532 16.676 1.00 9.74 ? 254 GLN A C 1 ATOM 2031 O O . GLN A 1 254 ? -1.239 48.965 17.669 1.00 9.78 ? 254 GLN A O 1 ATOM 2032 C CB . GLN A 1 254 ? -0.113 48.282 14.582 1.00 12.30 ? 254 GLN A CB 1 ATOM 2033 C CG . GLN A 1 254 ? 0.138 46.916 15.200 1.00 16.67 ? 254 GLN A CG 1 ATOM 2034 C CD . GLN A 1 254 ? 0.657 45.912 14.183 1.00 19.36 ? 254 GLN A CD 1 ATOM 2035 O OE1 . GLN A 1 254 ? -0.106 45.098 13.646 1.00 20.61 ? 254 GLN A OE1 1 ATOM 2036 N NE2 . GLN A 1 254 ? 1.957 45.976 13.899 1.00 21.45 ? 254 GLN A NE2 1 ATOM 2037 N N . ASN A 1 255 ? 0.083 50.544 16.773 1.00 9.32 ? 255 ASN A N 1 ATOM 2038 C CA . ASN A 1 255 ? 0.543 51.020 18.080 1.00 8.60 ? 255 ASN A CA 1 ATOM 2039 C C . ASN A 1 255 ? -0.460 51.987 18.712 1.00 8.30 ? 255 ASN A C 1 ATOM 2040 O O . ASN A 1 255 ? -0.278 52.439 19.841 1.00 8.97 ? 255 ASN A O 1 ATOM 2041 C CB . ASN A 1 255 ? 1.917 51.697 17.955 1.00 8.92 ? 255 ASN A CB 1 ATOM 2042 C CG . ASN A 1 255 ? 1.890 52.913 17.046 1.00 10.06 ? 255 ASN A CG 1 ATOM 2043 O OD1 . ASN A 1 255 ? 1.266 53.928 17.361 1.00 9.94 ? 255 ASN A OD1 1 ATOM 2044 N ND2 . ASN A 1 255 ? 2.562 52.813 15.904 1.00 11.19 ? 255 ASN A ND2 1 ATOM 2045 N N . GLY A 1 256 ? -1.520 52.302 17.979 1.00 7.64 ? 256 GLY A N 1 ATOM 2046 C CA . GLY A 1 256 ? -2.539 53.199 18.494 1.00 6.85 ? 256 GLY A CA 1 ATOM 2047 C C . GLY A 1 256 ? -2.123 54.648 18.677 1.00 5.78 ? 256 GLY A C 1 ATOM 2048 O O . GLY A 1 256 ? -2.626 55.330 19.564 1.00 6.10 ? 256 GLY A O 1 ATOM 2049 N N . LEU A 1 257 ? -1.219 55.139 17.845 1.00 4.50 ? 257 LEU A N 1 ATOM 2050 C CA . LEU A 1 257 ? -0.796 56.517 17.984 1.00 5.18 ? 257 LEU A CA 1 ATOM 2051 C C . LEU A 1 257 ? -0.996 57.297 16.701 1.00 6.06 ? 257 LEU A C 1 ATOM 2052 O O . LEU A 1 257 ? -0.918 56.734 15.609 1.00 6.14 ? 257 LEU A O 1 ATOM 2053 C CB . LEU A 1 257 ? 0.683 56.576 18.355 1.00 4.99 ? 257 LEU A CB 1 ATOM 2054 C CG . LEU A 1 257 ? 1.189 55.643 19.446 1.00 4.69 ? 257 LEU A CG 1 ATOM 2055 C CD1 . LEU A 1 257 ? 2.634 55.979 19.735 1.00 4.30 ? 257 LEU A CD1 1 ATOM 2056 C CD2 . LEU A 1 257 ? 0.341 55.788 20.697 1.00 6.18 ? 257 LEU A CD2 1 ATOM 2057 N N . SER A 1 258 ? -1.266 58.592 16.828 1.00 6.79 ? 258 SER A N 1 ATOM 2058 C CA . SER A 1 258 ? -1.399 59.432 15.641 1.00 8.75 ? 258 SER A CA 1 ATOM 2059 C C . SER A 1 258 ? 0.044 59.788 15.339 1.00 7.56 ? 258 SER A C 1 ATOM 2060 O O . SER A 1 258 ? 0.876 59.779 16.246 1.00 7.80 ? 258 SER A O 1 ATOM 2061 C CB . SER A 1 258 ? -2.189 60.711 15.941 1.00 11.09 ? 258 SER A CB 1 ATOM 2062 O OG . SER A 1 258 ? -3.567 60.441 16.125 1.00 15.36 ? 258 SER A OG 1 ATOM 2063 N N . LEU A 1 259 ? 0.371 60.087 14.089 1.00 6.34 ? 259 LEU A N 1 ATOM 2064 C CA . LEU A 1 259 ? 1.755 60.427 13.811 1.00 5.36 ? 259 LEU A CA 1 ATOM 2065 C C . LEU A 1 259 ? 2.108 61.666 14.607 1.00 5.30 ? 259 LEU A C 1 ATOM 2066 O O . LEU A 1 259 ? 1.277 62.569 14.772 1.00 5.29 ? 259 LEU A O 1 ATOM 2067 C CB . LEU A 1 259 ? 1.969 60.674 12.327 1.00 4.62 ? 259 LEU A CB 1 ATOM 2068 C CG . LEU A 1 259 ? 1.690 59.442 11.471 1.00 4.83 ? 259 LEU A CG 1 ATOM 2069 C CD1 . LEU A 1 259 ? 2.120 59.723 10.052 1.00 4.30 ? 259 LEU A CD1 1 ATOM 2070 C CD2 . LEU A 1 259 ? 2.443 58.241 12.030 1.00 5.03 ? 259 LEU A CD2 1 ATOM 2071 N N . THR A 1 260 ? 3.340 61.701 15.110 1.00 4.27 ? 260 THR A N 1 ATOM 2072 C CA . THR A 1 260 ? 3.799 62.822 15.910 1.00 2.12 ? 260 THR A CA 1 ATOM 2073 C C . THR A 1 260 ? 5.089 63.438 15.415 1.00 2.01 ? 260 THR A C 1 ATOM 2074 O O . THR A 1 260 ? 5.397 64.567 15.751 1.00 2.83 ? 260 THR A O 1 ATOM 2075 C CB . THR A 1 260 ? 4.015 62.405 17.346 1.00 1.45 ? 260 THR A CB 1 ATOM 2076 O OG1 . THR A 1 260 ? 3.376 61.142 17.578 1.00 1.80 ? 260 THR A OG1 1 ATOM 2077 C CG2 . THR A 1 260 ? 3.426 63.439 18.269 1.00 1.70 ? 260 THR A CG2 1 ATOM 2078 N N . GLY A 1 261 ? 5.854 62.708 14.621 1.00 1.93 ? 261 GLY A N 1 ATOM 2079 C CA . GLY A 1 261 ? 7.100 63.269 14.125 1.00 1.83 ? 261 GLY A CA 1 ATOM 2080 C C . GLY A 1 261 ? 8.141 63.284 15.220 1.00 1.22 ? 261 GLY A C 1 ATOM 2081 O O . GLY A 1 261 ? 9.138 64.001 15.158 1.00 0.96 ? 261 GLY A O 1 ATOM 2082 N N . SER A 1 262 ? 7.887 62.479 16.237 1.00 1.00 ? 262 SER A N 1 ATOM 2083 C CA . SER A 1 262 ? 8.785 62.357 17.366 1.00 1.94 ? 262 SER A CA 1 ATOM 2084 C C . SER A 1 262 ? 9.588 61.074 17.247 1.00 2.49 ? 262 SER A C 1 ATOM 2085 O O . SER A 1 262 ? 9.308 60.223 16.397 1.00 2.47 ? 262 SER A O 1 ATOM 2086 C CB . SER A 1 262 ? 7.982 62.321 18.661 1.00 2.57 ? 262 SER A CB 1 ATOM 2087 O OG . SER A 1 262 ? 7.001 61.298 18.634 1.00 2.35 ? 262 SER A OG 1 ATOM 2088 N N . THR A 1 263 ? 10.584 60.930 18.111 1.00 2.92 ? 263 THR A N 1 ATOM 2089 C CA . THR A 1 263 ? 11.411 59.735 18.110 1.00 3.64 ? 263 THR A CA 1 ATOM 2090 C C . THR A 1 263 ? 10.578 58.559 18.577 1.00 4.52 ? 263 THR A C 1 ATOM 2091 O O . THR A 1 263 ? 11.095 57.551 19.049 1.00 4.71 ? 263 THR A O 1 ATOM 2092 C CB . THR A 1 263 ? 12.598 59.903 19.039 1.00 3.50 ? 263 THR A CB 1 ATOM 2093 O OG1 . THR A 1 263 ? 12.151 60.374 20.320 1.00 1.60 ? 263 THR A OG1 1 ATOM 2094 C CG2 . THR A 1 263 ? 13.572 60.891 18.437 1.00 3.76 ? 263 THR A CG2 1 ATOM 2095 N N . LEU A 1 264 ? 9.272 58.711 18.422 1.00 5.61 ? 264 LEU A N 1 ATOM 2096 C CA . LEU A 1 264 ? 8.299 57.712 18.826 1.00 6.77 ? 264 LEU A CA 1 ATOM 2097 C C . LEU A 1 264 ? 7.800 56.968 17.596 1.00 6.88 ? 264 LEU A C 1 ATOM 2098 O O . LEU A 1 264 ? 7.347 55.829 17.691 1.00 6.84 ? 264 LEU A O 1 ATOM 2099 C CB . LEU A 1 264 ? 7.128 58.424 19.509 1.00 7.26 ? 264 LEU A CB 1 ATOM 2100 C CG . LEU A 1 264 ? 6.578 57.969 20.857 1.00 7.29 ? 264 LEU A CG 1 ATOM 2101 C CD1 . LEU A 1 264 ? 7.704 57.568 21.785 1.00 8.42 ? 264 LEU A CD1 1 ATOM 2102 C CD2 . LEU A 1 264 ? 5.768 59.113 21.454 1.00 7.62 ? 264 LEU A CD2 1 ATOM 2103 N N . ASP A 1 265 ? 7.898 57.625 16.444 1.00 7.09 ? 265 ASP A N 1 ATOM 2104 C CA . ASP A 1 265 ? 7.426 57.060 15.186 1.00 7.29 ? 265 ASP A CA 1 ATOM 2105 C C . ASP A 1 265 ? 8.513 56.434 14.323 1.00 6.69 ? 265 ASP A C 1 ATOM 2106 O O . ASP A 1 265 ? 9.691 56.389 14.701 1.00 7.86 ? 265 ASP A O 1 ATOM 2107 C CB . ASP A 1 265 ? 6.706 58.135 14.369 1.00 8.06 ? 265 ASP A CB 1 ATOM 2108 C CG . ASP A 1 265 ? 5.639 58.858 15.162 1.00 8.68 ? 265 ASP A CG 1 ATOM 2109 O OD1 . ASP A 1 265 ? 4.825 58.183 15.829 1.00 9.11 ? 265 ASP A OD1 1 ATOM 2110 O OD2 . ASP A 1 265 ? 5.614 60.106 15.107 1.00 8.87 ? 265 ASP A OD2 1 ATOM 2111 N N . LEU A 1 266 ? 8.099 55.967 13.149 1.00 4.49 ? 266 LEU A N 1 ATOM 2112 C CA . LEU A 1 266 ? 9.003 55.325 12.212 1.00 3.38 ? 266 LEU A CA 1 ATOM 2113 C C . LEU A 1 266 ? 9.176 56.051 10.883 1.00 4.12 ? 266 LEU A C 1 ATOM 2114 O O . LEU A 1 266 ? 8.250 56.689 10.372 1.00 5.36 ? 266 LEU A O 1 ATOM 2115 C CB . LEU A 1 266 ? 8.525 53.906 11.910 1.00 2.48 ? 266 LEU A CB 1 ATOM 2116 C CG . LEU A 1 266 ? 8.685 52.788 12.935 1.00 1.91 ? 266 LEU A CG 1 ATOM 2117 C CD1 . LEU A 1 266 ? 8.161 51.502 12.315 1.00 0.96 ? 266 LEU A CD1 1 ATOM 2118 C CD2 . LEU A 1 266 ? 10.151 52.633 13.341 1.00 2.57 ? 266 LEU A CD2 1 ATOM 2119 N N . ARG A 1 267 ? 10.376 55.934 10.323 1.00 3.47 ? 267 ARG A N 1 ATOM 2120 C CA . ARG A 1 267 ? 10.676 56.525 9.031 1.00 2.78 ? 267 ARG A CA 1 ATOM 2121 C C . ARG A 1 267 ? 11.226 55.399 8.178 1.00 3.22 ? 267 ARG A C 1 ATOM 2122 O O . ARG A 1 267 ? 11.678 54.379 8.703 1.00 3.57 ? 267 ARG A O 1 ATOM 2123 C CB . ARG A 1 267 ? 11.764 57.581 9.131 1.00 1.28 ? 267 ARG A CB 1 ATOM 2124 C CG . ARG A 1 267 ? 11.570 58.674 10.146 1.00 0.96 ? 267 ARG A CG 1 ATOM 2125 C CD . ARG A 1 267 ? 12.735 59.639 9.994 1.00 0.96 ? 267 ARG A CD 1 ATOM 2126 N NE . ARG A 1 267 ? 12.944 60.520 11.131 1.00 0.96 ? 267 ARG A NE 1 ATOM 2127 C CZ . ARG A 1 267 ? 13.937 61.398 11.193 1.00 3.18 ? 267 ARG A CZ 1 ATOM 2128 N NH1 . ARG A 1 267 ? 14.796 61.503 10.181 1.00 3.17 ? 267 ARG A NH1 1 ATOM 2129 N NH2 . ARG A 1 267 ? 14.078 62.161 12.268 1.00 5.91 ? 267 ARG A NH2 1 ATOM 2130 N N . TYR A 1 268 ? 11.188 55.574 6.864 1.00 3.16 ? 268 TYR A N 1 ATOM 2131 C CA . TYR A 1 268 ? 11.747 54.562 5.994 1.00 2.72 ? 268 TYR A CA 1 ATOM 2132 C C . TYR A 1 268 ? 13.256 54.682 6.213 1.00 3.34 ? 268 TYR A C 1 ATOM 2133 O O . TYR A 1 268 ? 13.933 53.738 6.638 1.00 3.00 ? 268 TYR A O 1 ATOM 2134 C CB . TYR A 1 268 ? 11.455 54.871 4.532 1.00 2.16 ? 268 TYR A CB 1 ATOM 2135 C CG . TYR A 1 268 ? 10.039 54.674 4.041 1.00 0.96 ? 268 TYR A CG 1 ATOM 2136 C CD1 . TYR A 1 268 ? 9.304 53.534 4.360 1.00 1.05 ? 268 TYR A CD1 1 ATOM 2137 C CD2 . TYR A 1 268 ? 9.496 55.565 3.121 1.00 1.00 ? 268 TYR A CD2 1 ATOM 2138 C CE1 . TYR A 1 268 ? 8.073 53.283 3.756 1.00 0.96 ? 268 TYR A CE1 1 ATOM 2139 C CE2 . TYR A 1 268 ? 8.278 55.328 2.515 1.00 1.18 ? 268 TYR A CE2 1 ATOM 2140 C CZ . TYR A 1 268 ? 7.572 54.190 2.827 1.00 1.60 ? 268 TYR A CZ 1 ATOM 2141 O OH . TYR A 1 268 ? 6.384 53.965 2.170 1.00 2.69 ? 268 TYR A OH 1 ATOM 2142 N N . ASP A 1 269 ? 13.760 55.878 5.930 1.00 3.09 ? 269 ASP A N 1 ATOM 2143 C CA . ASP A 1 269 ? 15.175 56.182 6.054 1.00 3.12 ? 269 ASP A CA 1 ATOM 2144 C C . ASP A 1 269 ? 15.332 57.381 6.982 1.00 3.21 ? 269 ASP A C 1 ATOM 2145 O O . ASP A 1 269 ? 14.561 58.340 6.894 1.00 4.65 ? 269 ASP A O 1 ATOM 2146 C CB . ASP A 1 269 ? 15.730 56.487 4.663 1.00 4.44 ? 269 ASP A CB 1 ATOM 2147 C CG . ASP A 1 269 ? 17.219 56.755 4.665 1.00 6.43 ? 269 ASP A CG 1 ATOM 2148 O OD1 . ASP A 1 269 ? 17.793 56.829 3.567 1.00 6.63 ? 269 ASP A OD1 1 ATOM 2149 O OD2 . ASP A 1 269 ? 17.820 56.899 5.750 1.00 8.22 ? 269 ASP A OD2 1 ATOM 2150 N N . TYR A 1 270 ? 16.333 57.328 7.861 1.00 2.30 ? 270 TYR A N 1 ATOM 2151 C CA . TYR A 1 270 ? 16.576 58.395 8.837 1.00 3.02 ? 270 TYR A CA 1 ATOM 2152 C C . TYR A 1 270 ? 17.578 59.472 8.430 1.00 3.29 ? 270 TYR A C 1 ATOM 2153 O O . TYR A 1 270 ? 18.035 60.259 9.274 1.00 4.09 ? 270 TYR A O 1 ATOM 2154 C CB . TYR A 1 270 ? 17.015 57.778 10.169 1.00 2.67 ? 270 TYR A CB 1 ATOM 2155 C CG . TYR A 1 270 ? 15.950 56.932 10.811 1.00 1.82 ? 270 TYR A CG 1 ATOM 2156 C CD1 . TYR A 1 270 ? 14.920 57.511 11.527 1.00 1.19 ? 270 TYR A CD1 1 ATOM 2157 C CD2 . TYR A 1 270 ? 15.921 55.560 10.615 1.00 3.35 ? 270 TYR A CD2 1 ATOM 2158 C CE1 . TYR A 1 270 ? 13.877 56.746 12.028 1.00 5.09 ? 270 TYR A CE1 1 ATOM 2159 C CE2 . TYR A 1 270 ? 14.884 54.782 11.107 1.00 5.54 ? 270 TYR A CE2 1 ATOM 2160 C CZ . TYR A 1 270 ? 13.858 55.379 11.812 1.00 6.43 ? 270 TYR A CZ 1 ATOM 2161 O OH . TYR A 1 270 ? 12.803 54.614 12.277 1.00 8.43 ? 270 TYR A OH 1 ATOM 2162 N N . GLY A 1 271 ? 17.923 59.502 7.147 1.00 2.96 ? 271 GLY A N 1 ATOM 2163 C CA . GLY A 1 271 ? 18.862 60.490 6.653 1.00 2.56 ? 271 GLY A CA 1 ATOM 2164 C C . GLY A 1 271 ? 18.160 61.337 5.619 1.00 2.71 ? 271 GLY A C 1 ATOM 2165 O O . GLY A 1 271 ? 16.999 61.714 5.815 1.00 3.21 ? 271 GLY A O 1 ATOM 2166 N N . GLN A 1 272 ? 18.855 61.644 4.525 1.00 2.72 ? 272 GLN A N 1 ATOM 2167 C CA . GLN A 1 272 ? 18.280 62.438 3.438 1.00 2.79 ? 272 GLN A CA 1 ATOM 2168 C C . GLN A 1 272 ? 17.441 61.522 2.538 1.00 2.41 ? 272 GLN A C 1 ATOM 2169 O O . GLN A 1 272 ? 17.966 60.783 1.705 1.00 2.18 ? 272 GLN A O 1 ATOM 2170 C CB . GLN A 1 272 ? 19.391 63.107 2.636 1.00 2.64 ? 272 GLN A CB 1 ATOM 2171 C CG . GLN A 1 272 ? 20.058 64.278 3.345 1.00 4.55 ? 272 GLN A CG 1 ATOM 2172 C CD . GLN A 1 272 ? 19.091 65.402 3.684 1.00 5.78 ? 272 GLN A CD 1 ATOM 2173 O OE1 . GLN A 1 272 ? 18.272 65.821 2.857 1.00 6.86 ? 272 GLN A OE1 1 ATOM 2174 N NE2 . GLN A 1 272 ? 19.192 65.908 4.906 1.00 7.22 ? 272 GLN A NE2 1 ATOM 2175 N N . PHE A 1 273 ? 16.128 61.617 2.693 1.00 1.58 ? 273 PHE A N 1 ATOM 2176 C CA . PHE A 1 273 ? 15.200 60.752 1.993 1.00 0.96 ? 273 PHE A CA 1 ATOM 2177 C C . PHE A 1 273 ? 13.855 61.466 2.101 1.00 0.96 ? 273 PHE A C 1 ATOM 2178 O O . PHE A 1 273 ? 13.359 61.657 3.216 1.00 0.96 ? 273 PHE A O 1 ATOM 2179 C CB . PHE A 1 273 ? 15.166 59.455 2.790 1.00 0.96 ? 273 PHE A CB 1 ATOM 2180 C CG . PHE A 1 273 ? 14.661 58.265 2.052 1.00 0.96 ? 273 PHE A CG 1 ATOM 2181 C CD1 . PHE A 1 273 ? 15.518 57.504 1.279 1.00 0.96 ? 273 PHE A CD1 1 ATOM 2182 C CD2 . PHE A 1 273 ? 13.357 57.833 2.226 1.00 0.96 ? 273 PHE A CD2 1 ATOM 2183 C CE1 . PHE A 1 273 ? 15.088 56.323 0.700 1.00 0.96 ? 273 PHE A CE1 1 ATOM 2184 C CE2 . PHE A 1 273 ? 12.919 56.659 1.654 1.00 0.96 ? 273 PHE A CE2 1 ATOM 2185 C CZ . PHE A 1 273 ? 13.786 55.898 0.891 1.00 0.96 ? 273 PHE A CZ 1 ATOM 2186 N N . TYR A 1 274 ? 13.266 61.875 0.978 1.00 0.96 ? 274 TYR A N 1 ATOM 2187 C CA . TYR A 1 274 ? 11.971 62.566 1.031 1.00 0.96 ? 274 TYR A CA 1 ATOM 2188 C C . TYR A 1 274 ? 11.081 62.446 -0.207 1.00 0.96 ? 274 TYR A C 1 ATOM 2189 O O . TYR A 1 274 ? 11.559 62.247 -1.325 1.00 0.96 ? 274 TYR A O 1 ATOM 2190 C CB . TYR A 1 274 ? 12.165 64.057 1.346 1.00 0.96 ? 274 TYR A CB 1 ATOM 2191 C CG . TYR A 1 274 ? 10.911 64.728 1.866 1.00 1.18 ? 274 TYR A CG 1 ATOM 2192 C CD1 . TYR A 1 274 ? 10.290 64.269 3.028 1.00 2.72 ? 274 TYR A CD1 1 ATOM 2193 C CD2 . TYR A 1 274 ? 10.320 65.790 1.186 1.00 1.41 ? 274 TYR A CD2 1 ATOM 2194 C CE1 . TYR A 1 274 ? 9.104 64.846 3.503 1.00 2.07 ? 274 TYR A CE1 1 ATOM 2195 C CE2 . TYR A 1 274 ? 9.129 66.379 1.656 1.00 1.25 ? 274 TYR A CE2 1 ATOM 2196 C CZ . TYR A 1 274 ? 8.531 65.897 2.816 1.00 1.98 ? 274 TYR A CZ 1 ATOM 2197 O OH . TYR A 1 274 ? 7.370 66.456 3.304 1.00 1.69 ? 274 TYR A OH 1 ATOM 2198 N N . ALA A 1 275 ? 9.775 62.573 0.020 1.00 0.99 ? 275 ALA A N 1 ATOM 2199 C CA . ALA A 1 275 ? 8.771 62.515 -1.032 1.00 0.96 ? 275 ALA A CA 1 ATOM 2200 C C . ALA A 1 275 ? 8.712 61.158 -1.681 1.00 1.21 ? 275 ALA A C 1 ATOM 2201 O O . ALA A 1 275 ? 8.448 61.045 -2.877 1.00 3.24 ? 275 ALA A O 1 ATOM 2202 C CB . ALA A 1 275 ? 9.056 63.571 -2.085 1.00 0.96 ? 275 ALA A CB 1 ATOM 2203 N N . SER A 1 276 ? 8.935 60.125 -0.884 1.00 0.96 ? 276 SER A N 1 ATOM 2204 C CA . SER A 1 276 ? 8.926 58.767 -1.384 1.00 0.96 ? 276 SER A CA 1 ATOM 2205 C C . SER A 1 276 ? 7.558 58.264 -1.836 1.00 1.76 ? 276 SER A C 1 ATOM 2206 O O . SER A 1 276 ? 6.506 58.679 -1.327 1.00 1.84 ? 276 SER A O 1 ATOM 2207 C CB . SER A 1 276 ? 9.479 57.844 -0.316 1.00 1.31 ? 276 SER A CB 1 ATOM 2208 O OG . SER A 1 276 ? 8.801 58.057 0.908 1.00 2.44 ? 276 SER A OG 1 ATOM 2209 N N . LYS A 1 277 ? 7.596 57.356 -2.806 1.00 2.00 ? 277 LYS A N 1 ATOM 2210 C CA . LYS A 1 277 ? 6.397 56.746 -3.356 1.00 1.57 ? 277 LYS A CA 1 ATOM 2211 C C . LYS A 1 277 ? 6.714 55.305 -3.741 1.00 0.96 ? 277 LYS A C 1 ATOM 2212 O O . LYS A 1 277 ? 7.786 55.013 -4.259 1.00 0.96 ? 277 LYS A O 1 ATOM 2213 C CB . LYS A 1 277 ? 5.920 57.540 -4.573 1.00 3.13 ? 277 LYS A CB 1 ATOM 2214 C CG . LYS A 1 277 ? 4.589 57.072 -5.155 1.00 6.35 ? 277 LYS A CG 1 ATOM 2215 C CD . LYS A 1 277 ? 3.996 58.098 -6.125 1.00 7.28 ? 277 LYS A CD 1 ATOM 2216 C CE . LYS A 1 277 ? 3.581 59.387 -5.417 1.00 8.41 ? 277 LYS A CE 1 ATOM 2217 N NZ . LYS A 1 277 ? 2.517 59.159 -4.390 1.00 11.83 ? 277 LYS A NZ 1 ATOM 2218 N N . SER A 1 278 ? 5.783 54.405 -3.460 1.00 0.96 ? 278 SER A N 1 ATOM 2219 C CA . SER A 1 278 ? 5.950 52.997 -3.771 1.00 0.96 ? 278 SER A CA 1 ATOM 2220 C C . SER A 1 278 ? 5.038 52.608 -4.919 1.00 1.10 ? 278 SER A C 1 ATOM 2221 O O . SER A 1 278 ? 4.174 53.383 -5.315 1.00 2.06 ? 278 SER A O 1 ATOM 2222 C CB . SER A 1 278 ? 5.553 52.183 -2.573 1.00 0.96 ? 278 SER A CB 1 ATOM 2223 O OG . SER A 1 278 ? 4.215 52.498 -2.244 1.00 1.01 ? 278 SER A OG 1 ATOM 2224 N N . PHE A 1 279 ? 5.218 51.400 -5.444 1.00 1.16 ? 279 PHE A N 1 ATOM 2225 C CA . PHE A 1 279 ? 4.380 50.903 -6.536 1.00 1.59 ? 279 PHE A CA 1 ATOM 2226 C C . PHE A 1 279 ? 4.474 49.383 -6.623 1.00 2.13 ? 279 PHE A C 1 ATOM 2227 O O . PHE A 1 279 ? 5.452 48.793 -6.167 1.00 3.45 ? 279 PHE A O 1 ATOM 2228 C CB . PHE A 1 279 ? 4.790 51.548 -7.863 1.00 1.59 ? 279 PHE A CB 1 ATOM 2229 C CG . PHE A 1 279 ? 6.035 50.974 -8.475 1.00 0.98 ? 279 PHE A CG 1 ATOM 2230 C CD1 . PHE A 1 279 ? 5.961 49.919 -9.378 1.00 1.68 ? 279 PHE A CD1 1 ATOM 2231 C CD2 . PHE A 1 279 ? 7.275 51.520 -8.191 1.00 1.68 ? 279 PHE A CD2 1 ATOM 2232 C CE1 . PHE A 1 279 ? 7.105 49.425 -9.994 1.00 1.13 ? 279 PHE A CE1 1 ATOM 2233 C CE2 . PHE A 1 279 ? 8.427 51.034 -8.801 1.00 1.37 ? 279 PHE A CE2 1 ATOM 2234 C CZ . PHE A 1 279 ? 8.341 49.985 -9.706 1.00 1.51 ? 279 PHE A CZ 1 ATOM 2235 N N . PHE A 1 280 ? 3.464 48.745 -7.204 1.00 2.21 ? 280 PHE A N 1 ATOM 2236 C CA . PHE A 1 280 ? 3.476 47.294 -7.298 1.00 2.70 ? 280 PHE A CA 1 ATOM 2237 C C . PHE A 1 280 ? 3.984 46.713 -8.609 1.00 3.21 ? 280 PHE A C 1 ATOM 2238 O O . PHE A 1 280 ? 3.445 46.995 -9.686 1.00 3.29 ? 280 PHE A O 1 ATOM 2239 C CB . PHE A 1 280 ? 2.087 46.727 -7.029 1.00 4.63 ? 280 PHE A CB 1 ATOM 2240 C CG . PHE A 1 280 ? 2.057 45.231 -6.980 1.00 5.68 ? 280 PHE A CG 1 ATOM 2241 C CD1 . PHE A 1 280 ? 2.698 44.548 -5.959 1.00 5.42 ? 280 PHE A CD1 1 ATOM 2242 C CD2 . PHE A 1 280 ? 1.431 44.500 -7.977 1.00 8.13 ? 280 PHE A CD2 1 ATOM 2243 C CE1 . PHE A 1 280 ? 2.721 43.161 -5.930 1.00 5.75 ? 280 PHE A CE1 1 ATOM 2244 C CE2 . PHE A 1 280 ? 1.450 43.103 -7.955 1.00 8.32 ? 280 PHE A CE2 1 ATOM 2245 C CZ . PHE A 1 280 ? 2.098 42.437 -6.929 1.00 6.48 ? 280 PHE A CZ 1 ATOM 2246 N N . ASP A 1 281 ? 5.011 45.873 -8.484 1.00 3.88 ? 281 ASP A N 1 ATOM 2247 C CA . ASP A 1 281 ? 5.674 45.173 -9.593 1.00 4.45 ? 281 ASP A CA 1 ATOM 2248 C C . ASP A 1 281 ? 5.071 43.763 -9.687 1.00 5.06 ? 281 ASP A C 1 ATOM 2249 O O . ASP A 1 281 ? 5.567 42.839 -9.047 1.00 4.71 ? 281 ASP A O 1 ATOM 2250 C CB . ASP A 1 281 ? 7.172 45.078 -9.277 1.00 4.02 ? 281 ASP A CB 1 ATOM 2251 C CG . ASP A 1 281 ? 7.969 44.368 -10.354 1.00 4.01 ? 281 ASP A CG 1 ATOM 2252 O OD1 . ASP A 1 281 ? 7.388 43.543 -11.090 1.00 5.88 ? 281 ASP A OD1 1 ATOM 2253 O OD2 . ASP A 1 281 ? 9.190 44.624 -10.443 1.00 2.57 ? 281 ASP A OD2 1 ATOM 2254 N N . ASP A 1 282 ? 4.014 43.590 -10.479 1.00 6.38 ? 282 ASP A N 1 ATOM 2255 C CA . ASP A 1 282 ? 3.374 42.281 -10.564 1.00 8.33 ? 282 ASP A CA 1 ATOM 2256 C C . ASP A 1 282 ? 4.177 41.245 -11.328 1.00 7.22 ? 282 ASP A C 1 ATOM 2257 O O . ASP A 1 282 ? 3.773 40.084 -11.415 1.00 8.15 ? 282 ASP A O 1 ATOM 2258 C CB . ASP A 1 282 ? 1.984 42.392 -11.187 1.00 12.36 ? 282 ASP A CB 1 ATOM 2259 C CG . ASP A 1 282 ? 2.033 42.524 -12.691 1.00 18.50 ? 282 ASP A CG 1 ATOM 2260 O OD1 . ASP A 1 282 ? 2.524 43.572 -13.182 1.00 23.03 ? 282 ASP A OD1 1 ATOM 2261 O OD2 . ASP A 1 282 ? 1.587 41.575 -13.382 1.00 20.05 ? 282 ASP A OD2 1 ATOM 2262 N N . ALA A 1 283 ? 5.312 41.656 -11.878 1.00 5.95 ? 283 ALA A N 1 ATOM 2263 C CA . ALA A 1 283 ? 6.149 40.733 -12.629 1.00 5.43 ? 283 ALA A CA 1 ATOM 2264 C C . ALA A 1 283 ? 7.034 39.974 -11.669 1.00 5.62 ? 283 ALA A C 1 ATOM 2265 O O . ALA A 1 283 ? 7.257 38.776 -11.836 1.00 7.01 ? 283 ALA A O 1 ATOM 2266 C CB . ALA A 1 283 ? 6.997 41.480 -13.619 1.00 4.82 ? 283 ALA A CB 1 ATOM 2267 N N . LYS A 1 284 ? 7.535 40.674 -10.660 1.00 5.50 ? 284 LYS A N 1 ATOM 2268 C CA . LYS A 1 284 ? 8.401 40.059 -9.668 1.00 5.38 ? 284 LYS A CA 1 ATOM 2269 C C . LYS A 1 284 ? 7.749 39.972 -8.290 1.00 5.61 ? 284 LYS A C 1 ATOM 2270 O O . LYS A 1 284 ? 8.402 39.587 -7.316 1.00 6.08 ? 284 LYS A O 1 ATOM 2271 C CB . LYS A 1 284 ? 9.714 40.838 -9.556 1.00 5.85 ? 284 LYS A CB 1 ATOM 2272 C CG . LYS A 1 284 ? 10.604 40.752 -10.773 1.00 8.20 ? 284 LYS A CG 1 ATOM 2273 C CD . LYS A 1 284 ? 12.066 40.537 -10.365 1.00 10.95 ? 284 LYS A CD 1 ATOM 2274 C CE . LYS A 1 284 ? 12.975 40.344 -11.588 1.00 13.97 ? 284 LYS A CE 1 ATOM 2275 N NZ . LYS A 1 284 ? 14.385 39.959 -11.237 1.00 15.52 ? 284 LYS A NZ 1 ATOM 2276 N N . ASN A 1 285 ? 6.468 40.323 -8.204 1.00 5.65 ? 285 ASN A N 1 ATOM 2277 C CA . ASN A 1 285 ? 5.753 40.291 -6.924 1.00 6.84 ? 285 ASN A CA 1 ATOM 2278 C C . ASN A 1 285 ? 6.556 40.946 -5.801 1.00 6.01 ? 285 ASN A C 1 ATOM 2279 O O . ASN A 1 285 ? 6.972 40.284 -4.848 1.00 5.79 ? 285 ASN A O 1 ATOM 2280 C CB . ASN A 1 285 ? 5.407 38.848 -6.544 1.00 8.94 ? 285 ASN A CB 1 ATOM 2281 C CG . ASN A 1 285 ? 4.017 38.447 -6.998 1.00 12.51 ? 285 ASN A CG 1 ATOM 2282 O OD1 . ASN A 1 285 ? 3.030 38.676 -6.283 1.00 14.48 ? 285 ASN A OD1 1 ATOM 2283 N ND2 . ASN A 1 285 ? 3.922 37.868 -8.202 1.00 13.35 ? 285 ASN A ND2 1 ATOM 2284 N N . ARG A 1 286 ? 6.766 42.254 -5.930 1.00 4.73 ? 286 ARG A N 1 ATOM 2285 C CA . ARG A 1 286 ? 7.524 43.035 -4.957 1.00 3.54 ? 286 ARG A CA 1 ATOM 2286 C C . ARG A 1 286 ? 7.026 44.464 -5.014 1.00 3.04 ? 286 ARG A C 1 ATOM 2287 O O . ARG A 1 286 ? 6.589 44.916 -6.067 1.00 3.97 ? 286 ARG A O 1 ATOM 2288 C CB . ARG A 1 286 ? 9.015 43.020 -5.314 1.00 2.45 ? 286 ARG A CB 1 ATOM 2289 C CG . ARG A 1 286 ? 9.303 43.499 -6.720 1.00 0.96 ? 286 ARG A CG 1 ATOM 2290 C CD . ARG A 1 286 ? 10.785 43.489 -7.052 1.00 0.96 ? 286 ARG A CD 1 ATOM 2291 N NE . ARG A 1 286 ? 11.019 43.850 -8.458 1.00 2.15 ? 286 ARG A NE 1 ATOM 2292 C CZ . ARG A 1 286 ? 12.215 44.103 -8.981 1.00 0.96 ? 286 ARG A CZ 1 ATOM 2293 N NH1 . ARG A 1 286 ? 13.302 44.038 -8.219 1.00 2.19 ? 286 ARG A NH1 1 ATOM 2294 N NH2 . ARG A 1 286 ? 12.324 44.424 -10.259 1.00 0.96 ? 286 ARG A NH2 1 ATOM 2295 N N . ARG A 1 287 ? 7.082 45.175 -3.895 1.00 1.86 ? 287 ARG A N 1 ATOM 2296 C CA . ARG A 1 287 ? 6.656 46.566 -3.876 1.00 0.96 ? 287 ARG A CA 1 ATOM 2297 C C . ARG A 1 287 ? 7.930 47.390 -3.937 1.00 0.96 ? 287 ARG A C 1 ATOM 2298 O O . ARG A 1 287 ? 8.817 47.218 -3.110 1.00 2.43 ? 287 ARG A O 1 ATOM 2299 C CB . ARG A 1 287 ? 5.886 46.858 -2.595 1.00 0.96 ? 287 ARG A CB 1 ATOM 2300 C CG . ARG A 1 287 ? 5.442 48.293 -2.436 1.00 0.96 ? 287 ARG A CG 1 ATOM 2301 C CD . ARG A 1 287 ? 4.352 48.383 -1.389 1.00 0.96 ? 287 ARG A CD 1 ATOM 2302 N NE . ARG A 1 287 ? 3.060 48.046 -1.963 1.00 0.96 ? 287 ARG A NE 1 ATOM 2303 C CZ . ARG A 1 287 ? 2.385 48.868 -2.755 1.00 0.96 ? 287 ARG A CZ 1 ATOM 2304 N NH1 . ARG A 1 287 ? 2.894 50.055 -3.038 1.00 1.46 ? 287 ARG A NH1 1 ATOM 2305 N NH2 . ARG A 1 287 ? 1.219 48.508 -3.278 1.00 0.96 ? 287 ARG A NH2 1 ATOM 2306 N N . VAL A 1 288 ? 8.044 48.269 -4.921 1.00 0.96 ? 288 VAL A N 1 ATOM 2307 C CA . VAL A 1 288 ? 9.249 49.067 -5.043 1.00 0.96 ? 288 VAL A CA 1 ATOM 2308 C C . VAL A 1 288 ? 9.107 50.459 -4.465 1.00 0.96 ? 288 VAL A C 1 ATOM 2309 O O . VAL A 1 288 ? 8.035 51.050 -4.511 1.00 1.02 ? 288 VAL A O 1 ATOM 2310 C CB . VAL A 1 288 ? 9.673 49.167 -6.492 1.00 1.40 ? 288 VAL A CB 1 ATOM 2311 C CG1 . VAL A 1 288 ? 10.889 50.067 -6.618 1.00 2.36 ? 288 VAL A CG1 1 ATOM 2312 C CG2 . VAL A 1 288 ? 9.984 47.775 -7.016 1.00 1.00 ? 288 VAL A CG2 1 ATOM 2313 N N . LEU A 1 289 ? 10.202 50.990 -3.933 1.00 0.96 ? 289 LEU A N 1 ATOM 2314 C CA . LEU A 1 289 ? 10.166 52.302 -3.308 1.00 1.04 ? 289 LEU A CA 1 ATOM 2315 C C . LEU A 1 289 ? 11.167 53.329 -3.815 1.00 1.18 ? 289 LEU A C 1 ATOM 2316 O O . LEU A 1 289 ? 12.383 53.208 -3.599 1.00 1.78 ? 289 LEU A O 1 ATOM 2317 C CB . LEU A 1 289 ? 10.331 52.145 -1.794 1.00 0.96 ? 289 LEU A CB 1 ATOM 2318 C CG . LEU A 1 289 ? 10.428 53.406 -0.945 1.00 0.96 ? 289 LEU A CG 1 ATOM 2319 C CD1 . LEU A 1 289 ? 9.347 54.359 -1.342 1.00 0.96 ? 289 LEU A CD1 1 ATOM 2320 C CD2 . LEU A 1 289 ? 10.301 53.060 0.512 1.00 0.96 ? 289 LEU A CD2 1 ATOM 2321 N N . TRP A 1 290 ? 10.643 54.350 -4.484 1.00 0.96 ? 290 TRP A N 1 ATOM 2322 C CA . TRP A 1 290 ? 11.473 55.429 -4.996 1.00 0.96 ? 290 TRP A CA 1 ATOM 2323 C C . TRP A 1 290 ? 11.439 56.535 -3.947 1.00 0.96 ? 290 TRP A C 1 ATOM 2324 O O . TRP A 1 290 ? 10.463 56.671 -3.217 1.00 0.96 ? 290 TRP A O 1 ATOM 2325 C CB . TRP A 1 290 ? 10.923 55.975 -6.323 1.00 1.34 ? 290 TRP A CB 1 ATOM 2326 C CG . TRP A 1 290 ? 11.147 55.122 -7.556 1.00 1.66 ? 290 TRP A CG 1 ATOM 2327 C CD1 . TRP A 1 290 ? 10.224 54.350 -8.198 1.00 2.84 ? 290 TRP A CD1 1 ATOM 2328 C CD2 . TRP A 1 290 ? 12.362 54.992 -8.306 1.00 2.52 ? 290 TRP A CD2 1 ATOM 2329 N NE1 . TRP A 1 290 ? 10.785 53.750 -9.301 1.00 3.18 ? 290 TRP A NE1 1 ATOM 2330 C CE2 . TRP A 1 290 ? 12.098 54.128 -9.386 1.00 3.31 ? 290 TRP A CE2 1 ATOM 2331 C CE3 . TRP A 1 290 ? 13.649 55.522 -8.168 1.00 2.73 ? 290 TRP A CE3 1 ATOM 2332 C CZ2 . TRP A 1 290 ? 13.074 53.783 -10.321 1.00 5.01 ? 290 TRP A CZ2 1 ATOM 2333 C CZ3 . TRP A 1 290 ? 14.616 55.180 -9.096 1.00 3.52 ? 290 TRP A CZ3 1 ATOM 2334 C CH2 . TRP A 1 290 ? 14.326 54.320 -10.158 1.00 4.86 ? 290 TRP A CH2 1 ATOM 2335 N N . ALA A 1 291 ? 12.502 57.323 -3.863 1.00 0.96 ? 291 ALA A N 1 ATOM 2336 C CA . ALA A 1 291 ? 12.539 58.412 -2.903 1.00 0.96 ? 291 ALA A CA 1 ATOM 2337 C C . ALA A 1 291 ? 13.556 59.438 -3.313 1.00 0.96 ? 291 ALA A C 1 ATOM 2338 O O . ALA A 1 291 ? 14.623 59.102 -3.812 1.00 0.96 ? 291 ALA A O 1 ATOM 2339 C CB . ALA A 1 291 ? 12.863 57.896 -1.549 1.00 0.99 ? 291 ALA A CB 1 ATOM 2340 N N . TRP A 1 292 ? 13.222 60.696 -3.082 1.00 0.96 ? 292 TRP A N 1 ATOM 2341 C CA . TRP A 1 292 ? 14.091 61.797 -3.442 1.00 0.96 ? 292 TRP A CA 1 ATOM 2342 C C . TRP A 1 292 ? 15.211 62.063 -2.440 1.00 0.96 ? 292 TRP A C 1 ATOM 2343 O O . TRP A 1 292 ? 14.991 62.080 -1.229 1.00 0.96 ? 292 TRP A O 1 ATOM 2344 C CB . TRP A 1 292 ? 13.235 63.051 -3.624 1.00 0.96 ? 292 TRP A CB 1 ATOM 2345 C CG . TRP A 1 292 ? 13.999 64.322 -3.818 1.00 1.58 ? 292 TRP A CG 1 ATOM 2346 C CD1 . TRP A 1 292 ? 15.159 64.485 -4.511 1.00 2.52 ? 292 TRP A CD1 1 ATOM 2347 C CD2 . TRP A 1 292 ? 13.624 65.621 -3.353 1.00 1.46 ? 292 TRP A CD2 1 ATOM 2348 N NE1 . TRP A 1 292 ? 15.533 65.808 -4.509 1.00 2.18 ? 292 TRP A NE1 1 ATOM 2349 C CE2 . TRP A 1 292 ? 14.607 66.525 -3.804 1.00 1.60 ? 292 TRP A CE2 1 ATOM 2350 C CE3 . TRP A 1 292 ? 12.551 66.107 -2.599 1.00 1.21 ? 292 TRP A CE3 1 ATOM 2351 C CZ2 . TRP A 1 292 ? 14.553 67.884 -3.530 1.00 2.42 ? 292 TRP A CZ2 1 ATOM 2352 C CZ3 . TRP A 1 292 ? 12.492 67.457 -2.323 1.00 1.67 ? 292 TRP A CZ3 1 ATOM 2353 C CH2 . TRP A 1 292 ? 13.490 68.335 -2.788 1.00 3.74 ? 292 TRP A CH2 1 ATOM 2354 N N . VAL A 1 293 ? 16.421 62.249 -2.947 1.00 0.96 ? 293 VAL A N 1 ATOM 2355 C CA . VAL A 1 293 ? 17.546 62.558 -2.080 1.00 0.96 ? 293 VAL A CA 1 ATOM 2356 C C . VAL A 1 293 ? 18.032 63.946 -2.487 1.00 1.22 ? 293 VAL A C 1 ATOM 2357 O O . VAL A 1 293 ? 18.675 64.116 -3.526 1.00 0.96 ? 293 VAL A O 1 ATOM 2358 C CB . VAL A 1 293 ? 18.688 61.561 -2.247 1.00 0.96 ? 293 VAL A CB 1 ATOM 2359 C CG1 . VAL A 1 293 ? 19.700 61.756 -1.138 1.00 0.96 ? 293 VAL A CG1 1 ATOM 2360 C CG2 . VAL A 1 293 ? 18.151 60.156 -2.236 1.00 0.96 ? 