data_3RJA # _entry.id 3RJA # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.287 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3RJA RCSB RCSB065000 WWPDB D_1000065000 # _pdbx_database_related.db_name PDB _pdbx_database_related.db_id 3RJ8 _pdbx_database_related.details . _pdbx_database_related.content_type unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3RJA _pdbx_database_status.recvd_initial_deposition_date 2011-04-15 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.methods_development_category ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Duskova, J.' 1 'Skalova, T.' 2 'Kolenko, P.' 3 'Stepankova, A.' 4 'Koval, T.' 5 'Hasek, J.' 6 'Ostergaard, L.H.' 7 'Fuglsang, C.C.' 8 'Dohnalek, J.' 9 # loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.journal_id_ASTM _citation.country _citation.journal_id_ISSN _citation.journal_id_CSD _citation.book_publisher _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary 'Crystal structure and kinetic studies of carbohydrate oxidase from Microdochium nivale' 'To be Published' ? ? ? ? ? ? ? 0353 ? ? ? 1 'Crystallization of carbohydrate oxidase from Microdochium nivale.' 'Acta Crystallogr.,Sect.F' 65 638 640 2009 ? DK 1744-3091 ? ? 19478452 10.1107/S1744309109017643 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Duskova, J.' 1 primary 'Skalova, T.' 2 primary 'Kolenko, P.' 3 primary 'Stepankova, A.' 4 primary 'Hasek, J.' 5 primary 'Koval, T.' 6 primary 'Ostergaard, L.H.' 7 primary 'Fuglsang, C.C.' 8 primary 'Dohnalek, J.' 9 1 'Duskova, J.' 10 1 'Dohnalek, J.' 11 1 'Skalova, T.' 12 1 'Ostergaard, L.H.' 13 1 'Fuglsang, C.C.' 14 1 'Kolenko, P.' 15 1 'Stepankova, A.' 16 1 'Hasek, J.' 17 # _cell.entry_id 3RJA _cell.length_a 132.040 _cell.length_b 56.920 _cell.length_c 86.900 _cell.angle_alpha 90.00 _cell.angle_beta 95.55 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 3RJA _symmetry.space_group_name_H-M 'C 1 2 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 5 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man 'Carbohydrate oxidase' 52466.957 1 1.1.3.4 ? 'mature enzyme' ? 2 non-polymer syn 'FLAVIN-ADENINE DINUCLEOTIDE' 785.550 1 ? ? ? ? 3 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 1 ? ? ? ? 4 non-polymer syn 'ZINC ION' 65.409 3 ? ? ? ? 5 non-polymer man '(2R,3R,4R,5R)-4,5-dihydroxy-2-(hydroxymethyl)-6-oxopiperidin-3-yl beta-D-glucopyranoside' 339.296 2 ? ? ? ? 6 non-polymer syn 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL 122.143 1 ? ? ? ? 7 non-polymer syn 'SULFATE ION' 96.063 1 ? ? ? ? 8 non-polymer syn 'CHLORIDE ION' 35.453 4 ? ? ? ? 9 water nat water 18.015 613 ? ? ? ? # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code ;GAIEACLSAAGVPIDIPGTADYERDVEPFNIRLPYIPTAIAQTQTTAHIQSAVQCAKKLNLKVSAKSGGHSYASFGFGGE NGHLMVQLDRMIDVISYNDKTGIAHVEPGARLGHLATVLNDKYGRAISHGTCPGVGISGHFAHGGFGFSSHMHGLAVDSV VGVTVVLADGRIVEASATENADLFWGIKGAGSNFGIVAVWKLATFPAPKVLTRFGVTLNWKNKTSALKGIEAVEDYARWV APREVNFRIGDYGAGNPGIEGLYYGTPEQWRAAFQPLLDTLPAGYVVNPTTSLNWIESVLSYSNFDHVDFITPQPVENFY AKSLTLKSIKGDAVKNFVDYYFDVSNKVKDRFWFYQLDVHGGKNSQVTKVTNAETAYPHRDKLWLIQFYDRYDNNQTYPE TSFKFLDGWVNSVTKALPKSDWGMYINYADPRMDRDYATKVYYGENLARLQKLKAKFDPTDRFYYPQAVRPVK ; _entity_poly.pdbx_seq_one_letter_code_can ;GAIEACLSAAGVPIDIPGTADYERDVEPFNIRLPYIPTAIAQTQTTAHIQSAVQCAKKLNLKVSAKSGGHSYASFGFGGE NGHLMVQLDRMIDVISYNDKTGIAHVEPGARLGHLATVLNDKYGRAISHGTCPGVGISGHFAHGGFGFSSHMHGLAVDSV VGVTVVLADGRIVEASATENADLFWGIKGAGSNFGIVAVWKLATFPAPKVLTRFGVTLNWKNKTSALKGIEAVEDYARWV APREVNFRIGDYGAGNPGIEGLYYGTPEQWRAAFQPLLDTLPAGYVVNPTTSLNWIESVLSYSNFDHVDFITPQPVENFY AKSLTLKSIKGDAVKNFVDYYFDVSNKVKDRFWFYQLDVHGGKNSQVTKVTNAETAYPHRDKLWLIQFYDRYDNNQTYPE TSFKFLDGWVNSVTKALPKSDWGMYINYADPRMDRDYATKVYYGENLARLQKLKAKFDPTDRFYYPQAVRPVK ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLY n 1 2 ALA n 1 3 ILE n 1 4 GLU n 1 5 ALA n 1 6 CYS n 1 7 LEU n 1 8 SER n 1 9 ALA n 1 10 ALA n 1 11 GLY n 1 12 VAL n 1 13 PRO n 1 14 ILE n 1 15 ASP n 1 16 ILE n 1 17 PRO n 1 18 GLY n 1 19 THR n 1 20 ALA n 1 21 ASP n 1 22 TYR n 1 23 GLU n 1 24 ARG n 1 25 ASP n 1 26 VAL n 1 27 GLU n 1 28 PRO n 1 29 PHE n 1 30 ASN n 1 31 ILE n 1 32 ARG n 1 33 LEU n 1 34 PRO n 1 35 TYR n 1 36 ILE n 1 37 PRO n 1 38 THR n 1 39 ALA n 1 40 ILE n 1 41 ALA n 1 42 GLN n 1 43 THR n 1 44 GLN n 1 45 THR n 1 46 THR n 1 47 ALA n 1 48 HIS n 1 49 ILE n 1 50 GLN n 1 51 SER n 1 52 ALA n 1 53 VAL n 1 54 GLN n 1 55 CYS n 1 56 ALA n 1 57 LYS n 1 58 LYS n 1 59 LEU n 1 60 ASN n 1 61 LEU n 1 62 LYS n 1 63 VAL n 1 64 SER n 1 65 ALA n 1 66 LYS n 1 67 SER n 1 68 GLY n 1 69 GLY n 1 70 HIS n 1 71 SER n 1 72 TYR n 1 73 ALA n 1 74 SER n 1 75 PHE n 1 76 GLY n 1 77 PHE n 1 78 GLY n 1 79 GLY n 1 80 GLU n 1 81 ASN n 1 82 GLY n 1 83 HIS n 1 84 LEU n 1 85 MET n 1 86 VAL n 1 87 GLN n 1 88 LEU n 1 89 ASP n 1 90 ARG n 1 91 MET n 1 92 ILE n 1 93 ASP n 1 94 VAL n 1 95 ILE n 1 96 SER n 1 97 TYR n 1 98 ASN n 1 99 ASP n 1 100 LYS n 1 101 THR n 1 102 GLY n 1 103 ILE n 1 104 ALA n 1 105 HIS n 1 106 VAL n 1 107 GLU n 1 108 PRO n 1 109 GLY n 1 110 ALA n 1 111 ARG n 1 112 LEU n 1 113 GLY n 1 114 HIS n 1 115 LEU n 1 116 ALA n 1 117 THR n 1 118 VAL n 1 119 LEU n 1 120 ASN n 1 121 ASP n 1 122 LYS n 1 123 TYR n 1 124 GLY n 1 125 ARG n 1 126 ALA n 1 127 ILE n 1 128 SER n 1 129 HIS n 1 130 GLY n 1 131 THR n 1 132 CYS n 1 133 PRO n 1 134 GLY n 1 135 VAL n 1 136 GLY n 1 137 ILE n 1 138 SER n 1 139 GLY n 1 140 HIS n 1 141 PHE n 1 142 ALA n 1 143 HIS n 1 144 GLY n 1 145 GLY n 1 146 PHE n 1 147 GLY n 1 148 PHE n 1 149 SER n 1 150 SER n 1 151 HIS n 1 152 MET n 1 153 HIS n 1 154 GLY n 1 155 LEU n 1 156 ALA n 1 157 VAL n 1 158 ASP n 1 159 SER n 1 160 VAL n 1 161 VAL n 1 162 GLY n 1 163 VAL n 1 164 THR n 1 165 VAL n 1 166 VAL n 1 167 LEU n 1 168 ALA n 1 169 ASP n 1 170 GLY n 1 171 ARG n 1 172 ILE n 1 173 VAL n 1 174 GLU n 1 175 ALA n 1 176 SER n 1 177 ALA n 1 178 THR n 1 179 GLU n 1 180 ASN n 1 181 ALA n 1 182 ASP n 1 183 LEU n 1 184 PHE n 1 185 TRP n 1 186 GLY n 1 187 ILE n 1 188 LYS n 1 189 GLY n 1 190 ALA n 1 191 GLY n 1 192 SER n 1 193 ASN n 1 194 PHE n 1 195 GLY n 1 196 ILE n 1 197 VAL n 1 198 ALA n 1 199 VAL n 1 200 TRP n 1 201 LYS n 1 202 LEU n 1 203 ALA n 1 204 THR n 1 205 PHE n 1 206 PRO n 1 207 ALA n 1 208 PRO n 1 209 LYS n 1 210 VAL n 1 211 LEU n 1 212 THR n 1 213 ARG n 1 214 PHE n 1 215 GLY n 1 216 VAL n 1 217 THR n 1 218 LEU n 1 219 ASN n 1 220 TRP n 1 221 LYS n 1 222 ASN n 1 223 LYS n 1 224 THR n 1 225 SER n 1 226 ALA n 1 227 LEU n 1 228 LYS n 1 229 GLY n 1 230 ILE n 1 231 GLU n 1 232 ALA n 1 233 VAL n 1 234 GLU n 1 235 ASP n 1 236 TYR n 1 237 ALA n 1 238 ARG n 1 239 TRP n 1 240 VAL n 1 241 ALA n 1 242 PRO n 1 243 ARG n 1 244 GLU n 1 245 VAL n 1 246 ASN n 1 247 PHE n 1 248 ARG n 1 249 ILE n 1 250 GLY n 1 251 ASP n 1 252 TYR n 1 253 GLY n 1 254 ALA n 1 255 GLY n 1 256 ASN n 1 257 PRO n 1 258 GLY n 1 259 ILE n 1 260 GLU n 1 261 GLY n 1 262 LEU n 1 263 TYR n 1 264 TYR n 1 265 GLY n 1 266 THR n 1 267 PRO n 1 268 GLU n 1 269 GLN n 1 270 TRP n 1 271 ARG n 1 272 ALA n 1 273 ALA n 1 274 PHE n 1 275 GLN n 1 276 PRO n 1 277 LEU n 1 278 LEU n 1 279 ASP n 1 280 THR n 1 281 LEU n 1 282 PRO n 1 283 ALA n 1 284 GLY n 1 285 TYR n 1 286 VAL n 1 287 VAL n 1 288 ASN n 1 289 PRO n 1 290 THR n 1 291 THR n 1 292 SER n 1 293 LEU n 1 294 ASN n 1 295 TRP n 1 296 ILE n 1 297 GLU n 1 298 SER n 1 299 VAL n 1 300 LEU n 1 301 SER n 1 302 TYR n 1 303 SER n 1 304 ASN n 1 305 PHE n 1 306 ASP n 1 307 HIS n 1 308 VAL n 1 309 ASP n 1 310 PHE n 1 311 ILE n 1 312 THR n 1 313 PRO n 1 314 GLN n 1 315 PRO n 1 316 VAL n 1 317 GLU n 1 318 ASN n 1 319 PHE n 1 320 TYR n 1 321 ALA n 1 322 LYS n 1 323 SER n 1 324 LEU n 1 325 THR n 1 326 LEU n 1 327 LYS n 1 328 SER n 