293 VAL A CG2 1 ATOM 2361 N N . PRO A 1 294 ? 17.713 64.964 -1.678 1.00 0.96 ? 294 PRO A N 1 ATOM 2362 C CA . PRO A 1 294 ? 18.100 66.346 -1.936 1.00 1.00 ? 294 PRO A CA 1 ATOM 2363 C C . PRO A 1 294 ? 19.587 66.543 -1.773 1.00 1.93 ? 294 PRO A C 1 ATOM 2364 O O . PRO A 1 294 ? 20.274 65.684 -1.222 1.00 2.20 ? 294 PRO A O 1 ATOM 2365 C CB . PRO A 1 294 ? 17.326 67.123 -0.882 1.00 0.96 ? 294 PRO A CB 1 ATOM 2366 C CG . PRO A 1 294 ? 16.207 66.225 -0.541 1.00 0.96 ? 294 PRO A CG 1 ATOM 2367 C CD . PRO A 1 294 ? 16.864 64.900 -0.486 1.00 0.96 ? 294 PRO A CD 1 ATOM 2368 N N . GLU A 1 295 ? 20.072 67.687 -2.246 1.00 2.80 ? 295 GLU A N 1 ATOM 2369 C CA . GLU A 1 295 ? 21.482 68.030 -2.145 1.00 3.70 ? 295 GLU A CA 1 ATOM 2370 C C . GLU A 1 295 ? 21.735 68.607 -0.760 1.00 4.70 ? 295 GLU A C 1 ATOM 2371 O O . GLU A 1 295 ? 20.798 69.010 -0.069 1.00 5.54 ? 295 GLU A O 1 ATOM 2372 C CB . GLU A 1 295 ? 21.839 69.085 -3.191 1.00 3.42 ? 295 GLU A CB 1 ATOM 2373 C CG . GLU A 1 295 ? 21.670 68.641 -4.625 1.00 3.26 ? 295 GLU A CG 1 ATOM 2374 C CD . GLU A 1 295 ? 22.601 67.513 -4.971 1.00 3.67 ? 295 GLU A CD 1 ATOM 2375 O OE1 . GLU A 1 295 ? 23.760 67.573 -4.529 1.00 4.41 ? 295 GLU A OE1 1 ATOM 2376 O OE2 . GLU A 1 295 ? 22.187 66.575 -5.680 1.00 3.92 ? 295 GLU A OE2 1 ATOM 2377 N N . THR A 1 296 ? 22.993 68.632 -0.338 1.00 5.73 ? 296 THR A N 1 ATOM 2378 C CA . THR A 1 296 ? 23.303 69.235 0.945 1.00 7.42 ? 296 THR A CA 1 ATOM 2379 C C . THR A 1 296 ? 24.332 70.341 0.759 1.00 8.39 ? 296 THR A C 1 ATOM 2380 O O . THR A 1 296 ? 24.666 71.049 1.702 1.00 9.64 ? 296 THR A O 1 ATOM 2381 C CB . THR A 1 296 ? 23.805 68.217 1.982 1.00 7.17 ? 296 THR A CB 1 ATOM 2382 O OG1 . THR A 1 296 ? 24.896 67.466 1.446 1.00 8.54 ? 296 THR A OG1 1 ATOM 2383 C CG2 . THR A 1 296 ? 22.687 67.288 2.377 1.00 7.88 ? 296 THR A CG2 1 ATOM 2384 N N . ASP A 1 297 ? 24.822 70.507 -0.464 1.00 8.68 ? 297 ASP A N 1 ATOM 2385 C CA . ASP A 1 297 ? 25.783 71.566 -0.725 1.00 9.51 ? 297 ASP A CA 1 ATOM 2386 C C . ASP A 1 297 ? 25.048 72.878 -1.027 1.00 10.71 ? 297 ASP A C 1 ATOM 2387 O O . ASP A 1 297 ? 23.847 72.878 -1.338 1.00 10.72 ? 297 ASP A O 1 ATOM 2388 C CB . ASP A 1 297 ? 26.713 71.173 -1.876 1.00 9.64 ? 297 ASP A CB 1 ATOM 2389 C CG . ASP A 1 297 ? 25.992 71.026 -3.193 1.00 10.50 ? 297 ASP A CG 1 ATOM 2390 O OD1 . ASP A 1 297 ? 24.781 70.704 -3.203 1.00 10.26 ? 297 ASP A OD1 1 ATOM 2391 O OD2 . ASP A 1 297 ? 26.662 71.216 -4.229 1.00 11.25 ? 297 ASP A OD2 1 ATOM 2392 N N . SER A 1 298 ? 25.782 73.985 -0.913 1.00 11.86 ? 298 SER A N 1 ATOM 2393 C CA . SER A 1 298 ? 25.265 75.342 -1.127 1.00 13.81 ? 298 SER A CA 1 ATOM 2394 C C . SER A 1 298 ? 24.491 75.525 -2.419 1.00 14.70 ? 298 SER A C 1 ATOM 2395 O O . SER A 1 298 ? 24.866 74.954 -3.448 1.00 15.13 ? 298 SER A O 1 ATOM 2396 C CB . SER A 1 298 ? 26.417 76.343 -1.145 1.00 14.62 ? 298 SER A CB 1 ATOM 2397 O OG . SER A 1 298 ? 27.092 76.299 -2.393 1.00 14.81 ? 298 SER A OG 1 ATOM 2398 N N . GLN A 1 299 ? 23.434 76.337 -2.383 1.00 15.05 ? 299 GLN A N 1 ATOM 2399 C CA . GLN A 1 299 ? 22.672 76.569 -3.605 1.00 16.63 ? 299 GLN A CA 1 ATOM 2400 C C . GLN A 1 299 ? 23.651 77.051 -4.665 1.00 16.59 ? 299 GLN A C 1 ATOM 2401 O O . GLN A 1 299 ? 23.604 76.628 -5.828 1.00 14.96 ? 299 GLN A O 1 ATOM 2402 C CB . GLN A 1 299 ? 21.592 77.635 -3.425 1.00 18.30 ? 299 GLN A CB 1 ATOM 2403 C CG . GLN A 1 299 ? 20.846 77.900 -4.741 1.00 21.12 ? 299 GLN A CG 1 ATOM 2404 C CD . GLN A 1 299 ? 19.830 79.019 -4.652 1.00 23.84 ? 299 GLN A CD 1 ATOM 2405 O OE1 . GLN A 1 299 ? 19.001 79.052 -3.737 1.00 24.87 ? 299 GLN A OE1 1 ATOM 2406 N NE2 . GLN A 1 299 ? 19.877 79.941 -5.616 1.00 24.97 ? 299 GLN A NE2 1 ATOM 2407 N N . ALA A 1 300 ? 24.535 77.950 -4.246 1.00 16.80 ? 300 ALA A N 1 ATOM 2408 C CA . ALA A 1 300 ? 25.544 78.480 -5.142 1.00 16.81 ? 300 ALA A CA 1 ATOM 2409 C C . ALA A 1 300 ? 26.216 77.297 -5.845 1.00 16.48 ? 300 ALA A C 1 ATOM 2410 O O . ALA A 1 300 ? 26.344 77.289 -7.071 1.00 16.47 ? 300 ALA A O 1 ATOM 2411 C CB . ALA A 1 300 ? 26.563 79.283 -4.351 1.00 16.91 ? 300 ALA A CB 1 ATOM 2412 N N . ASP A 1 301 ? 26.615 76.295 -5.059 1.00 16.05 ? 301 ASP A N 1 ATOM 2413 C CA . ASP A 1 301 ? 27.271 75.100 -5.586 1.00 15.84 ? 301 ASP A CA 1 ATOM 2414 C C . ASP A 1 301 ? 26.424 74.376 -6.636 1.00 14.32 ? 301 ASP A C 1 ATOM 2415 O O . ASP A 1 301 ? 26.947 73.914 -7.658 1.00 13.70 ? 301 ASP A O 1 ATOM 2416 C CB . ASP A 1 301 ? 27.620 74.114 -4.452 1.00 18.15 ? 301 ASP A CB 1 ATOM 2417 C CG . ASP A 1 301 ? 28.887 74.506 -3.683 1.00 21.11 ? 301 ASP A CG 1 ATOM 2418 O OD1 . ASP A 1 301 ? 29.831 75.052 -4.301 1.00 23.36 ? 301 ASP A OD1 1 ATOM 2419 O OD2 . ASP A 1 301 ? 28.951 74.246 -2.460 1.00 21.98 ? 301 ASP A OD2 1 ATOM 2420 N N . ASP A 1 302 ? 25.120 74.282 -6.387 1.00 12.48 ? 302 ASP A N 1 ATOM 2421 C CA . ASP A 1 302 ? 24.225 73.599 -7.314 1.00 12.10 ? 302 ASP A CA 1 ATOM 2422 C C . ASP A 1 302 ? 24.215 74.260 -8.689 1.00 11.56 ? 302 ASP A C 1 ATOM 2423 O O . ASP A 1 302 ? 24.277 73.585 -9.720 1.00 10.86 ? 302 ASP A O 1 ATOM 2424 C CB . ASP A 1 302 ? 22.799 73.553 -6.745 1.00 13.30 ? 302 ASP A CB 1 ATOM 2425 C CG . ASP A 1 302 ? 22.702 72.724 -5.470 1.00 15.23 ? 302 ASP A CG 1 ATOM 2426 O OD1 . ASP A 1 302 ? 23.326 71.640 -5.416 1.00 17.20 ? 302 ASP A OD1 1 ATOM 2427 O OD2 . ASP A 1 302 ? 21.994 73.141 -4.524 1.00 15.62 ? 302 ASP A OD2 1 ATOM 2428 N N . ILE A 1 303 ? 24.148 75.587 -8.694 1.00 11.34 ? 303 ILE A N 1 ATOM 2429 C CA . ILE A 1 303 ? 24.117 76.363 -9.929 1.00 10.49 ? 303 ILE A CA 1 ATOM 2430 C C . ILE A 1 303 ? 25.418 76.227 -10.699 1.00 11.31 ? 303 ILE A C 1 ATOM 2431 O O . ILE A 1 303 ? 25.434 76.318 -11.927 1.00 10.61 ? 303 ILE A O 1 ATOM 2432 C CB . ILE A 1 303 ? 23.853 77.849 -9.625 1.00 8.86 ? 303 ILE A CB 1 ATOM 2433 C CG1 . ILE A 1 303 ? 22.542 77.970 -8.854 1.00 8.13 ? 303 ILE A CG1 1 ATOM 2434 C CG2 . ILE A 1 303 ? 23.775 78.646 -10.904 1.00 8.38 ? 303 ILE A CG2 1 ATOM 2435 C CD1 . ILE A 1 303 ? 22.092 79.374 -8.616 1.00 9.15 ? 303 ILE A CD1 1 ATOM 2436 N N . GLU A 1 304 ? 26.502 76.004 -9.962 1.00 12.63 ? 304 GLU A N 1 ATOM 2437 C CA . GLU A 1 304 ? 27.820 75.845 -10.555 1.00 14.40 ? 304 GLU A CA 1 ATOM 2438 C C . GLU A 1 304 ? 27.887 74.484 -11.257 1.00 12.79 ? 304 GLU A C 1 ATOM 2439 O O . GLU A 1 304 ? 28.097 74.419 -12.477 1.00 12.57 ? 304 GLU A O 1 ATOM 2440 C CB . GLU A 1 304 ? 28.900 75.954 -9.471 1.00 18.47 ? 304 GLU A CB 1 ATOM 2441 C CG . GLU A 1 304 ? 30.221 76.575 -9.937 1.00 25.58 ? 304 GLU A CG 1 ATOM 2442 C CD . GLU A 1 304 ? 31.254 75.544 -10.396 1.00 30.03 ? 304 GLU A CD 1 ATOM 2443 O OE1 . GLU A 1 304 ? 31.045 74.894 -11.447 1.00 31.34 ? 304 GLU A OE1 1 ATOM 2444 O OE2 . GLU A 1 304 ? 32.283 75.389 -9.695 1.00 33.01 ? 304 GLU A OE2 1 ATOM 2445 N N . LYS A 1 305 ? 27.698 73.401 -10.503 1.00 10.23 ? 305 LYS A N 1 ATOM 2446 C CA . LYS A 1 305 ? 27.740 72.075 -11.113 1.00 8.51 ? 305 LYS A CA 1 ATOM 2447 C C . LYS A 1 305 ? 26.596 71.976 -12.109 1.00 7.58 ? 305 LYS A C 1 ATOM 2448 O O . LYS A 1 305 ? 26.665 71.246 -13.108 1.00 7.14 ? 305 LYS A O 1 ATOM 2449 C CB . LYS A 1 305 ? 27.644 70.969 -10.051 1.00 7.47 ? 305 LYS A CB 1 ATOM 2450 C CG . LYS A 1 305 ? 26.435 71.032 -9.156 1.00 5.23 ? 305 LYS A CG 1 ATOM 2451 C CD . LYS A 1 305 ? 26.478 69.948 -8.090 1.00 1.75 ? 305 LYS A CD 1 ATOM 2452 C CE . LYS A 1 305 ? 25.261 70.069 -7.212 1.00 1.04 ? 305 LYS A CE 1 ATOM 2453 N NZ . LYS A 1 305 ? 25.284 69.137 -6.084 1.00 0.96 ? 305 LYS A NZ 1 ATOM 2454 N N . GLY A 1 306 ? 25.545 72.735 -11.828 1.00 6.36 ? 306 GLY A N 1 ATOM 2455 C CA . GLY A 1 306 ? 24.402 72.771 -12.718 1.00 5.68 ? 306 GLY A CA 1 ATOM 2456 C C . GLY A 1 306 ? 23.439 71.613 -12.643 1.00 4.82 ? 306 GLY A C 1 ATOM 2457 O O . GLY A 1 306 ? 22.976 71.125 -13.671 1.00 5.19 ? 306 GLY A O 1 ATOM 2458 N N . TRP A 1 307 ? 23.142 71.170 -11.432 1.00 4.28 ? 307 TRP A N 1 ATOM 2459 C CA . TRP A 1 307 ? 22.204 70.085 -11.238 1.00 4.70 ? 307 TRP A CA 1 ATOM 2460 C C . TRP A 1 307 ? 22.008 69.827 -9.761 1.00 5.35 ? 307 TRP A C 1 ATOM 2461 O O . TRP A 1 307 ? 22.927 70.007 -8.960 1.00 5.50 ? 307 TRP A O 1 ATOM 2462 C CB . TRP A 1 307 ? 22.674 68.800 -11.923 1.00 5.05 ? 307 TRP A CB 1 ATOM 2463 C CG . TRP A 1 307 ? 23.929 68.242 -11.374 1.00 5.87 ? 307 TRP A CG 1 ATOM 2464 C CD1 . TRP A 1 307 ? 25.197 68.545 -11.764 1.00 7.26 ? 307 TRP A CD1 1 ATOM 2465 C CD2 . TRP A 1 307 ? 24.052 67.309 -10.298 1.00 7.56 ? 307 TRP A CD2 1 ATOM 2466 N NE1 . TRP A 1 307 ? 26.108 67.860 -10.998 1.00 7.98 ? 307 TRP A NE1 1 ATOM 2467 C CE2 . TRP A 1 307 ? 25.431 67.094 -10.087 1.00 8.41 ? 307 TRP A CE2 1 ATOM 2468 C CE3 . TRP A 1 307 ? 23.132 66.635 -9.487 1.00 8.24 ? 307 TRP A CE3 1 ATOM 2469 C CZ2 . TRP A 1 307 ? 25.914 66.232 -9.095 1.00 8.22 ? 307 TRP A CZ2 1 ATOM 2470 C CZ3 . TRP A 1 307 ? 23.614 65.776 -8.498 1.00 7.66 ? 307 TRP A CZ3 1 ATOM 2471 C CH2 . TRP A 1 307 ? 24.992 65.585 -8.313 1.00 7.26 ? 307 TRP A CH2 1 ATOM 2472 N N . ALA A 1 308 ? 20.795 69.406 -9.412 1.00 5.34 ? 308 ALA A N 1 ATOM 2473 C CA . ALA A 1 308 ? 20.436 69.117 -8.036 1.00 3.60 ? 308 ALA A CA 1 ATOM 2474 C C . ALA A 1 308 ? 19.460 67.967 -7.990 1.00 2.21 ? 308 ALA A C 1 ATOM 2475 O O . ALA A 1 308 ? 18.637 67.794 -8.884 1.00 2.17 ? 308 ALA A O 1 ATOM 2476 C CB . ALA A 1 308 ? 19.817 70.336 -7.395 1.00 4.39 ? 308 ALA A CB 1 ATOM 2477 N N . GLY A 1 309 ? 19.573 67.176 -6.935 1.00 1.56 ? 309 GLY A N 1 ATOM 2478 C CA . GLY A 1 309 ? 18.689 66.047 -6.756 1.00 1.69 ? 309 GLY A CA 1 ATOM 2479 C C . GLY A 1 309 ? 19.144 64.727 -7.350 1.00 1.49 ? 309 GLY A C 1 ATOM 2480 O O . GLY A 1 309 ? 19.651 64.669 -8.470 1.00 1.38 ? 309 GLY A O 1 ATOM 2481 N N . LEU A 1 310 ? 18.954 63.666 -6.573 1.00 1.63 ? 310 LEU A N 1 ATOM 2482 C CA . LEU A 1 310 ? 19.274 62.301 -6.967 1.00 0.96 ? 310 LEU A CA 1 ATOM 2483 C C . LEU A 1 310 ? 18.122 61.466 -6.448 1.00 1.66 ? 310 LEU A C 1 ATOM 2484 O O . LEU A 1 310 ? 17.429 61.872 -5.514 1.00 3.10 ? 310 LEU A O 1 ATOM 2485 C CB . LEU A 1 310 ? 20.535 61.815 -6.279 1.00 0.96 ? 310 LEU A CB 1 ATOM 2486 C CG . LEU A 1 310 ? 21.852 62.464 -6.641 1.00 0.96 ? 310 LEU A CG 1 ATOM 2487 C CD1 . LEU A 1 310 ? 22.933 61.874 -5.765 1.00 0.96 ? 310 LEU A CD1 1 ATOM 2488 C CD2 . LEU A 1 310 ? 22.143 62.228 -8.094 1.00 0.96 ? 310 LEU A CD2 1 ATOM 2489 N N . GLN A 1 311 ? 17.900 60.305 -7.044 1.00 1.17 ? 311 GLN A N 1 ATOM 2490 C CA . GLN A 1 311 ? 16.842 59.434 -6.555 1.00 1.34 ? 311 GLN A CA 1 ATOM 2491 C C . GLN A 1 311 ? 17.539 58.318 -5.779 1.00 1.38 ? 311 GLN A C 1 ATOM 2492 O O . GLN A 1 311 ? 18.648 57.921 -6.127 1.00 2.56 ? 311 GLN A O 1 ATOM 2493 C CB . GLN A 1 311 ? 16.046 58.832 -7.717 1.00 1.46 ? 311 GLN A CB 1 ATOM 2494 C CG . GLN A 1 311 ? 15.042 59.756 -8.392 1.00 1.07 ? 311 GLN A CG 1 ATOM 2495 C CD . GLN A 1 311 ? 13.981 60.271 -7.441 1.00 1.96 ? 311 GLN A CD 1 ATOM 2496 O OE1 . GLN A 1 311 ? 13.651 59.623 -6.455 1.00 2.01 ? 311 GLN A OE1 1 ATOM 2497 N NE2 . GLN A 1 311 ? 13.428 61.438 -7.745 1.00 2.77 ? 311 GLN A NE2 1 ATOM 2498 N N . SER A 1 312 ? 16.923 57.826 -4.714 1.00 0.96 ? 312 SER A N 1 ATOM 2499 C CA . SER A 1 312 ? 17.541 56.740 -3.979 1.00 0.96 ? 312 SER A CA 1 ATOM 2500 C C . SER A 1 312 ? 17.613 55.588 -4.985 1.00 1.71 ? 312 SER A C 1 ATOM 2501 O O . SER A 1 312 ? 16.981 55.656 -6.038 1.00 0.96 ? 312 SER A O 1 ATOM 2502 C CB . SER A 1 312 ? 16.651 56.331 -2.807 1.00 0.96 ? 312 SER A CB 1 ATOM 2503 O OG . SER A 1 312 ? 15.473 55.661 -3.246 1.00 0.96 ? 312 SER A OG 1 ATOM 2504 N N . PHE A 1 313 ? 18.393 54.548 -4.705 1.00 1.48 ? 313 PHE A N 1 ATOM 2505 C CA . PHE A 1 313 ? 18.400 53.416 -5.623 1.00 1.30 ? 313 PHE A CA 1 ATOM 2506 C C . PHE A 1 313 ? 17.127 52.692 -5.212 1.00 1.88 ? 313 PHE A C 1 ATOM 2507 O O . PHE A 1 313 ? 16.906 52.461 -4.020 1.00 2.79 ? 313 PHE A O 1 ATOM 2508 C CB . PHE A 1 313 ? 19.582 52.496 -5.387 1.00 1.49 ? 313 PHE A CB 1 ATOM 2509 C CG . PHE A 1 313 ? 19.659 51.372 -6.371 1.00 0.96 ? 313 PHE A CG 1 ATOM 2510 C CD1 . PHE A 1 313 ? 20.339 51.529 -7.564 1.00 1.48 ? 313 PHE A CD1 1 ATOM 2511 C CD2 . PHE A 1 313 ? 19.031 50.167 -6.119 1.00 1.52 ? 313 PHE A CD2 1 ATOM 2512 C CE1 . PHE A 1 313 ? 20.397 50.502 -8.496 1.00 1.30 ? 313 PHE A CE1 1 ATOM 2513 C CE2 . PHE A 1 313 ? 19.085 49.133 -7.049 1.00 1.96 ? 313 PHE A CE2 1 ATOM 2514 C CZ . PHE A 1 313 ? 19.771 49.304 -8.240 1.00 0.96 ? 313 PHE A CZ 1 ATOM 2515 N N . PRO A 1 314 ? 16.277 52.317 -6.179 1.00 0.96 ? 314 PRO A N 1 ATOM 2516 C CA . PRO A 1 314 ? 15.022 51.627 -5.866 1.00 1.04 ? 314 PRO A CA 1 ATOM 2517 C C . PRO A 1 314 ? 15.178 50.439 -4.938 1.00 0.96 ? 314 PRO A C 1 ATOM 2518 O O . PRO A 1 314 ? 15.962 49.531 -5.192 1.00 0.96 ? 314 PRO A O 1 ATOM 2519 C CB . PRO A 1 314 ? 14.465 51.266 -7.245 1.00 0.96 ? 314 PRO A CB 1 ATOM 2520 C CG . PRO A 1 314 ? 15.660 51.163 -8.079 1.00 1.02 ? 314 PRO A CG 1 ATOM 2521 C CD . PRO A 1 314 ? 16.536 52.296 -7.624 1.00 1.04 ? 314 PRO A CD 1 ATOM 2522 N N . ARG A 1 315 ? 14.412 50.459 -3.854 1.00 0.96 ? 315 ARG A N 1 ATOM 2523 C CA . ARG A 1 315 ? 14.482 49.408 -2.847 1.00 1.36 ? 315 ARG A CA 1 ATOM 2524 C C . ARG A 1 315 ? 13.172 48.634 -2.746 1.00 1.07 ? 315 ARG A C 1 ATOM 2525 O O . ARG A 1 315 ? 12.095 49.175 -2.996 1.00 0.96 ? 315 ARG A O 1 ATOM 2526 C CB . ARG A 1 315 ? 14.862 50.036 -1.486 1.00 1.69 ? 315 ARG A CB 1 ATOM 2527 C CG . ARG A 1 315 ? 15.571 51.408 -1.643 1.00 3.26 ? 315 ARG A CG 1 ATOM 2528 C CD . ARG A 1 315 ? 16.632 51.749 -0.590 1.00 2.24 ? 315 ARG A CD 1 ATOM 2529 N NE . ARG A 1 315 ? 16.096 52.378 0.617 1.00 1.36 ? 315 ARG A NE 1 ATOM 2530 C CZ . ARG A 1 315 ? 16.653 53.424 1.232 1.00 1.17 ? 315 ARG A CZ 1 ATOM 2531 N NH1 . ARG A 1 315 ? 17.761 53.982 0.765 1.00 0.96 ? 315 ARG A NH1 1 ATOM 2532 N NH2 . ARG A 1 315 ? 16.110 53.908 2.337 1.00 1.25 ? 315 ARG A NH2 1 ATOM 2533 N N . ALA A 1 316 ? 13.283 47.356 -2.402 1.00 0.96 ? 316 ALA A N 1 ATOM 2534 C CA . ALA A 1 316 ? 12.127 46.490 -2.245 1.00 0.96 ? 316 ALA A CA 1 ATOM 2535 C C . ALA A 1 316 ? 11.588 46.663 -0.827 1.00 2.19 ? 316 ALA A C 1 ATOM 2536 O O . ALA A 1 316 ? 12.357 46.710 0.138 1.00 3.74 ? 316 ALA A O 1 ATOM 2537 C CB . ALA A 1 316 ? 12.529 45.078 -2.471 1.00 0.96 ? 316 ALA A CB 1 ATOM 2538 N N . LEU A 1 317 ? 10.266 46.729 -0.704 1.00 2.09 ? 317 LEU A N 1 ATOM 2539 C CA . LEU A 1 317 ? 9.605 46.961 0.577 1.00 1.38 ? 317 LEU A CA 1 ATOM 2540 C C . LEU A 1 317 ? 8.761 45.794 1.071 1.00 2.22 ? 317 LEU A C 1 ATOM 2541 O O . LEU A 1 317 ? 8.102 45.126 0.284 1.00 3.88 ? 317 LEU A O 1 ATOM 2542 C CB . LEU A 1 317 ? 8.714 48.185 0.424 1.00 0.96 ? 317 LEU A CB 1 ATOM 2543 C CG . LEU A 1 317 ? 8.058 48.817 1.631 1.00 0.96 ? 317 LEU A CG 1 ATOM 2544 C CD1 . LEU A 1 317 ? 9.127 49.301 2.555 1.00 1.33 ? 317 LEU A CD1 1 ATOM 2545 C CD2 . LEU A 1 317 ? 7.214 49.981 1.197 1.00 0.96 ? 317 LEU A CD2 1 ATOM 2546 N N . TRP A 1 318 ? 8.774 45.554 2.378 1.00 2.14 ? 318 TRP A N 1 ATOM 2547 C CA . TRP A 1 318 ? 7.971 44.488 2.969 1.00 2.61 ? 318 TRP A CA 1 ATOM 2548 C C . TRP A 1 318 ? 7.982 44.593 4.493 1.00 3.25 ? 318 TRP A C 1 ATOM 2549 O O . TRP A 1 318 ? 8.919 45.135 5.075 1.00 4.11 ? 318 TRP A O 1 ATOM 2550 C CB . TRP A 1 318 ? 8.480 43.118 2.513 1.00 3.04 ? 318 TRP A CB 1 ATOM 2551 C CG . TRP A 1 318 ? 9.766 42.654 3.132 1.00 4.68 ? 318 TRP A CG 1 ATOM 2552 C CD1 . TRP A 1 318 ? 9.929 42.088 4.367 1.00 5.28 ? 318 TRP A CD1 1 ATOM 2553 C CD2 . TRP A 1 318 ? 11.062 42.680 2.533 1.00 5.46 ? 318 TRP A CD2 1 ATOM 2554 N NE1 . TRP A 1 318 ? 11.247 41.757 4.570 1.00 4.90 ? 318 TRP A NE1 1 ATOM 2555 C CE2 . TRP A 1 318 ? 11.964 42.111 3.459 1.00 5.91 ? 318 TRP A CE2 1 ATOM 2556 C CE3 . TRP A 1 318 ? 11.553 43.126 1.301 1.00 5.99 ? 318 TRP A CE3 1 ATOM 2557 C CZ2 . TRP A 1 318 ? 13.326 41.980 3.190 1.00 7.22 ? 318 TRP A CZ2 1 ATOM 2558 C CZ3 . TRP A 1 318 ? 12.910 42.994 1.032 1.00 6.42 ? 318 TRP A CZ3 1 ATOM 2559 C CH2 . TRP A 1 318 ? 13.780 42.425 1.973 1.00 7.67 ? 318 TRP A CH2 1 ATOM 2560 N N . ILE A 1 319 ? 6.936 44.090 5.140 1.00 3.99 ? 319 ILE A N 1 ATOM 2561 C CA . ILE A 1 319 ? 6.846 44.148 6.594 1.00 5.13 ? 319 ILE A CA 1 ATOM 2562 C C . ILE A 1 319 ? 7.703 43.051 7.225 1.00 6.45 ? 319 ILE A C 1 ATOM 2563 O O . ILE A 1 319 ? 7.852 41.979 6.658 1.00 6.13 ? 319 ILE A O 1 ATOM 2564 C CB . ILE A 1 319 ? 5.382 44.009 7.047 1.00 3.86 ? 319 ILE A CB 1 ATOM 2565 C CG1 . ILE A 1 319 ? 5.276 44.155 8.559 1.00 2.62 ? 319 ILE A CG1 1 ATOM 2566 C CG2 . ILE A 1 319 ? 4.838 42.674 6.619 1.00 4.27 ? 319 ILE A CG2 1 ATOM 2567 C CD1 . ILE A 1 319 ? 3.855 44.279 9.042 1.00 1.03 ? 319 ILE A CD1 1 ATOM 2568 N N . ASP A 1 320 ? 8.263 43.325 8.399 1.00 9.75 ? 320 ASP A N 1 ATOM 2569 C CA . ASP A 1 320 ? 9.130 42.374 9.094 1.00 13.81 ? 320 ASP A CA 1 ATOM 2570 C C . ASP A 1 320 ? 8.435 41.101 9.544 1.00 16.52 ? 320 ASP A C 1 ATOM 2571 O O . ASP A 1 320 ? 7.209 41.005 9.524 1.00 18.12 ? 320 ASP A O 1 ATOM 2572 C CB . ASP A 1 320 ? 9.768 43.040 10.316 1.00 14.02 ? 320 ASP A CB 1 ATOM 2573 C CG . ASP A 1 320 ? 10.800 42.151 10.998 1.00 15.10 ? 320 ASP A CG 1 ATOM 2574 O OD1 . ASP A 1 320 ? 11.778 41.733 10.334 1.00 15.50 ? 320 ASP A OD1 1 ATOM 2575 O OD2 . ASP A 1 320 ? 10.632 41.872 12.202 1.00 14.49 ? 320 ASP A OD2 1 ATOM 2576 N N . ARG A 1 321 ? 9.245 40.128 9.957 1.00 19.48 ? 321 ARG A N 1 ATOM 2577 C CA . ARG A 1 321 ? 8.767 38.836 10.437 1.00 22.29 ? 321 ARG A CA 1 ATOM 2578 C C . ARG A 1 321 ? 7.819 39.052 11.623 1.00 20.31 ? 321 ARG A C 1 ATOM 2579 O O . ARG A 1 321 ? 6.773 38.413 11.720 1.00 20.93 ? 321 ARG A O 1 ATOM 2580 C CB . ARG A 1 321 ? 9.961 37.972 10.884 1.00 27.17 ? 321 ARG A CB 1 ATOM 2581 C CG . ARG A 1 321 ? 11.304 38.288 10.166 1.00 35.00 ? 321 ARG A CG 1 ATOM 2582 C CD . ARG A 1 321 ? 12.535 38.189 11.122 1.00 41.17 ? 321 ARG A CD 1 ATOM 2583 N NE . ARG A 1 321 ? 12.403 39.052 12.311 1.00 47.04 ? 321 ARG A NE 1 ATOM 2584 C CZ . ARG A 1 321 ? 13.240 39.080 13.356 1.00 48.96 ? 321 ARG A CZ 1 ATOM 2585 N NH1 . ARG A 1 321 ? 14.312 38.291 13.392 1.00 49.38 ? 321 ARG A NH1 1 ATOM 2586 N NH2 . ARG A 1 321 ? 12.988 39.893 14.384 1.00 48.82 ? 321 ARG A NH2 1 ATOM 2587 N N . ASN A 1 322 ? 8.190 39.968 12.512 1.00 18.40 ? 322 ASN A N 1 ATOM 2588 C CA . ASN A 1 322 ? 7.396 40.269 13.701 1.00 17.15 ? 322 ASN A CA 1 ATOM 2589 C C . ASN A 1 322 ? 6.255 41.249 13.441 1.00 14.42 ? 322 ASN A C 1 ATOM 2590 O O . ASN A 1 322 ? 5.445 41.516 14.328 1.00 13.85 ? 322 ASN A O 1 ATOM 2591 C CB . ASN A 1 322 ? 8.289 40.854 14.784 1.00 20.29 ? 322 ASN A CB 1 ATOM 2592 C CG . ASN A 1 322 ? 8.945 42.152 14.347 1.00 23.72 ? 322 ASN A CG 1 ATOM 2593 O OD1 . ASN A 1 322 ? 8.298 43.018 13.749 1.00 24.81 ? 322 ASN A OD1 1 ATOM 2594 N ND2 . ASN A 1 322 ? 10.237 42.297 14.646 1.00 26.57 ? 322 ASN A ND2 1 ATOM 2595 N N . GLY A 1 323 ? 6.223 41.813 12.240 1.00 12.38 ? 323 GLY A N 1 ATOM 2596 C CA . GLY A 1 323 ? 5.167 42.746 11.866 1.00 9.59 ? 323 GLY A CA 1 ATOM 2597 C C . GLY A 1 323 ? 5.000 44.066 12.604 1.00 6.93 ? 323 GLY A C 1 ATOM 2598 O O . GLY A 1 323 ? 3.883 44.563 12.718 1.00 6.17 ? 323 GLY A O 1 ATOM 2599 N N . LYS A 1 324 ? 6.087 44.656 13.082 1.00 5.27 ? 324 LYS A N 1 ATOM 2600 C CA . LYS A 1 324 ? 5.974 45.915 13.794 1.00 4.97 ? 324 LYS A CA 1 ATOM 2601 C C . LYS A 1 324 ? 6.674 47.051 13.063 1.00 3.46 ? 324 LYS A C 1 ATOM 2602 O O . LYS A 1 324 ? 6.505 48.217 13.419 1.00 3.76 ? 324 LYS A O 1 ATOM 2603 C CB . LYS A 1 324 ? 6.538 45.760 15.203 1.00 7.79 ? 324 LYS A CB 1 ATOM 2604 C CG . LYS A 1 324 ? 6.085 44.471 15.883 1.00 14.00 ? 324 LYS A CG 1 ATOM 2605 C CD . LYS A 1 324 ? 5.600 44.681 17.324 1.00 19.19 ? 324 LYS A CD 1 ATOM 2606 C CE . LYS A 1 324 ? 6.710 45.161 18.267 1.00 22.46 ? 324 LYS A CE 1 ATOM 2607 N NZ . LYS A 1 324 ? 6.202 45.445 19.659 1.00 26.15 ? 324 LYS A NZ 1 ATOM 2608 N N . GLN A 1 325 ? 7.460 46.706 12.045 1.00 1.82 ? 325 GLN A N 1 ATOM 2609 C CA . GLN A 1 325 ? 8.177 47.695 11.236 1.00 1.53 ? 325 GLN A CA 1 ATOM 2610 C C . GLN A 1 325 ? 8.396 47.195 9.812 1.00 1.11 ? 325 GLN A C 1 ATOM 2611 O O . GLN A 1 325 ? 8.168 46.031 9.523 1.00 1.64 ? 325 GLN A O 1 ATOM 2612 C CB . GLN A 1 325 ? 9.532 48.039 11.852 1.00 2.14 ? 325 GLN A CB 1 ATOM 2613 C CG . GLN A 1 325 ? 10.540 46.905 11.875 1.00 3.71 ? 325 GLN A CG 1 ATOM 2614 C CD . GLN A 1 325 ? 11.976 47.405 11.927 1.00 3.52 ? 325 GLN A CD 1 ATOM 2615 O OE1 . GLN A 1 325 ? 12.487 47.927 10.939 1.00 2.19 ? 325 GLN A OE1 1 ATOM 2616 N NE2 . GLN A 1 325 ? 12.628 47.256 13.083 1.00 4.31 ? 325 GLN A NE2 1 ATOM 2617 N N . LEU A 1 326 ? 8.847 48.074 8.927 1.00 0.96 ? 326 LEU A N 1 ATOM 2618 C CA . LEU A 1 326 ? 9.081 47.709 7.535 1.00 0.96 ? 326 LEU A CA 1 ATOM 2619 C C . LEU A 1 326 ? 10.550 47.472 7.218 1.00 1.85 ? 326 LEU A C 1 ATOM 2620 O O . LEU A 1 326 ? 11.434 48.050 7.852 1.00 3.26 ? 326 LEU A O 1 ATOM 2621 C CB . LEU A 1 326 ? 8.551 48.807 6.626 1.00 0.96 ? 326 LEU A CB 1 ATOM 2622 C CG . LEU A 1 326 ? 7.119 48.704 6.110 1.00 0.96 ? 326 LEU A CG 1 ATOM 2623 C CD1 . LEU A 1 326 ? 6.185 48.196 7.176 1.00 1.43 ? 326 LEU A CD1 1 ATOM 2624 C CD2 . LEU A 1 326 ? 6.694 50.068 5.629 1.00 1.69 ? 326 LEU A CD2 1 ATOM 2625 N N . ILE A 1 327 ? 10.812 46.631 6.226 1.00 1.55 ? 327 ILE A N 1 ATOM 2626 C CA . ILE A 1 327 ? 12.182 46.328 5.816 1.00 2.98 ? 327 ILE A CA 1 ATOM 2627 C C . ILE A 1 327 ? 12.385 46.832 4.393 1.00 3.87 ? 327 ILE A C 1 ATOM 2628 O O . ILE A 1 327 ? 11.439 46.853 3.611 1.00 5.85 ? 327 ILE A O 1 ATOM 2629 C CB . ILE A 1 327 ? 12.442 44.820 5.785 1.00 2.12 ? 327 ILE A CB 1 ATOM 2630 C CG1 . ILE A 1 327 ? 11.889 44.162 7.043 1.00 2.69 ? 327 ILE A CG1 1 ATOM 2631 C CG2 . ILE A 1 327 ? 13.919 44.565 5.663 1.00 1.21 ? 327 ILE A CG2 1 ATOM 2632 C CD1 . ILE A 1 327 ? 12.627 44.534 8.295 1.00 5.04 ? 327 ILE A CD1 1 ATOM 2633 N N . GLN A 1 328 ? 13.605 47.225 4.042 1.00 3.78 ? 328 GLN A N 1 ATOM 2634 C CA . GLN A 1 328 ? 13.874 47.703 2.685 1.00 2.89 ? 328 GLN A CA 1 ATOM 2635 C C . GLN A 1 328 ? 15.186 47.098 2.212 1.00 3.30 ? 328 GLN A C 1 ATOM 2636 O O . GLN A 1 328 ? 16.056 46.800 3.030 1.00 4.57 ? 328 GLN A O 1 ATOM 2637 C CB . GLN A 1 328 ? 13.982 49.223 2.667 1.00 2.86 ? 328 GLN A CB 1 ATOM 2638 C CG . GLN A 1 328 ? 12.933 49.932 3.494 1.00 1.00 ? 328 GLN A CG 1 ATOM 2639 C CD . GLN A 1 328 ? 13.072 51.423 3.407 1.00 0.96 ? 328 GLN A CD 1 ATOM 2640 O OE1 . GLN A 1 328 ? 12.499 52.154 4.201 1.00 0.96 ? 328 GLN A OE1 1 ATOM 2641 N NE2 . GLN A 1 328 ? 13.839 51.889 2.432 1.00 1.05 ? 328 GLN A NE2 1 ATOM 2642 N N . TRP A 1 329 ? 15.343 46.921 0.903 1.00 2.59 ? 329 TRP A N 1 ATOM 2643 C CA . TRP A 1 329 ? 16.571 46.335 0.382 1.00 1.46 ? 329 TRP A CA 1 ATOM 2644 C C . TRP A 1 329 ? 16.721 46.626 -1.094 1.00 0.96 ? 329 TRP A C 1 ATOM 2645 O O . TRP A 1 329 ? 15.778 46.473 -1.857 1.00 0.96 ? 329 TRP A O 1 ATOM 2646 C CB . TRP A 1 329 ? 16.544 44.827 0.604 1.00 1.91 ? 329 TRP A CB 1 ATOM 2647 C CG . TRP A 1 329 ? 17.886 44.183 0.548 1.00 2.45 ? 329 TRP A CG 1 ATOM 2648 C CD1 . TRP A 1 329 ? 18.356 43.356 -0.425 1.00 3.24 ? 329 TRP A CD1 1 ATOM 2649 C CD2 . TRP A 1 329 ? 18.932 44.292 1.520 1.00 2.03 ? 329 TRP A CD2 1 ATOM 2650 N NE1 . TRP A 1 329 ? 19.629 42.938 -0.120 1.00 1.24 ? 329 TRP A NE1 1 ATOM 2651 C CE2 . TRP A 1 329 ? 20.004 43.499 1.070 1.00 0.96 ? 329 TRP A CE2 1 ATOM 2652 C CE3 . TRP A 1 329 ? 19.064 44.983 2.731 1.00 1.73 ? 329 TRP A CE3 1 ATOM 2653 C CZ2 . TRP A 1 329 ? 21.192 43.376 1.784 1.00 1.12 ? 329 TRP A CZ2 1 ATOM 2654 C CZ3 . TRP A 1 329 ? 20.248 44.858 3.443 1.00 1.10 ? 329 TRP A CZ3 1 ATOM 2655 C CH2 . TRP A 1 329 ? 21.295 44.060 2.965 1.00 1.68 ? 329 TRP A CH2 1 ATOM 2656 N N . PRO A 1 330 ? 17.908 47.063 -1.521 1.00 0.96 ? 330 PRO A N 1 ATOM 2657 C CA . PRO A 1 330 ? 18.032 47.335 -2.953 1.00 1.13 ? 330 PRO A CA 1 ATOM 2658 C C . PRO A 1 330 ? 17.630 46.118 -3.787 1.00 1.95 ? 330 PRO A C 1 ATOM 2659 O O . PRO A 1 330 ? 17.982 44.982 -3.451 1.00 1.90 ? 330 PRO A O 1 ATOM 2660 C CB . PRO A 1 330 ? 19.504 47.729 -3.108 1.00 0.96 ? 330 PRO A CB 1 ATOM 2661 C CG . PRO A 1 330 ? 20.175 47.145 -1.908 1.00 0.96 ? 330 PRO A CG 1 ATOM 2662 C CD . PRO A 1 330 ? 19.170 47.337 -0.816 1.00 0.96 ? 330 PRO A CD 1 ATOM 2663 N N . VAL A 1 331 ? 16.875 46.367 -4.860 1.00 2.00 ? 331 VAL A N 1 ATOM 2664 C CA . VAL A 1 331 ? 16.389 45.315 -5.758 1.00 2.32 ? 331 VAL A CA 1 ATOM 2665 C C . VAL A 1 331 ? 17.519 44.485 -6.362 1.00 2.78 ? 331 VAL A C 1 ATOM 2666 O O . VAL A 1 331 ? 18.560 45.021 -6.735 1.00 2.23 ? 331 VAL A O 1 ATOM 2667 C CB . VAL A 1 331 ? 15.561 45.915 -6.905 1.00 1.69 ? 331 VAL A CB 1 ATOM 2668 C CG1 . VAL A 1 331 ? 14.368 46.625 -6.357 1.00 3.23 ? 331 VAL A CG1 1 ATOM 2669 C CG2 . VAL A 1 331 ? 16.393 46.882 -7.683 1.00 0.96 ? 331 VAL A CG2 1 ATOM 2670 N N . GLU A 1 332 ? 17.304 43.177 -6.481 1.00 3.67 ? 332 GLU A N 1 ATOM 2671 C CA . GLU A 1 332 ? 18.334 42.292 -7.014 1.00 3.56 ? 332 GLU A CA 1 ATOM 2672 C C . GLU A 1 332 ? 19.002 42.748 -8.294 1.00 3.16 ? 332 GLU A C 1 ATOM 2673 O O . GLU A 1 332 ? 20.170 42.447 -8.521 1.00 3.58 ? 332 GLU A O 1 ATOM 2674 C CB . GLU A 1 332 ? 17.794 40.870 -7.197 1.00 6.48 ? 332 GLU A CB 1 ATOM 2675 C CG . GLU A 1 332 ? 16.395 40.748 -7.760 1.00 10.83 ? 332 GLU A CG 1 ATOM 2676 C CD . GLU A 1 332 ? 15.961 39.289 -7.890 1.00 14.36 ? 332 GLU A CD 1 ATOM 2677 O OE1 . GLU A 1 332 ? 16.221 38.498 -6.946 1.00 15.89 ? 332 GLU A OE1 1 ATOM 2678 O OE2 . GLU A 1 332 ? 15.357 38.936 -8.930 1.00 16.13 ? 332 GLU A OE2 1 ATOM 2679 N N . GLU A 1 333 ? 18.283 43.480 -9.132 1.00 2.33 ? 333 GLU A N 1 ATOM 2680 C CA . GLU A 1 333 ? 18.875 43.945 -10.379 1.00 2.28 ? 333 GLU A CA 1 ATOM 2681 C C . GLU A 1 333 ? 20.202 44.670 -10.171 1.00 1.24 ? 333 GLU A C 1 ATOM 2682 O O . GLU A 1 333 ? 21.052 44.688 -11.061 1.00 0.96 ? 333 GLU A O 1 ATOM 2683 C CB . GLU A 1 333 ? 17.913 44.875 -11.121 1.00 3.04 ? 333 GLU A CB 1 ATOM 2684 C CG . GLU A 1 333 ? 16.783 44.177 -11.873 1.00 5.80 ? 333 GLU A CG 1 ATOM 2685 C CD . GLU A 1 333 ? 15.648 43.729 -10.977 1.00 6.60 ? 333 GLU A CD 1 ATOM 2686 O OE1 . GLU A 1 333 ? 15.692 44.036 -9.766 1.00 6.15 ? 333 GLU A OE1 1 ATOM 2687 O OE2 . GLU A 1 333 ? 14.708 43.079 -11.493 1.00 7.37 ? 333 GLU A OE2 1 ATOM 2688 N N . ILE A 1 334 ? 20.381 45.265 -8.997 1.00 1.11 ? 334 ILE A N 1 ATOM 2689 C CA . ILE A 1 334 ? 