1 329 ILE n 1 330 LYS n 1 331 GLY n 1 332 ASP n 1 333 ALA n 1 334 VAL n 1 335 LYS n 1 336 ASN n 1 337 PHE n 1 338 VAL n 1 339 ASP n 1 340 TYR n 1 341 TYR n 1 342 PHE n 1 343 ASP n 1 344 VAL n 1 345 SER n 1 346 ASN n 1 347 LYS n 1 348 VAL n 1 349 LYS n 1 350 ASP n 1 351 ARG n 1 352 PHE n 1 353 TRP n 1 354 PHE n 1 355 TYR n 1 356 GLN n 1 357 LEU n 1 358 ASP n 1 359 VAL n 1 360 HIS n 1 361 GLY n 1 362 GLY n 1 363 LYS n 1 364 ASN n 1 365 SER n 1 366 GLN n 1 367 VAL n 1 368 THR n 1 369 LYS n 1 370 VAL n 1 371 THR n 1 372 ASN n 1 373 ALA n 1 374 GLU n 1 375 THR n 1 376 ALA n 1 377 TYR n 1 378 PRO n 1 379 HIS n 1 380 ARG n 1 381 ASP n 1 382 LYS n 1 383 LEU n 1 384 TRP n 1 385 LEU n 1 386 ILE n 1 387 GLN n 1 388 PHE n 1 389 TYR n 1 390 ASP n 1 391 ARG n 1 392 TYR n 1 393 ASP n 1 394 ASN n 1 395 ASN n 1 396 GLN n 1 397 THR n 1 398 TYR n 1 399 PRO n 1 400 GLU n 1 401 THR n 1 402 SER n 1 403 PHE n 1 404 LYS n 1 405 PHE n 1 406 LEU n 1 407 ASP n 1 408 GLY n 1 409 TRP n 1 410 VAL n 1 411 ASN n 1 412 SER n 1 413 VAL n 1 414 THR n 1 415 LYS n 1 416 ALA n 1 417 LEU n 1 418 PRO n 1 419 LYS n 1 420 SER n 1 421 ASP n 1 422 TRP n 1 423 GLY n 1 424 MET n 1 425 TYR n 1 426 ILE n 1 427 ASN n 1 428 TYR n 1 429 ALA n 1 430 ASP n 1 431 PRO n 1 432 ARG n 1 433 MET n 1 434 ASP n 1 435 ARG n 1 436 ASP n 1 437 TYR n 1 438 ALA n 1 439 THR n 1 440 LYS n 1 441 VAL n 1 442 TYR n 1 443 TYR n 1 444 GLY n 1 445 GLU n 1 446 ASN n 1 447 LEU n 1 448 ALA n 1 449 ARG n 1 450 LEU n 1 451 GLN n 1 452 LYS n 1 453 LEU n 1 454 LYS n 1 455 ALA n 1 456 LYS n 1 457 PHE n 1 458 ASP n 1 459 PRO n 1 460 THR n 1 461 ASP n 1 462 ARG n 1 463 PHE n 1 464 TYR n 1 465 TYR n 1 466 PRO n 1 467 GLN n 1 468 ALA n 1 469 VAL n 1 470 ARG n 1 471 PRO n 1 472 VAL n 1 473 LYS n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name ? _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene MnCO _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain NN008551 _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Microdochium nivale' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 5520 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name 'Aspergillus oryzae' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 5062 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain JaL228 _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type plasmid _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pEJG33 _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name PDB _struct_ref.db_code 3RJA _struct_ref.pdbx_db_accession 3RJA _struct_ref.entity_id 1 _struct_ref.pdbx_align_begin ? _struct_ref.pdbx_seq_one_letter_code ;GAIEACLSAAGVPIDIPGTADYERDVEPFNIRLPYIPTAIAQTQTTAHIQSAVQCAKKLNLKVSAKSGGHSYASFGFGGE NGHLMVQLDRMIDVISYNDKTGIAHVEPGARLGHLATVLNDKYGRAISHGTCPGVGISGHFAHGGFGFSSHMHGLAVDSV VGVTVVLADGRIVEASATENADLFWGIKGAGSNFGIVAVWKLATFPAPKVLTRFGVTLNWKNKTSALKGIEAVEDYARWV APREVNFRIGDYGAGNPGIEGLYYGTPEQWRAAFQPLLDTLPAGYVVNPTTSLNWIESVLSYSNFDHVDFITPQPVENFY AKSLTLKSIKGDAVKNFVDYYFDVSNKVKDRFWFYQLDVHGGKNSQVTKVTNAETAYPHRDKLWLIQFYDRYDNNQTYPE TSFKFLDGWVNSVTKALPKSDWGMYINYADPRMDRDYATKVYYGENLARLQKLKAKFDPTDRFYYPQAVRPVK ; _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 3RJA _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 473 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession 3RJA _struct_ref_seq.db_align_beg 1 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 473 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 1 _struct_ref_seq.pdbx_auth_seq_align_end 473 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ABL saccharide . '(2R,3R,4R,5R)-4,5-dihydroxy-2-(hydroxymethyl)-6-oxopiperidin-3-yl beta-D-glucopyranoside' 5-amino-5-deoxy-cellobiono-1,5-lactam 'C12 H21 N O10' 339.296 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 CL non-polymer . 'CHLORIDE ION' ? 'Cl -1' 35.453 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 FAD non-polymer . 'FLAVIN-ADENINE DINUCLEOTIDE' ? 'C27 H33 N9 O15 P2' 785.550 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 SO4 non-polymer . 'SULFATE ION' ? 'O4 S -2' 96.063 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TRS non-polymer . 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL 'TRIS BUFFER' 'C4 H12 N O3 1' 122.143 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 ZN non-polymer . 'ZINC ION' ? 'Zn 2' 65.409 # _exptl.entry_id 3RJA _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.10 _exptl_crystal.density_percent_sol 60.29 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.temp 298 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 6.5 _exptl_crystal_grow.pdbx_details '0.01 M zinc sulfate, 0.1 M MES, 12% PEG550 MME , pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.id 1 _diffrn.ambient_temp 120 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'Oxford Diffraction Atlas CCD' _diffrn_detector.pdbx_collection_date 2008-06-05 _diffrn_detector.details 'Enhance Ultra' # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'multilayer optics' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.5418 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source 'SEALED TUBE' _diffrn_source.type 'OXFORD DIFFRACTION ENHANCE ULTRA' _diffrn_source.pdbx_synchrotron_site ? _diffrn_source.pdbx_synchrotron_beamline ? _diffrn_source.pdbx_wavelength 1.5418 _diffrn_source.pdbx_wavelength_list ? # _reflns.entry_id 3RJA _reflns.observed_criterion_sigma_I -100 _reflns.observed_criterion_sigma_F 0 _reflns.d_resolution_low 15 _reflns.d_resolution_high 2.1 _reflns.number_obs 33917 _reflns.number_all 33917 _reflns.percent_possible_obs 90.1 _reflns.pdbx_Rmerge_I_obs 0.047 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 15.5 _reflns.B_iso_Wilson_estimate 26.7 _reflns.pdbx_redundancy 2.2 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 2.1 _reflns_shell.d_res_low 2.21 _reflns_shell.percent_possible_all 63.1 _reflns_shell.Rmerge_I_obs 0.171 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs 3.6 _reflns_shell.pdbx_redundancy 1.3 _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all 4312 _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 3RJA _refine.ls_number_reflns_obs 33917 _refine.ls_number_reflns_all 33917 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 15.00 _refine.ls_d_res_high 2.10 _refine.ls_percent_reflns_obs 90.11 _refine.ls_R_factor_obs 0.145 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.142 _refine.ls_R_factor_R_free ? _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free ? _refine.ls_number_reflns_R_free ? _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc 0.961 _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean 18.000 _refine.aniso_B[1][1] 0.25 _refine.aniso_B[2][2] -0.54 _refine.aniso_B[3][3] 0.01 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] -1.40 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_details MASK _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.20 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_ls_cross_valid_method ? _refine.details ;STRUCTURE SOLUTION AND REFINEMENT WERE PERFORMED USING FREE R FOR CROSS-VALIDATION THROUGHOUT: FREE R = 0.202 (FREE R = 0.284 FOR THE HIGHEST RESOLUTION SHELL) FROM A RANDOM TEST SET COMPRISING 5% OF REFLECTIONS (1694 TOTAL). FINAL REFINEMENT WAS PERFORMED USING ALL REFLECTIONS. ; _refine.pdbx_starting_model 'PDB ENTRY 1ZR6' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ISOTROPIC _refine.pdbx_stereochemistry_target_values 'CCP4 6.1.3 stereochemistry library' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.068 _refine.overall_SU_B 2.542 _refine.overall_SU_R_Cruickshank_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_overall_phase_error ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_overall_ESU_R 0.170 _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 3714 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 133 _refine_hist.number_atoms_solvent 613 _refine_hist.number_atoms_total 4460 _refine_hist.d_res_high 2.10 _refine_hist.d_res_low 15.00 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_restraint_function _refine_ls_restr.pdbx_refine_id r_bond_refined_d 0.015 0.022 ? 