21.600 46.001 -8.732 1.00 1.26 ? 334 ILE A CA 1 ATOM 2690 C C . ILE A 1 334 ? 22.780 45.066 -8.767 1.00 2.08 ? 334 ILE A C 1 ATOM 2691 O O . ILE A 1 334 ? 23.873 45.442 -9.172 1.00 1.47 ? 334 ILE A O 1 ATOM 2692 C CB . ILE A 1 334 ? 21.559 46.716 -7.368 1.00 0.96 ? 334 ILE A CB 1 ATOM 2693 C CG1 . ILE A 1 334 ? 22.677 47.758 -7.305 1.00 0.96 ? 334 ILE A CG1 1 ATOM 2694 C CG2 . ILE A 1 334 ? 21.724 45.714 -6.245 1.00 0.96 ? 334 ILE A CG2 1 ATOM 2695 C CD1 . ILE A 1 334 ? 22.552 48.758 -6.180 1.00 0.96 ? 334 ILE A CD1 1 ATOM 2696 N N . GLU A 1 335 ? 22.549 43.831 -8.360 1.00 4.26 ? 335 GLU A N 1 ATOM 2697 C CA . GLU A 1 335 ? 23.617 42.852 -8.334 1.00 6.90 ? 335 GLU A CA 1 ATOM 2698 C C . GLU A 1 335 ? 24.354 42.746 -9.657 1.00 7.61 ? 335 GLU A C 1 ATOM 2699 O O . GLU A 1 335 ? 25.573 42.613 -9.677 1.00 7.38 ? 335 GLU A O 1 ATOM 2700 C CB . GLU A 1 335 ? 23.068 41.485 -7.912 1.00 8.26 ? 335 GLU A CB 1 ATOM 2701 C CG . GLU A 1 335 ? 22.927 41.341 -6.398 1.00 11.32 ? 335 GLU A CG 1 ATOM 2702 C CD . GLU A 1 335 ? 22.078 40.152 -5.975 1.00 13.92 ? 335 GLU A CD 1 ATOM 2703 O OE1 . GLU A 1 335 ? 22.335 39.025 -6.473 1.00 15.33 ? 335 GLU A OE1 1 ATOM 2704 O OE2 . GLU A 1 335 ? 21.163 40.352 -5.134 1.00 13.56 ? 335 GLU A OE2 1 ATOM 2705 N N . GLU A 1 336 ? 23.628 42.838 -10.764 1.00 9.39 ? 336 GLU A N 1 ATOM 2706 C CA . GLU A 1 336 ? 24.261 42.713 -12.068 1.00 11.33 ? 336 GLU A CA 1 ATOM 2707 C C . GLU A 1 336 ? 25.312 43.762 -12.362 1.00 9.94 ? 336 GLU A C 1 ATOM 2708 O O . GLU A 1 336 ? 26.020 43.655 -13.363 1.00 11.44 ? 336 GLU A O 1 ATOM 2709 C CB . GLU A 1 336 ? 23.213 42.702 -13.186 1.00 15.54 ? 336 GLU A CB 1 ATOM 2710 C CG . GLU A 1 336 ? 22.391 41.412 -13.231 1.00 23.63 ? 336 GLU A CG 1 ATOM 2711 C CD . GLU A 1 336 ? 23.265 40.146 -13.325 1.00 29.38 ? 336 GLU A CD 1 ATOM 2712 O OE1 . GLU A 1 336 ? 23.956 39.969 -14.363 1.00 32.01 ? 336 GLU A OE1 1 ATOM 2713 O OE2 . GLU A 1 336 ? 23.262 39.330 -12.360 1.00 30.71 ? 336 GLU A OE2 1 ATOM 2714 N N . LEU A 1 337 ? 25.424 44.766 -11.497 1.00 7.66 ? 337 LEU A N 1 ATOM 2715 C CA . LEU A 1 337 ? 26.417 45.820 -11.693 1.00 5.50 ? 337 LEU A CA 1 ATOM 2716 C C . LEU A 1 337 ? 27.756 45.433 -11.091 1.00 4.92 ? 337 LEU A C 1 ATOM 2717 O O . LEU A 1 337 ? 28.789 46.010 -11.431 1.00 4.60 ? 337 LEU A O 1 ATOM 2718 C CB . LEU A 1 337 ? 25.956 47.127 -11.051 1.00 4.03 ? 337 LEU A CB 1 ATOM 2719 C CG . LEU A 1 337 ? 24.860 47.936 -11.733 1.00 2.21 ? 337 LEU A CG 1 ATOM 2720 C CD1 . LEU A 1 337 ? 24.451 49.072 -10.830 1.00 0.96 ? 337 LEU A CD1 1 ATOM 2721 C CD2 . LEU A 1 337 ? 25.361 48.464 -13.057 1.00 2.18 ? 337 LEU A CD2 1 ATOM 2722 N N . ARG A 1 338 ? 27.727 44.453 -10.195 1.00 5.21 ? 338 ARG A N 1 ATOM 2723 C CA . ARG A 1 338 ? 28.926 43.989 -9.507 1.00 5.25 ? 338 ARG A CA 1 ATOM 2724 C C . ARG A 1 338 ? 29.981 43.418 -10.441 1.00 6.52 ? 338 ARG A C 1 ATOM 2725 O O . ARG A 1 338 ? 29.694 42.577 -11.290 1.00 8.60 ? 338 ARG A O 1 ATOM 2726 C CB . ARG A 1 338 ? 28.545 42.956 -8.445 1.00 2.92 ? 338 ARG A CB 1 ATOM 2727 C CG . ARG A 1 338 ? 27.596 43.509 -7.392 1.00 1.71 ? 338 ARG A CG 1 ATOM 2728 C CD . ARG A 1 338 ? 27.105 42.447 -6.420 1.00 1.75 ? 338 ARG A CD 1 ATOM 2729 N NE . ARG A 1 338 ? 26.404 43.034 -5.280 1.00 0.96 ? 338 ARG A NE 1 ATOM 2730 C CZ . ARG A 1 338 ? 25.860 42.325 -4.299 1.00 0.96 ? 338 ARG A CZ 1 ATOM 2731 N NH1 . ARG A 1 338 ? 25.936 41.004 -4.329 1.00 0.96 ? 338 ARG A NH1 1 ATOM 2732 N NH2 . ARG A 1 338 ? 25.259 42.934 -3.285 1.00 0.96 ? 338 ARG A NH2 1 ATOM 2733 N N . GLN A 1 339 ? 31.207 43.898 -10.281 1.00 7.52 ? 339 GLN A N 1 ATOM 2734 C CA . GLN A 1 339 ? 32.322 43.443 -11.082 1.00 8.20 ? 339 GLN A CA 1 ATOM 2735 C C . GLN A 1 339 ? 33.175 42.473 -10.274 1.00 7.41 ? 339 GLN A C 1 ATOM 2736 O O . GLN A 1 339 ? 32.759 41.338 -10.041 1.00 6.22 ? 339 GLN A O 1 ATOM 2737 C CB . GLN A 1 339 ? 33.135 44.645 -11.545 1.00 12.59 ? 339 GLN A CB 1 ATOM 2738 C CG . GLN A 1 339 ? 32.542 45.308 -12.774 1.00 20.00 ? 339 GLN A CG 1 ATOM 2739 C CD . GLN A 1 339 ? 32.521 44.362 -13.980 1.00 26.03 ? 339 GLN A CD 1 ATOM 2740 O OE1 . GLN A 1 339 ? 33.572 43.970 -14.502 1.00 29.84 ? 339 GLN A OE1 1 ATOM 2741 N NE2 . GLN A 1 339 ? 31.323 43.983 -14.418 1.00 28.70 ? 339 GLN A NE2 1 ATOM 2742 N N . ASN A 1 340 ? 34.353 42.911 -9.835 1.00 7.59 ? 340 ASN A N 1 ATOM 2743 C CA . ASN A 1 340 ? 35.232 42.039 -9.053 1.00 8.14 ? 340 ASN A CA 1 ATOM 2744 C C . ASN A 1 340 ? 34.933 42.123 -7.565 1.00 7.66 ? 340 ASN A C 1 ATOM 2745 O O . ASN A 1 340 ? 34.317 43.078 -7.100 1.00 8.27 ? 340 ASN A O 1 ATOM 2746 C CB . ASN A 1 340 ? 36.709 42.359 -9.311 1.00 9.11 ? 340 ASN A CB 1 ATOM 2747 C CG . ASN A 1 340 ? 37.140 43.682 -8.719 1.00 9.44 ? 340 ASN A CG 1 ATOM 2748 O OD1 . ASN A 1 340 ? 36.654 44.749 -9.111 1.00 9.27 ? 340 ASN A OD1 1 ATOM 2749 N ND2 . ASN A 1 340 ? 38.070 43.619 -7.769 1.00 10.19 ? 340 ASN A ND2 1 ATOM 2750 N N . GLN A 1 341 ? 35.387 41.130 -6.813 1.00 7.36 ? 341 GLN A N 1 ATOM 2751 C CA . GLN A 1 341 ? 35.093 41.091 -5.389 1.00 7.35 ? 341 GLN A CA 1 ATOM 2752 C C . GLN A 1 341 ? 36.322 40.984 -4.500 1.00 6.23 ? 341 GLN A C 1 ATOM 2753 O O . GLN A 1 341 ? 37.406 40.619 -4.958 1.00 6.85 ? 341 GLN A O 1 ATOM 2754 C CB . GLN A 1 341 ? 34.173 39.910 -5.130 1.00 8.90 ? 341 GLN A CB 1 ATOM 2755 C CG . GLN A 1 341 ? 33.500 39.886 -3.792 1.00 12.43 ? 341 GLN A CG 1 ATOM 2756 C CD . GLN A 1 341 ? 32.703 38.614 -3.619 1.00 15.15 ? 341 GLN A CD 1 ATOM 2757 O OE1 . GLN A 1 341 ? 31.971 38.199 -4.529 1.00 16.53 ? 341 GLN A OE1 1 ATOM 2758 N NE2 . GLN A 1 341 ? 32.841 37.979 -2.458 1.00 16.36 ? 341 GLN A NE2 1 ATOM 2759 N N . VAL A 1 342 ? 36.135 41.320 -3.226 1.00 4.62 ? 342 VAL A N 1 ATOM 2760 C CA . VAL A 1 342 ? 37.190 41.257 -2.223 1.00 3.52 ? 342 VAL A CA 1 ATOM 2761 C C . VAL A 1 342 ? 36.530 40.835 -0.922 1.00 5.02 ? 342 VAL A C 1 ATOM 2762 O O . VAL A 1 342 ? 35.620 41.498 -0.421 1.00 5.74 ? 342 VAL A O 1 ATOM 2763 C CB . VAL A 1 342 ? 37.862 42.607 -2.019 1.00 0.96 ? 342 VAL A CB 1 ATOM 2764 C CG1 . VAL A 1 342 ? 38.990 42.473 -1.036 1.00 0.96 ? 342 VAL A CG1 1 ATOM 2765 C CG2 . VAL A 1 342 ? 38.383 43.121 -3.329 1.00 1.93 ? 342 VAL A CG2 1 ATOM 2766 N N . ASN A 1 343 ? 36.999 39.721 -0.375 1.00 6.68 ? 343 ASN A N 1 ATOM 2767 C CA . ASN A 1 343 ? 36.441 39.167 0.847 1.00 6.61 ? 343 ASN A CA 1 ATOM 2768 C C . ASN A 1 343 ? 37.346 39.290 2.053 1.00 4.61 ? 343 ASN A C 1 ATOM 2769 O O . ASN A 1 343 ? 38.498 39.680 1.955 1.00 4.09 ? 343 ASN A O 1 ATOM 2770 C CB . ASN A 1 343 ? 36.149 37.693 0.636 1.00 11.57 ? 343 ASN A CB 1 ATOM 2771 C CG . ASN A 1 343 ? 34.732 37.334 0.959 1.00 16.32 ? 343 ASN A CG 1 ATOM 2772 O OD1 . ASN A 1 343 ? 34.215 37.694 2.023 1.00 18.92 ? 343 ASN A OD1 1 ATOM 2773 N ND2 . ASN A 1 343 ? 34.085 36.605 0.047 1.00 19.08 ? 343 ASN A ND2 1 ATOM 2774 N N . LEU A 1 344 ? 36.798 38.931 3.199 1.00 3.42 ? 344 LEU A N 1 ATOM 2775 C CA . LEU A 1 344 ? 37.521 38.939 4.458 1.00 3.36 ? 344 LEU A CA 1 ATOM 2776 C C . LEU A 1 344 ? 36.686 38.067 5.364 1.00 4.80 ? 344 LEU A C 1 ATOM 2777 O O . LEU A 1 344 ? 35.454 38.141 5.343 1.00 5.70 ? 344 LEU A O 1 ATOM 2778 C CB . LEU A 1 344 ? 37.614 40.343 5.047 1.00 1.00 ? 344 LEU A CB 1 ATOM 2779 C CG . LEU A 1 344 ? 38.520 41.340 4.338 1.00 0.96 ? 344 LEU A CG 1 ATOM 2780 C CD1 . LEU A 1 344 ? 38.399 42.693 4.989 1.00 0.96 ? 344 LEU A CD1 1 ATOM 2781 C CD2 . LEU A 1 344 ? 39.945 40.854 4.415 1.00 2.91 ? 344 LEU A CD2 1 ATOM 2782 N N . GLN A 1 345 ? 37.344 37.213 6.131 1.00 6.03 ? 345 GLN A N 1 ATOM 2783 C CA . GLN A 1 345 ? 36.628 36.343 7.044 1.00 7.23 ? 345 GLN A CA 1 ATOM 2784 C C . GLN A 1 345 ? 37.446 36.131 8.291 1.00 6.90 ? 345 GLN A C 1 ATOM 2785 O O . GLN A 1 345 ? 38.668 36.006 8.231 1.00 7.16 ? 345 GLN A O 1 ATOM 2786 C CB . GLN A 1 345 ? 36.337 34.983 6.407 1.00 9.48 ? 345 GLN A CB 1 ATOM 2787 C CG . GLN A 1 345 ? 35.385 35.012 5.222 1.00 13.96 ? 345 GLN A CG 1 ATOM 2788 C CD . GLN A 1 345 ? 34.652 33.688 5.038 1.00 16.84 ? 345 GLN A CD 1 ATOM 2789 O OE1 . GLN A 1 345 ? 34.244 33.336 3.924 1.00 19.93 ? 345 GLN A OE1 1 ATOM 2790 N NE2 . GLN A 1 345 ? 34.469 32.955 6.136 1.00 16.85 ? 345 GLN A NE2 1 ATOM 2791 N N . ASN A 1 346 ? 36.773 36.117 9.429 1.00 6.87 ? 346 ASN A N 1 ATOM 2792 C CA . ASN A 1 346 ? 37.457 35.879 10.681 1.00 7.30 ? 346 ASN A CA 1 ATOM 2793 C C . ASN A 1 346 ? 38.647 36.830 10.854 1.00 6.07 ? 346 ASN A C 1 ATOM 2794 O O . ASN A 1 346 ? 39.792 36.393 10.915 1.00 5.07 ? 346 ASN A O 1 ATOM 2795 C CB . ASN A 1 346 ? 37.905 34.412 10.699 1.00 9.16 ? 346 ASN A CB 1 ATOM 2796 C CG . ASN A 1 346 ? 38.211 33.903 12.089 1.00 12.22 ? 346 ASN A CG 1 ATOM 2797 O OD1 . ASN A 1 346 ? 37.434 34.103 13.027 1.00 13.22 ? 346 ASN A OD1 1 ATOM 2798 N ND2 . ASN A 1 346 ? 39.344 33.221 12.228 1.00 15.02 ? 346 ASN A ND2 1 ATOM 2799 N N . LYS A 1 347 ? 38.370 38.130 10.927 1.00 5.85 ? 347 LYS A N 1 ATOM 2800 C CA . LYS A 1 347 ? 39.426 39.124 11.110 1.00 7.33 ? 347 LYS A CA 1 ATOM 2801 C C . LYS A 1 347 ? 39.135 40.027 12.297 1.00 9.60 ? 347 LYS A C 1 ATOM 2802 O O . LYS A 1 347 ? 38.157 40.771 12.288 1.00 10.54 ? 347 LYS A O 1 ATOM 2803 C CB . LYS A 1 347 ? 39.581 39.991 9.864 1.00 5.74 ? 347 LYS A CB 1 ATOM 2804 C CG . LYS A 1 347 ? 40.503 41.198 10.045 1.00 4.49 ? 347 LYS A CG 1 ATOM 2805 C CD . LYS A 1 347 ? 41.938 40.771 10.307 1.00 5.75 ? 347 LYS A CD 1 ATOM 2806 C CE . LYS A 1 347 ? 42.893 41.965 10.328 1.00 5.95 ? 347 LYS A CE 1 ATOM 2807 N NZ . LYS A 1 347 ? 44.312 41.576 10.625 1.00 4.75 ? 347 LYS A NZ 1 ATOM 2808 N N . ASN A 1 348 ? 39.988 39.966 13.314 1.00 12.05 ? 348 ASN A N 1 ATOM 2809 C CA . ASN A 1 348 ? 39.806 40.796 14.501 1.00 14.59 ? 348 ASN A CA 1 ATOM 2810 C C . ASN A 1 348 ? 40.260 42.214 14.232 1.00 14.23 ? 348 ASN A C 1 ATOM 2811 O O . ASN A 1 348 ? 41.259 42.437 13.547 1.00 15.40 ? 348 ASN A O 1 ATOM 2812 C CB . ASN A 1 348 ? 40.617 40.257 15.685 1.00 18.38 ? 348 ASN A CB 1 ATOM 2813 C CG . ASN A 1 348 ? 40.154 38.887 16.137 1.00 22.68 ? 348 ASN A CG 1 ATOM 2814 O OD1 . ASN A 1 348 ? 38.976 38.687 16.441 1.00 24.76 ? 348 ASN A OD1 1 ATOM 2815 N ND2 . ASN A 1 348 ? 41.083 37.932 16.193 1.00 24.72 ? 348 ASN A ND2 1 ATOM 2816 N N . LEU A 1 349 ? 39.525 43.177 14.768 1.00 13.01 ? 349 LEU A N 1 ATOM 2817 C CA . LEU A 1 349 ? 39.905 44.567 14.613 1.00 12.13 ? 349 LEU A CA 1 ATOM 2818 C C . LEU A 1 349 ? 40.277 45.068 16.004 1.00 12.83 ? 349 LEU A C 1 ATOM 2819 O O . LEU A 1 349 ? 39.421 45.515 16.766 1.00 12.49 ? 349 LEU A O 1 ATOM 2820 C CB . LEU A 1 349 ? 38.749 45.372 14.031 1.00 10.34 ? 349 LEU A CB 1 ATOM 2821 C CG . LEU A 1 349 ? 38.302 44.950 12.631 1.00 9.11 ? 349 LEU A CG 1 ATOM 2822 C CD1 . LEU A 1 349 ? 37.400 46.025 12.070 1.00 8.16 ? 349 LEU A CD1 1 ATOM 2823 C CD2 . LEU A 1 349 ? 39.500 44.762 11.717 1.00 8.39 ? 349 LEU A CD2 1 ATOM 2824 N N . LYS A 1 350 ? 41.560 44.970 16.340 1.00 14.07 ? 350 LYS A N 1 ATOM 2825 C CA . LYS A 1 350 ? 42.023 45.390 17.657 1.00 15.10 ? 350 LYS A CA 1 ATOM 2826 C C . LYS A 1 350 ? 41.668 46.834 17.962 1.00 14.23 ? 350 LYS A C 1 ATOM 2827 O O . LYS A 1 350 ? 41.590 47.679 17.070 1.00 13.87 ? 350 LYS A O 1 ATOM 2828 C CB . LYS A 1 350 ? 43.543 45.151 17.820 1.00 18.02 ? 350 LYS A CB 1 ATOM 2829 C CG . LYS A 1 350 ? 44.413 45.462 16.588 1.00 22.75 ? 350 LYS A CG 1 ATOM 2830 C CD . LYS A 1 350 ? 45.818 44.813 16.698 1.00 25.73 ? 350 LYS A CD 1 ATOM 2831 C CE . LYS A 1 350 ? 46.582 44.848 15.350 1.00 28.00 ? 350 LYS A CE 1 ATOM 2832 N NZ . LYS A 1 350 ? 47.853 44.036 15.323 1.00 27.99 ? 350 LYS A NZ 1 ATOM 2833 N N . PRO A 1 351 ? 41.424 47.128 19.242 1.00 13.48 ? 351 PRO A N 1 ATOM 2834 C CA . PRO A 1 351 ? 41.066 48.465 19.712 1.00 11.87 ? 351 PRO A CA 1 ATOM 2835 C C . PRO A 1 351 ? 41.827 49.599 19.041 1.00 10.17 ? 351 PRO A C 1 ATOM 2836 O O . PRO A 1 351 ? 43.056 49.617 19.026 1.00 8.90 ? 351 PRO A O 1 ATOM 2837 C CB . PRO A 1 351 ? 41.333 48.372 21.204 1.00 12.80 ? 351 PRO A CB 1 ATOM 2838 C CG . PRO A 1 351 ? 40.861 46.977 21.501 1.00 13.58 ? 351 PRO A CG 1 ATOM 2839 C CD . PRO A 1 351 ? 41.468 46.172 20.365 1.00 13.57 ? 351 PRO A CD 1 ATOM 2840 N N . GLY A 1 352 ? 41.067 50.534 18.477 1.00 9.24 ? 352 GLY A N 1 ATOM 2841 C CA . GLY A 1 352 ? 41.635 51.690 17.810 1.00 8.70 ? 352 GLY A CA 1 ATOM 2842 C C . GLY A 1 352 ? 42.392 51.395 16.534 1.00 8.25 ? 352 GLY A C 1 ATOM 2843 O O . GLY A 1 352 ? 43.418 52.029 16.261 1.00 9.28 ? 352 GLY A O 1 ATOM 2844 N N . SER A 1 353 ? 41.897 50.450 15.742 1.00 6.90 ? 353 SER A N 1 ATOM 2845 C CA . SER A 1 353 ? 42.576 50.102 14.505 1.00 6.07 ? 353 SER A CA 1 ATOM 2846 C C . SER A 1 353 ? 41.826 50.552 13.267 1.00 5.38 ? 353 SER A C 1 ATOM 2847 O O . SER A 1 353 ? 40.667 50.945 13.335 1.00 4.90 ? 353 SER A O 1 ATOM 2848 C CB . SER A 1 353 ? 42.817 48.596 14.441 1.00 7.23 ? 353 SER A CB 1 ATOM 2849 O OG . SER A 1 353 ? 41.599 47.881 14.461 1.00 9.19 ? 353 SER A OG 1 ATOM 2850 N N . VAL A 1 354 ? 42.512 50.494 12.133 1.00 5.13 ? 354 VAL A N 1 ATOM 2851 C CA . VAL A 1 354 ? 41.940 50.892 10.854 1.00 5.36 ? 354 VAL A CA 1 ATOM 2852 C C . VAL A 1 354 ? 42.467 49.957 9.772 1.00 5.58 ? 354 VAL A C 1 ATOM 2853 O O . VAL A 1 354 ? 43.651 50.008 9.429 1.00 7.52 ? 354 VAL A O 1 ATOM 2854 C CB . VAL A 1 354 ? 42.345 52.342 10.503 1.00 4.81 ? 354 VAL A CB 1 ATOM 2855 C CG1 . VAL A 1 354 ? 41.828 52.724 9.126 1.00 4.09 ? 354 VAL A CG1 1 ATOM 2856 C CG2 . VAL A 1 354 ? 41.809 53.292 11.554 1.00 5.19 ? 354 VAL A CG2 1 ATOM 2857 N N . LEU A 1 355 ? 41.599 49.102 9.241 1.00 4.26 ? 355 LEU A N 1 ATOM 2858 C CA . LEU A 1 355 ? 42.009 48.173 8.201 1.00 4.40 ? 355 LEU A CA 1 ATOM 2859 C C . LEU A 1 355 ? 41.489 48.621 6.843 1.00 5.43 ? 355 LEU A C 1 ATOM 2860 O O . LEU A 1 355 ? 40.294 48.848 6.673 1.00 7.40 ? 355 LEU A O 1 ATOM 2861 C CB . LEU A 1 355 ? 41.493 46.777 8.520 1.00 3.59 ? 355 LEU A CB 1 ATOM 2862 C CG . LEU A 1 355 ? 41.801 45.716 7.465 1.00 3.75 ? 355 LEU A CG 1 ATOM 2863 C CD1 . LEU A 1 355 ? 43.270 45.757 7.111 1.00 4.86 ? 355 LEU A CD1 1 ATOM 2864 C CD2 . LEU A 1 355 ? 41.413 44.344 7.989 1.00 4.42 ? 355 LEU A CD2 1 ATOM 2865 N N . GLU A 1 356 ? 42.379 48.754 5.869 1.00 5.59 ? 356 GLU A N 1 ATOM 2866 C CA . GLU A 1 356 ? 41.953 49.190 4.544 1.00 6.42 ? 356 GLU A CA 1 ATOM 2867 C C . GLU A 1 356 ? 41.543 48.068 3.598 1.00 5.84 ? 356 GLU A C 1 ATOM 2868 O O . GLU A 1 356 ? 42.196 47.032 3.537 1.00 7.31 ? 356 GLU A O 1 ATOM 2869 C CB . GLU A 1 356 ? 43.058 50.019 3.865 1.00 7.86 ? 356 GLU A CB 1 ATOM 2870 C CG . GLU A 1 356 ? 42.891 50.095 2.339 1.00 11.34 ? 356 GLU A CG 1 ATOM 2871 C CD . GLU A 1 356 ? 43.619 51.262 1.681 1.00 12.81 ? 356 GLU A CD 1 ATOM 2872 O OE1 . GLU A 1 356 ? 44.807 51.491 2.003 1.00 14.79 ? 356 GLU A OE1 1 ATOM 2873 O OE2 . GLU A 1 356 ? 42.994 51.934 0.824 1.00 12.88 ? 356 GLU A OE2 1 ATOM 2874 N N . ILE A 1 357 ? 40.461 48.276 2.858 1.00 4.71 ? 357 ILE A N 1 ATOM 2875 C CA . ILE A 1 357 ? 40.031 47.291 1.877 1.00 3.74 ? 357 ILE A CA 1 ATOM 2876 C C . ILE A 1 357 ? 40.805 47.650 0.613 1.00 4.47 ? 357 ILE A C 1 ATOM 2877 O O . ILE A 1 357 ? 40.736 48.789 0.156 1.00 4.80 ? 357 ILE A O 1 ATOM 2878 C CB . ILE A 1 357 ? 38.544 47.407 1.550 1.00 2.55 ? 357 ILE A CB 1 ATOM 2879 C CG1 . ILE A 1 357 ? 37.708 47.359 2.823 1.00 2.02 ? 357 ILE A CG1 1 ATOM 2880 C CG2 . ILE A 1 357 ? 38.153 46.279 0.635 1.00 1.82 ? 357 ILE A CG2 1 ATOM 2881 C CD1 . ILE A 1 357 ? 37.863 46.092 3.599 1.00 2.45 ? 357 ILE A CD1 1 ATOM 2882 N N . HIS A 1 358 ? 41.532 46.694 0.044 1.00 5.13 ? 358 HIS A N 1 ATOM 2883 C CA . HIS A 1 358 ? 42.324 46.963 -1.157 1.00 6.55 ? 358 HIS A CA 1 ATOM 2884 C C . HIS A 1 358 ? 41.727 46.427 -2.454 1.00 7.12 ? 358 HIS A C 1 ATOM 2885 O O . HIS A 1 358 ? 41.008 45.435 -2.450 1.00 8.64 ? 358 HIS A O 1 ATOM 2886 C CB . HIS A 1 358 ? 43.723 46.368 -0.987 1.00 7.48 ? 358 HIS A CB 1 ATOM 2887 C CG . HIS A 1 358 ? 44.610 47.140 -0.060 1.00 8.91 ? 358 HIS A CG 1 ATOM 2888 N ND1 . HIS A 1 358 ? 45.306 48.262 -0.457 1.00 9.64 ? 358 HIS A ND1 1 ATOM 2889 C CD2 . HIS A 1 358 ? 44.910 46.954 1.247 1.00 9.82 ? 358 HIS A CD2 1 ATOM 2890 C CE1 . HIS A 1 358 ? 45.998 48.732 0.567 1.00 10.69 ? 358 HIS A CE1 1 ATOM 2891 N NE2 . HIS A 1 358 ? 45.775 47.957 1.613 1.00 10.03 ? 358 HIS A NE2 1 ATOM 2892 N N . GLY A 1 359 ? 42.023 47.084 -3.568 1.00 7.43 ? 359 GLY A N 1 ATOM 2893 C CA . GLY A 1 359 ? 41.534 46.596 -4.851 1.00 8.27 ? 359 GLY A CA 1 ATOM 2894 C C . GLY A 1 359 ? 40.123 46.934 -5.314 1.00 7.56 ? 359 GLY A C 1 ATOM 2895 O O . GLY A 1 359 ? 39.769 46.672 -6.464 1.00 8.21 ? 359 GLY A O 1 ATOM 2896 N N . ILE A 1 360 ? 39.306 47.502 -4.440 1.00 6.33 ? 360 ILE A N 1 ATOM 2897 C CA . ILE A 1 360 ? 37.950 47.861 -4.827 1.00 4.36 ? 360 ILE A CA 1 ATOM 2898 C C . ILE A 1 360 ? 37.929 49.254 -5.457 1.00 4.70 ? 360 ILE A C 1 ATOM 2899 O O . ILE A 1 360 ? 38.876 50.036 -5.303 1.00 5.15 ? 360 ILE A O 1 ATOM 2900 C CB . ILE A 1 360 ? 37.012 47.838 -3.605 1.00 2.77 ? 360 ILE A CB 1 ATOM 2901 C CG1 . ILE A 1 360 ? 36.655 46.395 -3.251 1.00 2.29 ? 360 ILE A CG1 1 ATOM 2902 C CG2 . ILE A 1 360 ? 35.764 48.647 -3.877 1.00 0.96 ? 360 ILE A CG2 1 ATOM 2903 C CD1 . ILE A 1 360 ? 35.727 45.738 -4.236 1.00 2.42 ? 360 ILE A CD1 1 ATOM 2904 N N . ALA A 1 361 ? 36.843 49.544 -6.172 1.00 4.00 ? 361 ALA A N 1 ATOM 2905 C CA . ALA A 1 361 ? 36.633 50.828 -6.831 1.00 2.72 ? 361 ALA A CA 1 ATOM 2906 C C . ALA A 1 361 ? 36.074 51.836 -5.834 1.00 2.89 ? 361 ALA A C 1 ATOM 2907 O O . ALA A 1 361 ? 35.191 52.615 -6.154 1.00 3.58 ? 361 ALA A O 1 ATOM 2908 C CB . ALA A 1 361 ? 35.670 50.652 -7.971 1.00 2.32 ? 361 ALA A CB 1 ATOM 2909 N N . ALA A 1 362 ? 36.603 51.785 -4.620 1.00 2.85 ? 362 ALA A N 1 ATOM 2910 C CA . ALA A 1 362 ? 36.237 52.645 -3.494 1.00 2.64 ? 362 ALA A CA 1 ATOM 2911 C C . ALA A 1 362 ? 35.172 53.732 -3.614 1.00 2.66 ? 362 ALA A C 1 ATOM 2912 O O . ALA A 1 362 ? 34.421 53.963 -2.671 1.00 2.41 ? 362 ALA A O 1 ATOM 2913 C CB . ALA A 1 362 ? 37.502 53.277 -2.938 1.00 2.72 ? 362 ALA A CB 1 ATOM 2914 N N . SER A 1 363 ? 35.123 54.419 -4.745 1.00 3.27 ? 363 SER A N 1 ATOM 2915 C CA . SER A 1 363 ? 34.187 55.516 -4.919 1.00 3.15 ? 363 SER A CA 1 ATOM 2916 C C . SER A 1 363 ? 32.854 55.127 -5.537 1.00 3.19 ? 363 SER A C 1 ATOM 2917 O O . SER A 1 363 ? 31.953 55.953 -5.655 1.00 3.35 ? 363 SER A O 1 ATOM 2918 C CB . SER A 1 363 ? 34.854 56.596 -5.762 1.00 3.35 ? 363 SER A CB 1 ATOM 2919 O OG . SER A 1 363 ? 34.189 57.835 -5.620 1.00 6.61 ? 363 SER A OG 1 ATOM 2920 N N . GLN A 1 364 ? 32.728 53.865 -5.924 1.00 3.75 ? 364 GLN A N 1 ATOM 2921 C CA . GLN A 1 364 ? 31.503 53.362 -6.547 1.00 3.77 ? 364 GLN A CA 1 ATOM 2922 C C . GLN A 1 364 ? 31.473 51.854 -6.306 1.00 3.88 ? 364 GLN A C 1 ATOM 2923 O O . GLN A 1 364 ? 31.879 51.065 -7.166 1.00 3.00 ? 364 GLN A O 1 ATOM 2924 C CB . GLN A 1 364 ? 31.529 53.675 -8.048 1.00 3.42 ? 364 GLN A CB 1 ATOM 2925 C CG . GLN A 1 364 ? 30.297 53.287 -8.836 1.00 4.98 ? 364 GLN A CG 1 ATOM 2926 C CD . GLN A 1 364 ? 30.362 53.755 -10.291 1.00 7.72 ? 364 GLN A CD 1 ATOM 2927 O OE1 . GLN A 1 364 ? 30.497 54.953 -10.572 1.00 8.45 ? 364 GLN A OE1 1 ATOM 2928 N NE2 . GLN A 1 364 ? 30.264 52.810 -11.223 1.00 8.43 ? 364 GLN A NE2 1 ATOM 2929 N N . ALA A 1 365 ? 30.987 51.463 -5.127 1.00 3.16 ? 365 ALA A N 1 ATOM 2930 C CA . ALA A 1 365 ? 30.944 50.059 -4.760 1.00 2.38 ? 365 ALA A CA 1 ATOM 2931 C C . ALA A 1 365 ? 29.790 49.682 -3.855 1.00 2.12 ? 365 ALA A C 1 ATOM 2932 O O . ALA A 1 365 ? 29.023 50.528 -3.412 1.00 1.97 ? 365 ALA A O 1 ATOM 2933 C CB . ALA A 1 365 ? 32.243 49.685 -4.094 1.00 1.52 ? 365 ALA A CB 1 ATOM 2934 N N . ASP A 1 366 ? 29.694 48.385 -3.589 1.00 3.43 ? 366 ASP A N 1 ATOM 2935 C CA . ASP A 1 366 ? 28.664 47.810 -2.727 1.00 4.81 ? 366 ASP A CA 1 ATOM 2936 C C . ASP A 1 366 ? 29.423 47.047 -1.631 1.00 4.90 ? 366 ASP A C 1 ATOM 2937 O O . ASP A 1 366 ? 30.113 46.066 -1.922 1.00 5.40 ? 366 ASP A O 1 ATOM 2938 C CB . ASP A 1 366 ? 27.788 46.851 -3.543 1.00 5.47 ? 366 ASP A CB 1 ATOM 2939 C CG . ASP A 1 366 ? 26.587 46.357 -2.771 1.00 7.46 ? 366 ASP A CG 1 ATOM 2940 O OD1 . ASP A 1 366 ? 26.432 46.737 -1.592 1.00 9.22 ? 366 ASP A OD1 1 ATOM 2941 O OD2 . ASP A 1 366 ? 25.792 45.585 -3.342 1.00 8.91 ? 366 ASP A OD2 1 ATOM 2942 N N . VAL A 1 367 ? 29.309 47.486 -0.379 1.00 3.70 ? 367 VAL A N 1 ATOM 2943 C CA . VAL A 1 367 ? 30.048 46.827 0.688 1.00 3.71 ? 367 VAL A CA 1 ATOM 2944 C C . VAL A 1 367 ? 29.223 46.291 1.852 1.00 4.89 ? 367 VAL A C 1 ATOM 2945 O O . VAL A 1 367 ? 28.539 47.048 2.553 1.00 6.32 ? 367 VAL A O 1 ATOM 2946 C CB . VAL A 1 367 ? 31.111 47.766 1.267 1.00 1.89 ? 367 VAL A CB 1 ATOM 2947 C CG1 . VAL A 1 367 ? 32.107 46.976 2.067 1.00 2.49 ? 367 VAL A CG1 1 ATOM 2948 C CG2 . VAL A 1 367 ? 31.801 48.510 0.164 1.00 2.14 ? 367 VAL A CG2 1 ATOM 2949 N N . THR A 1 368 ? 29.314 44.980 2.063 1.00 4.81 ? 368 THR A N 1 ATOM 2950 C CA . THR A 1 368 ? 28.610 44.308 3.151 1.00 5.02 ? 368 THR A CA 1 ATOM 2951 C C . THR A 1 368 ? 29.643 43.916 4.180 1.00 3.68 ? 368 THR A C 1 ATOM 2952 O O . THR A 1 368 ? 30.731 43.478 3.827 1.00 4.53 ? 368 THR A O 1 ATOM 2953 C CB . THR A 1 368 ? 27.955 43.015 2.685 1.00 6.08 ? 368 THR A CB 1 ATOM 2954 O OG1 . THR A 1 368 ? 27.246 43.258 1.468 1.00 8.83 ? 368 THR A OG1 1 ATOM 2955 C CG2 . THR A 1 368 ? 26.994 42.489 3.751 1.00 7.03 ? 368 THR A CG2 1 ATOM 2956 N N . ILE A 1 369 ? 29.313 44.063 5.450 1.00 2.50 ? 369 ILE A N 1 ATOM 2957 C CA . ILE A 1 369 ? 30.250 43.694 6.491 1.00 3.14 ? 369 ILE A CA 1 ATOM 2958 C C . ILE A 1 369 ? 29.467 43.196 7.685 1.00 3.29 ? 369 ILE A C 1 ATOM 2959 O O . ILE A 1 369 ? 28.400 43.719 8.002 1.00 3.51 ? 369 ILE A O 1 ATOM 2960 C CB . ILE A 1 369 ? 31.128 44.883 6.891 1.00 3.57 ? 369 ILE A CB 1 ATOM 2961 C CG1 . ILE A 1 369 ? 32.135 44.448 7.944 1.00 4.76 ? 369 ILE A CG1 1 ATOM 2962 C CG2 . ILE A 1 369 ? 30.274 46.008 7.440 1.00 5.10 ? 369 ILE A CG2 1 ATOM 2963 C CD1 . ILE A 1 369 ? 33.132 45.528 8.281 1.00 5.91 ? 369 ILE A CD1 1 ATOM 2964 N N . SER A 1 370 ? 29.987 42.177 8.351 1.00 3.47 ? 370 SER A N 1 ATOM 2965 C CA . SER A 1 370 ? 29.277 41.612 9.483 1.00 4.69 ? 370 SER A CA 1 ATOM 2966 C C . SER A 1 370 ? 30.202 41.410 10.674 1.00 5.05 ? 370 SER A C 1 ATOM 2967 O O . SER A 1 370 ? 31.216 40.727 10.584 1.00 5.56 ? 370 SER A O 1 ATOM 2968 C CB . SER A 1 370 ? 28.636 40.290 9.058 1.00 5.20 ? 370 SER A CB 1 ATOM 2969 O OG . SER A 1 370 ? 27.740 39.808 10.039 1.00 6.79 ? 370 SER A OG 1 ATOM 2970 N N . PHE A 1 371 ? 29.837 42.005 11.798 1.00 5.87 ? 371 PHE A N 1 ATOM 2971 C CA . PHE A 1 371 ? 30.647 41.913 12.998 1.00 6.75 ? 371 PHE A CA 1 ATOM 2972 C C . PHE A 1 371 ? 30.178 40.828 13.948 1.00 9.55 ? 371 PHE A C 1 ATOM 2973 O O . PHE A 1 371 ? 28.976 40.582 14.062 1.00 10.20 ? 371 PHE A O 1 ATOM 2974 C CB . PHE A 1 371 ? 30.621 43.250 13.714 1.00 3.71 ? 371 PHE A CB 1 ATOM 2975 C CG . PHE A 1 371 ? 31.144 44.374 12.894 1.00 1.73 ? 371 PHE A CG 1 ATOM 2976 C CD1 . PHE A 1 371 ? 32.506 44.524 12.692 1.00 1.70 ? 371 PHE A CD1 1 ATOM 2977 C CD2 . PHE A 1 371 ? 30.277 45.287 12.319 1.00 0.96 ? 371 PHE A CD2 1 ATOM 2978 C CE1 . PHE A 1 371 ? 33.000 45.576 11.926 1.00 2.30 ? 371 PHE A CE1 1 ATOM 2979 C CE2 . PHE A 1 371 ? 30.758 46.340 11.554 1.00 2.10 ? 371 PHE A CE2 1 ATOM 2980 C CZ . PHE A 1 371 ? 32.121 46.488 11.356 1.00 1.68 ? 371 PHE A CZ 1 ATOM 2981 N N . LYS A 1 372 ? 31.137 40.182 14.616 1.00 12.59 ? 372 LYS A N 1 ATOM 2982 C CA . LYS A 1 372 ? 30.854 39.137 15.601 1.00 15.93 ? 372 LYS A CA 1 ATOM 2983 C C . LYS A 1 372 ? 31.317 39.684 16.934 1.00 17.52 ? 372 LYS A C 1 ATOM 2984 O O . LYS A 1 372 ? 32.517 39.831 17.172 1.00 18.34 ? 372 LYS A O 1 ATOM 2985 C CB . LYS A 1 372 ? 31.623 37.848 15.304 1.00 18.16 ? 372 LYS A CB 1 ATOM 2986 C CG . LYS A 1 372 ? 31.295 36.699 16.269 1.00 21.93 ? 372 LYS A CG 1 ATOM 2987 C CD . LYS A 1 372 ? 32.031 35.399 15.903 1.00 24.46 ? 372 LYS A CD 1 ATOM 2988 C CE . LYS A 1 372 ? 31.508 34.212 16.714 1.00 25.71 ? 372 LYS A CE 1 ATOM 2989 N NZ . LYS A 1 372 ? 30.032 34.003 16.518 1.00 26.47 ? 372 LYS A NZ 1 ATOM 2990 N N . LEU A 1 373 ? 30.359 39.990 17.799 1.00 19.12 ? 373 LEU A N 1 ATOM 2991 C CA . LEU A 1 373 ? 30.660 40.550 19.104 1.00 19.91 ? 373 LEU A CA 1 ATOM 2992 C C . LEU A 1 373 ? 30.906 39.509 20.170 1.00 23.12 ? 373 LEU A C 1 ATOM 2993 O O . LEU A 1 373 ? 30.237 38.472 20.218 1.00 23.64 ? 373 LEU A O 1 ATOM 2994 C CB . LEU A 1 373 ? 29.524 41.453 19.554 1.00 16.11 ? 373 LEU A CB 1 ATOM 2995 C CG . LEU A 1 373 ? 29.440 42.732 18.754 1.00 12.97 ? 373 LEU A CG 1 ATOM 2996 C CD1 . LEU A 1 373 ? 28.274 43.561 19.227 1.00 12.88 ? 373 LEU A CD1 1 ATOM 2997 C CD2 . LEU A 1 373 ? 30.742 43.470 18.923 1.00 12.31 ? 373 LEU A CD2 1 ATOM 2998 N N . GLU A 1 374 ? 31.873 39.808 21.029 1.00 25.97 ? 374 GLU A N 1 ATOM 2999 C CA . GLU A 1 374 ? 32.231 38.939 22.137 1.00 28.22 ? 374 GLU A CA 1 ATOM 3000 C C . GLU A 1 374 ? 32.576 39.831 23.320 1.00 26.84 ? 374 GLU A C 1 ATOM 3001 O O . GLU A 1 374 ? 33.356 40.787 23.202 1.00 26.87 ? 374 GLU A O 1 ATOM 3002 C CB . GLU A 1 374 ? 33.414 38.046 21.750 1.00 32.52 ? 374 GLU A CB 1 ATOM 3003 C CG . GLU A 1 374 ? 34.568 38.788 21.075 1.00 39.12 ? 374 GLU A CG 1 ATOM 3004 C CD . GLU A 1 374 ? 35.822 38.865 21.954 1.00 43.17 ? 374 GLU A CD 1 ATOM 3005 O OE1 . GLU A 1 374 ? 36.357 37.784 22.327 1.00 44.59 ? 374 GLU A OE1 1 ATOM 3006 O OE2 . GLU A 1 374 ? 36.271 40.002 22.265 1.00 44.57 ? 374 GLU A OE2 1 ATOM 3007 N N . GLY A 1 375 ? 31.966 39.529 24.458 1.00 25.54 ? 375 GLY A N 1 ATOM 3008 C CA . GLY A 1 375 ? 32.205 40.330 25.638 1.00 23.23 ? 375 GLY A CA 1 ATOM 3009 C C . GLY A 1 375 ? 31.246 41.503 25.667 1.00 20.74 ? 375 GLY A C 1 ATOM 3010 O O . GLY A 1 375 ? 31.669 42.655 25.654 1.00 20.10 ? 375 GLY A O 1 ATOM 3011 N N . LEU A 1 376 ? 29.951 41.206 25.692 1.00 18.63 ? 376 LEU A N 1 ATOM 3012 C CA . LEU A 1 376 ? 28.931 42.245 25.738 1.00 16.28 ? 376 LEU A CA 1 ATOM 3013 C C . LEU A 1 376 ? 28.811 42.829 27.121 1.00 15.69 ? 376 LEU A C 1 ATOM 3014 O O . LEU A 1 376 ? 28.539 44.008 27.272 1.00 15.36 ? 376 LEU A O 1 ATOM 3015 C CB . LEU A 1 376 ? 27.567 41.694 25.350 1.00 14.03 ? 376 LEU A CB 1 ATOM 3016 C CG . LEU A 1 376 ? 27.447 41.221 23.915 1.00 12.68 ? 376 LEU A CG 1 ATOM 3017 C CD1 . LEU A 1 376 ? 