4051 ? 'X-RAY DIFFRACTION' r_bond_other_d ? ? ? ? ? 'X-RAY DIFFRACTION' r_angle_refined_deg 1.437 1.974 ? 5545 ? 'X-RAY DIFFRACTION' r_angle_other_deg ? ? ? ? ? 'X-RAY DIFFRACTION' r_dihedral_angle_1_deg 6.698 5.000 ? 497 ? 'X-RAY DIFFRACTION' r_dihedral_angle_2_deg 33.791 23.587 ? 184 ? 'X-RAY DIFFRACTION' r_dihedral_angle_3_deg 12.754 15.000 ? 610 ? 'X-RAY DIFFRACTION' r_dihedral_angle_4_deg 19.708 15.000 ? 22 ? 'X-RAY DIFFRACTION' r_chiral_restr 0.102 0.200 ? 598 ? 'X-RAY DIFFRACTION' r_gen_planes_refined 0.012 0.021 ? 3110 ? 'X-RAY DIFFRACTION' r_gen_planes_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_nbd_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_nbd_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_nbtor_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_nbtor_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_xyhbond_nbd_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_xyhbond_nbd_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_metal_ion_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_metal_ion_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_vdw_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_vdw_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_hbond_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_hbond_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_metal_ion_refined ? ? ? ? ? 'X-RAY DIFFRACTION' r_symmetry_metal_ion_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_mcbond_it ? ? ? ? ? 'X-RAY DIFFRACTION' r_mcbond_other ? ? ? ? ? 'X-RAY DIFFRACTION' r_mcangle_it ? ? ? ? ? 'X-RAY DIFFRACTION' r_scbond_it ? ? ? ? ? 'X-RAY DIFFRACTION' r_scangle_it ? ? ? ? ? 'X-RAY DIFFRACTION' r_rigid_bond_restr ? ? ? ? ? 'X-RAY DIFFRACTION' r_sphericity_free ? ? ? ? ? 'X-RAY DIFFRACTION' r_sphericity_bonded ? ? ? ? ? 'X-RAY DIFFRACTION' # _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.d_res_high 2.100 _refine_ls_shell.d_res_low 2.153 _refine_ls_shell.number_reflns_R_work 1498 _refine_ls_shell.R_factor_R_work 0.173 _refine_ls_shell.percent_reflns_obs 55.52 _refine_ls_shell.R_factor_R_free ? _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.number_reflns_R_free ? _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.number_reflns_obs 1498 _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' # _struct.entry_id 3RJA _struct.title 'Crystal structure of carbohydrate oxidase from Microdochium nivale in complex with substrate analogue' _struct.pdbx_descriptor 'Carbohydrate oxidase (E.C.1.1.3.4)' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3RJA _struct_keywords.pdbx_keywords OXIDOREDUCTASE _struct_keywords.text ;protein-substrate analogue complex, FAD binding domain, berberine and berberine-like domain, glucooligosaccharide oxidase, FAD Binding, Carbohydrate/Sugar Binding, extracellular, OXIDOREDUCTASE ; # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 4 ? E N N 4 ? F N N 4 ? G N N 5 ? H N N 5 ? I N N 6 ? J N N 7 ? K N N 8 ? L N N 8 ? M N N 8 ? N N N 8 ? O N N 9 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLY A 1 ? ALA A 10 ? GLY A 1 ALA A 10 1 ? 10 HELX_P HELX_P2 2 THR A 19 ? VAL A 26 ? THR A 19 VAL A 26 1 ? 8 HELX_P HELX_P3 3 THR A 45 ? LEU A 59 ? THR A 45 LEU A 59 1 ? 15 HELX_P HELX_P4 4 SER A 74 ? GLY A 78 ? SER A 74 GLY A 78 5 ? 5 HELX_P HELX_P5 5 ARG A 111 ? GLY A 124 ? ARG A 111 GLY A 124 1 ? 14 HELX_P HELX_P6 6 GLY A 136 ? HIS A 143 ? GLY A 136 HIS A 143 1 ? 8 HELX_P HELX_P7 7 SER A 149 ? GLY A 154 ? SER A 149 GLY A 154 1 ? 6 HELX_P HELX_P8 8 LEU A 155 ? ASP A 158 ? LEU A 155 ASP A 158 5 ? 4 HELX_P HELX_P9 9 ASN A 180 ? GLY A 191 ? ASN A 180 GLY A 191 1 ? 12 HELX_P HELX_P10 10 SER A 192 ? PHE A 194 ? SER A 192 PHE A 194 5 ? 3 HELX_P HELX_P11 11 ASN A 222 ? VAL A 240 ? ASN A 222 VAL A 240 1 ? 19 HELX_P HELX_P12 12 THR A 266 ? ASP A 279 ? THR A 266 ASP A 279 1 ? 14 HELX_P HELX_P13 13 ASN A 294 ? TYR A 302 ? ASN A 294 TYR A 302 1 ? 9 HELX_P HELX_P14 14 GLY A 331 ? VAL A 344 ? GLY A 331 VAL A 344 1 ? 14 HELX_P HELX_P15 15 SER A 345 ? VAL A 348 ? SER A 345 VAL A 348 5 ? 4 HELX_P HELX_P16 16 SER A 365 ? VAL A 370 ? SER A 365 VAL A 370 5 ? 6 HELX_P HELX_P17 17 SER A 402 ? LYS A 415 ? SER A 402 LYS A 415 1 ? 14 HELX_P HELX_P18 18 ALA A 416 ? LEU A 417 ? ALA A 416 LEU A 417 5 ? 2 HELX_P HELX_P19 19 PRO A 418 ? SER A 420 ? PRO A 418 SER A 420 5 ? 3 HELX_P HELX_P20 20 TYR A 425 ? ALA A 429 ? TYR A 425 ALA A 429 5 ? 5 HELX_P HELX_P21 21 ASP A 434 ? GLY A 444 ? ASP A 434 GLY A 444 1 ? 11 HELX_P HELX_P22 22 ASN A 446 ? ASP A 458 ? ASN A 446 ASP A 458 1 ? 13 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order covale1 covale ? ? A ASN 222 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 222 A NAG 502 1_555 ? ? ? ? ? ? ? 1.438 ? metalc1 metalc ? ? A GLU 231 OE2 ? ? ? 1_555 F ZN . ZN ? ? A GLU 231 A ZN 603 1_555 ? ? ? ? ? ? ? 1.943 ? metalc2 metalc ? ? A ASP 306 OD1 ? ? ? 1_555 E ZN . ZN ? ? A ASP 306 A ZN 602 1_555 ? ? ? ? ? ? ? 1.985 ? metalc3 metalc ? ? A ASP 235 OD2 ? ? ? 1_555 F ZN . ZN ? ? A ASP 235 A ZN 603 1_555 ? ? ? ? ? ? ? 1.997 ? metalc4 metalc ? ? A HIS 114 ND1 ? ? ? 1_555 D ZN . ZN ? ? A HIS 114 A ZN 601 1_555 ? ? ? ? ? ? ? 2.001 ? metalc5 metalc ? ? A ASP 309 OD1 ? ? ? 1_555 D ZN . ZN ? ? A ASP 309 A ZN 601 1_555 ? ? ? ? ? ? ? 2.062 ? metalc6 metalc ? ? D ZN . ZN ? ? ? 1_555 O HOH . O ? ? A ZN 601 A HOH 643 1_555 ? ? ? ? ? ? ? 2.086 ? metalc7 metalc ? ? A HIS 307 ND1 ? ? ? 1_555 E ZN . ZN ? ? A HIS 307 A ZN 602 1_555 ? ? ? ? ? ? ? 2.156 ? metalc8 metalc ? ? D ZN . ZN ? ? ? 1_555 O HOH . O ? ? A ZN 601 A HOH 701 1_555 ? ? ? ? ? ? ? 2.167 ? metalc9 metalc ? ? A ASP 309 OD2 ? ? ? 1_555 D ZN . ZN ? ? A ASP 309 A ZN 601 1_555 ? ? ? ? ? ? ? 2.265 ? covale2 covale ? ? A HIS 70 ND1 ? ? ? 1_555 B FAD . C8M ? ? A HIS 70 A FAD 501 1_555 ? ? ? ? ? ? ? 1.466 ? covale3 covale ? ? A CYS 132 SG ? ? ? 1_555 B FAD . C6 ? ? A CYS 132 A FAD 501 1_555 ? ? ? ? ? ? ? 1.789 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference covale ? ? metalc ? ? # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 3 ? B ? 5 ? C ? 2 ? D ? 3 ? E ? 8 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? parallel A 2 3 ? parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel B 4 5 ? anti-parallel C 1 2 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel E 4 5 ? anti-parallel E 5 6 ? anti-parallel E 6 7 ? anti-parallel E 7 8 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 ALA A 39 ? GLN A 42 ? ALA A 39 GLN A 42 A 2 LEU A 84 ? GLN A 87 ? LEU A 84 GLN A 87 A 3 VAL A 63 ? LYS A 66 ? VAL A 63 LYS A 66 B 1 VAL A 94 ? ASN A 98 ? VAL A 94 ASN A 98 B 2 ILE A 103 ? VAL A 106 ? ILE A 103 VAL A 106 B 3 ILE A 196 ? ALA A 203 ? ILE A 196 ALA A 203 B 4 VAL A 160 ? VAL A 166 ? VAL A 160 VAL A 166 B 5 ILE A 172 ? SER A 176 ? ILE A 172 SER A 176 C 1 ARG A 125 ? ALA A 126 ? ARG A 125 ALA A 126 C 2 PHE A 205 ? PRO A 206 ? PHE A 205 PRO A 206 D 1 VAL A 286 ? VAL A 287 ? VAL A 286 VAL A 287 D 2 LEU A 211 ? THR A 217 ? LEU A 211 THR A 217 D 3 THR A 291 ? LEU A 293 ? THR A 291 LEU A 293 E 1 VAL A 286 ? VAL A 287 ? VAL A 286 VAL A 287 E 2 LEU A 