25.994 40.933 23.603 1.00 11.17 ? 376 LEU A CD1 1 ATOM 3018 C CD2 . LEU A 1 376 ? 27.983 42.295 22.996 1.00 12.31 ? 376 LEU A CD2 1 ATOM 3019 N N . LYS A 1 377 ? 28.999 41.994 28.132 1.00 15.90 ? 377 LYS A N 1 ATOM 3020 C CA . LYS A 1 377 ? 28.894 42.455 29.504 1.00 17.06 ? 377 LYS A CA 1 ATOM 3021 C C . LYS A 1 377 ? 29.626 43.781 29.680 1.00 15.28 ? 377 LYS A C 1 ATOM 3022 O O . LYS A 1 377 ? 29.316 44.537 30.599 1.00 16.29 ? 377 LYS A O 1 ATOM 3023 C CB . LYS A 1 377 ? 29.473 41.415 30.482 1.00 20.56 ? 377 LYS A CB 1 ATOM 3024 C CG . LYS A 1 377 ? 31.016 41.242 30.421 1.00 25.22 ? 377 LYS A CG 1 ATOM 3025 C CD . LYS A 1 377 ? 31.616 40.406 31.599 1.00 27.53 ? 377 LYS A CD 1 ATOM 3026 C CE . LYS A 1 377 ? 31.577 41.152 32.962 1.00 29.40 ? 377 LYS A CE 1 ATOM 3027 N NZ . LYS A 1 377 ? 32.161 40.394 34.137 1.00 28.83 ? 377 LYS A NZ 1 ATOM 3028 N N . GLU A 1 378 ? 30.581 44.069 28.796 1.00 13.15 ? 378 GLU A N 1 ATOM 3029 C CA . GLU A 1 378 ? 31.361 45.305 28.892 1.00 12.59 ? 378 GLU A CA 1 ATOM 3030 C C . GLU A 1 378 ? 30.708 46.549 28.282 1.00 10.75 ? 378 GLU A C 1 ATOM 3031 O O . GLU A 1 378 ? 31.276 47.645 28.332 1.00 9.02 ? 378 GLU A O 1 ATOM 3032 C CB . GLU A 1 378 ? 32.740 45.114 28.256 1.00 14.17 ? 378 GLU A CB 1 ATOM 3033 C CG . GLU A 1 378 ? 33.592 44.024 28.895 1.00 17.85 ? 378 GLU A CG 1 ATOM 3034 C CD . GLU A 1 378 ? 33.712 44.158 30.412 1.00 20.12 ? 378 GLU A CD 1 ATOM 3035 O OE1 . GLU A 1 378 ? 34.169 45.220 30.902 1.00 20.78 ? 378 GLU A OE1 1 ATOM 3036 O OE2 . GLU A 1 378 ? 33.352 43.185 31.116 1.00 21.23 ? 378 GLU A OE2 1 ATOM 3037 N N . ALA A 1 379 ? 29.518 46.371 27.717 1.00 9.38 ? 379 ALA A N 1 ATOM 3038 C CA . ALA A 1 379 ? 28.780 47.456 27.086 1.00 8.23 ? 379 ALA A CA 1 ATOM 3039 C C . ALA A 1 379 ? 28.618 48.629 28.022 1.00 8.59 ? 379 ALA A C 1 ATOM 3040 O O . ALA A 1 379 ? 28.423 48.447 29.222 1.00 8.32 ? 379 ALA A O 1 ATOM 3041 C CB . ALA A 1 379 ? 27.412 46.965 26.650 1.00 6.57 ? 379 ALA A CB 1 ATOM 3042 N N . GLU A 1 380 ? 28.706 49.836 27.469 1.00 10.01 ? 380 GLU A N 1 ATOM 3043 C CA . GLU A 1 380 ? 28.534 51.052 28.258 1.00 10.95 ? 380 GLU A CA 1 ATOM 3044 C C . GLU A 1 380 ? 27.141 50.998 28.868 1.00 10.66 ? 380 GLU A C 1 ATOM 3045 O O . GLU A 1 380 ? 26.302 50.209 28.430 1.00 11.79 ? 380 GLU A O 1 ATOM 3046 C CB . GLU A 1 380 ? 28.677 52.284 27.366 1.00 12.10 ? 380 GLU A CB 1 ATOM 3047 C CG . GLU A 1 380 ? 30.118 52.688 27.124 1.00 16.57 ? 380 GLU A CG 1 ATOM 3048 C CD . GLU A 1 380 ? 30.296 53.532 25.876 1.00 19.50 ? 380 GLU A CD 1 ATOM 3049 O OE1 . GLU A 1 380 ? 30.401 52.941 24.771 1.00 21.14 ? 380 GLU A OE1 1 ATOM 3050 O OE2 . GLU A 1 380 ? 30.322 54.782 26.002 1.00 21.24 ? 380 GLU A OE2 1 ATOM 3051 N N . VAL A 1 381 ? 26.884 51.817 29.879 1.00 9.74 ? 381 VAL A N 1 ATOM 3052 C CA . VAL A 1 381 ? 25.570 51.797 30.505 1.00 9.06 ? 381 VAL A CA 1 ATOM 3053 C C . VAL A 1 381 ? 24.778 53.037 30.152 1.00 8.42 ? 381 VAL A C 1 ATOM 3054 O O . VAL A 1 381 ? 25.079 54.131 30.620 1.00 9.30 ? 381 VAL A O 1 ATOM 3055 C CB . VAL A 1 381 ? 25.680 51.717 32.014 1.00 9.07 ? 381 VAL A CB 1 ATOM 3056 C CG1 . VAL A 1 381 ? 24.333 51.344 32.588 1.00 8.99 ? 381 VAL A CG1 1 ATOM 3057 C CG2 . VAL A 1 381 ? 26.755 50.709 32.404 1.00 10.16 ? 381 VAL A CG2 1 ATOM 3058 N N . LEU A 1 382 ? 23.748 52.861 29.337 1.00 7.68 ? 382 LEU A N 1 ATOM 3059 C CA . LEU A 1 382 ? 22.950 53.992 28.916 1.00 6.90 ? 382 LEU A CA 1 ATOM 3060 C C . LEU A 1 382 ? 21.541 53.601 28.506 1.00 7.91 ? 382 LEU A C 1 ATOM 3061 O O . LEU A 1 382 ? 21.321 53.115 27.398 1.00 8.60 ? 382 LEU A O 1 ATOM 3062 C CB . LEU A 1 382 ? 23.656 54.684 27.756 1.00 4.16 ? 382 LEU A CB 1 ATOM 3063 C CG . LEU A 1 382 ? 22.906 55.743 26.967 1.00 1.43 ? 382 LEU A CG 1 ATOM 3064 C CD1 . LEU A 1 382 ? 22.525 56.887 27.857 1.00 1.08 ? 382 LEU A CD1 1 ATOM 3065 C CD2 . LEU A 1 382 ? 23.801 56.224 25.857 1.00 1.72 ? 382 LEU A CD2 1 ATOM 3066 N N . ASP A 1 383 ? 20.589 53.807 29.407 1.00 8.62 ? 383 ASP A N 1 ATOM 3067 C CA . ASP A 1 383 ? 19.207 53.496 29.104 1.00 9.34 ? 383 ASP A CA 1 ATOM 3068 C C . ASP A 1 383 ? 18.852 54.383 27.924 1.00 9.11 ? 383 ASP A C 1 ATOM 3069 O O . ASP A 1 383 ? 19.116 55.582 27.955 1.00 9.55 ? 383 ASP A O 1 ATOM 3070 C CB . ASP A 1 383 ? 18.316 53.840 30.282 1.00 11.52 ? 383 ASP A CB 1 ATOM 3071 C CG . ASP A 1 383 ? 16.902 53.396 30.065 1.00 14.33 ? 383 ASP A CG 1 ATOM 3072 O OD1 . ASP A 1 383 ? 16.612 52.209 30.343 1.00 15.99 ? 383 ASP A OD1 1 ATOM 3073 O OD2 . ASP A 1 383 ? 16.091 54.228 29.596 1.00 15.67 ? 383 ASP A OD2 1 ATOM 3074 N N . THR A 1 384 ? 18.247 53.808 26.892 1.00 9.20 ? 384 THR A N 1 ATOM 3075 C CA . THR A 1 384 ? 17.915 54.572 25.689 1.00 9.39 ? 384 THR A CA 1 ATOM 3076 C C . THR A 1 384 ? 16.428 54.803 25.424 1.00 8.33 ? 384 THR A C 1 ATOM 3077 O O . THR A 1 384 ? 16.043 55.201 24.322 1.00 9.08 ? 384 THR A O 1 ATOM 3078 C CB . THR A 1 384 ? 18.529 53.887 24.432 1.00 10.26 ? 384 THR A CB 1 ATOM 3079 O OG1 . THR A 1 384 ? 18.260 52.477 24.475 1.00 11.25 ? 384 THR A OG1 1 ATOM 3080 C CG2 . THR A 1 384 ? 20.038 54.115 24.370 1.00 9.55 ? 384 THR A CG2 1 ATOM 3081 N N . THR A 1 385 ? 15.592 54.588 26.430 1.00 7.23 ? 385 THR A N 1 ATOM 3082 C CA . THR A 1 385 ? 14.161 54.741 26.232 1.00 6.20 ? 385 THR A CA 1 ATOM 3083 C C . THR A 1 385 ? 13.700 56.050 25.618 1.00 5.42 ? 385 THR A C 1 ATOM 3084 O O . THR A 1 385 ? 12.762 56.054 24.825 1.00 6.54 ? 385 THR A O 1 ATOM 3085 C CB . THR A 1 385 ? 13.398 54.526 27.535 1.00 6.56 ? 385 THR A CB 1 ATOM 3086 O OG1 . THR A 1 385 ? 13.765 53.258 28.095 1.00 8.02 ? 385 THR A OG1 1 ATOM 3087 C CG2 . THR A 1 385 ? 11.899 54.531 27.268 1.00 6.76 ? 385 THR A CG2 1 ATOM 3088 N N . LEU A 1 386 ? 14.352 57.156 25.964 1.00 4.22 ? 386 LEU A N 1 ATOM 3089 C CA . LEU A 1 386 ? 13.958 58.461 25.434 1.00 2.67 ? 386 LEU A CA 1 ATOM 3090 C C . LEU A 1 386 ? 15.019 59.186 24.633 1.00 2.67 ? 386 LEU A C 1 ATOM 3091 O O . LEU A 1 386 ? 14.774 60.268 24.102 1.00 3.01 ? 386 LEU A O 1 ATOM 3092 C CB . LEU A 1 386 ? 13.505 59.356 26.576 1.00 1.78 ? 386 LEU A CB 1 ATOM 3093 C CG . LEU A 1 386 ? 12.189 58.859 27.153 1.00 0.96 ? 386 LEU A CG 1 ATOM 3094 C CD1 . LEU A 1 386 ? 11.838 59.599 28.412 1.00 1.36 ? 386 LEU A CD1 1 ATOM 3095 C CD2 . LEU A 1 386 ? 11.125 59.055 26.108 1.00 2.16 ? 386 LEU A CD2 1 ATOM 3096 N N . VAL A 1 387 ? 16.192 58.580 24.536 1.00 2.39 ? 387 VAL A N 1 ATOM 3097 C CA . VAL A 1 387 ? 17.297 59.183 23.815 1.00 3.02 ? 387 VAL A CA 1 ATOM 3098 C C . VAL A 1 387 ? 17.052 59.303 22.328 1.00 2.86 ? 387 VAL A C 1 ATOM 3099 O O . VAL A 1 387 ? 16.595 58.362 21.689 1.00 2.58 ? 387 VAL A O 1 ATOM 3100 C CB . VAL A 1 387 ? 18.582 58.381 24.007 1.00 3.76 ? 387 VAL A CB 1 ATOM 3101 C CG1 . VAL A 1 387 ? 19.726 59.088 23.309 1.00 5.13 ? 387 VAL A CG1 1 ATOM 3102 C CG2 . VAL A 1 387 ? 18.875 58.206 25.488 1.00 4.32 ? 387 VAL A CG2 1 ATOM 3103 N N . ASP A 1 388 ? 17.374 60.470 21.785 1.00 3.64 ? 388 ASP A N 1 ATOM 3104 C CA . ASP A 1 388 ? 17.219 60.737 20.361 1.00 4.02 ? 388 ASP A CA 1 ATOM 3105 C C . ASP A 1 388 ? 18.538 60.475 19.635 1.00 4.67 ? 388 ASP A C 1 ATOM 3106 O O . ASP A 1 388 ? 19.469 61.276 19.682 1.00 4.11 ? 388 ASP A O 1 ATOM 3107 C CB . ASP A 1 388 ? 16.766 62.184 20.147 1.00 4.36 ? 388 ASP A CB 1 ATOM 3108 C CG . ASP A 1 388 ? 16.956 62.656 18.718 1.00 4.17 ? 388 ASP A CG 1 ATOM 3109 O OD1 . ASP A 1 388 ? 17.005 61.806 17.798 1.00 3.66 ? 388 ASP A OD1 1 ATOM 3110 O OD2 . ASP A 1 388 ? 17.040 63.889 18.519 1.00 3.18 ? 388 ASP A OD2 1 ATOM 3111 N N . PRO A 1 389 ? 18.619 59.345 18.936 1.00 5.51 ? 389 PRO A N 1 ATOM 3112 C CA . PRO A 1 389 ? 19.805 58.932 18.189 1.00 6.86 ? 389 PRO A CA 1 ATOM 3113 C C . PRO A 1 389 ? 20.501 60.000 17.355 1.00 8.09 ? 389 PRO A C 1 ATOM 3114 O O . PRO A 1 389 ? 21.729 60.014 17.287 1.00 9.55 ? 389 PRO A O 1 ATOM 3115 C CB . PRO A 1 389 ? 19.296 57.766 17.345 1.00 6.86 ? 389 PRO A CB 1 ATOM 3116 C CG . PRO A 1 389 ? 17.860 58.074 17.175 1.00 7.54 ? 389 PRO A CG 1 ATOM 3117 C CD . PRO A 1 389 ? 17.467 58.520 18.558 1.00 6.31 ? 389 PRO A CD 1 ATOM 3118 N N . GLN A 1 390 ? 19.754 60.886 16.708 1.00 8.61 ? 390 GLN A N 1 ATOM 3119 C CA . GLN A 1 390 ? 20.432 61.915 15.926 1.00 10.30 ? 390 GLN A CA 1 ATOM 3120 C C . GLN A 1 390 ? 21.325 62.742 16.838 1.00 10.61 ? 390 GLN A C 1 ATOM 3121 O O . GLN A 1 390 ? 22.461 63.076 16.489 1.00 10.85 ? 390 GLN A O 1 ATOM 3122 C CB . GLN A 1 390 ? 19.440 62.835 15.229 1.00 12.02 ? 390 GLN A CB 1 ATOM 3123 C CG . GLN A 1 390 ? 18.905 62.277 13.940 1.00 15.38 ? 390 GLN A CG 1 ATOM 3124 C CD . GLN A 1 390 ? 18.971 63.290 12.828 1.00 16.65 ? 390 GLN A CD 1 ATOM 3125 O OE1 . GLN A 1 390 ? 18.351 63.108 11.771 1.00 19.90 ? 390 GLN A OE1 1 ATOM 3126 N NE2 . GLN A 1 390 ? 19.728 64.368 13.049 1.00 13.12 ? 390 GLN A NE2 1 ATOM 3127 N N . ALA A 1 391 ? 20.811 63.071 18.017 1.00 10.08 ? 391 ALA A N 1 ATOM 3128 C CA . ALA A 1 391 ? 21.587 63.850 18.958 1.00 9.06 ? 391 ALA A CA 1 ATOM 3129 C C . ALA A 1 391 ? 22.801 63.036 19.362 1.00 8.89 ? 391 ALA A C 1 ATOM 3130 O O . ALA A 1 391 ? 23.913 63.544 19.369 1.00 11.00 ? 391 ALA A O 1 ATOM 3131 C CB . ALA A 1 391 ? 20.755 64.182 20.170 1.00 9.21 ? 391 ALA A CB 1 ATOM 3132 N N . LEU A 1 392 ? 22.587 61.762 19.670 1.00 8.01 ? 392 LEU A N 1 ATOM 3133 C CA . LEU A 1 392 ? 23.675 60.895 20.098 1.00 7.86 ? 392 LEU A CA 1 ATOM 3134 C C . LEU A 1 392 ? 24.789 60.698 19.050 1.00 9.82 ? 392 LEU A C 1 ATOM 3135 O O . LEU A 1 392 ? 25.967 60.742 19.406 1.00 11.00 ? 392 LEU A O 1 ATOM 3136 C CB . LEU A 1 392 ? 23.103 59.549 20.573 1.00 4.70 ? 392 LEU A CB 1 ATOM 3137 C CG . LEU A 1 392 ? 23.982 58.640 21.441 1.00 0.96 ? 392 LEU A CG 1 ATOM 3138 C CD1 . LEU A 1 392 ? 24.675 59.444 22.513 1.00 0.96 ? 392 LEU A CD1 1 ATOM 3139 C CD2 . LEU A 1 392 ? 23.138 57.554 22.060 1.00 0.96 ? 392 LEU A CD2 1 ATOM 3140 N N . CYS A 1 393 ? 24.457 60.492 17.774 1.00 10.95 ? 393 CYS A N 1 ATOM 3141 C CA . CYS A 1 393 ? 25.530 60.323 16.786 1.00 13.48 ? 393 CYS A CA 1 ATOM 3142 C C . CYS A 1 393 ? 26.209 61.649 16.564 1.00 13.82 ? 393 CYS A C 1 ATOM 3143 O O . CYS A 1 393 ? 27.386 61.698 16.225 1.00 17.26 ? 393 CYS A O 1 ATOM 3144 C CB . CYS A 1 393 ? 25.044 59.859 15.406 1.00 13.86 ? 393 CYS A CB 1 ATOM 3145 S SG . CYS A 1 393 ? 24.329 58.192 15.248 1.00 20.73 ? 393 CYS A SG 1 ATOM 3146 N N . ASN A 1 394 ? 25.464 62.733 16.730 1.00 12.67 ? 394 ASN A N 1 ATOM 3147 C CA . ASN A 1 394 ? 26.033 64.048 16.496 1.00 11.27 ? 394 ASN A CA 1 ATOM 3148 C C . ASN A 1 394 ? 26.869 64.530 17.650 1.00 11.10 ? 394 ASN A C 1 ATOM 3149 O O . ASN A 1 394 ? 27.648 65.469 17.512 1.00 11.40 ? 394 ASN A O 1 ATOM 3150 C CB . ASN A 1 394 ? 24.929 65.056 16.190 1.00 10.38 ? 394 ASN A CB 1 ATOM 3151 C CG . ASN A 1 394 ? 24.671 65.205 14.698 1.00 9.08 ? 394 ASN A CG 1 ATOM 3152 O OD1 . ASN A 1 394 ? 25.471 65.798 13.967 1.00 8.99 ? 394 ASN A OD1 1 ATOM 3153 N ND2 . ASN A 1 394 ? 23.553 64.660 14.238 1.00 8.26 ? 394 ASN A ND2 1 ATOM 3154 N N . GLU A 1 395 ? 26.709 63.889 18.795 1.00 11.54 ? 395 GLU A N 1 ATOM 3155 C CA . GLU A 1 395 ? 27.480 64.276 19.957 1.00 13.09 ? 395 GLU A CA 1 ATOM 3156 C C . GLU A 1 395 ? 28.659 63.329 20.045 1.00 11.55 ? 395 GLU A C 1 ATOM 3157 O O . GLU A 1 395 ? 29.780 63.743 20.342 1.00 13.06 ? 395 GLU A O 1 ATOM 3158 C CB . GLU A 1 395 ? 26.631 64.191 21.232 1.00 16.40 ? 395 GLU A CB 1 ATOM 3159 C CG . GLU A 1 395 ? 27.416 64.456 22.512 1.00 22.84 ? 395 GLU A CG 1 ATOM 3160 C CD . GLU A 1 395 ? 26.578 64.268 23.778 1.00 28.09 ? 395 GLU A CD 1 ATOM 3161 O OE1 . GLU A 1 395 ? 25.860 63.238 23.882 1.00 30.33 ? 395 GLU A OE1 1 ATOM 3162 O OE2 . GLU A 1 395 ? 26.648 65.147 24.674 1.00 30.30 ? 395 GLU A OE2 1 ATOM 3163 N N . ARG A 1 396 ? 28.403 62.057 19.768 1.00 8.74 ? 396 ARG A N 1 ATOM 3164 C CA . ARG A 1 396 ? 29.444 61.049 19.825 1.00 5.98 ? 396 ARG A CA 1 ATOM 3165 C C . ARG A 1 396 ? 29.761 60.529 18.445 1.00 4.24 ? 396 ARG A C 1 ATOM 3166 O O . ARG A 1 396 ? 29.221 59.515 18.017 1.00 3.81 ? 396 ARG A O 1 ATOM 3167 C CB . ARG A 1 396 ? 29.013 59.907 20.745 1.00 6.82 ? 396 ARG A CB 1 ATOM 3168 C CG . ARG A 1 396 ? 29.456 60.098 22.188 1.00 9.06 ? 396 ARG A CG 1 ATOM 3169 C CD . ARG A 1 396 ? 28.929 59.011 23.123 1.00 12.52 ? 396 ARG A CD 1 ATOM 3170 N NE . ARG A 1 396 ? 27.839 59.523 23.956 1.00 16.01 ? 396 ARG A NE 1 ATOM 3171 C CZ . ARG A 1 396 ? 27.221 58.834 24.914 1.00 16.83 ? 396 ARG A CZ 1 ATOM 3172 N NH1 . ARG A 1 396 ? 27.575 57.579 25.177 1.00 18.20 ? 396 ARG A NH1 1 ATOM 3173 N NH2 . ARG A 1 396 ? 26.262 59.414 25.627 1.00 16.11 ? 396 ARG A NH2 1 ATOM 3174 N N . GLY A 1 397 ? 30.639 61.235 17.747 1.00 3.12 ? 397 GLY A N 1 ATOM 3175 C CA . GLY A 1 397 ? 31.010 60.821 16.411 1.00 3.87 ? 397 GLY A CA 1 ATOM 3176 C C . GLY A 1 397 ? 32.052 59.714 16.387 1.00 5.23 ? 397 GLY A C 1 ATOM 3177 O O . GLY A 1 397 ? 32.339 59.072 17.408 1.00 4.21 ? 397 GLY A O 1 ATOM 3178 N N . ALA A 1 398 ? 32.626 59.502 15.205 1.00 6.25 ? 398 ALA A N 1 ATOM 3179 C CA . ALA A 1 398 ? 33.636 58.471 14.990 1.00 6.64 ? 398 ALA A CA 1 ATOM 3180 C C . ALA A 1 398 ? 34.826 58.592 15.915 1.00 6.96 ? 398 ALA A C 1 ATOM 3181 O O . ALA A 1 398 ? 35.472 57.600 16.226 1.00 7.92 ? 398 ALA A O 1 ATOM 3182 C CB . ALA A 1 398 ? 34.118 58.511 13.554 1.00 6.92 ? 398 ALA A CB 1 ATOM 3183 N N . SER A 1 399 ? 35.124 59.808 16.348 1.00 7.22 ? 399 SER A N 1 ATOM 3184 C CA . SER A 1 399 ? 36.263 60.016 17.221 1.00 6.99 ? 399 SER A CA 1 ATOM 3185 C C . SER A 1 399 ? 35.929 59.904 18.696 1.00 7.15 ? 399 SER A C 1 ATOM 3186 O O . SER A 1 399 ? 36.792 60.124 19.533 1.00 7.68 ? 399 SER A O 1 ATOM 3187 C CB . SER A 1 399 ? 36.877 61.376 16.949 1.00 6.85 ? 399 SER A CB 1 ATOM 3188 O OG . SER A 1 399 ? 35.936 62.386 17.229 1.00 9.76 ? 399 SER A OG 1 ATOM 3189 N N . SER A 1 400 ? 34.682 59.580 19.025 1.00 8.17 ? 400 SER A N 1 ATOM 3190 C CA . SER A 1 400 ? 34.293 59.422 20.430 1.00 8.68 ? 400 SER A CA 1 ATOM 3191 C C . SER A 1 400 ? 34.403 57.940 20.786 1.00 9.08 ? 400 SER A C 1 ATOM 3192 O O . SER A 1 400 ? 33.521 57.148 20.435 1.00 10.32 ? 400 SER A O 1 ATOM 3193 C CB . SER A 1 400 ? 32.856 59.887 20.647 1.00 8.35 ? 400 SER A CB 1 ATOM 3194 O OG . SER A 1 400 ? 32.462 59.640 21.986 1.00 9.58 ? 400 SER A OG 1 ATOM 3195 N N . ARG A 1 401 ? 35.469 57.562 21.488 1.00 8.54 ? 401 ARG A N 1 ATOM 3196 C CA . ARG A 1 401 ? 35.685 56.151 21.820 1.00 7.93 ? 401 ARG A CA 1 ATOM 3197 C C . ARG A 1 401 ? 34.818 55.603 22.946 1.00 6.84 ? 401 ARG A C 1 ATOM 3198 O O . ARG A 1 401 ? 34.583 56.280 23.948 1.00 6.90 ? 401 ARG A O 1 ATOM 3199 C CB . ARG A 1 401 ? 37.166 55.922 22.140 1.00 8.74 ? 401 ARG A CB 1 ATOM 3200 C CG . ARG A 1 401 ? 38.104 56.453 21.061 1.00 10.03 ? 401 ARG A CG 1 ATOM 3201 C CD . ARG A 1 401 ? 39.552 56.053 21.296 1.00 12.15 ? 401 ARG A CD 1 ATOM 3202 N NE . ARG A 1 401 ? 39.708 54.605 21.399 1.00 13.99 ? 401 ARG A NE 1 ATOM 3203 C CZ . ARG A 1 401 ? 40.877 53.979 21.505 1.00 14.84 ? 401 ARG A CZ 1 ATOM 3204 N NH1 . ARG A 1 401 ? 42.009 54.674 21.518 1.00 14.71 ? 401 ARG A NH1 1 ATOM 3205 N NH2 . ARG A 1 401 ? 40.911 52.655 21.612 1.00 15.05 ? 401 ARG A NH2 1 ATOM 3206 N N . GLY A 1 402 ? 34.342 54.372 22.774 1.00 5.78 ? 402 GLY A N 1 ATOM 3207 C CA . GLY A 1 402 ? 33.506 53.754 23.788 1.00 7.17 ? 402 GLY A CA 1 ATOM 3208 C C . GLY A 1 402 ? 33.918 52.324 24.075 1.00 8.16 ? 402 GLY A C 1 ATOM 3209 O O . GLY A 1 402 ? 35.040 51.930 23.778 1.00 10.11 ? 402 GLY A O 1 ATOM 3210 N N . ALA A 1 403 ? 33.028 51.541 24.671 1.00 7.97 ? 403 ALA A N 1 ATOM 3211 C CA . ALA A 1 403 ? 33.329 50.142 24.951 1.00 6.43 ? 403 ALA A CA 1 ATOM 3212 C C . ALA A 1 403 ? 33.142 49.420 23.625 1.00 6.70 ? 403 ALA A C 1 ATOM 3213 O O . ALA A 1 403 ? 34.113 49.099 22.952 1.00 7.21 ? 403 ALA A O 1 ATOM 3214 C CB . ALA A 1 403 ? 32.371 49.600 25.976 1.00 8.54 ? 403 ALA A CB 1 ATOM 3215 N N . LEU A 1 404 ? 31.888 49.165 23.254 1.00 6.27 ? 404 LEU A N 1 ATOM 3216 C CA . LEU A 1 404 ? 31.586 48.522 21.978 1.00 5.57 ? 404 LEU A CA 1 ATOM 3217 C C . LEU A 1 404 ? 31.217 49.628 21.014 1.00 5.69 ? 404 LEU A C 1 ATOM 3218 O O . LEU A 1 404 ? 30.185 50.284 21.156 1.00 5.78 ? 404 LEU A O 1 ATOM 3219 C CB . LEU A 1 404 ? 30.421 47.549 22.108 1.00 5.38 ? 404 LEU A CB 1 ATOM 3220 C CG . LEU A 1 404 ? 30.839 46.146 22.523 1.00 4.54 ? 404 LEU A CG 1 ATOM 3221 C CD1 . LEU A 1 404 ? 31.619 46.225 23.796 1.00 5.03 ? 404 LEU A CD1 1 ATOM 3222 C CD2 . LEU A 1 404 ? 29.627 45.272 22.714 1.00 5.52 ? 404 LEU A CD2 1 ATOM 3223 N N . GLY A 1 405 ? 32.072 49.833 20.026 1.00 5.98 ? 405 GLY A N 1 ATOM 3224 C CA . GLY A 1 405 ? 31.825 50.888 19.071 1.00 5.82 ? 405 GLY A CA 1 ATOM 3225 C C . GLY A 1 405 ? 32.566 52.101 19.584 1.00 5.63 ? 405 GLY A C 1 ATOM 3226 O O . GLY A 1 405 ? 32.912 52.157 20.764 1.00 6.95 ? 405 GLY A O 1 ATOM 3227 N N . PRO A 1 406 ? 32.800 53.103 18.735 1.00 5.10 ? 406 PRO A N 1 ATOM 3228 C CA . PRO A 1 406 ? 32.361 53.087 17.343 1.00 4.20 ? 406 PRO A CA 1 ATOM 3229 C C . PRO A 1 406 ? 33.134 52.100 16.490 1.00 3.62 ? 406 PRO A C 1 ATOM 3230 O O . PRO A 1 406 ? 34.354 52.166 16.432 1.00 5.82 ? 406 PRO A O 1 ATOM 3231 C CB . PRO A 1 406 ? 32.604 54.524 16.904 1.00 4.18 ? 406 PRO A CB 1 ATOM 3232 C CG . PRO A 1 406 ? 33.862 54.863 17.644 1.00 4.74 ? 406 PRO A CG 1 ATOM 3233 C CD . PRO A 1 406 ? 33.584 54.316 19.026 1.00 4.94 ? 406 PRO A CD 1 ATOM 3234 N N . PHE A 1 407 ? 32.441 51.167 15.853 1.00 1.36 ? 407 PHE A N 1 ATOM 3235 C CA . PHE A 1 407 ? 33.128 50.246 14.969 1.00 1.49 ? 407 PHE A CA 1 ATOM 3236 C C . PHE A 1 407 ? 32.317 50.148 13.689 1.00 1.98 ? 407 PHE A C 1 ATOM 3237 O O . PHE A 1 407 ? 31.089 50.036 13.731 1.00 3.44 ? 407 PHE A O 1 ATOM 3238 C CB . PHE A 1 407 ? 33.321 48.880 15.627 1.00 0.96 ? 407 PHE A CB 1 ATOM 3239 C CG . PHE A 1 407 ? 32.052 48.149 15.925 1.00 0.96 ? 407 PHE A CG 1 ATOM 3240 C CD1 . PHE A 1 407 ? 31.338 47.523 14.917 1.00 0.96 ? 407 PHE A CD1 1 ATOM 3241 C CD2 . PHE A 1 407 ? 31.590 48.049 17.229 1.00 1.00 ? 407 PHE A CD2 1 ATOM 3242 C CE1 . PHE A 1 407 ? 30.188 46.810 15.208 1.00 1.03 ? 407 PHE A CE1 1 ATOM 3243 C CE2 . PHE A 1 407 ? 30.436 47.334 17.532 1.00 0.96 ? 407 PHE A CE2 1 ATOM 3244 C CZ . PHE A 1 407 ? 29.734 46.714 16.522 1.00 0.96 ? 407 PHE A CZ 1 ATOM 3245 N N . GLY A 1 408 ? 32.992 50.232 12.549 1.00 1.29 ? 408 GLY A N 1 ATOM 3246 C CA . GLY A 1 408 ? 32.270 50.168 11.300 1.00 0.96 ? 408 GLY A CA 1 ATOM 3247 C C . GLY A 1 408 ? 33.070 50.421 10.040 1.00 2.01 ? 408 GLY A C 1 ATOM 3248 O O . GLY A 1 408 ? 34.164 49.890 9.856 1.00 3.33 ? 408 GLY A O 1 ATOM 3249 N N . LEU A 1 409 ? 32.530 51.261 9.169 1.00 1.15 ? 409 LEU A N 1 ATOM 3250 C CA . LEU A 1 409 ? 33.173 51.523 7.899 1.00 0.96 ? 409 LEU A CA 1 ATOM 3251 C C . LEU A 1 409 ? 33.501 52.978 7.596 1.00 0.96 ? 409 LEU A C 1 ATOM 3252 O O . LEU A 1 409 ? 32.744 53.887 7.921 1.00 1.05 ? 409 LEU A O 1 ATOM 3253 C CB . LEU A 1 409 ? 32.267 50.995 6.803 1.00 0.96 ? 409 LEU A CB 1 ATOM 3254 C CG . LEU A 1 409 ? 32.886 50.626 5.470 1.00 2.20 ? 409 LEU A CG 1 ATOM 3255 C CD1 . LEU A 1 409 ? 33.602 49.313 5.663 1.00 3.86 ? 409 LEU A CD1 1 ATOM 3256 C CD2 . LEU A 1 409 ? 31.821 50.488 4.391 1.00 3.01 ? 409 LEU A CD2 1 ATOM 3257 N N . LEU A 1 410 ? 34.639 53.190 6.952 1.00 0.96 ? 410 LEU A N 1 ATOM 3258 C CA . LEU A 1 410 ? 35.035 54.524 6.549 1.00 1.22 ? 410 LEU A CA 1 ATOM 3259 C C . LEU A 1 410 ? 34.904 54.570 5.037 1.00 1.34 ? 410 LEU A C 1 ATOM 3260 O O . LEU A 1 410 ? 35.713 53.978 4.326 1.00 1.98 ? 410 LEU A O 1 ATOM 3261 C CB . LEU A 1 410 ? 36.475 54.801 6.951 1.00 1.89 ? 410 LEU A CB 1 ATOM 3262 C CG . LEU A 1 410 ? 36.658 54.903 8.458 1.00 3.68 ? 410 LEU A CG 1 ATOM 3263 C CD1 . LEU A 1 410 ? 38.069 55.364 8.774 1.00 4.85 ? 410 LEU A CD1 1 ATOM 3264 C CD2 . LEU A 1 410 ? 35.646 55.883 9.018 1.00 4.18 ? 410 LEU A CD2 1 ATOM 3265 N N . ALA A 1 411 ? 33.876 55.258 4.547 1.00 0.96 ? 411 ALA A N 1 ATOM 3266 C CA . ALA A 1 411 ? 33.635 55.360 3.113 1.00 0.96 ? 411 ALA A CA 1 ATOM 3267 C C . ALA A 1 411 ? 33.950 56.747 2.589 1.00 1.13 ? 411 ALA A C 1 ATOM 3268 O O . ALA A 1 411 ? 34.060 57.693 3.369 1.00 1.36 ? 411 ALA A O 1 ATOM 3269 C CB . ALA A 1 411 ? 32.202 55.016 2.810 1.00 0.96 ? 411 ALA A CB 1 ATOM 3270 N N . MET A 1 412 ? 34.082 56.863 1.266 1.00 1.51 ? 412 MET A N 1 ATOM 3271 C CA . MET A 1 412 ? 34.403 58.138 0.627 1.00 1.97 ? 412 MET A CA 1 ATOM 3272 C C . MET A 1 412 ? 35.443 58.857 1.453 1.00 2.67 ? 412 MET A C 1 ATOM 3273 O O . MET A 1 412 ? 35.250 60.010 1.839 1.00 3.24 ? 412 MET A O 1 ATOM 3274 C CB . MET A 1 412 ? 33.160 59.017 0.502 1.00 1.15 ? 412 MET A CB 1 ATOM 3275 C CG . MET A 1 412 ? 32.261 58.608 -0.624 1.00 0.96 ? 412 MET A CG 1 ATOM 3276 S SD . MET A 1 412 ? 33.222 58.272 -2.121 1.00 0.96 ? 412 MET A SD 1 ATOM 3277 C CE . MET A 1 412 ? 33.484 59.889 -2.733 1.00 0.96 ? 412 MET A CE 1 ATOM 3278 N N . ALA A 1 413 ? 36.542 58.159 1.722 1.00 3.45 ? 413 ALA A N 1 ATOM 3279 C CA . ALA A 1 413 ? 37.623 58.691 2.539 1.00 4.49 ? 413 ALA A CA 1 ATOM 3280 C C . ALA A 1 413 ? 38.893 58.956 1.752 1.00 5.83 ? 413 ALA A C 1 ATOM 3281 O O . ALA A 1 413 ? 39.186 58.253 0.792 1.00 7.42 ? 413 ALA A O 1 ATOM 3282 C CB . ALA A 1 413 ? 37.915 57.731 3.651 1.00 4.09 ? 413 ALA A CB 1 ATOM 3283 N N . SER A 1 414 ? 39.647 59.968 2.172 1.00 6.75 ? 414 SER A N 1 ATOM 3284 C CA . SER A 1 414 ? 40.899 60.334 1.517 1.00 8.32 ? 414 SER A CA 1 ATOM 3285 C C . SER A 1 414 ? 41.991 59.372 1.967 1.00 9.55 ? 414 SER A C 1 ATOM 3286 O O . SER A 1 414 ? 41.809 58.640 2.943 1.00 9.06 ? 414 SER A O 1 ATOM 3287 C CB . SER A 1 414 ? 41.306 61.750 1.909 1.00 9.15 ? 414 SER A CB 1 ATOM 3288 O OG . SER A 1 414 ? 41.757 61.787 3.256 1.00 10.30 ? 414 SER A OG 1 ATOM 3289 N N . LYS A 1 415 ? 43.130 59.382 1.280 1.00 11.05 ? 415 LYS A N 1 ATOM 3290 C CA . LYS A 1 415 ? 44.202 58.484 1.668 1.00 13.58 ? 415 LYS A CA 1 ATOM 3291 C C . LYS A 1 415 ? 44.754 58.837 3.035 1.00 14.55 ? 415 LYS A C 1 ATOM 3292 O O . LYS A 1 415 ? 45.179 57.954 3.783 1.00 16.18 ? 415 LYS A O 1 ATOM 3293 C CB . LYS A 1 415 ? 45.343 58.487 0.652 1.00 15.04 ? 415 LYS A CB 1 ATOM 3294 C CG . LYS A 1 415 ? 46.354 57.371 0.940 1.00 19.47 ? 415 LYS A CG 1 ATOM 3295 C CD . LYS A 1 415 ? 47.259 57.040 -0.253 1.00 23.19 ? 415 LYS A CD 1 ATOM 3296 C CE . LYS A 1 415 ? 48.084 55.754 -0.014 1.00 25.12 ? 415 LYS A CE 1 ATOM 3297 N NZ . LYS A 1 415 ? 47.248 54.514 0.165 1.00 26.78 ? 415 LYS A NZ 1 ATOM 3298 N N . ASP A 1 416 ? 44.746 60.123 3.372 1.00 15.10 ? 416 ASP A N 1 ATOM 3299 C CA . ASP A 1 416 ? 45.265 60.555 4.666 1.00 15.43 ? 416 ASP A CA 1 ATOM 3300 C C . ASP A 1 416 ? 44.181 60.675 5.710 1.00 14.27 ? 416 ASP A C 1 ATOM 3301 O O . ASP A 1 416 ? 44.384 61.288 6.753 1.00 14.14 ? 416 ASP A O 1 ATOM 3302 C CB . ASP A 1 416 ? 46.002 61.893 4.537 1.00 18.33 ? 416 ASP A CB 1 ATOM 3303 C CG . ASP A 1 416 ? 45.122 63.005 3.988 1.00 20.70 ? 416 ASP A CG 1 ATOM 3304 O OD1 . ASP A 1 416 ? 44.481 62.806 2.928 1.00 22.94 ? 416 ASP A OD1 1 ATOM 3305 O OD2 . ASP A 1 416 ? 45.087 64.086 4.613 1.00 20.82 ? 416 ASP A OD2 1 ATOM 3306 N N . LEU A 1 417 ? 43.028 60.087 5.421 1.00 13.85 ? 417 LEU A N 1 ATOM 3307 C CA . LEU A 1 417 ? 41.908 60.121 6.349 1.00 13.52 ? 417 LEU A CA 1 ATOM 3308 C C . LEU A 1 417 ? 41.612 61.531 6.844 1.00 13.71 ? 417 LEU A C 1 ATOM 3309 O O . LEU A 1 417 ? 41.020 61.699 7.910 1.00 14.78 ? 417 LEU A O 1 ATOM 3310 C CB . LEU A 1 417 ? 42.206 59.225 7.545 1.00 12.04 ? 417 LEU A CB 1 ATOM 3311 C CG . LEU A 1 417 ? 42.342 57.753 7.194 1.00 11.07 ? 417 LEU A CG 1 ATOM 3312 C CD1 . LEU A 1 417 ? 42.979 57.008 8.351 1.00 13.17 ? 417 LEU A CD1 1 ATOM 3313 C CD2 . LEU A 1 417 ? 40.977 57.194 6.874 1.00 9.45 ? 417 LEU A CD2 1 ATOM 3314 N N . LYS A 1 418 ? 42.027 62.541 6.083 1.00 13.21 ? 418 LYS A N 1 ATOM 3315 C CA . LYS A 1 418 ? 41.784 63.924 6.480 1.00 12.52 ? 418 LYS A CA 1 ATOM 3316 C C . LYS A 1 418 ? 40.294 64.195 6.303 1.00 10.09 ? 418 LYS A C 1 ATOM 3317 O O . LYS A 1 418 ? 39.694 64.962 7.060 1.00 9.69 ? 418 LYS A O 1 ATOM 3318 C CB . LYS A 1 418 ? 42.613 64.880 5.618 1.00 16.64 ? 418 LYS A CB 1 ATOM 3319 C CG . LYS A 1 418 ? 42.951 66.220 6.291 1.00 22.38 ? 418 LYS A CG 1 ATOM 3320 C CD . LYS A 1 418 ? 43.889 66.054 7.515 1.00 26.69 ? 418 LYS A CD 1 ATOM 3321 C CE . LYS A 1 418 ? 45.346 65.721 7.122 1.00 28.60 ? 418 LYS A CE 1 ATOM 3322 N NZ . LYS A 1 418 ? 46.064 66.828 6.389 1.00 29.19 ? 418 LYS A NZ 1 ATOM 3323 N N . GLU A 1 419 ? 39.718 63.551 5.288 1.00 7.59 ? 419 GLU A N 1 ATOM 3324 C CA . GLU A 1 419 ? 38.293 63.629 4.964 1.00 4.94 ? 419 GLU A CA 1 ATOM 3325 C C . GLU A 1 419 ? 37.786 62.192 4.997 1.00 4.23 ? 419 GLU A C 1 ATOM 3326 O O . GLU A 1 419 ? 38.417 61.303 4.434 1.00 4.12 ? 419 GLU A O 1 ATOM 3327 C CB . GLU A 1 419 ? 38.076 64.196 3.562 1.00 3.50 ? 419 GLU A CB 1 ATOM 3328 C CG . GLU A 1 419 ? 38.294 65.688 3.440 1.00 4.10 ? 419 GLU A CG 1 ATOM 3329 C CD . GLU A 1 419 ? 38.108 66.202 2.014 1.00 4.59 ? 419 GLU A CD 1 ATOM 3330 O OE1 . GLU A 1 419 ? 38.938 65.875 1.126 1.00 3.30 ? 419 GLU A OE1 1 ATOM 3331 O OE2 . GLU A 1 419 ? 37.122 66.937 1.787 1.00 3.81 ? 419 GLU A OE2 1 ATOM 3332 N N . GLN A 1 420 ? 36.661 61.954 5.660 1.00 4.07 ? 420 GLN A N 1 ATOM 3333 C CA . GLN A 1 420 ? 36.112 60.603 5.739 1.00 4.04 ? 420 GLN A CA 1 ATOM 3334 C C . GLN A 1 420 ? 34.640 60.619 6.124 1.00 4.11 ? 420 GLN A C 1 ATOM 3335 O O . GLN A 1 420 ? 34.164 61.547 6.789 1.00 4.14 ? 420 GLN A O 1 ATOM 3336 C CB . GLN A 1 420 ? 36.879 59.772 6.781 1.00 3.52 ? 420 GLN A CB 1 ATOM 3337 C CG . GLN A 1 420 ? 36.752 60.313 8.203 1.00 6.85 ? 420 GLN A CG 1 ATOM 3338 C CD . GLN A 1 420 ? 37.392 59.435 9.283 1.00 8.43 ? 420 GLN A CD 1 ATOM 3339 O OE1 . GLN A 1 420 ? 38.583 59.107 9.225 1.00 10.15 ? 420 GLN A OE1 1 ATOM 3340 N NE2 . GLN A 1 420 ? 36.599 59.072 10.290 1.00 8.33 ? 420 GLN A NE2 1 ATOM 3341 N N . SER A 1 421 ? 33.922 59.587 5.697 1.00 3.77 ? 421 SER A N 1 ATOM 3342 C CA . SER A 1 421 ? 32.512 59.439 6.043 1.00 3.37 ? 421 SER A CA 1 ATOM 3343 C C . SER A 1 421 ? 32.415 58.104 6.769 1.00 2.92 ? 421 SER A C 1 ATOM 3344 O O . SER A 1 421 ? 32.717 57.058 6.203 1.00 3.16 ? 421 SER A O 1 ATOM 3345 C CB . SER A 1 421 ? 31.657 59.456 4.787 1.00 3.23 ? 421 SER A CB 1 ATOM 3346 O OG . SER A 1 421 ? 31.828 60.702 4.131 1.00 3.91 ? 421 SER A OG 1 ATOM 3347 N N . ALA A 1 422 ? 32.007 58.151 8.032 1.00 2.42 ? 422 ALA A N 1 ATOM 3348 C CA . ALA A 1 422 ? 31.941 56.951 8.848 1.00 2.13 ? 422 ALA A CA 1 ATOM 3349 C C . ALA A 1 422 ? 30.561 56.441 9.210 1.00 2.49 ? 422 ALA A C 1 ATOM 3350 O O . ALA A 1 422 ? 29.769 57.156 9.823 1.00 2.12 ? 422 ALA A O 1 ATOM 3351 C CB . ALA A 1 422 ? 32.731 57.167 10.113 1.00 1.78 ? 422 ALA A CB 1 ATOM 3352 N N . ILE A 1 423 ? 30.304 55.188 8.833 1.00 1.91 ? 423 ILE A N 1 ATOM 3353 C CA . ILE A 1 423 ? 29.055 54.490 9.113 1.00 0.96 ? 423 ILE A CA 1 ATOM 3354 C C . ILE A 1 423 ? 29.447 53.420 10.122 1.00 0.96 ? 423 ILE A C 1 ATOM 3355 O O . ILE A 1 423 ? 30.253 52.551 9.820 1.00 0.96 ? 423 ILE A O 1 ATOM 3356 C CB . ILE A 1 423 ? 28.497 53.842 7.838 1.00 0.96 ? 423 ILE A CB 1 ATOM 3357 C CG1 . ILE A 1 423 ? 28.001 54.920 6.893 1.00 0.96 ? 423 ILE A CG1 1 ATOM 3358 C CG2 . ILE A 1 423 ? 27.339 52.943 8.167 1.00 0.96 ? 423 ILE A CG2 1 ATOM 3359 C CD1 . ILE A 1 423 ? 29.001 55.980 6.610 1.00 0.96 ? 423 ILE A CD1 1 ATOM 3360 N N . PHE A 1 424 ? 28.890 53.487 11.324 1.00 0.96 ? 424 PHE A N 1 ATOM 3361 C CA . PHE A 1 424 ? 29.264 52.537 12.357 1.00 0.96 ? 424 PHE A CA 1 ATOM 3362 C C . PHE A 1 424 ? 28.177 52.218 13.368 1.00 0.96 ? 424 PHE A C 1 ATOM 3363 O O . PHE A 1 424 ? 27.043 52.679 13.260 1.00 1.30 ? 424 PHE A O 1 ATOM 3364 C CB . PHE A 1 424 ? 30.471 53.080 13.099 1.00 0.96 ? 424 PHE A CB 1 ATOM 3365 C CG . PHE A 1 424 ? 30.189 54.353 13.847 1.00 1.88 ? 424 PHE A CG 1 ATOM 3366 C CD1 . PHE A 1 424 ? 29.719 54.323 15.154 1.00 1.98 ? 424 PHE A CD1 1 ATOM 3367 C CD2 . PHE A 1 424 ? 30.401 55.587 13.250 1.00 1.86 ? 424 PHE A CD2 1 ATOM 3368 C CE1 . PHE A 1 424 ? 29.472 55.500 15.854 1.00 0.96 ? 424 PHE A CE1 1 ATOM 3369 C CE2 . PHE A 1 424 ? 30.153 56.765 13.948 1.00 0.96 ? 424 PHE A CE2 1 ATOM 3370 C CZ . PHE A 1 424 ? 29.690 56.717 15.252 1.00 0.96 ? 424 PHE A CZ 1 ATOM 3371 N N . PHE A 1 425 ? 28.554 51.438 14.374 1.00 0.96 ? 425 PHE A N 1 ATOM 3372 C CA . PHE A 1 425 ? 27.628 51.033 15.421 1.00 0.96 ? 425 PHE A CA 1 ATOM 3373 C C . PHE A 1 425 ? 28.172 51.311 16.828 1.00 1.35 ? 425 PHE A C 1 ATOM 3374 O O . PHE A 1 425 ? 29.339 51.664 17.011 1.00 2.00 ? 425 PHE A O 1 ATOM 3375 C CB . PHE A 1 425 ? 27.348 49.535 15.315 1.00 0.96 ? 425 PHE A CB 1 ATOM 3376 C CG . PHE A 1 425 ? 26.682 49.120 14.045 1.00 0.96 ? 425 PHE A CG 1 ATOM 3377 C CD1 . PHE A 1 425 ? 25.320 49.321 13.861 1.00 0.96 ? 425 PHE A CD1 1 ATOM 3378 C CD2 . PHE A 1 425 ? 27.412 48.496 13.040 1.00 0.96 ? 425 PHE A CD2 1 ATOM 3379 C CE1 . PHE A 1 425 ? 24.691 48.902 12.694 1.00 0.96 ? 425 PHE A CE1 1 ATOM 3380 C CE2 . PHE A 1 425 ? 26.793 48.073 11.867 1.00 0.96 ? 425 PHE A CE2 1 ATOM 3381 C CZ . PHE A 1 425 ? 25.429 48.275 11.692 1.00 0.96 ? 425 PHE A CZ 1 ATOM 3382 N N . ARG A 1 426 ? 27.301 51.130 17.814 1.00 0.96 ? 426 ARG A N 1 ATOM 3383 C CA . ARG A 1 426 ? 27.631 51.293 19.221 1.00 0.96 ? 426 ARG A CA 1 ATOM 3384 C C . ARG A 1 426 ? 26.649 50.395 19.929 1.00 0.96 ? 426 ARG A C 1 ATOM 3385 O O . ARG A 1 426 ? 25.480 50.368 19.566 1.00 0.96 ? 426 ARG A O 1 ATOM 3386 C CB . ARG A 1 426 ? 27.409 52.731 19.692 1.00 1.41 ? 426 ARG A CB 1 ATOM 3387 C CG . ARG A 1 426 ? 28.550 53.678 19.419 1.00 1.00 ? 426 ARG A CG 1 ATOM 3388 C CD . ARG A 1 426 ? 28.936 54.444 20.679 1.00 1.91 ? 426 ARG A CD 1 ATOM 3389 N NE . ARG A 1 426 ? 30.096 55.301 20.447 1.00 1.14 ? 426 ARG A NE 1 ATOM 3390 C CZ . ARG A 1 426 ? 30.057 56.421 19.738 1.00 0.96 ? 426 ARG A CZ 1 ATOM 3391 N NH1 . ARG A 1 426 ? 28.906 56.821 19.203 1.00 1.62 ? 426 ARG A NH1 1 ATOM 3392 N NH2 . ARG A 1 426 ? 31.165 57.123 19.542 1.00 0.96 ? 426 ARG A NH2 1 ATOM 3393 N N . VAL A 1 427 ? 27.107 49.640 20.915 1.00 0.96 ? 427 VAL A N 1 ATOM 3394 C CA . VAL A 1 427 ? 26.194 48.773 21.640 1.00 1.77 ? 427 VAL A CA 1 ATOM 3395 C C . VAL A 1 427 ? 26.123 49.263 23.069 1.00 3.33 ? 427 VAL A C 1 ATOM 3396 O O . VAL A 1 427 ? 27.155 49.464 23.710 1.00 4.83 ? 427 VAL A O 1 ATOM 3397 C CB . VAL A 1 427 ? 26.660 47.316 21.657 1.00 1.21 ? 427 VAL A CB 1 ATOM 3398 C CG1 . VAL A 1 427 ? 25.623 46.480 22.349 1.00 0.96 ? 427 VAL A CG1 1 ATOM 3399 C CG2 . VAL A 1 427 ? 26.882 46.810 20.251 1.00 0.96 ? 427 VAL A CG2 1 ATOM 3400 N N . PHE A 1 428 ? 24.907 49.456 23.565 1.00 3.91 ? 428 PHE A N 1 ATOM 3401 C CA . PHE A 1 428 ? 24.706 49.934 24.926 1.00 4.88 ? 428 PHE A CA 1 ATOM 3402 C C . PHE A 1 428 ? 23.882 48.934 25.712 1.00 6.69 ? 428 PHE A C 1 ATOM 3403 O O . PHE A 1 428 ? 23.272 48.030 25.137 1.00 7.33 ? 428 PHE A O 1 ATOM 3404 C CB . PHE A 1 428 ? 23.953 51.266 24.925 1.00 4.54 ? 428 PHE A CB 1 ATOM 3405 C CG . PHE A 1 428 ? 24.714 52.406 24.326 1.00 2.89 ? 428 PHE A CG 1 ATOM 3406 C CD1 . PHE A 1 428 ? 25.672 53.080 25.063 1.00 3.74 ? 428 PHE A CD1 1 ATOM 3407 C CD2 . PHE A 1 428 ? 24.456 52.819 23.032 1.00 2.42 ? 428 PHE A CD2 1 ATOM 3408 C CE1 . PHE A 1 428 ? 26.362 54.154 24.518 1.00 4.06 ? 428 PHE A CE1 1 ATOM 3409 C CE2 . PHE A 1 428 ? 25.135 53.885 22.477 1.00 3.60 ? 428 PHE A CE2 1 ATOM 3410 C CZ . PHE A 1 428 ? 26.092 54.557 23.222 1.00 4.79 ? 428 PHE A CZ 1 ATOM 3411 N N . GLN A 1 429 ? 23.856 49.118 27.031 1.00 8.80 ? 429 GLN A N 1 ATOM 3412 C CA . GLN A 1 429 ? 23.084 48.256 27.925 1.00 9.61 ? 429 GLN A CA 1 ATOM 3413 C C . GLN A 1 429 ? 22.381 49.082 29.012 1.00 10.68 ? 429 GLN A C 1 ATOM 3414 O O . GLN A 1 429 ? 22.932 50.062 29.527 1.00 10.15 ? 429 GLN A O 1 ATOM 3415 C CB . GLN A 1 429 ? 23.989 47.194 28.570 1.00 8.84 ? 429 GLN A CB 1 ATOM 3416 C CG . GLN A 1 429 ? 24.748 47.631 29.817 1.00 7.21 ? 429 GLN A CG 1 ATOM 3417 C CD . GLN A 1 429 ? 25.566 46.495 30.427 1.00 7.49 ? 429 GLN A CD 1 ATOM 3418 O OE1 . GLN A 1 429 ? 26.681 46.218 29.988 1.00 7.65 ? 429 GLN A OE1 1 ATOM 3419 N NE2 . GLN A 1 429 ? 25.005 45.824 31.434 1.00 7.50 ? 429 GLN A NE2 1 ATOM 3420 N N . ASN A 1 430 ? 21.155 48.687 29.345 1.00 12.07 ? 430 ASN A N 1 ATOM 3421 C CA . ASN A 1 430 ? 20.385 49.384 30.368 1.00 12.79 ? 430 ASN A CA 1 ATOM 3422 C C . ASN A 1 430 ? 20.570 48.690 31.721 1.00 13.16 ? 430 ASN A C 1 ATOM 3423 O O . ASN A 1 430 ? 20.971 47.526 31.794 1.00 13.01 ? 430 ASN A O 1 ATOM 3424 C CB . ASN A 1 430 ? 18.899 49.450 29.964 1.00 13.69 ? 430 ASN A CB 1 ATOM 3425 C CG . ASN A 1 430 ? 18.113 48.211 30.358 1.00 14.23 ? 430 ASN A CG 1 ATOM 3426 O OD1 . ASN A 1 430 ? 18.651 47.104 30.419 1.00 14.80 ? 430 ASN A OD1 1 ATOM 3427 N ND2 . ASN A 1 430 ? 16.818 48.394 30.608 1.00 14.74 ? 430 ASN A ND2 1 ATOM 3428 N N . GLN A 1 431 ? 20.286 49.417 32.791 1.00 13.77 ? 431 GLN A N 1 ATOM 3429 C CA . GLN A 1 431 ? 20.459 48.889 34.126 1.00 14.54 ? 431 GLN A CA 1 ATOM 3430 C C . GLN A 1 431 ? 20.003 47.436 34.290 1.00 15.01 ? 431 GLN A C 1 ATOM 3431 O O . GLN A 1 431 ? 20.683 46.645 34.946 1.00 16.18 ? 431 GLN A O 1 ATOM 3432 C CB . GLN A 1 431 ? 19.746 49.792 35.129 1.00 15.39 ? 431 GLN A CB 1 ATOM 3433 C CG . GLN A 1 431 ? 20.319 49.687 36.532 1.00 18.99 ? 431 GLN A CG 1 ATOM 3434 C CD . GLN A 1 431 ? 21.839 49.878 36.564 1.00 21.14 ? 431 GLN A CD 1 ATOM 3435 O OE1 . GLN A 1 431 ? 22.369 50.883 36.066 1.00 21.31 ? 431 GLN A OE1 1 ATOM 3436 N NE2 . GLN A 1 431 ? 22.545 48.910 37.157 1.00 21.42 ? 431 GLN A NE2 1 ATOM 3437 N N . LEU A 1 432 ? 18.874 47.071 33.687 1.00 14.94 ? 432 LEU A N 1 ATOM 3438 C CA . LEU A 1 432 ? 18.373 45.702 33.807 1.00 14.96 ? 432 LEU A CA 1 ATOM 3439 C C . LEU A 1 432 ? 19.183 44.661 33.030 1.00 15.80 ? 432 LEU A C 1 ATOM 3440 O O . LEU A 1 432 ? 18.983 43.460 33.206 1.00 15.75 ? 432 LEU A O 1 ATOM 3441 C CB . LEU A 1 432 ? 16.905 45.614 33.374 1.00 14.41 ? 432 LEU A CB 1 ATOM 3442 C CG . LEU A 1 432 ? 15.848 46.390 34.159 1.00 13.44 ? 432 LEU A CG 1 ATOM 3443 C CD1 . LEU A 1 432 ? 16.176 46.297 35.636 1.00 13.27 ? 432 LEU A CD1 1 ATOM 3444 C CD2 . LEU A 1 432 ? 15.805 47.846 33.705 1.00 13.73 ? 432 LEU A CD2 1 ATOM 3445 N N . GLY A 1 433 ? 20.078 45.112 32.159 1.00 16.60 ? 433 GLY A N 1 ATOM 3446 C CA . GLY A 1 433 ? 20.889 44.169 31.414 1.00 18.41 ? 433 GLY A CA 1 ATOM 3447 C C . GLY A 1 433 ? 20.508 43.887 29.969 1.00 20.44 ? 433 GLY A C 1 ATOM 3448 O O . GLY A 1 433 ? 21.220 43.138 29.294 1.00 21.33 ? 433 GLY A O 1 ATOM 3449 N N . ARG A 1 434 ? 19.402 44.447 29.480 1.00 21.47 ? 434 ARG A N 1 ATOM 3450 C CA . ARG A 1 434 ? 19.017 44.213 28.082 1.00 22.54 ? 434 ARG A CA 1 ATOM 3451 C C . ARG A 1 434 ? 19.803 45.224 27.231 1.00 20.18 ? 434 ARG A C 1 ATOM 3452 O O . ARG A 1 434 ? 20.072 46.343 27.676 1.00 20.08 ? 434 ARG A O 1 ATOM 3453 C CB . ARG A 1 434 ? 17.490 44.362 27.889 1.00 27.00 ? 434 ARG A CB 1 ATOM 3454 C CG . ARG A 1 434 ? 16.598 43.326 28.680 1.00 33.29 ? 434 ARG A CG 1 ATOM 3455 C CD . ARG A 1 434 ? 16.491 41.875 28.077 1.00 36.04 ? 434 ARG A CD 1 ATOM 3456 N NE . ARG A 1 434 ? 15.748 40.952 28.962 1.00 38.33 ? 434 ARG A NE 1 ATOM 3457 C CZ . ARG A 1 434 ? 15.408 39.686 28.677 1.00 39.53 ? 434 ARG A CZ 1 ATOM 3458 N NH1 . ARG A 1 434 ? 15.725 39.128 27.510 1.00 38.69 ? 434 ARG A NH1 1 ATOM 3459 N NH2 . ARG A 1 434 ? 14.745 38.961 29.578 1.00 38.91 ? 434 ARG A NH2 1 ATOM 3460 N N . TYR A 1 435 ? 20.176 44.829 26.014 1.00 17.21 ? 435 TYR A N 1 ATOM 3461 C CA . TYR A 1 435 ? 20.992 45.681 25.142 1.00 12.45 ? 435 TYR A CA 1 ATOM 3462 C C . TYR A 1 435 ? 20.276 46.485 24.070 1.00 9.75 ? 435 TYR A C 1 ATOM 3463 O O . TYR A 1 435 ? 19.116 46.233 23.743 1.00 9.59 ? 435 TYR A O 1 ATOM 3464 C CB . TYR A 1 435 ? 22.061 44.827 24.451 1.00 11.68 ? 435 TYR A CB 1 ATOM 3465 C CG . TYR A 1 435 ? 22.921 44.002 25.386 1.00 9.48 ? 435 TYR A CG 1 ATOM 3466 C CD1 . TYR A 1 435 ? 24.092 44.519 25.930 1.00 7.85 ? 435 TYR A CD1 1 ATOM 3467 C CD2 . TYR A 1 435 ? 22.559 42.699 25.724 1.00 8.85 ? 435 TYR A CD2 1 ATOM 3468 C CE1 . TYR A 1 435 ? 24.886 43.753 26.787 1.00 8.32 ? 435 TYR A CE1 1 ATOM 3469 C CE2 . TYR A 1 435 ? 23.341 41.929 26.582 1.00 8.50 ? 435 TYR A CE2 1 ATOM 3470 C CZ . TYR A 1 435 ? 24.503 42.459 27.109 1.00 8.13 ? 435 TYR A CZ 1 ATOM 3471 O OH . TYR A 1 435 ? 25.274 41.697 27.958 1.00 7.62 ? 435 TYR A OH 1 ATOM 3472 N N . SER A 1 436 ? 21.006 47.449 23.516 1.00 7.81 ? 436 SER A N 1 ATOM 3473 C CA . SER A 1 436 ? 20.512 48.307 22.443 1.00 6.37 ? 436 SER A CA 1 ATOM 3474 C C . SER A 1 436 ? 21.654 48.628 21.481 1.00 4.77 ? 436 SER A C 1 ATOM 3475 O O . SER A 1 436 ? 22.814 48.742 21.892 1.00 3.76 ? 436 SER A O 1 ATOM 3476 C CB . SER A 1 436 ? 19.923 49.609 23.004 1.00 6.97 ? 436 SER A CB 1 ATOM 3477 O OG . SER A 1 436 ? 20.885 50.364 23.718 1.00 6.29 ? 436 SER A OG 1 ATOM 3478 N N . VAL A 1 437 ? 21.320 48.760 20.201 1.00 3.40 ? 437 VAL A N 1 ATOM 3479 C CA . VAL A 1 437 ? 22.310 49.057 19.174 1.00 2.23 ? 437 VAL A CA 1 ATOM 3480 C C . VAL A 1 437 ? 21.968 50.367 18.491 1.00 2.71 ? 437 VAL A C 1 ATOM 3481 O O . VAL A 1 437 ? 20.809 50.624 18.165 1.00 3.81 ? 437 VAL A O 1 ATOM 3482 C CB . VAL A 1 437 ? 22.347 47.953 18.106 1.00 0.96 ? 437 VAL A CB 1 ATOM 3483 C CG1 . VAL A 1 437 ? 23.348 48.287 17.041 1.00 0.96 ? 437 VAL A CG1 1 ATOM 3484 C CG2 . VAL A 1 437 ? 22.688 46.645 18.743 1.00 1.03 ? 437 VAL A CG2 1 ATOM 3485 N N . LEU A 1 438 ? 22.978 51.198 18.283 1.00 2.50 ? 438 LEU A N 1 ATOM 3486 C CA . LEU A 1 438 ? 22.783 52.476 17.623 1.00 3.17 ? 438 LEU A CA 1 ATOM 3487 C C . LEU A 1 438 ? 23.582 52.464 16.327 1.00 3.63 ? 438 LEU A C 1 ATOM 3488 O O . LEU A 1 438 ? 24.721 51.994 16.312 1.00 4.22 ? 438 LEU A O 1 ATOM 3489 C CB . LEU A 1 438 ? 23.266 53.611 18.525 1.00 3.58 ? 438 LEU A CB 1 ATOM 3490 C CG . LEU A 1 438 ? 23.430 54.959 17.819 1.00 5.07 ? 438 LEU A CG 1 ATOM 3491 C CD1 . LEU A 1 438 ? 22.075 55.478 17.390 1.00 5.35 ? 438 LEU A CD1 1 ATOM 3492 C CD2 . LEU A 1 438 ? 24.123 55.950 18.741 1.00 5.94 ? 438 LEU A CD2 1 ATOM 3493 N N . MET A 1 439 ? 22.986 52.963 15.242 1.00 3.60 ? 439 MET A N 1 ATOM 3494 C CA . MET A 1 439 ? 23.657 53.017 13.936 1.00 2.63 ? 439 MET A CA 1 ATOM 3495 C C . MET A 1 439 ? 23.945 54.481 13.621 1.00 2.70 ? 439 MET A C 1 ATOM 3496 O O . MET A 1 439 ? 23.080 55.330 13.795 1.00 3.04 ? 439 MET A O 1 ATOM 3497 C CB . MET A 1 439 ? 22.761 52.418 12.850 1.00 0.96 ? 439 MET A CB 1 ATOM 3498 C CG . MET A 1 439 ? 23.463 52.172 11.536 1.00 0.96 ? 439 MET A CG 1 ATOM 3499 S SD . MET A 1 439 ? 22.368 51.494 10.283 1.00 0.96 ? 439 MET A SD 1 ATOM 3500 C CE . MET A 1 439 ? 22.986 52.241 8.825 1.00 0.96 ? 439 MET A CE 1 ATOM 3501 N N . CYS A 1 440 ? 25.151 54.780 13.154 1.00 2.80 ? 440 CYS A N 1 ATOM 3502 C CA . CYS A 1 440 ? 25.507 56.160 12.863 1.00 4.04 ? 440 CYS A CA 1 ATOM 3503 C C . CYS A 1 440 ? 26.077 56.436 11.490 1.00 2.95 ? 440 CYS A C 1 ATOM 3504 O O . CYS A 1 440 ? 26.644 55.564 10.855 1.00 4.84 ? 440 CYS A O 1 ATOM 3505 C CB . CYS A 1 440 ? 26.522 56.651 13.885 1.00 7.58 ? 440 CYS A CB 1 ATOM 3506 S SG . CYS A 1 440 ? 25.856 56.880 15.559 1.00 14.03 ? 440 CYS A SG 1 ATOM 3507 N N . SER A 1 441 ? 25.922 57.672 11.044 1.00 2.57 ? 441 SER A N 1 ATOM 3508 C CA . SER A 1 441 ? 26.476 58.128 9.780 1.00 2.73 ? 441 SER A CA 1 ATOM 3509 C C . SER A 1 441 ? 27.171 59.433 10.148 1.00 4.04 ? 441 SER A C 1 ATOM 3510 O O . SER A 1 441 ? 26.579 60.507 10.043 1.00 3.96 ? 441 SER A O 1 ATOM 3511 C CB . SER A 1 441 ? 25.379 58.390 8.767 1.00 1.49 ? 441 SER A CB 1 ATOM 3512 O OG . SER A 1 441 ? 24.951 57.182 8.180 1.00 1.72 ? 441 SER A OG 1 ATOM 3513 N N . ASP A 1 442 ? 28.421 59.330 10.598 1.00 5.45 ? 442 ASP A N 1 ATOM 3514 C CA . ASP A 1 442 ? 29.191 60.492 11.033 1.00 7.28 ? 442 ASP A CA 1 ATOM 3515 C C . ASP A 1 442 ? 29.804 61.313 9.916 1.00 7.99 ? 442 ASP A C 1 ATOM 3516 O O . ASP A 1 442 ? 30.963 61.123 9.529 1.00 8.68 ? 442 ASP A O 1 ATOM 3517 C CB . ASP A 1 442 ? 30.282 60.059 12.007 1.00 10.29 ? 442 ASP A CB 1 ATOM 3518 C CG . ASP A 1 442 ? 31.179 61.205 12.407 1.00 12.42 ? 442 ASP A CG 1 ATOM 3519 O OD1 . ASP A 1 442 ? 30.642 62.323 12.560 1.00 14.15 ? 442 ASP A OD1 1 ATOM 3520 O OD2 . ASP A 1 442 ? 32.404 60.989 12.570 1.00 13.11 ? 442 ASP A OD2 1 ATOM 3521 N N . LEU A 1 443 ? 29.020 62.263 9.430 1.00 8.44 ? 443 LEU A N 1 ATOM 3522 C CA . LEU A 1 443 ? 29.437 63.123 8.337 1.00 8.26 ? 443 LEU A CA 1 ATOM 3523 C C . LEU A 1 443 ? 30.223 64.351 8.782 1.00 8.62 ? 443 LEU A C 1 ATOM 3524 O O . LEU A 1 443 ? 30.632 65.157 7.942 1.00 8.70 ? 443 LEU A O 1 ATOM 3525 C CB . LEU A 1 443 ? 28.204 63.558 7.550 1.00 6.56 ? 443 LEU A CB 1 ATOM 3526 C CG . LEU A 1 443 ? 27.544 62.501 6.659 1.00 7.03 ? 443 LEU A CG 1 ATOM 3527 C CD1 . LEU A 1 443 ? 27.685 61.114 7.239 1.00 7.38 ? 443 LEU A CD1 1 ATOM 3528 C CD2 . LEU A 1 443 ? 26.084 62.855 6.485 1.00 8.49 ? 443 LEU A CD2 1 ATOM 3529 N N . SER A 1 444 ? 30.454 64.488 10.086 1.00 7.69 ? 444 SER A N 1 ATOM 3530 C CA . SER A 1 444 ? 31.171 65.653 10.592 1.00 7.34 ? 444 SER A CA 1 ATOM 3531 C C . SER A 1 444 ? 32.520 65.910 9.912 1.00 6.29 ? 444 SER A C 1 ATOM 3532 O O . SER A 1 444 ? 32.950 67.053 9.799 1.00 5.99 ? 444 SER A O 1 ATOM 3533 C CB . SER A 1 444 ? 31.369 65.542 12.104 1.00 7.78 ? 444 SER A CB 1 ATOM 3534 O OG . SER A 1 444 ? 32.409 64.642 12.426 1.00 9.87 ? 444 SER A OG 1 ATOM 3535 N N . ARG A 1 445 ? 33.187 64.858 9.456 1.00 6.19 ? 445 ARG A N 1 ATOM 3536 C CA . ARG A 1 445 ? 34.479 65.028 8.795 1.00 6.38 ? 445 ARG A CA 1 ATOM 3537 C C . ARG A 1 445 ? 34.433 64.573 7.342 1.00 6.21 ? 445 ARG A C 1 ATOM 3538 O O . ARG A 1 445 ? 35.466 64.295 6.732 1.00 4.64 ? 445 ARG A O 1 ATOM 3539 C CB . ARG A 1 445 ? 35.557 64.228 9.523 1.00 7.07 ? 445 ARG A CB 1 ATOM 3540 C CG . ARG A 1 445 ? 36.080 64.849 10.797 1.00 7.94 ? 445 ARG A CG 1 ATOM 3541 C CD . ARG A 1 445 ? 37.325 64.099 11.258 1.00 11.00 ? 445 ARG A CD 1 ATOM 3542 N NE . ARG A 1 445 ? 37.007 62.874 11.992 1.00 14.81 ? 445 ARG A NE 1 ATOM 3543 C CZ . ARG A 1 445 ? 37.831 61.835 12.106 1.00 16.95 ? 445 ARG A CZ 1 ATOM 3544 N NH1 . ARG A 1 445 ? 39.027 61.870 11.521 1.00 17.38 ? 445 ARG A NH1 1 ATOM 3545 N NH2 . ARG A 1 445 ? 37.465 60.769 12.816 1.00 17.21 ? 445 ARG A NH2 1 ATOM 3546 N N . SER A 1 446 ? 33.232 64.509 6.789 1.00 6.89 ? 446 SER A N 1 ATOM 3547 C CA . SER A 1 446 ? 33.055 64.048 5.425 1.00 7.51 ? 446 SER A CA 1 ATOM 3548 C C . SER A 1 446 ? 33.733 64.931 4.401 1.00 8.04 ? 446 SER A C 1 ATOM 3549 O O . SER A 1 446 ? 34.246 64.438 3.401 1.00 8.95 ? 446 SER A O 1 ATOM 3550 C CB . SER A 1 446 ? 31.570 63.956 5.089 1.00 7.66 ? 446 SER A CB 1 ATOM 3551 O OG . SER A 1 446 ? 31.023 65.248 4.915 1.00 7.69 ? 446 SER A OG 1 ATOM 3552 N N . THR A 1 447 ? 33.729 66.236 4.643 1.00 8.61 ? 447 THR A N 1 ATOM 3553 C CA . THR A 1 447 ? 34.330 67.179 3.702 1.00 9.13 ? 447 THR A CA 1 ATOM 3554 C C . THR A 1 447 ? 34.935 68.379 4.404 1.00 9.74 ? 447 THR A C 1 ATOM 3555 O O . THR A 1 447 ? 34.414 68.843 5.418 1.00 11.02 ? 447 THR A O 1 ATOM 3556 C CB . THR A 1 447 ? 33.286 67.723 2.710 1.00 9.05 ? 447 THR A CB 1 ATOM 3557 O OG1 . THR A 1 447 ? 33.943 68.495 1.700 1.00 9.79 ? 447 THR A OG1 1 ATOM 3558 C CG2 . THR A 1 447 ? 32.292 68.624 3.429 1.00 7.30 ? 447 THR A CG2 1 ATOM 3559 N N . VAL A 1 448 ? 36.026 68.892 3.855 1.00 9.30 ? 448 VAL A N 1 ATOM 3560 C CA . VAL A 1 448 ? 36.671 70.057 4.436 1.00 8.42 ? 448 VAL A CA 1 ATOM 3561 C C . VAL A 1 448 ? 36.093 71.342 3.830 1.00 9.07 ? 448 VAL A C 1 ATOM 3562 O O . VAL A 1 448 ? 36.319 72.439 4.340 1.00 8.03 ? 448 VAL A O 1 ATOM 3563 C CB . VAL A 1 448 ? 38.188 69.984 4.222 1.00 7.41 ? 448 VAL A CB 1 ATOM 3564 C CG1 . VAL A 1 448 ? 38.742 68.815 5.000 1.00 6.27 ? 448 VAL A CG1 1 ATOM 3565 C CG2 . VAL A 1 448 ? 38.500 69.817 2.744 1.00 6.65 ? 448 VAL A CG2 1 ATOM 3566 N N . ARG A 1 449 ? 35.326 71.196 2.754 1.00 10.54 ? 449 ARG A N 1 ATOM 3567 C CA . ARG A 1 449 ? 34.713 72.349 2.105 1.00 13.03 ? 449 ARG A CA 1 ATOM 3568 C C . ARG A 1 449 ? 33.800 73.133 3.053 1.00 14.75 ? 449 ARG A C 1 ATOM 3569 O O . ARG A 1 449 ? 33.214 72.575 3.989 1.00 14.69 ? 449 ARG A O 1 ATOM 3570 C CB . ARG A 1 449 ? 33.900 71.920 0.880 1.00 12.20 ? 449 ARG A CB 1 ATOM 3571 C CG . ARG A 1 449 ? 34.688 71.176 -0.168 1.00 12.36 ? 449 ARG A CG 1 ATOM 3572 C CD . ARG A 1 449 ? 34.176 71.499 -1.557 1.00 13.46 ? 449 ARG A CD 1 ATOM 3573 N NE . ARG A 1 449 ? 32.721 71.527 -1.636 1.00 14.90 ? 449 ARG A NE 1 ATOM 3574 C CZ . ARG A 1 449 ? 32.045 71.503 -2.779 1.00 17.11 ? 449 ARG A CZ 1 ATOM 3575 N NH1 . ARG A 1 449 ? 32.707 71.446 -3.933 1.00 19.07 ? 449 ARG A NH1 1 ATOM 3576 N NH2 . ARG A 1 449 ? 30.715 71.541 -2.776 1.00 16.67 ? 449 ARG A NH2 1 ATOM 3577 N N . SER A 1 450 ? 33.680 74.433 2.799 1.00 16.32 ? 450 SER A N 1 ATOM 3578 C CA . SER A 1 450 ? 32.838 75.290 3.618 1.00 17.97 ? 450 SER A CA 1 ATOM 3579 C C . SER A 1 450 ? 31.463 75.425 2.995 1.00 18.13 ? 450 SER A C 1 ATOM 3580 O O . SER A 1 450 ? 31.321 75.344 1.770 1.00 19.06 ? 450 SER A O 1 ATOM 3581 C CB . SER A 1 450 ? 33.466 76.676 3.760 1.00 19.64 ? 450 SER A CB 1 ATOM 3582 O OG . SER A 1 450 ? 34.598 76.643 4.613 1.00 23.16 ? 450 SER A OG 1 ATOM 3583 N N . ASN A 1 451 ? 30.457 75.630 3.846 1.00 17.36 ? 451 ASN A N 1 ATOM 3584 C CA . ASN A 1 451 ? 29.068 75.797 3.411 1.00 15.81 ? 451 ASN A CA 1 ATOM 3585 C C . ASN A 1 451 ? 28.345 74.510 3.070 1.00 12.97 ? 451 ASN A C 1 ATOM 3586 O O . ASN A 1 451 ? 27.365 74.543 2.329 1.00 12.03 ? 451 ASN A O 1 ATOM 3587 C CB . ASN A 1 451 ? 28.968 76.726 2.196 1.00 18.79 ? 451 ASN A CB 1 ATOM 3588 C CG . ASN A 1 451 ? 29.270 78.170 2.535 1.00 21.63 ? 451 ASN A CG 1 ATOM 3589 O OD1 . ASN A 1 451 ? 28.706 78.726 3.486 1.00 23.04 ? 451 ASN A OD1 1 ATOM 3590 N ND2 . ASN A 1 451 ? 30.157 78.797 1.750 1.00 21.97 ? 451 ASN A ND2 1 ATOM 3591 N N . ILE A 1 452 ? 28.822 73.384 3.597 1.00 10.33 ? 452 ILE A N 1 ATOM 3592 C CA . ILE A 1 452 ? 28.180 72.098 3.343 1.00 7.82 ? 452 ILE A CA 1 ATOM 3593 C C . ILE A 1 452 ? 27.490 71.624 4.616 1.00 7.47 ? 452 ILE A C 1 ATOM 3594 O O . ILE A 1 452 ? 28.052 71.751 5.713 1.00 7.13 ? 452 ILE A O 1 ATOM 3595 C CB . ILE A 1 452 ? 29.193 71.034 2.920 1.00 6.72 ? 452 ILE A CB 1 ATOM 3596 C CG1 . ILE A 1 452 ? 30.065 71.564 1.788 1.00 5.94 ? 452 ILE A CG1 1 ATOM 3597 C CG2 . ILE A 1 452 ? 28.467 69.785 2.475 1.00 6.96 ? 452 ILE A CG2 1 ATOM 3598 C CD1 . ILE A 1 452 ? 29.297 71.986 0.583 1.00 5.71 ? 452 ILE A CD1 1 ATOM 3599 N N . ASP A 1 453 ? 26.270 71.098 4.476 1.00 7.03 ? 453 ASP A N 1 ATOM 3600 C CA . ASP A 1 453 ? 25.519 70.612 5.629 1.00 7.44 ? 453 ASP A CA 1 ATOM 3601 C C . ASP A 1 453 ? 26.074 69.253 5.937 1.00 8.58 ? 453 ASP A C 1 ATOM 3602 O O . ASP A 1 453 ? 25.818 68.286 5.216 1.00 10.25 ? 453 ASP A O 1 ATOM 3603 C CB . ASP A 1 453 ? 24.029 70.472 5.334 1.00 7.01 ? 453 ASP A CB 1 ATOM 3604 C CG . ASP A 1 453 ? 23.248 69.989 6.546 1.00 8.07 ? 453 ASP A CG 1 ATOM 3605 O OD1 . ASP A 1 453 ? 23.886 69.371 7.427 1.00 10.43 ? 453 ASP A OD1 1 ATOM 3606 O OD2 . ASP A 1 453 ? 22.012 70.209 6.625 1.00 6.84 ? 453 ASP A OD2 1 ATOM 3607 N N . THR A 1 454 ? 26.833 69.183 7.019 1.00 9.16 ? 454 THR A N 1 ATOM 3608 C CA . THR A 1 454 ? 27.463 67.946 7.413 1.00 9.48 ? 454 THR A CA 1 ATOM 3609 C C . THR A 1 454 ? 26.853 67.379 8.675 1.00 8.99 ? 454 THR A C 1 ATOM 3610 O O . THR A 1 454 ? 27.527 66.708 9.464 1.00 10.74 ? 454 THR A O 1 ATOM 3611 C CB . THR A 1 454 ? 28.976 68.160 7.593 1.00 9.99 ? 454 THR A CB 1 ATOM 3612 O OG1 . THR A 1 454 ? 29.220 69.201 8.553 1.00 11.65 ? 454 THR A OG1 1 ATOM 3613 C CG2 . THR A 1 454 ? 29.590 68.563 6.260 1.00 10.47 ? 454 THR A CG2 1 ATOM 3614 N N . THR A 1 455 ? 25.572 67.655 8.873 1.00 7.67 ? 455 THR A N 1 ATOM 3615 C CA . THR A 1 455 ? 24.887 67.132 10.040 1.00 6.97 ? 455 THR A CA 1 ATOM 3616 C C . THR A 1 455 ? 24.974 65.625 9.930 1.00 6.55 ? 455 THR A C 1 ATOM 3617 O O . THR A 1 455 ? 25.037 65.093 8.817 1.00 7.84 ? 455 THR A O 1 ATOM 3618 C CB . THR A 1 455 ? 23.416 67.526 10.042 1.00 6.50 ? 455 THR A CB 1 ATOM 3619 O OG1 . THR A 1 455 ? 23.308 68.945 10.179 1.00 6.88 ? 455 THR A OG1 1 ATOM 3620 C CG2 . THR A 1 455 ? 22.689 66.848 11.183 1.00 7.13 ? 455 THR A CG2 1 ATOM 3621 N N . SER A 1 456 ? 24.996 64.935 11.065 1.00 5.54 ? 456 SER A N 1 ATOM 3622 C CA . SER A 1 456 ? 25.062 63.477 11.047 1.00 4.83 ? 456 SER A CA 1 ATOM 3623 C C . SER A 1 456 ? 23.680 62.880 11.267 1.00 3.43 ? 456 SER A C 1 ATOM 3624 O O . SER A 1 456 ? 22.773 63.550 11.763 1.00 3.70 ? 456 SER A O 1 ATOM 3625 C CB . SER A 1 456 ? 26.040 62.972 12.105 1.00 5.17 ? 456 SER A CB 1 ATOM 3626 O OG . SER A 1 456 ? 27.367 63.327 11.750 1.00 8.62 ? 456 SER A OG 1 ATOM 3627 N N . TYR A 1 457 ? 23.514 61.623 10.876 1.00 1.99 ? 457 TYR A N 1 ATOM 3628 C CA . TYR A 1 457 ? 22.231 60.961 11.029 1.00 1.36 ? 457 TYR A CA 1 ATOM 3629 C C . TYR A 1 457 ? 22.406 59.676 11.827 1.00 1.14 ? 457 TYR A C 1 ATOM 3630 O O . TYR A 1 457 ? 23.465 59.045 11.780 1.00 1.37 ? 457 TYR A O 1 ATOM 3631 C CB . TYR A 1 457 ? 21.627 60.692 9.642 1.00 0.96 ? 457 TYR A CB 1 ATOM 3632 C CG . TYR A 1 457 ? 21.581 61.940 8.792 1.00 1.30 ? 457 TYR A CG 1 ATOM 3633 C CD1 . TYR A 1 457 ? 20.960 63.095 9.260 1.00 3.26 ? 457 TYR A CD1 1 ATOM 3634 C CD2 . TYR A 1 457 ? 22.232 62.002 7.567 1.00 2.37 ? 457 TYR A CD2 1 ATOM 3635 C CE1 . TYR A 1 457 ? 20.997 64.293 8.538 1.00 4.28 ? 457 TYR A CE1 1 ATOM 3636 C CE2 . TYR A 1 457 ? 22.278 63.201 6.828 1.00 4.31 ? 457 TYR A CE2 1 ATOM 3637 C CZ . TYR A 1 457 ? 21.660 64.345 7.325 1.00 4.83 ? 457 TYR A CZ 1 ATOM 3638 O OH . TYR A 1 457 ? 21.740 65.547 6.647 1.00 4.87 ? 457 TYR A OH 1 ATOM 3639 N N . GLY A 1 458 ? 21.377 59.302 12.581 1.00 0.96 ? 458 GLY A N 1 ATOM 3640 C CA . GLY A 1 458 ? 21.462 58.090 13.373 1.00 0.96 ? 458 GLY A CA 1 ATOM 3641 C C . GLY A 1 458 ? 20.110 57.503 13.715 1.00 0.96 ? 458 GLY A C 1 ATOM 3642 O O . GLY A 1 458 ? 19.093 58.191 13.655 1.00 1.13 ? 458 GLY A O 1 ATOM 3643 N N . ALA A 1 459 ? 20.100 56.226 14.074 1.00 0.96 ? 459 ALA A N 1 ATOM 3644 C CA . ALA A 1 459 ? 18.870 55.551 14.434 1.00 0.96 ? 459 ALA A CA 1 ATOM 3645 C C . ALA A 1 459 ? 19.192 54.293 15.192 1.00 0.96 ? 459 ALA A C 1 ATOM 3646 O O . ALA A 1 459 ? 20.266 53.727 15.030 1.00 0.96 ? 459 ALA A O 1 ATOM 3647 C CB . ALA A 1 459 ? 18.092 55.213 13.205 1.00 1.05 ? 459 ALA A CB 1 ATOM 3648 N N . PHE A 1 460 ? 18.261 53.854 16.028 1.00 1.81 ? 460 PHE A N 1 ATOM 3649 C CA . PHE A 1 460 ? 18.486 52.644 16.799 1.00 3.30 ? 460 PHE A CA 1 ATOM 3650 C C . PHE A 1 460 ? 18.039 51.436 16.000 1.00 3.98 ? 460 PHE A C 1 ATOM 3651 O O . PHE A 1 460 ? 16.967 51.442 15.379 1.00 5.41 ? 460 PHE A O 1 ATOM 3652 C CB . PHE A 1 460 ? 17.735 52.691 18.129 1.00 4.05 ? 460 PHE A CB 1 ATOM 3653 C CG . PHE A 1 460 ? 18.334 53.638 19.142 1.00 5.40 ? 460 PHE A CG 1 ATOM 3654 C CD1 . PHE A 1 460 ? 17.823 54.921 19.307 1.00 5.23 ? 460 PHE A CD1 1 ATOM 3655 C CD2 . PHE A 1 460 ? 19.396 53.235 19.951 1.00 5.55 ? 460 PHE A CD2 1 ATOM 3656 C CE1 . PHE A 1 460 ? 18.356 55.785 20.267 1.00 4.45 ? 460 PHE A CE1 1 ATOM 3657 C CE2 . PHE A 1 460 ? 19.931 54.092 20.910 1.00 4.81 ? 460 PHE A CE2 1 ATOM 3658 C CZ . PHE A 1 460 ? 19.408 55.368 21.068 1.00 4.07 ? 460 PHE A CZ 1 ATOM 3659 N N . VAL A 1 461 ? 18.868 50.398 16.018 1.00 3.44 ? 461 VAL A N 1 ATOM 3660 C CA . VAL A 1 461 ? 18.580 49.178 15.286 1.00 2.51 ? 461 VAL A CA 1 ATOM 3661 C C . VAL A 1 461 ? 17.901 48.173 16.198 1.00 3.11 ? 461 VAL A C 1 ATOM 3662 O O . VAL A 1 461 ? 18.371 47.919 17.303 1.00 3.76 ? 461 VAL A O 1 ATOM 3663 C CB . VAL A 1 461 ? 19.863 48.586 14.744 1.00 0.96 ? 461 VAL A CB 1 ATOM 3664 C CG1 . VAL A 1 461 ? 19.546 47.424 13.842 1.00 1.13 ? 461 VAL A CG1 1 ATOM 3665 C CG2 . VAL A 1 461 ? 20.641 49.658 14.008 1.00 0.96 ? 461 VAL A CG2 1 ATOM 3666 N N . ASP A 1 462 ? 16.799 47.600 15.724 1.00 4.18 ? 462 ASP A N 1 ATOM 3667 C CA . ASP A 1 462 ? 16.014 46.649 16.502 1.00 5.58 ? 462 ASP A CA 1 ATOM 3668 C C . ASP A 1 462 ? 16.391 45.177 16.322 1.00 5.21 ? 462 ASP A C 1 ATOM 3669 O O . ASP A 1 462 ? 15.709 44.435 15.621 1.00 5.59 ? 462 ASP A O 1 ATOM 3670 C CB . ASP A 1 462 ? 14.527 46.877 16.182 1.00 9.75 ? 462 ASP A CB 1 ATOM 3671 C CG . ASP A 1 462 ? 13.596 45.913 16.913 1.00 13.94 ? 462 ASP A CG 1 ATOM 3672 O OD1 . ASP A 1 462 ? 13.741 45.744 18.151 1.00 14.49 ? 462 ASP A OD1 1 ATOM 3673 O OD2 . ASP A 1 462 ? 12.701 45.339 16.236 1.00 16.39 ? 462 ASP A OD2 1 ATOM 3674 N N . ILE A 1 463 ? 17.483 44.767 16.964 1.00 5.90 ? 