211 ? THR A 217 ? LEU A 211 THR A 217 E 3 GLY A 258 ? TYR A 264 ? GLY A 258 TYR A 264 E 4 VAL A 245 ? ASP A 251 ? VAL A 245 ASP A 251 E 5 PHE A 352 ? VAL A 359 ? PHE A 352 VAL A 359 E 6 TRP A 384 ? TYR A 392 ? TRP A 384 TYR A 392 E 7 ASN A 318 ? LEU A 326 ? ASN A 318 LEU A 326 E 8 TRP A 422 ? GLY A 423 ? TRP A 422 GLY A 423 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N ALA A 41 ? N ALA A 41 O MET A 85 ? O MET A 85 A 2 3 O LEU A 84 ? O LEU A 84 N SER A 64 ? N SER A 64 B 1 2 N ASN A 98 ? N ASN A 98 O ILE A 103 ? O ILE A 103 B 2 3 N ALA A 104 ? N ALA A 104 O LEU A 202 ? O LEU A 202 B 3 4 O LYS A 201 ? O LYS A 201 N GLY A 162 ? N GLY A 162 B 4 5 N VAL A 165 ? N VAL A 165 O VAL A 173 ? O VAL A 173 C 1 2 N ALA A 126 ? N ALA A 126 O PHE A 205 ? O PHE A 205 D 1 2 O VAL A 286 ? O VAL A 286 N THR A 217 ? N THR A 217 D 2 3 N ARG A 213 ? N ARG A 213 O THR A 291 ? O THR A 291 E 1 2 O VAL A 286 ? O VAL A 286 N THR A 217 ? N THR A 217 E 2 3 N THR A 212 ? N THR A 212 O TYR A 263 ? O TYR A 263 E 3 4 O GLY A 258 ? O GLY A 258 N GLY A 250 ? N GLY A 250 E 4 5 N ILE A 249 ? N ILE A 249 O LEU A 357 ? O LEU A 357 E 5 6 N ASP A 358 ? N ASP A 358 O LEU A 385 ? O LEU A 385 E 6 7 O ILE A 386 ? O ILE A 386 N LEU A 324 ? N LEU A 324 E 7 8 N THR A 325 ? N THR A 325 O GLY A 423 ? O GLY A 423 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 37 'BINDING SITE FOR RESIDUE FAD A 501' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 502' AC3 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ZN A 601' AC4 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ZN A 602' AC5 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ZN A 603' AC6 Software ? ? ? ? 16 'BINDING SITE FOR RESIDUE ABL A 604' AC7 Software ? ? ? ? 13 'BINDING SITE FOR RESIDUE ABL A 605' AC8 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE TRS A 606' AC9 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE SO4 A 607' BC1 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE CL A 608' BC2 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE CL A 609' BC3 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE CL A 610' BC4 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE CL A 611' # 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 37 PHE A 29 ? PHE A 29 . ? 1_555 ? 2 AC1 37 ALA A 65 ? ALA A 65 . ? 1_555 ? 3 AC1 37 LYS A 66 ? LYS A 66 . ? 1_555 ? 4 AC1 37 SER A 67 ? SER A 67 . ? 1_555 ? 5 AC1 37 GLY A 68 ? GLY A 68 . ? 1_555 ? 6 AC1 37 GLY A 69 ? GLY A 69 . ? 1_555 ? 7 AC1 37 HIS A 70 ? HIS A 70 . ? 1_555 ? 8 AC1 37 SER A 71 ? SER A 71 . ? 1_555 ? 9 AC1 37 TYR A 72 ? TYR A 72 . ? 1_555 ? 10 AC1 37 LEU A 88 ? LEU A 88 . ? 1_555 ? 11 AC1 37 GLY A 130 ? GLY A 130 . ? 1_555 ? 12 AC1 37 THR A 131 ? THR A 131 . ? 1_555 ? 13 AC1 37 CYS A 132 ? CYS A 132 . ? 1_555 ? 14 AC1 37 VAL A 135 ? VAL A 135 . ? 1_555 ? 15 AC1 37 GLY A 136 ? GLY A 136 . ? 1_555 ? 16 AC1 37 SER A 138 ? SER A 138 . ? 1_555 ? 17 AC1 37 GLY A 139 ? GLY A 139 . ? 1_555 ? 18 AC1 37 HIS A 140 ? HIS A 140 . ? 1_555 ? 19 AC1 37 HIS A 143 ? HIS A 143 . ? 1_555 ? 20 AC1 37 GLY A 145 ? GLY A 145 . ? 1_555 ? 21 AC1 37 PHE A 146 ? PHE A 146 . ? 1_555 ? 22 AC1 37 SER A 192 ? SER A 192 . ? 1_555 ? 23 AC1 37 GLY A 195 ? GLY A 195 . ? 1_555 ? 24 AC1 37 ILE A 196 ? ILE A 196 . ? 1_555 ? 25 AC1 37 VAL A 197 ? VAL A 197 . ? 1_555 ? 26 AC1 37 GLN A 314 ? GLN A 314 . ? 1_555 ? 27 AC1 37 TYR A 425 ? TYR A 425 . ? 1_555 ? 28 AC1 37 ASN A 427 ? ASN A 427 . ? 1_555 ? 29 AC1 37 TYR A 428 ? TYR A 428 . ? 1_555 ? 30 AC1 37 ABL G . ? ABL A 604 . ? 1_555 ? 31 AC1 37 HOH O . ? HOH A 767 . ? 1_555 ? 32 AC1 37 HOH O . ? HOH A 869 . ? 1_555 ? 33 AC1 37 HOH O . ? HOH A 1144 . ? 1_555 ? 34 AC1 37 HOH O . ? HOH A 1146 . ? 1_555 ? 35 AC1 37 HOH O . ? HOH A 1148 . ? 1_555 ? 36 AC1 37 HOH O . ? HOH A 1149 . ? 1_555 ? 