463 ILE A N 1 ATOM 3675 C CA . ILE A 1 463 ? 17.968 43.381 16.927 1.00 6.30 ? 463 ILE A CA 1 ATOM 3676 C C . ILE A 1 463 ? 18.524 43.016 18.301 1.00 8.42 ? 463 ILE A C 1 ATOM 3677 O O . ILE A 1 463 ? 18.590 43.871 19.186 1.00 10.20 ? 463 ILE A O 1 ATOM 3678 C CB . ILE A 1 463 ? 19.082 43.196 15.896 1.00 3.01 ? 463 ILE A CB 1 ATOM 3679 C CG1 . ILE A 1 463 ? 20.231 44.151 16.186 1.00 2.04 ? 463 ILE A CG1 1 ATOM 3680 C CG2 . ILE A 1 463 ? 18.540 43.432 14.516 1.00 3.98 ? 463 ILE A CG2 1 ATOM 3681 C CD1 . ILE A 1 463 ? 21.373 44.038 15.198 1.00 0.99 ? 463 ILE A CD1 1 ATOM 3682 N N . ASP A 1 464 ? 18.917 41.756 18.493 1.00 10.17 ? 464 ASP A N 1 ATOM 3683 C CA . ASP A 1 464 ? 19.468 41.330 19.787 1.00 10.47 ? 464 ASP A CA 1 ATOM 3684 C C . ASP A 1 464 ? 20.938 40.938 19.667 1.00 8.08 ? 464 ASP A C 1 ATOM 3685 O O . ASP A 1 464 ? 21.272 39.810 19.315 1.00 8.09 ? 464 ASP A O 1 ATOM 3686 C CB . ASP A 1 464 ? 18.668 40.160 20.352 1.00 14.48 ? 464 ASP A CB 1 ATOM 3687 C CG . ASP A 1 464 ? 18.947 39.935 21.817 1.00 18.48 ? 464 ASP A CG 1 ATOM 3688 O OD1 . ASP A 1 464 ? 18.982 40.951 22.548 1.00 22.12 ? 464 ASP A OD1 1 ATOM 3689 O OD2 . ASP A 1 464 ? 19.120 38.766 22.238 1.00 19.82 ? 464 ASP A OD2 1 ATOM 3690 N N . PRO A 1 465 ? 21.835 41.869 19.989 1.00 6.05 ? 465 PRO A N 1 ATOM 3691 C CA . PRO A 1 465 ? 23.277 41.670 19.922 1.00 6.09 ? 465 PRO A CA 1 ATOM 3692 C C . PRO A 1 465 ? 23.733 40.334 20.460 1.00 6.78 ? 465 PRO A C 1 ATOM 3693 O O . PRO A 1 465 ? 24.767 39.827 20.040 1.00 9.04 ? 465 PRO A O 1 ATOM 3694 C CB . PRO A 1 465 ? 23.816 42.817 20.750 1.00 5.25 ? 465 PRO A CB 1 ATOM 3695 C CG . PRO A 1 465 ? 22.785 43.858 20.578 1.00 4.55 ? 465 PRO A CG 1 ATOM 3696 C CD . PRO A 1 465 ? 21.527 43.091 20.739 1.00 5.14 ? 465 PRO A CD 1 ATOM 3697 N N . ARG A 1 466 ? 22.980 39.766 21.394 1.00 6.61 ? 466 ARG A N 1 ATOM 3698 C CA . ARG A 1 466 ? 23.359 38.479 21.967 1.00 7.48 ? 466 ARG A CA 1 ATOM 3699 C C . ARG A 1 466 ? 23.282 37.362 20.939 1.00 8.83 ? 466 ARG A C 1 ATOM 3700 O O . ARG A 1 466 ? 24.241 36.614 20.730 1.00 9.49 ? 466 ARG A O 1 ATOM 3701 C CB . ARG A 1 466 ? 22.452 38.124 23.141 1.00 6.34 ? 466 ARG A CB 1 ATOM 3702 C CG . ARG A 1 466 ? 22.654 38.978 24.365 1.00 7.75 ? 466 ARG A CG 1 ATOM 3703 C CD . ARG A 1 466 ? 21.710 38.570 25.478 1.00 7.98 ? 466 ARG A CD 1 ATOM 3704 N NE . ARG A 1 466 ? 20.321 38.650 25.046 1.00 9.08 ? 466 ARG A NE 1 ATOM 3705 C CZ . ARG A 1 466 ? 19.295 38.276 25.798 1.00 10.95 ? 466 ARG A CZ 1 ATOM 3706 N NH1 . ARG A 1 466 ? 19.516 37.800 27.018 1.00 11.82 ? 466 ARG A NH1 1 ATOM 3707 N NH2 . ARG A 1 466 ? 18.056 38.365 25.329 1.00 11.78 ? 466 ARG A NH2 1 ATOM 3708 N N . SER A 1 467 ? 22.132 37.258 20.292 1.00 10.23 ? 467 SER A N 1 ATOM 3709 C CA . SER A 1 467 ? 21.907 36.214 19.314 1.00 12.27 ? 467 SER A CA 1 ATOM 3710 C C . SER A 1 467 ? 22.395 36.494 17.896 1.00 12.97 ? 467 SER A C 1 ATOM 3711 O O . SER A 1 467 ? 23.023 35.626 17.286 1.00 14.18 ? 467 SER A O 1 ATOM 3712 C CB . SER A 1 467 ? 20.421 35.863 19.284 1.00 14.18 ? 467 SER A CB 1 ATOM 3713 O OG . SER A 1 467 ? 20.113 35.059 18.156 1.00 20.04 ? 467 SER A OG 1 ATOM 3714 N N . GLU A 1 468 ? 22.114 37.681 17.357 1.00 13.27 ? 468 GLU A N 1 ATOM 3715 C CA . GLU A 1 468 ? 22.541 37.983 15.989 1.00 12.93 ? 468 GLU A CA 1 ATOM 3716 C C . GLU A 1 468 ? 23.672 38.991 15.811 1.00 10.24 ? 468 GLU A C 1 ATOM 3717 O O . GLU A 1 468 ? 23.854 39.894 16.621 1.00 9.95 ? 468 GLU A O 1 ATOM 3718 C CB . GLU A 1 468 ? 21.334 38.398 15.118 1.00 16.28 ? 468 GLU A CB 1 ATOM 3719 C CG . GLU A 1 468 ? 20.212 39.179 15.807 1.00 19.96 ? 468 GLU A CG 1 ATOM 3720 C CD . GLU A 1 468 ? 19.153 39.684 14.812 1.00 23.42 ? 468 GLU A CD 1 ATOM 3721 O OE1 . GLU A 1 468 ? 18.054 40.093 15.269 1.00 25.30 ? 468 GLU A OE1 1 ATOM 3722 O OE2 . GLU A 1 468 ? 19.426 39.679 13.581 1.00 22.97 ? 468 GLU A OE2 1 ATOM 3723 N N . GLU A 1 469 ? 24.437 38.810 14.737 1.00 8.46 ? 469 GLU A N 1 ATOM 3724 C CA . GLU A 1 469 ? 25.555 39.690 14.419 1.00 7.48 ? 469 GLU A CA 1 ATOM 3725 C C . GLU A 1 469 ? 25.057 40.970 13.774 1.00 5.71 ? 469 GLU A C 1 ATOM 3726 O O . GLU A 1 469 ? 24.046 40.971 13.067 1.00 6.54 ? 469 GLU A O 1 ATOM 3727 C CB . GLU A 1 469 ? 26.533 38.994 13.465 1.00 9.36 ? 469 GLU A CB 1 ATOM 3728 C CG . GLU A 1 469 ? 27.329 37.846 14.083 1.00 11.38 ? 469 GLU A CG 1 ATOM 3729 C CD . GLU A 1 469 ? 28.272 37.167 13.092 1.00 12.23 ? 469 GLU A CD 1 ATOM 3730 O OE1 . GLU A 1 469 ? 29.078 36.307 13.525 1.00 12.74 ? 469 GLU A OE1 1 ATOM 3731 O OE2 . GLU A 1 469 ? 28.204 37.486 11.882 1.00 12.30 ? 469 GLU A OE2 1 ATOM 3732 N N . ILE A 1 470 ? 25.774 42.059 14.009 1.00 3.24 ? 470 ILE A N 1 ATOM 3733 C CA . ILE A 1 470 ? 25.387 43.339 13.450 1.00 2.21 ? 470 ILE A CA 1 ATOM 3734 C C . ILE A 1 470 ? 25.895 43.436 12.026 1.00 2.46 ? 470 ILE A C 1 ATOM 3735 O O . ILE A 1 470 ? 27.096 43.491 11.803 1.00 2.39 ? 470 ILE A O 1 ATOM 3736 C CB . ILE A 1 470 ? 25.977 44.463 14.264 1.00 0.96 ? 470 ILE A CB 1 ATOM 3737 C CG1 . ILE A 1 470 ? 25.691 44.217 15.739 1.00 0.96 ? 470 ILE A CG1 1 ATOM 3738 C CG2 . ILE A 1 470 ? 25.375 45.766 13.839 1.00 0.96 ? 470 ILE A CG2 1 ATOM 3739 C CD1 . ILE A 1 470 ? 26.427 45.142 16.661 1.00 1.04 ? 470 ILE A CD1 1 ATOM 3740 N N . SER A 1 471 ? 24.974 43.457 11.067 1.00 3.56 ? 471 SER A N 1 ATOM 3741 C CA . SER A 1 471 ? 25.322 43.524 9.645 1.00 5.49 ? 471 SER A CA 1 ATOM 3742 C C . SER A 1 471 ? 25.102 44.910 9.035 1.00 5.36 ? 471 SER A C 1 ATOM 3743 O O . SER A 1 471 ? 24.187 45.637 9.430 1.00 6.40 ? 471 SER A O 1 ATOM 3744 C CB . SER A 1 471 ? 24.501 42.491 8.884 1.00 8.33 ? 471 SER A CB 1 ATOM 3745 O OG . SER A 1 471 ? 23.182 42.443 9.415 1.00 14.00 ? 471 SER A OG 1 ATOM 3746 N N . LEU A 1 472 ? 25.921 45.262 8.049 1.00 3.54 ? 472 LEU A N 1 ATOM 3747 C CA . LEU A 1 472 ? 25.825 46.578 7.434 1.00 2.06 ? 472 LEU A CA 1 ATOM 3748 C C . LEU A 1 472 ? 26.262 46.622 5.971 1.00 2.17 ? 472 LEU A C 1 ATOM 3749 O O . LEU A 1 472 ? 27.426 46.368 5.651 1.00 2.71 ? 472 LEU A O 1 ATOM 3750 C CB . LEU A 1 472 ? 26.680 47.551 8.238 1.00 1.83 ? 472 LEU A CB 1 ATOM 3751 C CG . LEU A 1 472 ? 26.861 48.948 7.661 1.00 1.42 ? 472 LEU A CG 1 ATOM 3752 C CD1 . LEU A 1 472 ? 25.655 49.770 8.022 1.00 2.03 ? 472 LEU A CD1 1 ATOM 3753 C CD2 . LEU A 1 472 ? 28.122 49.581 8.201 1.00 0.96 ? 472 LEU A CD2 1 ATOM 3754 N N . ARG A 1 473 ? 25.334 46.958 5.081 1.00 2.32 ? 473 ARG A N 1 ATOM 3755 C CA . ARG A 1 473 ? 25.655 47.048 3.658 1.00 2.31 ? 473 ARG A CA 1 ATOM 3756 C C . ARG A 1 473 ? 25.673 48.514 3.260 1.00 2.68 ? 473 ARG A C 1 ATOM 3757 O O . ARG A 1 473 ? 24.895 49.325 3.776 1.00 1.94 ? 473 ARG A O 1 ATOM 3758 C CB . ARG A 1 473 ? 24.625 46.288 2.812 1.00 1.17 ? 473 ARG A CB 1 ATOM 3759 C CG . ARG A 1 473 ? 24.824 46.376 1.309 1.00 0.96 ? 473 ARG A CG 1 ATOM 3760 C CD . ARG A 1 473 ? 23.724 45.607 0.586 1.00 0.96 ? 473 ARG A CD 1 ATOM 3761 N NE . ARG A 1 473 ? 23.827 45.709 -0.870 1.00 0.96 ? 473 ARG A NE 1 ATOM 3762 C CZ . ARG A 1 473 ? 22.923 45.233 -1.723 1.00 2.38 ? 473 ARG A CZ 1 ATOM 3763 N NH1 . ARG A 1 473 ? 21.840 44.612 -1.276 1.00 4.44 ? 473 ARG A NH1 1 ATOM 3764 N NH2 . ARG A 1 473 ? 23.086 45.386 -3.029 1.00 1.90 ? 473 ARG A NH2 1 ATOM 3765 N N . ASN A 1 474 ? 26.576 48.852 2.350 1.00 3.04 ? 474 ASN A N 1 ATOM 3766 C CA . ASN A 1 474 ? 26.695 50.219 1.890 1.00 3.36 ? 474 ASN A CA 1 ATOM 3767 C C . ASN A 1 474 ? 26.800 50.322 0.394 1.00 3.52 ? 474 ASN A C 1 ATOM 3768 O O . ASN A 1 474 ? 27.600 49.635 -0.245 1.00 4.38 ? 474 ASN A O 1 ATOM 3769 C CB . ASN A 1 474 ? 27.907 50.886 2.514 1.00 3.66 ? 474 ASN A CB 1 ATOM 3770 C CG . ASN A 1 474 ? 27.688 51.222 3.952 1.00 5.88 ? 474 ASN A CG 1 ATOM 3771 O OD1 . ASN A 1 474 ? 26.935 52.146 4.280 1.00 5.66 ? 474 ASN A OD1 1 ATOM 3772 N ND2 . ASN A 1 474 ? 28.330 50.466 4.836 1.00 7.10 ? 474 ASN A ND2 1 ATOM 3773 N N . LEU A 1 475 ? 25.961 51.183 -0.158 1.00 2.87 ? 475 LEU A N 1 ATOM 3774 C CA . LEU A 1 475 ? 25.954 51.445 -1.575 1.00 1.52 ? 475 LEU A CA 1 ATOM 3775 C C . LEU A 1 475 ? 26.688 52.770 -1.660 1.00 1.48 ? 475 LEU A C 1 ATOM 3776 O O . LEU A 1 475 ? 26.166 53.805 -1.244 1.00 0.96 ? 475 LEU A O 1 ATOM 3777 C CB . LEU A 1 475 ? 24.520 51.583 -2.062 1.00 0.96 ? 475 LEU A CB 1 ATOM 3778 C CG . LEU A 1 475 ? 23.974 50.444 -2.914 1.00 0.96 ? 475 LEU A CG 1 ATOM 3779 C CD1 . LEU A 1 475 ? 24.233 49.106 -2.286 1.00 0.96 ? 475 LEU A CD1 1 ATOM 3780 C CD2 . LEU A 1 475 ? 22.503 50.675 -3.097 1.00 0.96 ? 475 LEU A CD2 1 ATOM 3781 N N . ILE A 1 476 ? 27.922 52.723 -2.148 1.00 1.41 ? 476 ILE A N 1 ATOM 3782 C CA . ILE A 1 476 ? 28.743 53.919 -2.277 1.00 1.06 ? 476 ILE A CA 1 ATOM 3783 C C . ILE A 1 476 ? 28.741 54.405 -3.717 1.00 0.96 ? 476 ILE A C 1 ATOM 3784 O O . ILE A 1 476 ? 29.181 53.695 -4.614 1.00 0.96 ? 476 ILE A O 1 ATOM 3785 C CB . ILE A 1 476 ? 30.206 53.651 -1.873 1.00 0.96 ? 476 ILE A CB 1 ATOM 3786 C CG1 . ILE A 1 476 ? 30.276 53.147 -0.439 1.00 0.96 ? 476 ILE A CG1 1 ATOM 3787 C CG2 . ILE A 1 476 ? 31.010 54.922 -1.979 1.00 1.43 ? 476 ILE A CG2 1 ATOM 3788 C CD1 . ILE A 1 476 ? 31.681 52.869 0.031 1.00 0.96 ? 476 ILE A CD1 1 ATOM 3789 N N . ASP A 1 477 ? 28.249 55.622 -3.925 1.00 0.96 ? 477 ASP A N 1 ATOM 3790 C CA . ASP A 1 477 ? 28.195 56.209 -5.254 1.00 0.96 ? 477 ASP A CA 1 ATOM 3791 C C . ASP A 1 477 ? 28.560 57.698 -5.212 1.00 0.96 ? 477 ASP A C 1 ATOM 3792 O O . ASP A 1 477 ? 27.697 58.565 -5.199 1.00 0.96 ? 477 ASP A O 1 ATOM 3793 C CB . ASP A 1 477 ? 26.798 56.015 -5.852 1.00 0.96 ? 477 ASP A CB 1 ATOM 3794 C CG . ASP A 1 477 ? 26.815 55.907 -7.368 1.00 0.96 ? 477 ASP A CG 1 ATOM 3795 O OD1 . ASP A 1 477 ? 25.761 55.587 -7.958 1.00 1.01 ? 477 ASP A OD1 1 ATOM 3796 O OD2 . ASP A 1 477 ? 27.877 56.140 -7.973 1.00 0.96 ? 477 ASP A OD2 1 ATOM 3797 N N . HIS A 1 478 ? 29.854 57.977 -5.161 1.00 0.96 ? 478 HIS A N 1 ATOM 3798 C CA . HIS A 1 478 ? 30.362 59.337 -5.151 1.00 1.54 ? 478 HIS A CA 1 ATOM 3799 C C . HIS A 1 478 ? 29.814 60.333 -4.137 1.00 2.09 ? 478 HIS A C 1 ATOM 3800 O O . HIS A 1 478 ? 30.496 60.653 -3.166 1.00 2.98 ? 478 HIS A O 1 ATOM 3801 C CB . HIS A 1 478 ? 30.238 59.934 -6.546 1.00 3.53 ? 478 HIS A CB 1 ATOM 3802 C CG . HIS A 1 478 ? 31.006 59.184 -7.585 1.00 7.08 ? 478 HIS A CG 1 ATOM 3803 N ND1 . HIS A 1 478 ? 30.468 58.132 -8.294 1.00 7.97 ? 478 HIS A ND1 1 ATOM 3804 C CD2 . HIS A 1 478 ? 32.291 59.298 -7.996 1.00 9.16 ? 478 HIS A CD2 1 ATOM 3805 C CE1 . HIS A 1 478 ? 31.389 57.630 -9.098 1.00 9.42 ? 478 HIS A CE1 1 ATOM 3806 N NE2 . HIS A 1 478 ? 32.505 58.319 -8.936 1.00 10.29 ? 478 HIS A NE2 1 ATOM 3807 N N . SER A 1 479 ? 28.605 60.846 -4.352 1.00 1.68 ? 479 SER A N 1 ATOM 3808 C CA . SER A 1 479 ? 28.061 61.834 -3.421 1.00 1.21 ? 479 SER A CA 1 ATOM 3809 C C . SER A 1 479 ? 26.883 61.357 -2.591 1.00 1.37 ? 479 SER A C 1 ATOM 3810 O O . SER A 1 479 ? 26.289 62.137 -1.842 1.00 1.84 ? 479 SER A O 1 ATOM 3811 C CB . SER A 1 479 ? 27.662 63.105 -4.162 1.00 0.96 ? 479 SER A CB 1 ATOM 3812 O OG . SER A 1 479 ? 26.475 62.898 -4.893 1.00 0.96 ? 479 SER A OG 1 ATOM 3813 N N . ILE A 1 480 ? 26.538 60.083 -2.723 1.00 0.96 ? 480 ILE A N 1 ATOM 3814 C CA . ILE A 1 480 ? 25.445 59.531 -1.945 1.00 0.96 ? 480 ILE A CA 1 ATOM 3815 C C . ILE A 1 480 ? 25.871 58.202 -1.372 1.00 0.96 ? 480 ILE A C 1 ATOM 3816 O O . ILE A 1 480 ? 26.580 57.450 -2.018 1.00 1.23 ? 480 ILE A O 1 ATOM 3817 C CB . ILE A 1 480 ? 24.185 59.297 -2.794 1.00 0.96 ? 480 ILE A CB 1 ATOM 3818 C CG1 . ILE A 1 480 ? 23.062 58.772 -1.899 1.00 0.96 ? 480 ILE A CG1 1 ATOM 3819 C CG2 . ILE A 1 480 ? 24.465 58.285 -3.880 1.00 0.96 ? 480 ILE A CG2 1 ATOM 3820 C CD1 . ILE A 1 480 ? 21.754 58.556 -2.605 1.00 1.32 ? 480 ILE A CD1 1 ATOM 3821 N N . ILE A 1 481 ? 25.450 57.918 -0.150 1.00 0.96 ? 481 ILE A N 1 ATOM 3822 C CA . ILE A 1 481 ? 25.773 56.652 0.483 1.00 0.96 ? 481 ILE A CA 1 ATOM 3823 C C . ILE A 1 481 ? 24.501 56.184 1.157 1.00 0.96 ? 481 ILE A C 1 ATOM 3824 O O . ILE A 1 481 ? 23.968 56.867 2.040 1.00 0.96 ? 481 ILE A O 1 ATOM 3825 C CB . ILE A 1 481 ? 26.866 56.794 1.558 1.00 0.96 ? 481 ILE A CB 1 ATOM 3826 C CG1 . ILE A 1 481 ? 28.173 57.271 0.934 1.00 0.96 ? 481 ILE A CG1 1 ATOM 3827 C CG2 . ILE A 1 481 ? 27.087 55.466 2.240 1.00 0.96 ? 481 ILE A CG2 1 ATOM 3828 C CD1 . ILE A 1 481 ? 29.258 57.541 1.947 1.00 0.96 ? 481 ILE A CD1 1 ATOM 3829 N N . GLU A 1 482 ? 23.995 55.039 0.716 1.00 1.49 ? 482 GLU A N 1 ATOM 3830 C CA . GLU A 1 482 ? 22.783 54.476 1.296 1.00 2.04 ? 482 GLU A CA 1 ATOM 3831 C C . GLU A 1 482 ? 23.253 53.385 2.247 1.00 2.85 ? 482 GLU A C 1 ATOM 3832 O O . GLU A 1 482 ? 23.754 52.346 1.823 1.00 5.47 ? 482 GLU A O 1 ATOM 3833 C CB . GLU A 1 482 ? 21.865 53.930 0.192 1.00 0.96 ? 482 GLU A CB 1 ATOM 3834 C CG . GLU A 1 482 ? 21.282 55.030 -0.678 1.00 0.96 ? 482 GLU A CG 1 ATOM 3835 C CD . GLU A 1 482 ? 20.308 54.534 -1.723 1.00 2.38 ? 482 GLU A CD 1 ATOM 3836 O OE1 . GLU A 1 482 ? 19.331 53.842 -1.368 1.00 3.83 ? 482 GLU A OE1 1 ATOM 3837 O OE2 . GLU A 1 482 ? 20.510 54.849 -2.914 1.00 3.56 ? 482 GLU A OE2 1 ATOM 3838 N N . SER A 1 483 ? 23.114 53.640 3.541 1.00 2.17 ? 483 SER A N 1 ATOM 3839 C CA . SER A 1 483 ? 23.575 52.704 4.544 1.00 1.92 ? 483 SER A CA 1 ATOM 3840 C C . SER A 1 483 ? 22.439 51.827 5.018 1.00 0.96 ? 483 SER A C 1 ATOM 3841 O O . SER A 1 483 ? 21.468 52.316 5.578 1.00 0.96 ? 483 SER A O 1 ATOM 3842 C CB . SER A 1 483 ? 24.177 53.477 5.724 1.00 3.01 ? 483 SER A CB 1 ATOM 3843 O OG . SER A 1 483 ? 25.003 54.554 5.288 1.00 3.61 ? 483 SER A OG 1 ATOM 3844 N N . PHE A 1 484 ? 22.563 50.525 4.787 1.00 1.56 ? 484 PHE A N 1 ATOM 3845 C CA . PHE A 1 484 ? 21.538 49.568 5.202 1.00 1.62 ? 484 PHE A CA 1 ATOM 3846 C C . PHE A 1 484 ? 22.006 48.752 6.393 1.00 1.53 ? 484 PHE A C 1 ATOM 3847 O O . PHE A 1 484 ? 22.952 47.972 6.295 1.00 3.26 ? 484 PHE A O 1 ATOM 3848 C CB . PHE A 1 484 ? 21.198 48.631 4.053 1.00 0.96 ? 484 PHE A CB 1 ATOM 3849 C CG . PHE A 1 484 ? 20.573 49.320 2.883 1.00 1.01 ? 484 PHE A CG 1 ATOM 3850 C CD1 . PHE A 1 484 ? 19.191 49.485 2.813 1.00 0.97 ? 484 PHE A CD1 1 ATOM 3851 C CD2 . PHE A 1 484 ? 21.366 49.824 1.855 1.00 0.96 ? 484 PHE A CD2 1 ATOM 3852 C CE1 . PHE A 1 484 ? 18.606 50.140 1.738 1.00 0.96 ? 484 PHE A CE1 1 ATOM 3853 C CE2 . PHE A 1 484 ? 20.797 50.480 0.774 1.00 0.97 ? 484 PHE A CE2 1 ATOM 3854 C CZ . PHE A 1 484 ? 19.413 50.640 0.714 1.00 1.15 ? 484 PHE A CZ 1 ATOM 3855 N N . GLY A 1 485 ? 21.345 48.932 7.525 1.00 0.96 ? 485 GLY A N 1 ATOM 3856 C CA . GLY A 1 485 ? 21.744 48.196 8.700 1.00 0.96 ? 485 GLY A CA 1 ATOM 3857 C C . GLY A 1 485 ? 20.817 47.066 9.077 1.00 0.96 ? 485 GLY A C 1 ATOM 3858 O O . GLY A 1 485 ? 19.602 47.169 8.945 1.00 0.96 ? 485 GLY A O 1 ATOM 3859 N N . ALA A 1 486 ? 21.408 45.976 9.545 1.00 0.96 ? 486 ALA A N 1 ATOM 3860 C CA . ALA A 1 486 ? 20.648 44.824 9.988 1.00 0.96 ? 486 ALA A CA 1 ATOM 3861 C C . ALA A 1 486 ? 19.708 44.314 8.932 1.00 1.01 ? 486 ALA A C 1 ATOM 3862 O O . ALA A 1 486 ? 18.545 44.052 9.210 1.00 1.48 ? 486 ALA A O 1 ATOM 3863 C CB . ALA A 1 486 ? 19.865 45.176 11.231 1.00 1.31 ? 486 ALA A CB 1 ATOM 3864 N N . GLY A 1 487 ? 20.205 44.185 7.714 1.00 2.05 ? 487 GLY A N 1 ATOM 3865 C CA . GLY A 1 487 ? 19.367 43.674 6.647 1.00 4.06 ? 487 GLY A CA 1 ATOM 3866 C C . GLY A 1 487 ? 18.236 44.567 6.170 1.00 4.38 ? 487 GLY A C 1 ATOM 3867 O O . GLY A 1 487 ? 17.319 44.099 5.497 1.00 4.23 ? 487 GLY A O 1 ATOM 3868 N N . GLY A 1 488 ? 18.289 45.848 6.515 1.00 5.05 ? 488 GLY A N 1 ATOM 3869 C CA . GLY A 1 488 ? 17.259 46.761 6.066 1.00 4.20 ? 488 GLY A CA 1 ATOM 3870 C C . GLY A 1 488 ? 16.303 47.128 7.165 1.00 5.14 ? 488 GLY A C 1 ATOM 3871 O O . GLY A 1 488 ? 15.261 47.726 6.913 1.00 7.72 ? 488 GLY A O 1 ATOM 3872 N N . LYS A 1 489 ? 16.641 46.766 8.393 1.00 4.56 ? 489 LYS A N 1 ATOM 3873 C CA . LYS A 1 489 ? 15.774 47.090 9.512 1.00 4.17 ? 489 LYS A CA 1 ATOM 3874 C C . LYS A 1 489 ? 15.959 48.557 9.899 1.00 4.26 ? 489 LYS A C 1 ATOM 3875 O O . LYS A 1 489 ? 15.138 49.133 10.612 1.00 5.69 ? 489 LYS A O 1 ATOM 3876 C CB . LYS A 1 489 ? 16.101 46.194 10.707 1.00 3.40 ? 489 LYS A CB 1 ATOM 3877 C CG . LYS A 1 489 ? 15.132 45.059 10.927 1.00 3.28 ? 489 LYS A CG 1 ATOM 3878 C CD . LYS A 1 489 ? 15.504 44.291 12.183 1.00 5.44 ? 489 LYS A CD 1 ATOM 3879 C CE . LYS A 1 489 ? 14.415 43.310 12.603 1.00 7.14 ? 489 LYS A CE 1 ATOM 3880 N NZ . LYS A 1 489 ? 14.813 42.526 13.810 1.00 7.06 ? 489 LYS A NZ 1 ATOM 3881 N N . THR A 1 490 ? 17.035 49.161 9.413 1.00 2.90 ? 490 THR A N 1 ATOM 3882 C CA . THR A 1 490 ? 17.340 50.540 9.737 1.00 2.11 ? 490 THR A CA 1 ATOM 3883 C C . THR A 1 490 ? 18.195 51.082 8.620 1.00 2.12 ? 490 THR A C 1 ATOM 3884 O O . THR A 1 490 ? 19.358 50.713 8.514 1.00 4.31 ? 490 THR A O 1 ATOM 3885 C CB . THR A 1 490 ? 18.129 50.611 11.058 1.00 0.96 ? 490 THR A CB 1 ATOM 3886 O OG1 . THR A 1 490 ? 17.251 50.354 12.163 1.00 1.28 ? 490 THR A OG1 1 ATOM 3887 C CG2 . THR A 1 490 ? 18.755 51.952 11.230 1.00 0.96 ? 490 THR A CG2 1 ATOM 3888 N N . CYS A 1 491 ? 17.627 51.960 7.797 1.00 2.01 ? 491 CYS A N 1 ATOM 3889 C CA . CYS A 1 491 ? 18.346 52.540 6.658 1.00 2.07 ? 491 CYS A CA 1 ATOM 3890 C C . CYS A 1 491 ? 18.735 54.016 6.843 1.00 2.59 ? 491 CYS A C 1 ATOM 3891 O O . CYS A 1 491 ? 18.022 54.764 7.512 1.00 3.35 ? 491 CYS A O 1 ATOM 3892 C CB . CYS A 1 491 ? 17.478 52.406 5.418 1.00 2.07 ? 491 CYS A CB 1 ATOM 3893 S SG . CYS A 1 491 ? 16.712 50.794 5.266 1.00 3.75 ? 491 CYS A SG 1 ATOM 3894 N N . ILE A 1 492 ? 19.849 54.436 6.236 1.00 1.99 ? 492 ILE A N 1 ATOM 3895 C CA . ILE A 1 492 ? 20.326 55.823 6.337 1.00 0.96 ? 492 ILE A CA 1 ATOM 3896 C C . ILE A 1 492 ? 21.046 56.313 5.089 1.00 0.96 ? 492 ILE A C 1 ATOM 3897 O O . ILE A 1 492 ? 22.162 55.874 4.800 1.00 0.96 ? 492 ILE A O 1 ATOM 3898 C CB . ILE A 1 492 ? 21.318 56.011 7.502 1.00 1.02 ? 492 ILE A CB 1 ATOM 3899 C CG1 . ILE A 1 492 ? 20.618 55.817 8.839 1.00 0.96 ? 492 ILE A CG1 1 ATOM 3900 C CG2 . ILE A 1 492 ? 21.932 57.396 7.441 1.00 1.35 ? 492 ILE A CG2 1 ATOM 3901 C CD1 . ILE A 1 492 ? 21.553 55.945 10.015 1.00 0.96 ? 492 ILE A CD1 1 ATOM 3902 N N . THR A 1 493 ? 20.425 57.243 4.370 1.00 1.07 ? 493 THR A N 1 ATOM 3903 C CA . THR A 1 493 ? 21.027 57.807 3.160 1.00 0.96 ? 493 THR A CA 1 ATOM 3904 C C . THR A 1 493 ? 21.752 59.094 3.505 1.00 0.97 ? 493 THR A C 1 ATOM 3905 O O . THR A 1 493 ? 21.190 59.966 4.172 1.00 0.96 ? 493 THR A O 1 ATOM 3906 C CB . THR A 1 493 ? 19.973 58.160 2.120 1.00 0.96 ? 493 THR A CB 1 ATOM 3907 O OG1 . THR A 1 493 ? 19.208 56.997 1.802 1.00 0.96 ? 493 THR A OG1 1 ATOM 3908 C CG2 . THR A 1 493 ? 20.629 58.683 0.867 1.00 0.96 ? 493 THR A CG2 1 ATOM 3909 N N . SER A 1 494 ? 22.992 59.226 3.051 1.00 0.96 ? 494 SER A N 1 ATOM 3910 C CA . SER A 1 494 ? 23.745 60.432 3.344 1.00 0.96 ? 494 SER A CA 1 ATOM 3911 C C . SER A 1 494 ? 24.363 61.002 2.095 1.00 0.96 ? 494 SER A C 1 ATOM 3912 O O . SER A 1 494 ? 24.776 60.255 1.211 1.00 0.96 ? 494 SER A O 1 ATOM 3913 C CB . SER A 1 494 ? 24.847 60.144 4.364 1.00 0.96 ? 494 SER A CB 1 ATOM 3914 O OG . SER A 1 494 ? 24.849 58.778 4.740 1.00 0.96 ? 494 SER A OG 1 ATOM 3915 N N . ARG A 1 495 ? 24.401 62.332 2.020 1.00 1.43 ? 495 ARG A N 1 ATOM 3916 C CA . ARG A 1 495 ? 25.013 63.025 0.890 1.00 1.29 ? 495 ARG A CA 1 ATOM 3917 C C . ARG A 1 495 ? 26.295 63.641 1.446 1.00 1.50 ? 495 ARG A C 1 ATOM 3918 O O . ARG A 1 495 ? 26.277 64.246 2.525 1.00 0.96 ? 495 ARG A O 1 ATOM 3919 C CB . ARG A 1 495 ? 24.091 64.125 0.348 1.00 0.96 ? 495 ARG A CB 1 ATOM 3920 C CG . ARG A 1 495 ? 22.770 63.638 -0.240 1.00 0.96 ? 495 ARG A CG 1 ATOM 3921 C CD . ARG A 1 495 ? 22.972 62.639 -1.367 1.00 0.96 ? 495 ARG A CD 1 ATOM 3922 N NE . ARG A 1 495 ? 23.737 63.197 -2.477 1.00 1.36 ? 495 ARG A NE 1 ATOM 3923 C CZ . ARG A 1 495 ? 23.313 64.186 -3.257 1.00 1.73 ? 495 ARG A CZ 1 ATOM 3924 N NH1 . ARG A 1 495 ? 22.125 64.729 -3.053 1.00 2.57 ? 495 ARG A NH1 1 ATOM 3925 N NH2 . ARG A 1 495 ? 24.076 64.638 -4.242 1.00 0.96 ? 495 ARG A NH2 1 ATOM 3926 N N . ILE A 1 496 ? 27.400 63.465 0.724 1.00 1.22 ? 496 ILE A N 1 ATOM 3927 C CA . ILE A 1 496 ? 28.700 63.984 1.151 1.00 1.44 ? 496 ILE A CA 1 ATOM 3928 C C . ILE A 1 496 ? 29.490 64.531 -0.036 1.00 2.12 ? 496 ILE A C 1 ATOM 3929 O O . ILE A 1 496 ? 29.360 64.024 -1.152 1.00 1.99 ? 496 ILE A O 1 ATOM 3930 C CB . ILE A 1 496 ? 29.546 62.883 1.820 1.00 0.96 ? 496 ILE A CB 1 ATOM 3931 C CG1 . ILE A 1 496 ? 29.964 61.830 0.784 1.00 1.17 ? 496 ILE A CG1 1 ATOM 3932 C CG2 . ILE A 1 496 ? 28.778 62.263 2.963 1.00 0.96 ? 496 ILE A CG2 1 ATOM 3933 C CD1 . ILE A 1 496 ? 28.831 61.155 0.063 1.00 0.96 ? 496 ILE A CD1 1 ATOM 3934 N N . TYR A 1 497 ? 30.325 65.544 0.206 1.00 2.54 ? 497 TYR A N 1 ATOM 3935 C CA . TYR A 1 497 ? 31.111 66.156 -0.870 1.00 2.23 ? 497 TYR A CA 1 ATOM 3936 C C . TYR A 1 497 ? 32.577 66.416 -0.550 1.00 2.35 ? 497 TYR A C 1 ATOM 3937 O O . TYR A 1 497 ? 33.022 67.557 -0.580 1.00 1.29 ? 497 TYR A O 1 ATOM 3938 C CB . TYR A 1 497 ? 30.496 67.489 -1.271 1.00 2.80 ? 497 TYR A CB 1 ATOM 3939 C CG . TYR A 1 497 ? 29.019 67.445 -1.544 1.00 3.62 ? 497 TYR A CG 1 ATOM 3940 C CD1 . TYR A 1 497 ? 28.532 67.225 -2.830 1.00 4.32 ? 497 TYR A CD1 1 ATOM 3941 C CD2 . TYR A 1 497 ? 28.103 67.656 -0.521 1.00 4.00 ? 497 TYR A CD2 1 ATOM 3942 C CE1 . TYR A 1 497 ? 27.164 67.223 -3.088 1.00 4.53 ? 497 TYR A CE1 1 ATOM 3943 C CE2 . TYR A 1 497 ? 26.736 67.656 -0.769 1.00 4.61 ? 497 TYR A CE2 1 ATOM 3944 C CZ . TYR A 1 497 ? 26.272 67.442 -2.051 1.00 4.68 ? 497 TYR A CZ 1 ATOM 3945 O OH . TYR A 1 497 ? 24.916 67.466 -2.288 1.00 5.38 ? 497 TYR A OH 1 ATOM 3946 N N . PRO A 1 498 ? 33.352 65.370 -0.259 1.00 3.45 ? 498 PRO A N 1 ATOM 3947 C CA . PRO A 1 498 ? 34.763 65.610 0.045 1.00 4.10 ? 498 PRO A CA 1 ATOM 3948 C C . PRO A 1 498 ? 35.423 66.397 -1.079 1.00 4.84 ? 498 PRO A C 1 ATOM 3949 O O . PRO A 1 498 ? 34.977 66.346 -2.220 1.00 5.33 ? 498 PRO A O 1 ATOM 3950 C CB . PRO A 1 498 ? 35.329 64.202 0.168 1.00 4.50 ? 498 PRO A CB 1 ATOM 3951 C CG . PRO A 1 498 ? 34.502 63.436 -0.800 1.00 4.27 ? 498 PRO A CG 1 ATOM 3952 C CD . PRO A 1 498 ? 33.110 63.939 -0.495 1.00 4.37 ? 498 PRO A CD 1 ATOM 3953 N N . LYS A 1 499 ? 36.489 67.116 -0.753 1.00 5.39 ? 499 LYS A N 1 ATOM 3954 C CA . LYS A 1 499 ? 37.193 67.923 -1.733 1.00 6.48 ? 499 LYS A CA 1 ATOM 3955 C C . LYS A 1 499 ? 38.126 67.087 -2.583 1.00 5.41 ? 499 LYS A C 1 ATOM 3956 O O . LYS A 1 499 ? 38.207 67.271 -3.796 1.00 4.12 ? 499 LYS A O 1 ATOM 3957 C CB . LYS A 1 499 ? 38.001 69.009 -1.022 1.00 10.40 ? 499 LYS A CB 1 ATOM 3958 C CG . LYS A 1 499 ? 38.834 69.897 -1.940 1.00 15.68 ? 499 LYS A CG 1 ATOM 3959 C CD . LYS A 1 499 ? 39.675 70.878 -1.120 1.00 20.66 ? 499 LYS A CD 1 ATOM 3960 C CE . LYS A 1 499 ? 40.494 71.823 -2.006 1.00 24.91 ? 499 LYS A CE 1 ATOM 3961 N NZ . LYS A 1 499 ? 41.532 71.131 -2.846 1.00 27.90 ? 499 LYS A NZ 1 ATOM 3962 N N . PHE A 1 500 ? 38.818 66.158 -1.935 1.00 5.55 ? 500 PHE A N 1 ATOM 3963 C CA . PHE A 1 500 ? 39.785 65.299 -2.606 1.00 5.82 ? 500 PHE A CA 1 ATOM 3964 C C . PHE A 1 500 ? 39.314 64.605 -3.876 1.00 5.45 ? 500 PHE A C 1 ATOM 3965 O O . PHE A 1 500 ? 40.119 64.279 -4.752 1.00 3.78 ? 500 PHE A O 1 ATOM 3966 C CB . PHE A 1 500 ? 40.311 64.253 -1.626 1.00 6.63 ? 500 PHE A CB 1 ATOM 3967 C CG . PHE A 1 500 ? 39.380 63.099 -1.388 1.00 8.95 ? 500 PHE A CG 1 ATOM 3968 C CD1 . PHE A 1 500 ? 39.148 62.150 -2.381 1.00 11.01 ? 500 PHE A CD1 1 ATOM 3969 C CD2 . PHE A 1 500 ? 38.786 62.921 -0.146 1.00 10.22 ? 500 PHE A CD2 1 ATOM 3970 C CE1 . PHE A 1 500 ? 38.338 61.031 -2.139 1.00 11.70 ? 500 PHE A CE1 1 ATOM 3971 C CE2 . PHE A 1 500 ? 37.978 61.809 0.108 1.00 12.24 ? 500 PHE A CE2 1 ATOM 3972 C CZ . PHE A 1 500 ? 37.753 60.860 -0.891 1.00 12.15 ? 500 PHE A CZ 1 ATOM 3973 N N . VAL A 1 501 ? 38.015 64.369 -3.980 1.00 6.15 ? 501 VAL A N 1 ATOM 3974 C CA . VAL A 1 501 ? 37.501 63.684 -5.149 1.00 7.60 ? 501 VAL A CA 1 ATOM 3975 C C . VAL A 1 501 ? 37.775 64.437 -6.427 1.00 9.26 ? 501 VAL A C 1 ATOM 3976 O O . VAL A 1 501 ? 37.401 63.979 -7.500 1.00 10.10 ? 501 VAL A O 1 ATOM 3977 C CB . VAL A 1 501 ? 36.006 63.436 -5.039 1.00 6.57 ? 501 VAL A CB 1 ATOM 3978 C CG1 . VAL A 1 501 ? 35.735 62.489 -3.899 1.00 6.77 ? 501 VAL A CG1 1 ATOM 3979 C CG2 . VAL A 1 501 ? 35.284 64.741 -4.825 1.00 7.37 ? 501 VAL A CG2 1 ATOM 3980 N N . ASN A 1 502 ? 38.419 65.593 -6.323 1.00 11.45 ? 502 ASN A N 1 ATOM 3981 C CA . ASN A 1 502 ? 38.738 66.359 -7.516 1.00 14.50 ? 502 ASN A CA 1 ATOM 3982 C C . ASN A 1 502 ? 40.079 65.929 -8.082 1.00 16.79 ? 502 ASN A C 1 ATOM 3983 O O . ASN A 1 502 ? 40.267 65.916 -9.300 1.00 17.66 ? 502 ASN A O 1 ATOM 3984 C CB . ASN A 1 502 ? 38.789 67.854 -7.220 1.00 15.22 ? 502 ASN A CB 1 ATOM 3985 C CG . ASN A 1 502 ? 37.442 68.515 -7.336 1.00 16.08 ? 502 ASN A CG 1 ATOM 3986 O OD1 . ASN A 1 502 ? 36.695 68.605 -6.359 1.00 16.15 ? 502 ASN A OD1 1 ATOM 3987 N ND2 . ASN A 1 502 ? 37.112 68.976 -8.543 1.00 17.75 ? 502 ASN A ND2 1 ATOM 3988 N N . ASN A 1 503 ? 41.008 65.575 -7.197 1.00 18.97 ? 503 ASN A N 1 ATOM 3989 C CA . ASN A 1 503 ? 42.339 65.155 -7.626 1.00 21.01 ? 503 ASN A CA 1 ATOM 3990 C C . ASN A 1 503 ? 42.650 63.688 -7.366 1.00 21.47 ? 503 ASN A C 1 ATOM 3991 O O . ASN A 1 503 ? 42.868 62.910 -8.305 1.00 22.77 ? 503 ASN A O 1 ATOM 3992 C CB . ASN A 1 503 ? 43.407 66.019 -6.956 1.00 22.35 ? 503 ASN A CB 1 ATOM 3993 C CG . ASN A 1 503 ? 43.301 67.473 -7.348 1.00 24.34 ? 503 ASN A CG 1 ATOM 3994 O OD1 . ASN A 1 503 ? 42.454 68.206 -6.833 1.00 24.11 ? 503 ASN A OD1 1 ATOM 3995 N ND2 . ASN A 1 503 ? 44.151 67.899 -8.282 1.00 26.19 ? 503 ASN A ND2 1 ATOM 3996 N N . GLU A 1 504 ? 42.674 63.309 -6.093 1.00 20.52 ? 504 GLU A N 1 ATOM 3997 C CA . GLU A 1 504 ? 42.981 61.936 -5.735 1.00 19.27 ? 504 GLU A CA 1 ATOM 3998 C C . GLU A 1 504 ? 41.795 60.973 -5.761 1.00 17.14 ? 504 GLU A C 1 ATOM 3999 O O . GLU A 1 504 ? 40.631 61.383 -5.836 1.00 15.54 ? 504 GLU A O 1 ATOM 4000 C CB . GLU A 1 504 ? 43.678 61.910 -4.371 1.00 21.12 ? 504 GLU A CB 1 ATOM 4001 C CG . GLU A 1 504 ? 43.158 62.929 -3.364 1.00 22.69 ? 504 GLU A CG 1 ATOM 4002 C CD . GLU A 1 504 ? 44.220 63.313 -2.330 1.00 25.06 ? 504 GLU A CD 1 ATOM 4003 O OE1 . GLU A 1 504 ? 45.191 64.006 -2.714 1.00 25.86 ? 504 GLU A OE1 1 ATOM 4004 O OE2 . GLU A 1 504 ? 44.094 62.919 -1.142 1.00 25.96 ? 504 GLU A OE2 1 ATOM 4005 N N . GLU A 1 505 ? 42.118 59.684 -5.724 1.00 15.29 ? 505 GLU A N 1 ATOM 4006 C CA . GLU A 1 505 ? 41.121 58.631 -5.746 1.00 14.81 ? 505 GLU A CA 1 ATOM 4007 C C . GLU A 1 505 ? 40.650 58.367 -4.322 1.00 13.11 ? 505 GLU A C 1 ATOM 4008 O O . GLU A 1 505 ? 41.361 58.674 -3.366 1.00 12.70 ? 505 GLU A O 1 ATOM 4009 C CB . GLU A 1 505 ? 41.738 57.374 -6.346 1.00 17.18 ? 505 GLU A CB 1 ATOM 4010 C CG . GLU A 1 505 ? 40.808 56.601 -7.258 1.00 23.65 ? 505 GLU A CG 1 ATOM 4011 C CD . GLU A 1 505 ? 41.566 55.616 -8.139 1.00 27.69 ? 505 GLU A CD 1 ATOM 4012 O OE1 . GLU A 1 505 ? 42.312 54.772 -7.583 1.00 29.83 ? 505 GLU A OE1 1 ATOM 4013 O OE2 . GLU A 1 505 ? 41.414 55.690 -9.384 1.00 29.60 ? 505 GLU A OE2 1 ATOM 4014 N N . ALA A 1 506 ? 39.456 57.796 -4.182 1.00 11.76 ? 506 ALA A N 1 ATOM 4015 C CA . ALA A 1 506 ? 38.888 57.511 -2.864 1.00 10.37 ? 506 ALA A CA 1 ATOM 4016 C C . ALA A 1 506 ? 39.424 56.229 -2.243 1.00 9.81 ? 506 ALA A C 1 ATOM 4017 O O . ALA A 1 506 ? 40.005 55.396 -2.932 1.00 11.22 ? 506 ALA A O 1 ATOM 4018 C CB . ALA A 1 506 ? 37.387 57.436 -2.962 1.00 10.34 ? 506 ALA A CB 1 ATOM 4019 N N . HIS A 1 507 ? 39.219 56.074 -0.938 1.00 9.31 ? 507 HIS A N 1 ATOM 4020 C CA . HIS A 1 507 ? 39.688 54.894 -0.218 1.00 9.15 ? 507 HIS A CA 1 ATOM 4021 C C . HIS A 1 507 ? 38.584 54.266 0.634 1.00 8.16 ? 507 HIS A C 1 ATOM 4022 O O . HIS A 1 507 ? 37.588 54.916 0.972 1.00 8.16 ? 507 HIS A O 1 ATOM 4023 C CB . HIS A 1 507 ? 40.892 55.265 0.651 1.00 11.33 ? 507 HIS A CB 1 ATOM 4024 C CG . HIS A 1 507 ? 42.154 55.482 -0.129 1.00 14.13 ? 507 HIS A CG 1 ATOM 4025 N ND1 . HIS A 1 507 ? 43.033 54.462 -0.420 1.00 15.53 ? 507 HIS A ND1 1 ATOM 4026 C CD2 . HIS A 1 507 ? 42.662 56.594 -0.713 1.00 15.54 ? 507 HIS A CD2 1 ATOM 4027 C CE1 . HIS A 1 507 ? 44.028 54.935 -1.150 1.00 16.06 ? 507 HIS A CE1 1 ATOM 4028 N NE2 . HIS A 1 507 ? 43.827 56.226 -1.343 1.00 15.71 ? 507 HIS A NE2 1 ATOM 4029 N N . LEU A 1 508 ? 38.768 52.997 0.981 1.00 6.44 ? 508 LEU A N 1 ATOM 4030 C CA . LEU A 1 508 ? 37.775 52.277 1.761 1.00 5.08 ? 508 LEU A CA 1 ATOM 4031 C C . LEU A 1 508 ? 38.400 51.569 2.953 1.00 4.98 ? 508 LEU A C 1 ATOM 4032 O O . LEU A 1 508 ? 39.336 50.798 2.785 1.00 6.44 ? 508 LEU A O 1 ATOM 4033 C CB . LEU A 1 508 ? 37.088 51.262 0.859 1.00 3.77 ? 508 LEU A CB 1 ATOM 4034 C CG . LEU A 1 508 ? 36.003 50.406 1.492 1.00 4.39 ? 508 LEU A CG 1 ATOM 4035 C CD1 . LEU A 1 508 ? 34.963 51.301 2.145 1.00 5.70 ? 508 LEU A CD1 1 ATOM 4036 C CD2 . LEU A 1 508 ? 35.385 49.532 0.423 1.00 3.52 ? 508 LEU A CD2 1 ATOM 4037 N N . PHE A 1 509 ? 37.875 51.808 4.150 1.00 4.15 ? 509 PHE A N 1 ATOM 4038 C CA . PHE A 1 509 ? 38.425 51.182 5.348 1.00 3.66 ? 509 PHE A CA 1 ATOM 4039 C C . PHE A 1 509 ? 37.366 50.616 6.250 1.00 3.62 ? 509 PHE A C 1 ATOM 4040 O O . PHE A 1 509 ? 36.235 51.084 6.257 1.00 5.19 ? 509 PHE A O 1 ATOM 4041 C CB . PHE A 1 509 ? 39.158 52.197 6.202 1.00 5.06 ? 509 PHE A CB 1 ATOM 4042 C CG . PHE A 1 509 ? 40.236 52.935 5.494 1.00 7.25 ? 509 PHE A CG 1 ATOM 4043 C CD1 . PHE A 1 509 ? 41.509 52.402 5.400 1.00 8.27 ? 509 PHE A CD1 1 ATOM 4044 C CD2 . PHE A 1 509 ? 39.995 54.192 4.964 1.00 7.80 ? 509 PHE A CD2 1 ATOM 4045 C CE1 . PHE A 1 509 ? 42.528 53.111 4.796 1.00 8.10 ? 509 PHE A CE1 1 ATOM 4046 C CE2 . PHE A 1 509 ? 41.007 54.907 4.358 1.00 8.12 ? 509 PHE A CE2 1 ATOM 4047 C CZ . PHE A 1 509 ? 42.277 54.366 4.276 1.00 8.48 ? 509 PHE A CZ 1 ATOM 4048 N N . VAL A 1 510 ? 37.759 49.623 7.038 1.00 3.35 ? 510 VAL A N 1 ATOM 4049 C CA . VAL A 1 510 ? 36.892 49.015 8.039 1.00 3.22 ? 510 VAL A CA 1 ATOM 4050 C C . VAL A 1 510 ? 37.601 49.470 9.306 1.00 3.74 ? 510 VAL A C 1 ATOM 4051 O O . VAL A 1 510 ? 38.830 49.502 9.333 1.00 4.48 ? 510 VAL A O 1 ATOM 4052 C CB . VAL A 1 510 ? 36.931 47.493 7.990 1.00 2.07 ? 510 VAL A CB 1 ATOM 4053 C CG1 . VAL A 1 510 ? 36.117 46.938 9.124 1.00 4.56 ? 510 VAL A CG1 1 ATOM 4054 C CG2 . VAL A 1 510 ? 36.384 46.998 6.684 1.00 2.63 ? 510 VAL A CG2 1 ATOM 4055 N N . PHE A 1 511 ? 36.871 49.822 10.356 1.00 4.04 ? 511 PHE A N 1 ATOM 4056 C CA . PHE A 1 511 ? 37.557 50.297 11.553 1.00 5.52 ? 511 PHE A CA 1 ATOM 4057 C C . PHE A 1 511 ? 36.853 50.040 12.877 1.00 6.72 ? 511 PHE A C 1 ATOM 4058 O O . PHE A 1 511 ? 35.642 49.802 12.930 1.00 8.35 ? 511 PHE A O 1 ATOM 4059 C CB . PHE A 1 511 ? 37.800 51.798 11.438 1.00 4.86 ? 511 PHE A CB 1 ATOM 4060 C CG . PHE A 1 511 ? 36.591 52.621 11.775 1.00 4.78 ? 511 PHE A CG 1 ATOM 4061 C CD1 . PHE A 1 511 ? 36.408 53.117 13.063 1.00 3.78 ? 511 PHE A CD1 1 ATOM 4062 C CD2 . PHE A 1 511 ? 35.604 52.855 10.820 1.00 4.97 ? 511 PHE A CD2 1 ATOM 4063 C CE1 . PHE A 1 511 ? 35.262 53.830 13.394 1.00 3.32 ? 511 PHE A CE1 1 ATOM 4064 C CE2 . PHE A 1 511 ? 34.457 53.565 11.141 1.00 3.81 ? 511 PHE A CE2 1 ATOM 4065 C CZ . PHE A 1 511 ? 34.285 54.053 12.431 1.00 3.56 ? 511 PHE A CZ 1 ATOM 4066 N N . ASN A 1 512 ? 37.640 50.127 13.946 1.00 6.67 ? 512 ASN A N 1 ATOM 4067 C CA . ASN A 1 512 ? 37.169 49.952 15.314 1.00 5.98 ? 512 ASN A CA 1 ATOM 4068 C C . ASN A 1 512 ? 37.895 50.994 16.161 1.00 6.69 ? 512 ASN A C 1 ATOM 4069 O O . ASN A 1 512 ? 39.118 50.936 16.311 1.00 7.99 ? 512 ASN A O 1 ATOM 4070 C CB . ASN A 1 512 ? 37.511 48.558 15.827 1.00 4.08 ? 512 ASN A CB 1 ATOM 4071 C CG . ASN A 1 512 ? 36.978 48.310 17.217 1.00 3.76 ? 512 ASN A CG 1 ATOM 4072 O OD1 . ASN A 1 512 ? 36.482 49.218 17.873 1.00 3.44 ? 512 ASN A OD1 1 ATOM 4073 N ND2 . ASN A 1 512 ? 37.079 47.073 17.676 1.00 4.82 ? 512 ASN A ND2 1 ATOM 4074 N N . ASN A 1 513 ? 37.159 51.959 16.699 1.00 6.41 ? 513 ASN A N 1 ATOM 4075 C CA . ASN A 1 513 ? 37.792 52.981 17.511 1.00 6.57 ? 513 ASN A CA 1 ATOM 4076 C C . ASN A 1 513 ? 37.413 52.809 18.974 1.00 7.30 ? 513 ASN A C 1 ATOM 4077 O O . ASN A 1 513 ? 37.701 53.675 19.794 1.00 8.45 ? 513 ASN A O 1 ATOM 4078 C CB . ASN A 1 513 ? 37.408 54.385 17.030 1.00 5.98 ? 513 ASN A CB 1 ATOM 4079 C CG . ASN A 1 513 ? 38.531 55.399 17.232 1.00 6.26 ? 513 ASN A CG 1 ATOM 4080 O OD1 . ASN A 1 513 ? 39.242 55.346 18.235 1.00 6.45 ? 513 ASN A OD1 1 ATOM 4081 N ND2 . ASN A 1 513 ? 38.688 56.322 16.286 1.00 7.25 ? 513 ASN A ND2 1 ATOM 4082 N N . GLY A 1 514 ? 36.774 51.690 19.303 1.00 7.77 ? 514 GLY A N 1 ATOM 4083 C CA . GLY A 1 514 ? 36.397 51.430 20.688 1.00 8.37 ? 514 GLY A CA 1 ATOM 4084 C C . GLY A 1 514 ? 37.558 50.895 21.525 1.00 8.81 ? 514 GLY A C 1 ATOM 4085 O O . GLY A 1 514 ? 38.712 50.919 21.085 1.00 8.82 ? 514 GLY A O 1 ATOM 4086 N N . THR A 1 515 ? 37.268 50.423 22.736 1.00 9.13 ? 515 THR A N 1 ATOM 4087 C CA . THR A 1 515 ? 38.308 49.880 23.606 1.00 10.14 ? 515 THR A CA 1 ATOM 4088 C C . THR A 1 515 ? 38.194 48.364 23.633 1.00 10.81 ? 515 THR A C 1 ATOM 4089 O O . THR A 1 515 ? 39.106 47.675 24.077 1.00 11.91 ? 515 THR A O 1 ATOM 4090 C CB . THR A 1 515 ? 38.185 50.377 25.059 1.00 9.57 ? 515 THR A CB 1 ATOM 4091 O OG1 . THR A 1 515 ? 37.190 49.604 25.750 1.00 10.29 ? 515 THR A OG1 1 ATOM 4092 C CG2 . THR A 1 515 ? 37.804 51.850 25.088 1.00 9.09 ? 515 THR A CG2 1 ATOM 4093 N N . GLN A 1 516 ? 37.060 47.853 23.169 1.00 11.40 ? 516 GLN A N 1 ATOM 4094 C CA . GLN A 1 516 ? 36.826 46.419 23.132 1.00 13.21 ? 516 GLN A CA 1 ATOM 4095 C C . GLN A 1 516 ? 37.040 45.866 21.732 1.00 14.59 ? 516 GLN A C 1 ATOM 4096 O O . GLN A 1 516 ? 36.636 46.469 20.739 1.00 16.53 ? 516 GLN A O 1 ATOM 4097 C CB . GLN A 1 516 ? 35.412 46.101 23.597 1.00 13.66 ? 516 GLN A CB 1 ATOM 4098 C CG . GLN A 1 516 ? 35.243 46.157 25.095 1.00 17.69 ? 516 GLN A CG 1 ATOM 4099 C CD . GLN A 1 516 ? 35.942 45.009 25.802 1.00 20.90 ? 516 GLN A CD 1 ATOM 4100 O OE1 . GLN A 1 516 ? 35.643 43.828 25.554 1.00 22.33 ? 516 GLN A OE1 1 ATOM 4101 N NE2 . GLN A 1 516 ? 36.877 45.346 26.694 1.00 22.15 ? 516 GLN A NE2 1 ATOM 4102 N N . ASN A 1 517 ? 37.677 44.706 21.662 1.00 15.29 ? 517 ASN A N 1 ATOM 4103 C CA . ASN A 1 517 ? 37.968 44.060 20.396 1.00 14.63 ? 517 ASN A CA 1 ATOM 4104 C C . ASN A 1 517 ? 36.676 43.603 19.706 1.00 11.69 ? 517 ASN A C 1 ATOM 4105 O O . ASN A 1 517 ? 35.709 43.226 20.370 1.00 11.85 ? 517 ASN A O 1 ATOM 4106 C CB . ASN A 1 517 ? 38.890 42.864 20.675 1.00 19.78 ? 517 ASN A CB 1 ATOM 4107 C CG . ASN A 1 517 ? 39.523 42.286 19.412 1.00 25.39 ? 517 ASN A CG 1 ATOM 4108 O OD1 . ASN A 1 517 ? 38.829 41.790 18.512 1.00 27.09 ? 517 ASN A OD1 1 ATOM 4109 N ND2 . ASN A 1 517 ? 40.858 42.341 19.344 1.00 27.25 ? 517 ASN A ND2 1 ATOM 4110 N N . VAL A 1 518 ? 36.646 43.676 18.380 1.00 8.48 ? 518 VAL A N 1 ATOM 4111 C CA . VAL A 1 518 ? 35.496 43.198 17.614 1.00 7.22 ? 518 VAL A CA 1 ATOM 4112 C C . VAL A 1 518 ? 36.080 42.386 16.475 1.00 7.84 ? 518 VAL A C 1 ATOM 4113 O O . VAL A 1 518 ? 37.238 42.590 16.099 1.00 9.05 ? 518 VAL A O 1 ATOM 4114 C CB . VAL A 1 518 ? 34.657 44.320 16.997 1.00 4.93 ? 518 VAL A CB 1 ATOM 4115 C CG1 . VAL A 1 518 ? 34.190 45.257 18.067 1.00 6.53 ? 518 VAL A CG1 1 ATOM 4116 C CG2 . VAL A 1 518 ? 35.457 45.045 15.942 1.00 4.69 ? 518 VAL A CG2 1 ATOM 4117 N N . LYS A 1 519 ? 35.290 41.473 15.918 1.00 7.56 ? 519 LYS A N 1 ATOM 4118 C CA . LYS A 1 519 ? 35.776 40.644 14.823 1.00 7.28 ? 519 LYS A CA 1 ATOM 4119 C C . LYS A 1 519 ? 34.911 40.768 13.579 1.00 5.50 ? 519 LYS A C 1 ATOM 4120 O O . LYS A 1 519 ? 33.698 40.943 13.667 1.00 5.33 ? 519 LYS A O 1 ATOM 4121 C CB . LYS A 1 519 ? 35.830 39.178 15.261 1.00 10.65 ? 519 LYS A CB 1 ATOM 4122 C CG . LYS A 1 519 ? 36.431 38.232 14.218 1.00 15.43 ? 519 LYS A CG 1 ATOM 4123 C CD . LYS A 1 519 ? 36.204 36.751 14.566 1.00 19.13 ? 519 LYS A CD 1 ATOM 4124 C CE . LYS A 1 519 ? 37.010 36.306 15.783 1.00 22.17 ? 519 LYS A CE 1 ATOM 4125 N NZ . LYS A 1 519 ? 36.694 34.904 16.192 1.00 25.12 ? 519 LYS A NZ 1 ATOM 4126 N N . ILE A 1 520 ? 35.540 40.688 12.415 1.00 3.58 ? 520 ILE A N 1 ATOM 4127 C CA . ILE A 1 520 ? 34.793 40.758 11.178 1.00 1.76 ? 520 ILE A CA 1 ATOM 4128 C C . ILE A 1 520 ? 34.437 39.337 10.788 1.00 1.86 ? 520 ILE A C 1 ATOM 4129 O O . ILE A 1 520 ? 35.291 38.582 10.327 1.00 1.54 ? 520 ILE A O 1 ATOM 4130 C CB . ILE A 1 520 ? 35.613 41.373 10.055 1.00 0.96 ? 520 ILE A CB 1 ATOM 4131 C CG1 . ILE A 1 520 ? 36.059 42.773 10.452 1.00 0.96 ? 520 ILE A CG1 1 ATOM 4132 C CG2 . ILE A 1 520 ? 34.778 41.439 8.792 1.00 0.96 ? 520 ILE A CG2 1 ATOM 4133 C CD1 . ILE A 1 520 ? 36.858 43.468 9.388 1.00 0.96 ? 520 ILE A CD1 1 ATOM 4134 N N . SER A 1 521 ? 33.178 38.974 10.996 1.00 1.96 ? 521 SER A N 1 ATOM 4135 C CA . SER A 1 521 ? 32.698 37.645 10.658 1.00 3.47 ? 521 SER A CA 1 ATOM 4136 C C . SER A 1 521 ? 32.867 37.397 9.160 1.00 5.41 ? 521 SER A C 1 ATOM 4137 O O . SER A 1 521 ? 33.351 36.346 8.751 1.00 6.21 ? 521 SER A O 1 ATOM 4138 C CB . SER A 1 521 ? 31.231 37.510 11.052 1.00 3.02 ? 521 SER A CB 1 ATOM 4139 O OG . SER A 1 521 ? 30.717 36.247 10.671 1.00 5.58 ? 521 SER A OG 1 ATOM 4140 N N . GLU A 1 522 ? 32.447 38.364 8.348 1.00 7.47 ? 522 GLU A N 1 ATOM 4141 C CA . GLU A 1 522 ? 32.579 38.292 6.895 1.00 9.51 ? 522 GLU A CA 1 ATOM 4142 C C . GLU A 1 522 ? 32.419 39.695 6.303 1.00 8.81 ? 522 GLU A C 1 ATOM 4143 O O . GLU A 1 522 ? 31.596 40.490 6.765 1.00 8.94 ? 522 GLU A O 1 ATOM 4144 C CB . GLU A 1 522 ? 31.541 37.347 6.275 1.00 13.54 ? 522 GLU A CB 1 ATOM 4145 C CG . GLU A 1 522 ? 31.977 36.813 4.892 1.00 20.55 ? 522 GLU A CG 1 ATOM 4146 C CD . GLU A 1 522 ? 30.943 35.900 4.207 1.00 24.90 ? 522 GLU A CD 1 ATOM 4147 O OE1 . GLU A 1 522 ? 30.095 35.298 4.916 1.00 27.36 ? 522 GLU A OE1 1 ATOM 4148 O OE2 . GLU A 1 522 ? 31.000 35.773 2.955 1.00 25.56 ? 522 GLU A OE2 1 ATOM 4149 N N . MET A 1 523 ? 33.215 39.994 5.281 1.00 7.58 ? 523 MET A N 1 ATOM 4150 C CA . MET A 1 523 ? 33.177 41.296 4.634 1.00 6.47 ? 523 MET A CA 1 ATOM 4151 C C . MET A 1 523 ? 33.229 41.114 3.118 1.00 7.57 ? 523 MET A C 1 ATOM 4152 O O . MET A 1 523 ? 34.287 40.824 2.558 1.00 8.29 ? 523 MET A O 1 ATOM 4153 C CB . MET A 1 523 ? 34.372 42.122 5.117 1.00 4.78 ? 523 MET A CB 1 ATOM 4154 C CG . MET A 1 523 ? 34.311 43.628 4.864 1.00 3.50 ? 523 MET A CG 1 ATOM 4155 S SD . MET A 1 523 ? 34.426 44.135 3.146 1.00 0.96 ? 523 MET A SD 1 ATOM 4156 C CE . MET A 1 523 ? 36.017 43.485 2.708 1.00 1.22 ? 523 MET A CE 1 ATOM 4157 N N . SER A 1 524 ? 32.082 41.260 2.457 1.00 8.75 ? 524 SER A N 1 ATOM 4158 C CA . SER A 1 524 ? 32.011 41.124 1.001 1.00 10.47 ? 524 SER A CA 1 ATOM 4159 C C . SER A 1 524 ? 31.917 42.496 0.352 1.00 10.94 ? 524 SER A C 1 ATOM 4160 O O . SER A 1 524 ? 30.968 43.241 0.614 1.00 12.61 ? 524 SER A O 1 ATOM 4161 C CB . SER A 1 524 ? 30.786 40.304 0.577 1.00 11.94 ? 524 SER A CB 1 ATOM 4162 O OG . SER A 1 524 ? 31.050 38.909 0.560 1.00 13.98 ? 524 SER A OG 1 ATOM 4163 N N . ALA A 1 525 ? 32.893 42.824 -0.495 1.00 10.38 ? 525 ALA A N 1 ATOM 4164 C CA . ALA A 1 525 ? 32.913 44.112 -1.192 1.00 9.20 ? 525 ALA A CA 1 ATOM 4165 C C . ALA A 1 525 ? 33.040 43.932 -2.706 1.00 8.56 ? 525 ALA A C 1 ATOM 4166 O O . ALA A 1 525 ? 33.898 43.189 -3.188 1.00 9.08 ? 525 ALA A O 1 ATOM 4167 C CB . ALA A 1 525 ? 34.058 44.972 -0.669 1.00 7.75 ? 525 ALA A CB 1 ATOM 4168 N N . TRP A 1 526 ? 32.178 44.616 -3.452 1.00 7.44 ? 526 TRP A N 1 ATOM 4169 C CA . TRP A 1 526 ? 32.195 44.541 -4.909 1.00 5.76 ? 526 TRP A CA 1 ATOM 4170 C C . TRP A 1 526 ? 32.375 45.912 -5.531 1.00 4.12 ? 526 TRP A C 1 ATOM 4171 O O . TRP A 1 526 ? 31.829 46.899 -5.044 1.00 2.64 ? 526 TRP A O 1 ATOM 4172 C CB . TRP A 1 526 ? 30.880 43.983 -5.438 1.00 6.71 ? 526 TRP A CB 1 ATOM 4173 C CG . TRP A 1 526 ? 30.698 42.539 -5.319 1.00 8.09 ? 526 TRP A CG 1 ATOM 4174 C CD1 . TRP A 1 526 ? 31.139 41.586 -6.182 1.00 10.02 ? 526 TRP A CD1 1 ATOM 4175 C CD2 . TRP A 1 526 ? 29.938 41.865 -4.325 1.00 10.59 ? 526 TRP A CD2 1 ATOM 4176 N NE1 . TRP A 1 526 ? 30.690 40.348 -5.793 1.00 11.14 ? 526 TRP A NE1 1 ATOM 4177 C CE2 . TRP A 1 526 ? 29.947 40.492 -4.652 1.00 11.91 ? 526 TRP A CE2 1 ATOM 4178 C CE3 . TRP A 1 526 ? 29.244 42.287 -3.183 1.00 12.69 ? 526 TRP A CE3 1 ATOM 4179 C CZ2 . TRP A 1 526 ? 29.283 39.532 -3.877 1.00 14.50 ? 526 TRP A CZ2 1 ATOM 4180 C CZ3 . TRP A 1 526 ? 28.584 41.334 -2.409 1.00 14.59 ? 526 TRP A CZ3 1 ATOM 4181 C CH2 . TRP A 1 526 ? 28.608 39.970 -2.762 1.00 15.54 ? 526 TRP A CH2 1 ATOM 4182 N N . SER A 1 527 ? 33.134 45.963 -6.615 1.00 3.56 ? 527 SER A N 1 ATOM 4183 C CA . SER A 1 527 ? 33.332 47.206 -7.334 1.00 4.38 ? 527 SER A CA 1 ATOM 4184 C C . SER A 1 527 ? 32.102 47.287 -8.221 1.00 4.96 ? 527 SER A C 1 ATOM 4185 O O . SER A 1 527 ? 31.758 46.308 -8.870 1.00 6.39 ? 527 SER A O 1 ATOM 4186 C CB . SER A 1 527 ? 34.585 47.138 -8.210 1.00 4.53 ? 527 SER A CB 1 ATOM 4187 O OG . SER A 1 527 ? 35.774 47.074 -7.438 1.00 6.29 ? 527 SER A OG 1 ATOM 4188 N N . MET A 1 528 ? 31.435 48.435 -8.252 1.00 5.68 ? 528 MET A N 1 ATOM 4189 C CA . MET A 1 528 ? 30.237 48.602 -9.075 1.00 5.10 ? 528 MET A CA 1 ATOM 4190 C C . MET A 1 528 ? 30.517 49.373 -10.368 1.00 5.59 ? 528 MET A C 1 ATOM 4191 O O . MET A 1 528 ? 31.115 50.450 -10.331 1.00 4.98 ? 528 MET A O 1 ATOM 4192 C CB . MET A 1 528 ? 29.174 49.335 -8.270 1.00 4.75 ? 528 MET A CB 1 ATOM 4193 C CG . MET A 1 528 ? 28.713 48.584 -7.053 1.00 4.39 ? 528 MET A CG 1 ATOM 4194 S SD . MET A 1 528 ? 27.746 47.177 -7.542 1.00 3.20 ? 528 MET A SD 1 ATOM 4195 C CE . MET A 1 528 ? 26.100 47.808 -7.366 1.00 4.13 ? 528 MET A CE 1 ATOM 4196 N N . LYS A 1 529 ? 30.084 48.821 -11.502 1.00 6.74 ? 529 LYS A N 1 ATOM 4197 C CA . LYS A 1 529 ? 30.286 49.463 -12.806 1.00 8.27 ? 529 LYS A CA 1 ATOM 4198 C C . LYS A 1 529 ? 29.153 50.448 -13.070 1.00 8.18 ? 529 LYS A C 1 ATOM 4199 O O . LYS A 1 529 ? 28.092 50.344 -12.462 1.00 8.96 ? 529 LYS A O 1 ATOM 4200 C CB . LYS A 1 529 ? 30.328 48.418 -13.925 1.00 9.61 ? 529 LYS A CB 1 ATOM 4201 C CG . LYS A 1 529 ? 29.002 47.729 -14.175 1.00 11.42 ? 529 LYS A CG 1 ATOM 4202 C CD . LYS A 1 529 ? 29.078 46.721 -15.326 1.00 13.55 ? 529 LYS A CD 1 ATOM 4203 C CE . LYS A 1 529 ? 27.727 46.022 -15.533 1.00 15.21 ? 529 LYS A CE 1 ATOM 4204 N NZ . LYS A 1 529 ? 27.760 44.861 -16.474 1.00 15.90 ? 529 LYS A NZ 1 ATOM 4205 N N . ASN A 1 530 ? 29.362 51.391 -13.982 1.00 8.26 ? 530 ASN A N 1 ATOM 4206 C CA . ASN A 1 530 ? 28.336 52.388 -14.259 1.00 9.19 ? 530 ASN A CA 1 ATOM 4207 C C . ASN A 1 530 ? 27.041 51.831 -14.832 1.00 8.58 ? 530 ASN A C 1 ATOM 4208 O O . ASN A 1 530 ? 27.017 50.781 -15.475 1.00 6.91 ? 530 ASN A O 1 ATOM 4209 C CB . ASN A 1 530 ? 28.862 53.460 -15.214 1.00 12.14 ? 530 ASN A CB 1 ATOM 4210 C CG . ASN A 1 530 ? 30.239 53.943 -14.841 1.00 14.85 ? 530 ASN A CG 1 ATOM 4211 O OD1 . ASN A 1 530 ? 31.225 53.213 -14.992 1.00 16.76 ? 530 ASN A OD1 1 ATOM 4212 N ND2 . ASN A 1 530 ? 30.323 55.178 -14.345 1.00 16.07 ? 530 ASN A ND2 1 ATOM 4213 N N . ALA A 1 531 ? 25.963 52.563 -14.581 1.00 8.52 ? 531 ALA A N 1 ATOM 4214 C CA . ALA A 1 531 ? 24.651 52.204 -15.080 1.00 8.99 ? 531 ALA A CA 1 ATOM 4215 C C . ALA A 1 531 ? 24.534 52.885 -16.436 1.00 9.84 ? 531 ALA A C 1 ATOM 4216 O O . ALA A 1 531 ? 25.033 54.002 -16.618 1.00 10.14 ? 531 ALA A O 1 ATOM 4217 C CB . ALA A 1 531 ? 23.582 52.718 -14.140 1.00 8.84 ? 531 ALA A CB 1 ATOM 4218 N N . LYS A 1 532 ? 23.885 52.214 -17.383 1.00 10.16 ? 532 LYS A N 1 ATOM 4219 C CA . LYS A 1 532 ? 23.726 52.754 -18.727 1.00 10.17 ? 532 LYS A CA 1 ATOM 4220 C C . LYS A 1 532 ? 22.559 53.737 -18.816 1.00 9.14 ? 532 LYS A C 1 ATOM 4221 O O . LYS A 1 532 ? 21.432 53.413 -18.441 1.00 9.90 ? 532 LYS A O 1 ATOM 4222 C CB . LYS A 1 532 ? 23.536 51.605 -19.726 1.00 12.40 ? 532 LYS A CB 1 ATOM 4223 C CG . LYS A 1 532 ? 24.753 50.681 -19.848 1.00 16.65 ? 532 LYS A CG 1 ATOM 4224 C CD . LYS A 1 532 ? 24.443 49.374 -20.611 1.00 21.38 ? 532 LYS A CD 1 ATOM 4225 C CE . LYS A 1 532 ? 25.668 48.420 -20.631 1.00 24.49 ? 532 LYS A CE 1 ATOM 4226 N NZ . LYS A 1 532 ? 25.424 47.067 -21.251 1.00 25.66 ? 532 LYS A NZ 1 ATOM 4227 N N . PHE A 1 533 ? 22.844 54.938 -19.313 1.00 7.36 ? 533 PHE A N 1 ATOM 4228 C CA . PHE A 1 533 ? 21.837 55.978 -19.467 1.00 6.07 ? 533 PHE A CA 1 ATOM 4229 C C . PHE A 1 533 ? 21.764 56.525 -20.893 1.00 7.26 ? 533 PHE A C 1 ATOM 4230 O O . PHE A 1 533 ? 22.460 57.475 -21.247 1.00 8.50 ? 533 PHE A O 1 ATOM 4231 C CB . PHE A 1 533 ? 22.149 57.108 -18.526 1.00 4.89 ? 533 PHE A CB 1 ATOM 4232 C CG . PHE A 1 533 ? 21.806 56.822 -17.111 1.00 3.78 ? 533 PHE A CG 1 ATOM 4233 C CD1 . PHE A 1 533 ? 20.489 56.856 -16.689 1.00 3.71 ? 533 PHE A CD1 1 ATOM 4234 C CD2 . PHE A 1 533 ? 22.802 56.595 -16.175 1.00 4.79 ? 533 PHE A CD2 1 ATOM 4235 C CE1 . PHE A 1 533 ? 20.162 56.678 -15.347 1.00 2.91 ? 533 PHE A CE1 1 ATOM 4236 C CE2 . PHE A 1 533 ? 22.487 56.414 -14.831 1.00 4.17 ? 533 PHE A CE2 1 ATOM 4237 C CZ . PHE A 1 533 ? 21.162 56.460 -14.417 1.00 2.72 ? 533 PHE A CZ 1 ATOM 4238 N N . VAL A 1 534 ? 20.902 55.928 -21.705 1.00 8.40 ? 534 VAL A N 1 ATOM 4239 C CA . VAL A 1 534 ? 20.723 56.334 -23.087 1.00 9.55 ? 534 VAL A CA 1 ATOM 4240 C C . VAL A 1 534 ? 19.758 57.505 -23.202 1.00 9.77 ? 534 VAL A C 1 ATOM 4241 O O . VAL A 1 534 ? 18.859 57.665 -22.380 1.00 9.82 ? 534 VAL A O 1 ATOM 4242 C CB . VAL A 1 534 ? 20.158 55.174 -23.904 1.00 10.27 ? 534 VAL A CB 1 ATOM 4243 C CG1 . VAL A 1 534 ? 19.928 55.601 -25.341 1.00 12.52 ? 534 VAL A CG1 1 ATOM 4244 C CG2 . VAL A 1 534 ? 21.111 53.991 -23.839 1.00 13.45 ? 534 VAL A CG2 1 ATOM 4245 N N . VAL A 1 535 ? 19.940 58.317 -24.236 1.00 11.61 ? 535 VAL A N 1 ATOM 4246 C CA . VAL A 1 535 ? 19.067 59.464 -24.466 1.00 12.66 ? 535 VAL A CA 1 ATOM 4247 C C . VAL A 1 535 ? 18.406 59.442 -25.849 1.00 14.52 ? 535 VAL A C 1 ATOM 4248 O O . VAL A 1 535 ? 19.076 59.428 -26.890 1.00 13.98 ? 535 VAL A O 1 ATOM 4249 C CB . VAL A 1 535 ? 19.825 60.788 -24.307 1.00 10.12 ? 535 VAL A CB 1 ATOM 4250 C CG1 . VAL A 1 535 ? 18.857 61.947 -24.415 1.00 7.49 ? 535 VAL A CG1 1 ATOM 4251 C CG2 . VAL A 1 535 ? 20.540 60.812 -22.978 1.00 9.21 ? 535 VAL A CG2 1 ATOM 4252 N N . ASP A 1 536 ? 17.076 59.438 -25.820 1.00 17.99 ? 536 ASP A N 1 ATOM 4253 C CA . ASP A 1 536 ? 16.218 59.425 -27.002 1.00 21.66 ? 536 ASP A CA 1 ATOM 4254 C C . ASP A 1 536 ? 15.159 60.512 -26.787 1.00 23.35 ? 536 ASP A C 1 ATOM 4255 O O . ASP A 1 536 ? 14.035 60.209 -26.376 1.00 24.00 ? 536 ASP A O 1 ATOM 4256 C CB . ASP A 1 536 ? 15.540 58.050 -27.138 1.00 22.05 ? 536 ASP A CB 1 ATOM 4257 C CG . ASP A 1 536 ? 14.398 58.035 -28.157 1.00 23.99 ? 536 ASP A CG 1 ATOM 4258 O OD1 . ASP A 1 536 ? 13.689 57.001 -28.217 1.00 23.73 ? 536 ASP A OD1 1 ATOM 4259 O OD2 . ASP A 1 536 ? 14.206 59.032 -28.896 1.00 25.54 ? 536 ASP A OD2 1 ATOM 4260 N N . GLN A 1 537 ? 15.522 61.769 -27.057 1.00 24.88 ? 537 GLN A N 1 ATOM 4261 C CA . GLN A 1 537 ? 14.606 62.901 -26.887 1.00 26.15 ? 537 GLN A CA 1 ATOM 4262 C C . GLN A 1 537 ? 14.225 63.626 -28.193 1.00 27.50 ? 537 GLN A C 1 ATOM 4263 O O . GLN A 1 537 ? 13.246 63.250 -28.859 1.00 27.28 ? 537 GLN A O 1 ATOM 4264 C CB . GLN A 1 537 ? 15.200 63.899 -25.885 1.00 25.57 ? 537 GLN A CB 1 ATOM 4265 C CG . GLN A 1 537 ? 15.211 63.394 -24.440 1.00 26.22 ? 537 GLN A CG 1 ATOM 4266 C CD . GLN A 1 537 ? 15.903 64.350 -23.473 1.00 26.99 ? 537 GLN A CD 1 ATOM 4267 O OE1 . GLN A 1 537 ? 15.754 64.233 -22.252 1.00 26.17 ? 537 GLN A OE1 1 ATOM 4268 N NE2 . GLN A 1 537 ? 16.674 65.293 -24.014 1.00 26.96 ? 537 GLN A NE2 1 ATOM 4269 N N . SER A 1 538 ? 14.991 64.663 -28.545 1.00 29.41 ? 538 SER A N 1 ATOM 4270 C CA . SER A 1 538 ? 14.750 65.461 -29.761 1.00 30.52 ? 538 SER A CA 1 ATOM 4271 C C . SER A 1 538 ? 13.346 66.080 -29.742 1.00 29.72 ? 538 SER A C 1 ATOM 4272 O O . SER A 1 538 ? 13.134 67.144 -29.156 1.00 28.28 ? 538 SER A O 1 ATOM 4273 C CB . SER A 1 538 ? 14.936 64.588 -31.031 1.00 32.27 ? 538 SER A CB 1 ATOM 4274 O OG . SER A 1 538 ? 14.779 65.327 -32.246 1.00 31.67 ? 538 SER A OG 1 HETATM 4275 C C1 . NAG B 2 . ? 39.024 57.699 16.626 1.00 8.74 ? 650 NAG A C1 1 HETATM 4276 C C2 . NAG B 2 . ? 39.384 58.429 15.339 1.00 8.84 ? 650 NAG A C2 1 HETATM 4277 C C3 . NAG B 2 . ? 40.639 59.287 15.484 1.00 9.16 ? 650 NAG A C3 1 HETATM 4278 C C4 . NAG B 2 . ? 40.570 60.060 16.803 1.00 11.03 ? 650 NAG A C4 1 HETATM 4279 C C5 . NAG B 2 . ? 40.545 59.077 17.964 1.00 10.22 ? 650 NAG A C5 1 HETATM 4280 C C6 . NAG B 2 . ? 39.652 59.534 19.087 1.00 10.20 ? 650 NAG A C6 1 HETATM 4281 C C7 . NAG B 2 . ? 39.222 57.773 13.055 1.00 16.01 ? 650 NAG A C7 1 HETATM 4282 C C8 . NAG B 2 . ? 40.337 57.912 12.021 1.00 17.61 ? 650 NAG A C8 1 HETATM 4283 N N2 . NAG B 2 . ? 39.584 57.459 14.290 1.00 11.99 ? 650 NAG A N2 1 HETATM 4284 O O3 . NAG B 2 . ? 40.712 60.185 14.390 1.00 7.92 ? 650 NAG A O3 1 HETATM 4285 O O4 . NAG B 2 . ? 41.700 60.956 16.971 1.00 16.06 ? 650 NAG A O4 1 HETATM 4286 O O5 . NAG B 2 . ? 40.125 57.738 17.553 1.00 10.96 ? 650 NAG A O5 1 HETATM 4287 O O6 . NAG B 2 . ? 40.068 60.807 19.562 1.00 9.34 ? 650 NAG A O6 1 HETATM 4288 O O7 . NAG B 2 . ? 38.043 57.982 12.739 1.00 16.05 ? 650 NAG A O7 1 HETATM 4289 C C1 . NAG C 2 . ? 41.855 62.023 16.079 1.00 22.93 ? 660 NAG A C1 1 HETATM 4290 C C2 . NAG C 2 . ? 40.641 62.983 16.071 1.00 25.14 ? 660 NAG A C2 1 HETATM 4291 C C3 . NAG C 2 . ? 40.722 64.182 17.035 1.00 27.16 ? 660 NAG A C3 1 HETATM 4292 C C4 . NAG C 2 . ? 42.138 64.686 17.366 1.00 27.67 ? 660 NAG A C4 1 HETATM 4293 C C5 . NAG C 2 . ? 43.196 63.573 17.444 1.00 24.64 ? 660 NAG A C5 1 HETATM 4294 C C6 . NAG C 2 . ? 43.178 62.729 18.708 1.00 22.06 ? 660 NAG A C6 1 HETATM 4295 C C7 . NAG C 2 . ? 41.245 64.157 14.057 1.00 28.01 ? 660 NAG A C7 1 HETATM 4296 C C8 . NAG C 2 . ? 42.253 63.398 13.185 1.00 26.82 ? 660 NAG A C8 1 HETATM 4297 N N2 . NAG C 2 . ? 40.348 63.444 14.729 1.00 25.53 ? 660 NAG A N2 1 HETATM 4298 O O3 . NAG C 2 . ? 40.051 63.863 18.245 1.00 31.73 ? 660 NAG A O3 1 HETATM 4299 O O4 . NAG C 2 . ? 42.553 65.721 16.443 1.00 31.65 ? 660 NAG A O4 1 HETATM 4300 O O5 . NAG C 2 . ? 43.128 62.687 16.294 1.00 25.21 ? 660 NAG A O5 1 HETATM 4301 O O6 . NAG C 2 . ? 44.269 61.824 18.726 1.00 18.55 ? 660 NAG A O6 1 HETATM 4302 O O7 . NAG C 2 . ? 41.283 65.389 14.117 1.00 30.03 ? 660 NAG A O7 1 HETATM 4303 C C1 . MAN D 3 . ? 42.945 66.931 17.024 1.00 34.94 ? 670 MAN A C1 1 HETATM 4304 C C2 . MAN D 3 . ? 41.721 67.821 17.354 1.00 35.35 ? 670 MAN A C2 1 HETATM 4305 C C3 . MAN D 3 . ? 41.095 68.401 16.071 1.00 36.14 ? 670 MAN A C3 1 HETATM 4306 C C4 . MAN D 3 . ? 42.172 69.124 15.253 1.00 37.06 ? 670 MAN A C4 1 HETATM 4307 C C5 . MAN D 3 . ? 43.298 68.118 14.929 1.00 37.19 ? 670 MAN A C5 1 HETATM 4308 C C6 . MAN D 3 . ? 44.434 68.701 14.094 1.00 37.50 ? 670 MAN A C6 1 HETATM 4309 O O2 . MAN D 3 . ? 42.122 68.876 18.221 1.00 34.35 ? 670 MAN A O2 1 HETATM 4310 O O3 . MAN D 3 . ? 40.032 69.297 16.388 1.00 36.10 ? 670 MAN A O3 1 HETATM 4311 O O4 . MAN D 3 . ? 41.603 69.652 14.056 1.00 37.51 ? 670 MAN A O4 1 HETATM 4312 O O5 . MAN D 3 . ? 43.887 67.613 16.157 1.00 36.31 ? 670 MAN A O5 1 HETATM 4313 O O6 . MAN D 3 . ? 44.416 68.197 12.762 1.00 37.45 ? 670 MAN A O6 1 HETATM 4314 C C1 . NAG E 2 . ? 2.586 55.424 -31.730 1.00 25.32 ? 680 NAG A C1 1 HETATM 4315 C C2 . NAG E 2 . ? 3.167 56.351 -32.802 1.00 26.58 ? 680 NAG A C2 1 HETATM 4316 C C3 . NAG E 2 . ? 3.802 55.540 -33.935 1.00 29.05 ? 680 NAG A C3 1 HETATM 4317 C C4 . NAG E 2 . ? 4.821 54.519 -33.384 1.00 31.01 ? 680 NAG A C4 1 HETATM 4318 C C5 . NAG E 2 . ? 4.166 53.696 -32.258 1.00 29.38 ? 680 NAG A C5 1 HETATM 4319 C C6 . NAG E 2 . ? 5.143 52.756 -31.566 1.00 28.38 ? 680 NAG A C6 1 HETATM 4320 C C7 . NAG E 2 . ? 2.123 58.499 -33.030 1.00 26.59 ? 680 NAG A C7 1 HETATM 4321 C C8 . NAG E 2 . ? 0.774 59.101 -32.666 1.00 26.24 ? 680 NAG A C8 1 HETATM 4322 N N2 . NAG E 2 . ? 2.136 57.209 -33.346 1.00 26.06 ? 680 NAG A N2 1 HETATM 4323 O O3 . NAG E 2 . ? 4.444 56.428 -34.843 1.00 29.25 ? 680 NAG A O3 1 HETATM 4324 O O4 . NAG E 2 . ? 5.249 53.627 -34.447 1.00 35.33 ? 680 NAG A O4 1 HETATM 4325 O O5 . NAG E 2 . ? 3.625 54.569 -31.237 1.00 27.42 ? 680 NAG A O5 1 HETATM 4326 O O6 . NAG E 2 . ? 6.385 53.395 -31.311 1.00 26.87 ? 680 NAG A O6 1 HETATM 4327 O O7 . NAG E 2 . ? 3.142 59.198 -33.012 1.00 25.87 ? 680 NAG A O7 1 HETATM 4328 C C1 . NAG F 2 . ? 6.588 53.638 -34.838 1.00 38.28 ? 690 NAG A C1 1 HETATM 4329 C C2 . NAG F 2 . ? 6.847 52.422 -35.740 1.00 39.65 ? 690 NAG A C2 1 HETATM 4330 C C3 . NAG F 2 . ? 8.281 52.451 -36.292 1.00 42.40 ? 690 NAG A C3 1 HETATM 4331 C C4 . NAG F 2 . ? 8.529 53.793 -37.009 1.00 43.37 ? 690 NAG A C4 1 HETATM 4332 C C5 . NAG F 2 . ? 8.187 54.974 -36.082 1.00 42.59 ? 690 NAG A C5 1 HETATM 4333 C C6 . NAG F 2 . ? 8.275 56.301 -36.833 1.00 42.43 ? 690 NAG A C6 1 HETATM 4334 C C7 . NAG F 2 . ? 5.371 50.668 -35.008 1.00 35.88 ? 690 NAG A C7 1 HETATM 4335 C C8 . NAG F 2 . ? 5.069 49.614 -33.949 1.00 35.56 ? 690 NAG A C8 1 HETATM 4336 N N2 . NAG F 2 . ? 6.597 51.187 -35.021 1.00 37.03 ? 690 NAG A N2 1 HETATM 4337 O O3 . NAG F 2 . ? 8.461 51.375 -37.212 1.00 44.71 ? 690 NAG A O3 1 HETATM 4338 O O4 . NAG F 2 . ? 9.889 53.887 -37.432 1.00 44.23 ? 690 NAG A O4 1 HETATM 4339 O O5 . NAG F 2 . ? 6.827 54.854 -35.580 1.00 41.32 ? 690 NAG A O5 1 HETATM 4340 O O6 . NAG F 2 . ? 7.619 57.350 -36.132 1.00 42.63 ? 690 NAG A O6 1 HETATM 4341 O O7 . NAG F 2 . ? 4.492 51.009 -35.805 1.00 34.26 ? 690 NAG A O7 1 HETATM 4342 N N1 . DQQ G 4 . ? 7.188 69.161 -3.801 1.00 1.15 ? 801 DQQ A N1 1 HETATM 4343 C C1 . DQQ G 4 . ? 6.587 68.682 -2.531 1.00 1.75 ? 801 DQQ A C1 1 HETATM 4344 C C2 . DQQ G 4 . ? 5.238 68.090 -2.921 1.00 0.96 ? 801 DQQ A C2 1 HETATM 4345 C C3 . DQQ G 4 . ? 4.887 68.937 -4.111 1.00 1.54 ? 801 DQQ A C3 1 HETATM 4346 C C4 . DQQ G 4 . ? 6.216 68.884 -4.873 1.00 1.72 ? 801 DQQ A C4 1 HETATM 4347 C C5 . DQQ G 4 . ? 7.465 67.681 -1.810 1.00 2.17 ? 801 DQQ A C5 1 HETATM 4348 C C6 . DQQ G 4 . ? 6.342 69.930 -5.947 1.00 1.83 ? 801 DQQ A C6 1 HETATM 4349 O O1 . DQQ G 4 . ? 4.283 68.252 -1.893 1.00 0.96 ? 801 DQQ A O1 1 HETATM 4350 O O2 . DQQ G 4 . ? 3.801 68.397 -4.855 1.00 1.17 ? 801 DQQ A O2 1 HETATM 4351 O O3 . DQQ G 4 . ? 8.790 68.167 -1.618 1.00 4.29 ? 801 DQQ A O3 1 HETATM 4352 O O4 . DQQ G 4 . ? 7.599 69.815 -6.594 1.00 3.41 ? 801 DQQ A O4 1 HETATM 4353 O O . HOH H 5 . ? 29.061 72.566 8.117 1.00 0.96 ? 1001 HOH A O 1 HETATM 4354 O O . HOH H 5 . ? 41.241 51.146 -5.570 1.00 6.10 ? 1002 HOH A O 1 HETATM 4355 O O . HOH H 5 . ? 12.026 52.521 -38.220 1.00 4.47 ? 1003 HOH A O 1 HETATM 4356 O O . HOH H 5 . ? 9.310 71.683 -3.247 1.00 0.96 ? 1004 HOH A O 1 HETATM 4357 O O . HOH H 5 . ? -9.111 46.805 -0.928 1.00 0.96 ? 1005 HOH A O 1 HETATM 4358 O O . HOH H 5 . ? -7.973 74.609 -21.472 1.00 4.88 ? 1006 HOH A O 1 HETATM 4359 O O . HOH H 5 . ? 18.520 55.384 -8.547 1.00 4.68 ? 1007 HOH A O 1 HETATM 4360 O O . HOH H 5 . ? 1.634 52.169 -9.691 1.00 0.96 ? 1008 HOH A O 1 HETATM 4361 O O . HOH H 5 . ? 0.869 51.355 -4.947 1.00 2.20 ? 1009 HOH A O 1 HETATM 4362 O O . HOH H 5 . ? 30.969 75.803 7.386 1.00 15.55 ? 1010 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 GLN 1 1 ? ? ? A . n A 1 2 GLN 2 2 2 GLN GLN 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 GLN 5 5 5 GLN GLN A . n A 1 6 PRO 6 6 6 PRO PRO A . n A 1 7 TYR 7 7 7 TYR TYR A . n A 1 8 ARG 8 8 8 ARG ARG A . n A 1 9 THR 9 9 9 THR THR A . n A 1 10 GLY 10 10 10 GLY GLY A . n A 1 11 TYR 11 11 11 TYR TYR A . n A 1 12 HIS 12 12 12 HIS HIS A . n A 1 13 PHE 13 13 13 PHE PHE A . n A 1 14 GLN 14 14 14 GLN GLN A . n A 1 15 PRO 15 15 15 PRO PRO A . n A 1 16 PRO 16 16 16 PRO PRO A . n A 1 17 SER 17 17 17 SER SER A . n A 1 18 ASN 18 18 18 ASN ASN A . n A 1 19 TRP 19 19 19 TRP TRP A . n A 1 20 MET 20 20 20 MET MET A . n A 1 21 ASN 21 21 21 ASN ASN A . n A 1 22 ASP 22 22 22 ASP ASP A . n A 1 23 PRO 23 23 23 PRO PRO A . n A 1 24 ASN 24 24 24 ASN ASN A . n A 1 25 GLY 25 25 25 GLY GLY A . n A 1 26 PRO 26 26 26 PRO PRO A . n A 1 27 MET 27 27 27 MET MET A . n A 1 28 LEU 28 28 28 LEU LEU A . n A 1 29 TYR 29 29 29 TYR TYR A . n A 1 30 GLN 30 30 30 GLN GLN A . n A 1 31 GLY 31 31 31 GLY GLY A . n A 1 32 VAL 32 32 32 VAL VAL A . n A 1 33 TYR 33 33 33 TYR TYR A . n A 1 34 HIS 34 34 34 HIS HIS A . n A 1 35 PHE 35 35 35 PHE PHE A . n A 1 36 PHE 36 36 36 PHE PHE A . n A 1 37 TYR 37 37 37 TYR TYR A . n A 1 38 GLN 38 38 38 GLN GLN A . n A 1 39 TYR 39 39 39 TYR TYR A . n A 1 40 ASN 40 40 40 ASN ASN A . n A 1 41 PRO 41 41 41 PRO PRO A . n A 1 42 TYR 42 42 42 TYR TYR A . n A 1 43 ALA 43 43 43 ALA ALA A . n A 1 44 ALA 44 44 44 ALA ALA A . n A 1 45 THR 45 45 45 THR THR A . n A 1 46 PHE 46 46 46 PHE PHE A . n A 1 47 GLY 47 47 47 GLY GLY A . n A 1 48 ASP 48 48 48 ASP ASP A . n A 1 49 VAL 49 49 49 VAL VAL A . n A 1 50 ILE 50 50 50 ILE ILE A . n A 1 51 ILE 51 51 51 ILE ILE A . n A 1 52 TRP 52 52 52 TRP TRP A . n A 1 53 GLY 53 53 53 GLY GLY A . n A 1 54 HIS 54 54 54 HIS HIS A . n A 1 55 ALA 55 55 55 ALA ALA A . n A 1 56 VAL 56 56 56 VAL VAL A . n A 1 57 SER 57 57 57 SER SER A . n A 1 58 TYR 58 58 58 TYR TYR A . n A 1 59 ASP 59 59 59 ASP ASP A . n A 1 60 LEU 60 60 60 LEU LEU A . n A 1 61 VAL 61 61 61 VAL VAL A . n A 1 62 ASN 62 62 62 ASN ASN A . n A 1 63 TRP 63 63 63 TRP TRP A . n A 1 64 ILE 64 64 64 ILE ILE A . n A 1 65 HIS 65 65 65 HIS HIS A . n A 1 66 LEU 66 66 66 LEU LEU A . n A 1 67 ASP 67 67 67 ASP ASP A . n A 1 68 PRO 68 68 68 PRO PRO A . n A 1 69 ALA 69 69 69 ALA ALA A . n A 1 70 ILE 70 70 70 ILE ILE A . n A 1 71 TYR 71 71 71 TYR TYR A . n A 1 72 PRO 72 72 72 PRO PRO A . n A 1 73 THR 73 73 73 THR THR A . n A 1 74 GLN 74 74 74 GLN GLN A . n A 1 75 GLU 75 75 75 GLU GLU A . n A 1 76 ALA 76 76 76 ALA ALA A . n A 1 77 ASP 77 77 77 ASP ASP A . n A 1 78 SER 78 78 78 SER SER A . n A 1 79 LYS 79 79 79 LYS LYS A . n A 1 80 SER 80 80 80 SER SER A . n A 1 81 CYS 81 81 81 CYS CYS A . n A 1 82 TRP 82 82 82 TRP TRP A . n A 1 83 SER 83 83 83 SER SER A . n A 1 84 GLY 84 84 84 GLY GLY A . n A 1 85 SER 85 85 85 SER SER A . n A 1 86 ALA 86 86 86 ALA ALA A . n A 1 87 THR 87 87 87 THR THR A . n A 1 88 ILE 88 88 88 ILE ILE A . n A 1 89 LEU 89 89 89 LEU LEU A . n A 1 90 PRO 90 90 90 PRO PRO A . n A 1 91 GLY 91 91 91 GLY GLY A . n A 1 92 ASN 92 92 92 ASN ASN A . n A 1 93 ILE 93 93 93 ILE ILE A . n A 1 94 PRO 94 94 94 PRO PRO A . n A 1 95 ALA 95 95 95 ALA ALA A . n A 1 96 MET 96 96 96 MET MET A . n A 1 97 LEU 97 97 97 LEU LEU A . n A 1 98 TYR 98 98 98 TYR TYR A . n A 1 99 THR 99 99 99 THR THR A . n A 1 100 GLY 100 100 100 GLY GLY A . n A 1 101 SER 101 101 101 SER SER A . n A 1 102 ASP 102 102 102 ASP ASP A . n A 1 103 SER 103 103 103 SER SER A . n A 1 104 LYS 104 104 104 LYS LYS A . n A 1 105 SER 105 105 105 SER SER A . n A 1 106 ARG 106 106 106 ARG ARG A . n A 1 107 GLN 107 107 107 GLN GLN A . n A 1 108 VAL 108 108 108 VAL VAL A . n A 1 109 GLN 109 109 109 GLN GLN A . n A 1 110 ASP 110 110 110 ASP ASP A . n A 1 111 LEU 111 111 111 LEU LEU A . n A 1 112 ALA 112 112 112 ALA ALA A . n A 1 113 TRP 113 113 113 TRP TRP A . n A 1 114 PRO 114 114 114 PRO PRO A . n A 1 115 LYS 115 115 115 LYS LYS A . n A 1 116 ASN 116 116 116 ASN ASN A . n A 1 117 LEU 117 117 117 LEU LEU A . n A 1 118 SER 118 118 118 SER SER A . n A 1 119 ASP 119 119 119 ASP ASP A . n A 1 120 PRO 120 120 120 PRO PRO A . n A 1 121 PHE 121 121 121 PHE PHE A . n A 1 122 LEU 122 122 122 LEU LEU A . n A 1 123 ARG 123 123 123 ARG ARG A . n A 1 124 GLU 124 124 124 GLU GLU A . n A 1 125 TRP 125 125 125 TRP TRP A . n A 1 126 VAL 126 126 126 VAL VAL A . n A 1 127 LYS 127 127 127 LYS LYS A . n A 1 128 HIS 128 128 128 HIS HIS A . n A 1 129 PRO 129 129 129 PRO PRO A . n A 1 130 LYS 130 130 130 LYS LYS A . n A 1 131 ASN 131 131 131 ASN ASN A . n A 1 132 PRO 132 132 132 PRO PRO A . n A 1 133 LEU 133 133 133 LEU LEU A . n A 1 134 ILE 134 134 134 ILE ILE A . n A 1 135 THR 135 135 135 THR THR A . n A 1 136 PRO 136 136 136 PRO PRO A . n A 1 137 PRO 137 137 137 PRO PRO A . n A 1 138 GLU 138 138 138 GLU GLU A . n A 1 139 GLY 139 139 139 GLY GLY A . n A 1 140 VAL 140 140 140 VAL VAL A . n A 1 141 LYS 141 141 141 LYS LYS A . n A 1 142 ASP 142 142 142 ASP ASP A . n A 1 143 ASP 143 143 143 ASP ASP A . n A 1 144 CYS 144 144 144 CYS CYS A . n A 1 145 PHE 145 145 145 PHE PHE A . n A 1 146 ARG 146 146 146 ARG ARG A . n A 1 147 ASP 147 147 147 ASP ASP A . n A 1 148 PRO 148 148 148 PRO PRO A . n A 1 149 SER 149 149 149 SER SER A . n A 1 150 THR 150 150 150 THR THR A . n A 1 151 ALA 151 151 151 ALA ALA A . n A 1 152 TRP 152 152 152 TRP TRP A . n A 1 153 LEU 153 153 153 LEU LEU A . n A 1 154 GLY 154 154 154 GLY GLY A . n A 1 155 PRO 155 155 155 PRO PRO A . n A 1 156 ASP 156 156 156 ASP ASP A . n A 1 157 GLY 157 157 157 GLY GLY A . n A 1 158 VAL 158 158 158 VAL VAL A . n A 1 159 TRP 159 159 159 TRP TRP A . n A 1 160 ARG 160 160 160 ARG ARG A . n A 1 161 ILE 161 161 161 ILE ILE A . n A 1 162 VAL 162 162 162 VAL VAL A . n A 1 163 VAL 163 163 163 VAL VAL A . n A 1 164 GLY 164 164 164 GLY GLY A . n A 1 165 GLY 165 165 165 GLY GLY A . n A 1 166 ASP 166 166 166 ASP ASP A . n A 1 167 ARG 167 167 167 ARG ARG A . n A 1 168 ASP 168 168 168 ASP ASP A . n A 1 169 ASN 169 169 169 ASN ASN A . n A 1 170 ASN 170 170 170 ASN ASN A . n A 1 171 GLY 171 171 171 GLY GLY A . n A 1 172 MET 172 172 172 MET MET A . n A 1 173 ALA 173 173 173 ALA ALA A . n A 1 174 PHE 174 174 174 PHE PHE A . n A 1 175 LEU 175 175 175 LEU LEU A . n A 1 176 TYR 176 176 176 TYR TYR A . n A 1 177 GLN 177 177 177 GLN GLN A . n A 1 178 SER 178 178 178 SER SER A . n A 1 179 THR 179 179 179 THR THR A . n A 1 180 ASP 180 180 180 ASP ASP A . n A 1 181 PHE 181 181 181 PHE PHE A . n A 1 182 VAL 182 182 182 VAL VAL A . n A 1 183 ASN 183 183 183 ASN ASN A . n A 1 184 TRP 184 184 184 TRP TRP A . n A 1 185 LYS 185 185 185 LYS LYS A . n A 1 186 ARG 186 186 186 ARG ARG A . n A 1 187 TYR 187 187 187 TYR TYR A . n A 1 188 ASP 188 188 188 ASP ASP A . n A 1 189 GLN 189 189 189 GLN GLN A . n A 1 190 PRO 190 190 190 PRO PRO A . n A 1 191 LEU 191 191 191 LEU LEU A . n A 1 192 SER 192 192 192 SER SER A . n A 1 193 SER 193 193 193 SER SER A . n A 1 194 ALA 194 194 194 ALA ALA A . n A 1 195 ASP 195 195 195 ASP ASP A . n A 1 196 ALA 196 196 196 ALA ALA A . n A 1 197 THR 197 197 197 THR THR A . n A 1 198 GLY 198 198 198 GLY GLY A . n A 1 199 THR 199 199 199 THR THR A . n A 1 200 TRP 200 200 200 TRP TRP A . n A 1 201 GLU 201 201 201 GLU GLU A . n A 1 202 CYS 202 202 202 CYS CYS A . n A 1 203 PRO 203 203 203 PRO PRO A . n A 1 204 ASP 204 204 204 ASP ASP A . n A 1 205 PHE 205 205 205 PHE PHE A . n A 1 206 TYR 206 206 206 TYR TYR A . n A 1 207 PRO 207 207 207 PRO PRO A . n A 1 208 VAL 208 208 208 VAL VAL A . n A 1 209 PRO 209 209 209 PRO PRO A . n A 1 210 LEU 210 210 210 LEU LEU A . n A 1 211 ASN 211 211 211 ASN ASN A . n A 1 212 SER 212 212 212 SER SER A . n A 1 213 THR 213 213 213 THR THR A . n A 1 214 ASN 214 214 214 ASN ASN A . n A 1 215 GLY 215 215 215 GLY GLY A . n A 1 216 LEU 216 216 216 LEU LEU A . n A 1 217 ASP 217 217 217 ASP ASP A . n A 1 218 THR 218 218 218 THR THR A . n A 1 219 SER 219 219 219 SER SER A . n A 1 220 VAL 220 220 220 VAL VAL A . n A 1 221 TYR 221 221 221 TYR TYR A . n A 1 222 GLY 222 222 222 GLY GLY A . n A 1 223 GLY 223 223 223 GLY GLY A . n A 1 224 SER 224 224 224 SER SER A . n A 1 225 VAL 225 225 225 VAL VAL A . n A 1 226 ARG 226 226 226 ARG ARG A . n A 1 227 HIS 227 227 227 HIS HIS A . n A 1 228 VAL 228 228 228 VAL VAL A . n A 1 229 MET 229 229 229 MET MET A . n A 1 230 LYS 230 230 230 LYS LYS A . n A 1 231 ALA 231 231 231 ALA ALA A . n A 1 232 GLY 232 232 232 GLY GLY A . n A 1 233 PHE 233 233 233 PHE PHE A . n A 1 234 GLU 234 234 234 GLU GLU A . n A 1 235 GLY 235 235 235 GLY GLY A . n A 1 236 HIS 236 236 236 HIS HIS A . n A 1 237 ASP 237 237 237 ASP ASP A . n A 1 238 TRP 238 238 238 TRP TRP A . n A 1 239 TYR 239 239 239 TYR TYR A . n A 1 240 THR 240 240 240 THR THR A . n A 1 241 ILE 241 241 241 ILE ILE A . n A 1 242 GLY 242 242 242 GLY GLY A . n A 1 243 THR 243 243 243 THR THR A . n A 1 244 TYR 244 244 244 TYR TYR A . n A 1 245 SER 245 245 245 SER SER A . n A 1 246 PRO 246 246 246 PRO PRO A . n A 1 247 ASP 247 247 247 ASP ASP A . n A 1 248 ARG 248 248 248 ARG ARG A . n A 1 249 GLU 249 249 249 GLU GLU A . n A 1 250 ASN 250 250 250 ASN ASN A . n A 1 251 PHE 251 251 251 PHE PHE A . n A 1 252 LEU 252 252 252 LEU LEU A . n A 1 253 PRO 253 253 253 PRO PRO A . n A 1 254 GLN 254 254 254 GLN GLN A . n A 1 255 ASN 255 255 255 ASN ASN A . n A 1 256 GLY 256 256 256 GLY GLY A . n A 1 257 LEU 257 257 257 LEU LEU A . n A 1 258 SER 258 258 258 SER SER A . n A 1 259 LEU 259 259 259 LEU LEU A . n A 1 260 THR 260 260 260 THR THR A . n A 1 261 GLY 261 261 261 GLY GLY A . n A 1 262 SER 262 262 262 SER SER A . n A 1 263 THR 263 263 263 THR THR A . n A 1 264 LEU 264 264 264 LEU LEU A . n A 1 265 ASP 265 265 265 ASP ASP A . n A 1 266 LEU 266 266 266 LEU LEU A . n A 1 267 ARG 267 267 267 ARG ARG A . n A 1 268 TYR 268 268 268 TYR TYR A . n A 1 269 ASP 269 269 269 ASP ASP A . n A 1 270 TYR 270 270 270 TYR TYR A . n A 1 271 GLY 271 271 271 GLY GLY A . n A 1 272 GLN 272 272 272 GLN GLN A . n A 1 273 PHE 273 273 273 PHE PHE A . n A 1 274 TYR 274 274 274 TYR TYR A . n A 1 275 ALA 275 275 275 ALA ALA A . n A 1 276 SER 276 276 276 SER SER A . n A 1 277 LYS 277 277 277 LYS LYS A . n A 1 278 SER 278 278 278 SER SER A . n A 1 279 PHE 279 279 279 PHE PHE A . n A 1 280 PHE 280 280 280 PHE PHE A . n A 1 281 ASP 281 281 281 ASP ASP A . n A 1 282 ASP 282 282 282 ASP ASP A . n A 1 283 ALA 283 283 283 ALA ALA A . n A 1 284 LYS 284 284 284 LYS LYS A . n A 1 285 ASN 285 285 285 ASN ASN A . n A 1 286 ARG 286 286 286 ARG ARG A . n A 1 287 ARG 287 287 287 ARG ARG A . n A 1 288 VAL 288 288 288 VAL VAL A . n A 1 289 LEU 289 289 289 LEU LEU A . n A 1 290 TRP 290 290 290 TRP TRP A . n A 1 291 ALA 291 291 291 ALA ALA A . n A 1 292 TRP 292 292 292 TRP TRP A . n A 1 293 VAL 293 293 293 VAL VAL A . n A 1 294 PRO 294 294 294 PRO PRO A . n A 1 295 GLU 295 295 295 GLU GLU A . n A 1 296 THR 296 296 296 THR THR A . n A 1 297 ASP 297 297 297 ASP ASP A . n A 1 298 SER 298 298 298 SER SER A . n A 1 299 GLN 299 299 299 GLN GLN A . n A 1 300 ALA 300 300 300 ALA ALA A . n A 1 301 ASP 301 301 301 ASP ASP A . n A 1 302 ASP 302 302 302 ASP ASP A . n A 1 303 ILE 303 303 303 ILE ILE A . n A 1 304 GLU 304 304 304 GLU GLU A . n A 1 305 LYS 305 305 305 LYS LYS A . n A 1 306 GLY 306 306 306 GLY GLY A . n A 1 307 TRP 307 307 307 TRP TRP A . n A 1 308 ALA 308 308 308 ALA ALA A . n A 1 309 GLY 309 309 309 GLY GLY A . n A 1 310 LEU 310 310 310 LEU LEU A . n A 1 311 GLN 311 311 311 GLN GLN A . n A 1 312 SER 312 312 312 SER SER A . n A 1 313 PHE 313 313 313 PHE PHE A . n A 1 314 PRO 314 314 314 PRO PRO A . n A 1 315 ARG 315 315 315 ARG ARG A . n A 1 316 ALA 316 316 316 ALA ALA A . n A 1 317 LEU 317 317 317 LEU LEU A . n A 1 318 TRP 318 318 318 TRP TRP A . n A 1 319 ILE 319 319 319 ILE ILE A . n A 1 320 ASP 320 320 320 ASP ASP A . n A 1 321 ARG 321 321 321 ARG ARG A . n A 1 322 ASN 322 322 322 ASN ASN A . n A 1 323 GLY 323 323 323 GLY GLY A . n A 1 324 LYS 324 324 324 LYS LYS A . n A 1 325 GLN 325 325 325 GLN GLN A . n A 1 326 LEU 326 326 326 LEU LEU A . n A 1 327 ILE 327 327 327 ILE ILE A . n A 1 328 GLN 328 328 328 GLN GLN A . n A 1 329 TRP 329 329 329 TRP TRP A . n A 1 330 PRO 330 330 330 PRO PRO A . n A 1 331 VAL 331 331 331 VAL VAL A . n A 1 332 GLU 332 332 332 GLU GLU A . n A 1 333 GLU 333 333 333 GLU GLU A . n A 1 334 ILE 334 334 334 ILE ILE A . n A 1 335 GLU 335 335 335 GLU GLU A . n A 1 336 GLU 336 336 336 GLU GLU A . n A 1 337 LEU 337 337 337 LEU LEU A . n A 1 338 ARG 338 338 338 ARG ARG A . n A 1 339 GLN 339 339 339 GLN GLN A . n A 1 340 ASN 340 340 340 ASN ASN A . n A 1 341 GLN 341 341 341 GLN GLN A . n A 1 342 VAL 342 342 342 VAL VAL A . n A 1 343 ASN 343 343 343 ASN ASN A . n A 1 344 LEU 344 344 344 LEU LEU A . n A 1 345 GLN 345 345 345 GLN GLN 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 ASN 348 348 348 ASN ASN A . n A 1 349 LEU 349 349 349 LEU LEU A . n A 1 350 LYS 350 350 350 LYS LYS A . n A 1 351 PRO 351 351 351 PRO PRO A . n A 1 352 GLY 352 352 352 GLY GLY A . n A 1 353 SER 353 353 353 SER SER A . n A 1 354 VAL 354 354 354 VAL VAL A . n A 1 355 LEU 355 355 355 LEU LEU A . n A 1 356 GLU 356 356 356 GLU GLU A . n A 1 357 ILE 357 357 357 ILE ILE A . n A 1 358 HIS 358 358 358 HIS HIS A . n A 1 359 GLY 359 359 359 GLY GLY A . n A 1 360 ILE 360 360 360 ILE ILE A . n A 1 361 ALA 361 361 361 ALA ALA A . n A 1 362 ALA 362 362 362 ALA ALA A . n A 1 363 SER 363 363 363 SER SER A . n A 1 364 GLN 364 364 364 GLN GLN A . n A 1 365 ALA 365 365 365 ALA ALA A . n A 1 366 ASP 366 366 366 ASP ASP 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 ILE 369 369 369 ILE ILE A . n A 1 370 SER 370 370 370 SER SER A . n A 1 371 PHE 371 371 371 PHE PHE A . n A 1 372 LYS 372 372 372 LYS LYS A . n A 1 373 LEU 373 373 373 LEU LEU A . n A 1 374 GLU 374 374 374 GLU GLU A . n A 1 375 GLY 375 375 375 GLY GLY A . n A 1 376 LEU 376 376 376 LEU LEU A . n A 1 377 LYS 377 377 377 LYS LYS A . n A 1 378 GLU 378 378 378 GLU GLU A . n A 1 379 ALA 379 379 379 ALA ALA A . n A 1 380 GLU 380 380 380 GLU GLU A . n A 1 381 VAL 381 381 381 VAL VAL A . n A 1 382 LEU 382 382 382 LEU LEU A . n A 1 383 ASP 383 383 383 ASP ASP A . n A 1 384 THR 384 384 384 THR THR A . n A 1 385 THR 385 385 385 THR THR A . n A 1 386 LEU 386 386 386 LEU LEU A . n A 1 387 VAL 387 387 387 VAL VAL A . n A 1 388 ASP 388 388 388 ASP ASP A . n A 1 389 PRO 389 389 389 PRO PRO A . n A 1 390 GLN 390 390 390 GLN GLN A . n A 1 391 ALA 391 391 391 ALA ALA A . n A 1 392 LEU 392 392 392 LEU LEU A . n A 1 393 CYS 393 393 393 CYS CYS A . n A 1 394 ASN 394 394 394 ASN ASN A . n A 1 395 GLU 395 395 395 GLU GLU A . n A 1 396 ARG 396 396 396 ARG ARG A . n A 1 397 GLY 397 397 397 GLY GLY A . n A 1 398 ALA 398 398 398 ALA ALA A . n A 1 399 SER 399 399 399 SER SER A . n A 1 400 SER 400 400 400 SER SER A . n A 1 401 ARG 401 401 401 ARG ARG A . n A 1 402 GLY 402 402 402 GLY GLY A . n A 1 403 ALA 403 403 403 ALA ALA A . n A 1 404 LEU 404 404 404 LEU LEU A . n A 1 405 GLY 405 405 405 GLY GLY A . n A 1 406 PRO 406 406 406 PRO PRO A . n A 1 407 PHE 407 407 407 PHE PHE A . n A 1 408 GLY 408 408 408 GLY GLY A . n A 1 409 LEU 409 409 409 LEU LEU A . n A 1 410 LEU 410 410 410 LEU LEU A . n A 1 411 ALA 411 411 411 ALA ALA A . n A 1 412 MET 412 412 412 MET MET A . n A 1 413 ALA 413 413 413 ALA ALA A . n A 1 414 SER 414 414 414 SER SER A . n A 1 415 LYS 415 415 415 LYS LYS A . n A 1 416 ASP 416 416 416 ASP ASP A . n A 1 417 LEU 417 417 417 LEU LEU A . n A 1 418 LYS 418 418 418 LYS LYS A . n A 1 419 GLU 419 419 419 GLU GLU A . n A 1 420 GLN 420 420 420 GLN GLN A . n A 1 421 SER 421 421 421 SER SER A . n A 1 422 ALA 422 422 422 ALA ALA A . n A 1 423 ILE 423 423 423 ILE ILE A . n A 1 424 PHE 424 424 424 PHE PHE A . n A 1 425 PHE 425 425 425 PHE PHE A . n A 1 426 ARG 426 426 426 ARG ARG A . n A 1 427 VAL 427 427 427 VAL VAL A . n A 1 428 PHE 428 428 428 PHE PHE A . n A 1 429 GLN 429 429 429 GLN GLN A . n A 1 430 ASN 430 430 430 ASN ASN A . n A 1 431 GLN 431 431 431 GLN GLN A . n A 1 432 LEU 432 432 432 LEU LEU A . n A 1 433 GLY 433 433 433 GLY GLY A . n A 1 434 ARG 434 434 434 ARG ARG A . n A 1 435 TYR 435 435 435 TYR TYR A . n A 1 436 SER 436 436 436 SER SER A . n A 1 437 VAL 437 437 437 VAL VAL A . n A 1 438 LEU 438 438 438 LEU LEU A . n A 1 439 MET 439 439 439 MET MET A . n A 1 440 CYS 440 440 440 CYS CYS A . n A 1 441 SER 441 441 441 SER SER A . n A 1 442 ASP 442 442 442 ASP ASP A . n A 1 443 LEU 443 443 443 LEU LEU A . n A 1 444 SER 444 444 444 SER SER A . n A 1 445 ARG 445 445 445 ARG ARG A . n A 1 446 SER 446 446 446 SER SER A . n A 1 447 THR 447 447 447 THR THR A . n A 1 448 VAL 448 448 448 VAL VAL A . n A 1 449 ARG 449 449 449 ARG ARG A . n A 1 450 SER 450 450 450 SER SER A . n A 1 451 ASN 451 451 451 ASN ASN A . n A 1 452 ILE 452 452 452 ILE ILE A . n A 1 453 ASP 453 453 453 ASP ASP A . n A 1 454 THR 454 454 454 THR THR A . n A 1 455 THR 455 455 455 THR THR A . n A 1 456 SER 456 456 456 SER SER A . n A 1 457 TYR 457 457 457 TYR TYR A . n A 1 458 GLY 458 458 458 GLY GLY A . n A 1 459 ALA 459 459 459 ALA ALA A . n A 1 460 PHE 460 460 460 PHE PHE A . n A 1 461 VAL 461 461 461 VAL VAL A . n A 1 462 ASP 462 462 462 ASP ASP A . n A 1 463 ILE 463 463 463 ILE ILE A . n A 1 464 ASP 464 464 464 ASP ASP A . n A 1 465 PRO 465 465 465 PRO PRO A . n A 1 466 ARG 466 466 466 ARG ARG A . n A 1 467 SER 467 467 467 SER SER A . n A 1 468 GLU 468 468 468 GLU GLU A . n A 1 469 GLU 469 469 469 GLU GLU A . n A 1 470 ILE 470 470 470 ILE ILE A . n A 1 471 SER 471 471 471 SER SER A . n A 1 472 LEU 472 472 472 LEU LEU A . n A 1 473 ARG 473 473 473 ARG ARG A . n A 1 474 ASN 474 474 474 ASN ASN A . n A 1 475 LEU 475 475 475 LEU LEU A . n A 1 476 ILE 476 476 476 ILE ILE A . n A 1 477 ASP 477 477 477 ASP ASP A . n A 1 478 HIS 478 478 478 HIS HIS A . n A 1 479 SER 479 479 479 SER SER A . n A 1 480 ILE 480 480 480 ILE ILE A . n A 1 481 ILE 481 481 481 ILE ILE A . n A 1 482 GLU 482 482 482 GLU GLU A . n A 1 483 SER 483 483 483 SER SER A . n A 1 484 PHE 484 484 484 PHE PHE A . n A 1 485 GLY 485 485 485 GLY GLY A . n A 1 486 ALA 486 486 486 ALA ALA A . n A 1 487 GLY 487 487 487 GLY GLY A . n A 1 488 GLY 488 488 488 GLY GLY A . n A 1 489 LYS 489 489 489 LYS LYS A . n A 1 490 THR 490 490 490 THR THR A . n A 1 491 CYS 491 491 491 CYS CYS A . n A 1 492 ILE 492 492 492 ILE ILE A . n A 1 493 THR 493 493 493 THR THR A . n A 1 494 SER 494 494 494 SER SER A . n A 1 495 ARG 495 495 495 ARG ARG A . n A 1 496 ILE 496 496 496 ILE ILE A . n A 1 497 TYR 497 497 497 TYR TYR A . n A 1 498 PRO 498 498 498 PRO PRO A . n A 1 499 LYS 499 499 499 LYS LYS A . n A 1 500 PHE 500 500 500 PHE PHE A . n A 1 501 VAL 501 501 501 VAL VAL A . n A 1 502 ASN 502 502 502 ASN ASN A . n A 1 503 ASN 503 503 503 ASN ASN A . n A 1 504 GLU 504 504 504 GLU GLU A . n A 1 505 GLU 505 505 505 GLU GLU A . n A 1 506 ALA 506 506 506 ALA ALA A . n A 1 507 HIS 507 507 507 HIS HIS A . n A 1 508 LEU 508 508 508 LEU LEU A . n A 1 509 PHE 509 509 509 PHE PHE A . n A 1 510 VAL 510 510 510 VAL VAL A . n A 1 511 PHE 511 511 511 PHE PHE A . n A 1 512 ASN 512 512 512 ASN ASN A . n A 1 513 ASN 513 513 513 ASN ASN A . n A 1 514 GLY 514 514 514 GLY GLY A . n A 1 515 THR 515 515 515 THR THR A . n A 1 516 GLN 516 516 516 GLN GLN A . n A 1 517 ASN 517 517 517 ASN ASN A . n A 1 518 VAL 518 518 518 VAL VAL A . n A 1 519 LYS 519 519 519 LYS LYS A . n A 1 520 ILE 520 520 520 ILE ILE A . n A 1 521 SER 521 521 521 SER SER A . n A 1 522 GLU 522 522 522 GLU GLU A . n A 1 523 MET 523 523 523 MET MET A . n A 1 524 SER 524 524 524 SER SER A . n A 1 525 ALA 525 525 525 ALA ALA A . n A 1 526 TRP 526 526 526 TRP TRP A . n A 1 527 SER 527 527 527 SER SER A . n A 1 528 MET 528 528 528 MET MET A . n A 1 529 LYS 529 529 529 LYS LYS A . n A 1 530 ASN 530 530 530 ASN ASN A . n A 1 531 ALA 531 531 531 ALA ALA A . n A 1 532 LYS 532 532 532 LYS LYS A . n A 1 533 PHE 533 533 533 PHE PHE A . n A 1 534 VAL 534 534 534 VAL VAL A . n A 1 535 VAL 535 535 535 VAL VAL A . n A 1 536 ASP 536 536 536 ASP ASP A . n A 1 537 GLN 537 537 537 GLN GLN A . n A 1 538 SER 538 538 538 SER SER A . n A 1 539 VAL 539 539 ? ? ? A . n A 1 540 LYS 540 540 ? ? ? A . n A 1 541 SER 541 541 ? ? ? A . n A 1 542 ALA 542 542 ? ? ? A . n A 1 543 ALA 543 543 ? ? ? 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 NAG 1 650 650 NAG NAG A . C 2 NAG 2 660 660 NAG NAG A . D 3 MAN 3 670 670 MAN MAN A . E 2 NAG 1 680 680 NAG NAG A . F 2 NAG 2 690 690 NAG NAG A . G 4 DQQ 1 801 801 DQQ DQQ A . H 5 HOH 1 1001 1001 HOH TIP A . H 5 HOH 2 1002 1002 HOH TIP A . H 5 HOH 3 1003 1003 HOH TIP A . H 5 HOH 4 1004 1004 HOH TIP A . H 5 HOH 5 1005 1005 HOH TIP A . H 5 HOH 6 1006 1006 HOH TIP A . H 5 HOH 7 1007 1007 HOH TIP A . H 5 HOH 8 1008 1008 HOH TIP A . H 5 HOH 9 1009 1009 HOH TIP A . H 5 HOH 10 1010 1010 HOH TIP A . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 A ASN 116 A ASN 116 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 513 A ASN 513 ? ASN '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 # _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_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 2006-08-29 2 'Structure model' 1 1 2008-04-30 3 'Structure model' 1 2 2011-07-13 # _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' 'Version format compliance' 2 3 'Structure model' 'Non-polymer description' 3 3 'Structure model' 'Version format compliance' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal CNS refinement 1.1 ? 1 DENZO 'data reduction' . ? 2 SCALEPACK 'data scaling' . ? 3 CNS phasing . ? 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 GLN A 14 ? ? -171.60 137.04 2 1 ASN A 18 ? ? 83.10 -166.18 3 1 ASN A 21 ? ? -148.89 -128.63 4 1 ASP A 22 ? ? -27.15 118.69 5 1 PRO A 41 ? ? -57.87 -0.69 6 1 ASP A 59 ? ? -153.24 18.62 7 1 ALA A 76 ? ? -48.01 -5.75 8 1 ASP A 77 ? ? -159.51 32.15 9 1 SER A 83 ? ? -45.58 152.50 10 1 LEU A 117 ? ? -46.13 -5.31 11 1 LEU A 122 ? ? 37.99 59.85 12 1 PRO A 137 ? ? -69.39 -168.86 13 1 GLU A 138 ? ? -50.20 -92.53 14 1 ASP A 142 ? ? -52.94 8.79 15 1 PHE A 145 ? ? -160.40 98.74 16 1 PHE A 181 ? ? 91.40 12.14 17 1 THR A 199 ? ? -31.67 126.18 18 1 ASN A 211 ? ? 38.33 67.12 19 1 SER A 219 ? ? -58.76 -5.77 20 1 PHE A 233 ? ? -178.81 141.72 21 1 GLU A 234 ? ? 71.79 32.53 22 1 THR A 263 ? ? -68.59 22.95 23 1 PHE A 273 ? ? -162.58 117.09 24 1 TRP A 307 ? ? -177.53 147.55 25 1 GLN A 339 ? ? -102.40 -106.71 26 1 PRO A 351 ? ? -39.80 124.77 27 1 ALA A 361 ? ? -83.02 40.10 28 1 ALA A 362 ? ? -0.27 -38.27 29 1 GLN A 364 ? ? -156.17 83.58 30 1 ALA A 403 ? ? -78.57 -77.81 31 1 LEU A 417 ? ? 49.92 22.77 32 1 HIS A 478 ? ? 51.86 -75.73 33 1 GLN A 537 ? ? -114.87 -91.64 # _pdbx_validate_chiral.id 1 _pdbx_validate_chiral.PDB_model_num 1 _pdbx_validate_chiral.auth_atom_id C1 _pdbx_validate_chiral.label_alt_id ? _pdbx_validate_chiral.auth_asym_id A _pdbx_validate_chiral.auth_comp_id NAG _pdbx_validate_chiral.auth_seq_id 650 _pdbx_validate_chiral.PDB_ins_code ? _pdbx_validate_chiral.details 'WRONG HAND' _pdbx_validate_chiral.omega . # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A GLN 1 ? A GLN 1 2 1 Y 1 A VAL 539 ? A VAL 539 3 1 Y 1 A LYS 540 ? A LYS 540 4 1 Y 1 A SER 541 ? A SER 541 5 1 Y 1 A ALA 542 ? A ALA 542 6 1 Y 1 A ALA 543 ? A ALA 543 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 ALPHA-D-MANNOSE MAN 4 2,5-DIDEOXY-2,5-IMINO-D-MANNITOL DQQ 5 water HOH #