37 AC1 37 HOH O . ? HOH A 1151 . ? 1_555 ? 38 AC2 4 ASN A 222 ? ASN A 222 . ? 1_555 ? 39 AC2 4 SER A 225 ? SER A 225 . ? 1_555 ? 40 AC2 4 HOH O . ? HOH A 722 . ? 1_555 ? 41 AC2 4 HOH O . ? HOH A 975 . ? 1_555 ? 42 AC3 4 HIS A 114 ? HIS A 114 . ? 1_555 ? 43 AC3 4 ASP A 309 ? ASP A 309 . ? 1_555 ? 44 AC3 4 HOH O . ? HOH A 643 . ? 1_555 ? 45 AC3 4 HOH O . ? HOH A 701 . ? 1_555 ? 46 AC4 4 ASP A 306 ? ASP A 306 . ? 2_555 ? 47 AC4 4 ASP A 306 ? ASP A 306 . ? 1_555 ? 48 AC4 4 HIS A 307 ? HIS A 307 . ? 2_555 ? 49 AC4 4 HIS A 307 ? HIS A 307 . ? 1_555 ? 50 AC5 4 GLU A 231 ? GLU A 231 . ? 1_555 ? 51 AC5 4 GLU A 231 ? GLU A 231 . ? 2_556 ? 52 AC5 4 ASP A 235 ? ASP A 235 . ? 2_556 ? 53 AC5 4 ASP A 235 ? ASP A 235 . ? 1_555 ? 54 AC6 16 TYR A 72 ? TYR A 72 . ? 1_555 ? 55 AC6 16 ARG A 248 ? ARG A 248 . ? 1_555 ? 56 AC6 16 TYR A 252 ? TYR A 252 . ? 1_555 ? 57 AC6 16 ASN A 304 ? ASN A 304 . ? 1_555 ? 58 AC6 16 GLN A 356 ? GLN A 356 . ? 1_555 ? 59 AC6 16 GLN A 387 ? GLN A 387 . ? 1_555 ? 60 AC6 16 TYR A 389 ? TYR A 389 . ? 1_555 ? 61 AC6 16 ARG A 391 ? ARG A 391 . ? 1_555 ? 62 AC6 16 TYR A 428 ? TYR A 428 . ? 1_555 ? 63 AC6 16 FAD B . ? FAD A 501 . ? 1_555 ? 64 AC6 16 HOH O . ? HOH A 627 . ? 1_555 ? 65 AC6 16 HOH O . ? HOH A 676 . ? 1_555 ? 66 AC6 16 HOH O . ? HOH A 692 . ? 1_555 ? 67 AC6 16 HOH O . ? HOH A 829 . ? 1_555 ? 68 AC6 16 HOH O . ? HOH A 989 . ? 1_555 ? 69 AC6 16 HOH O . ? HOH A 1095 . ? 1_555 ? 70 AC7 13 PRO A 13 ? PRO A 13 . ? 1_555 ? 71 AC7 13 ILE A 14 ? ILE A 14 . ? 1_555 ? 72 AC7 13 ASP A 15 ? ASP A 15 . ? 1_555 ? 73 AC7 13 ILE A 16 ? ILE A 16 . ? 1_555 ? 74 AC7 13 THR A 19 ? THR A 19 . ? 1_555 ? 75 AC7 13 ASP A 21 ? ASP A 21 . ? 1_555 ? 76 AC7 13 TYR A 22 ? TYR A 22 . ? 1_555 ? 77 AC7 13 GLN A 42 ? GLN A 42 . ? 1_555 ? 78 AC7 13 CL K . ? CL A 608 . ? 1_555 ? 79 AC7 13 HOH O . ? HOH A 682 . ? 1_555 ? 80 AC7 13 HOH O . ? HOH A 753 . ? 1_555 ? 81 AC7 13 HOH O . ? HOH A 915 . ? 1_555 ? 82 AC7 13 HOH O . ? HOH A 1187 . ? 1_555 ? 83 AC8 8 GLN A 44 ? GLN A 44 . ? 1_555 ? 84 AC8 8 ARG A 90 ? ARG A 90 . ? 1_555 ? 85 AC8 8 MET A 91 ? MET A 91 . ? 1_555 ? 86 AC8 8 ILE A 92 ? ILE A 92 . ? 1_555 ? 87 AC8 8 ASP A 93 ? ASP A 93 . ? 1_555 ? 88 AC8 8 GLU A 107 ? GLU A 107 . ? 1_555 ? 89 AC8 8 HOH O . ? HOH A 710 . ? 1_555 ? 90 AC8 8 HOH O . ? HOH A 1048 . ? 1_555 ? 91 AC9 5 ALA A 9 ? ALA A 9 . ? 4_445 ? 92 AC9 5 ARG A 32 ? ARG A 32 . ? 1_555 ? 93 AC9 5 HOH O . ? HOH A 651 . ? 4_445 ? 94 AC9 5 HOH O . ? HOH A 735 . ? 1_555 ? 95 AC9 5 HOH O . ? HOH A 1198 . ? 1_555 ? 96 BC1 2 ASP A 21 ? ASP A 21 . ? 1_555 ? 97 BC1 2 ABL H . ? ABL A 605 . ? 1_555 ? 98 BC2 1 LYS A 473 ? LYS A 473 . ? 1_555 ? 99 BC3 3 ARG A 435 ? ARG A 435 . ? 1_555 ? 100 BC3 3 TYR A 464 ? TYR A 464 . ? 1_555 ? 101 BC3 3 CL N . ? CL A 611 . ? 1_555 ? 102 BC4 3 ARG A 435 ? ARG A 435 . ? 1_555 ? 103 BC4 3 ARG A 470 ? ARG A 470 . ? 1_555 ? 104 BC4 3 CL M . ? CL A 610 . ? 1_555 ? # _database_PDB_matrix.entry_id 3RJA _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 3RJA _atom_sites.fract_transf_matrix[1][1] 0.007573 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000736 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.017569 _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] 0.011562 _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 CL N O P S ZN # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . GLY A 1 1 ? -36.752 -29.684 -11.810 1.00 24.06 ? 1 GLY A N 1 ATOM 2 C CA . GLY A 1 1 ? -37.987 -29.542 -11.003 1.00 21.88 ? 1 GLY A CA 1 ATOM 3 C C . GLY A 1 1 ? -38.090 -28.162 -10.373 1.00 19.19 ? 1 GLY A C 1 ATOM 4 O O . GLY A 1 1 ? -37.308 -27.256 -10.670 1.00 18.97 ? 1 GLY A O 1 ATOM 5 N N . ALA A 1 2 ? -39.056 -28.020 -9.484 1.00 16.14 ? 2 ALA A N 1 ATOM 6 C CA . ALA A 1 2 ? -39.418 -26.719 -8.942 1.00 15.81 ? 2 ALA A CA 1 ATOM 7 C C . ALA A 1 2 ? -38.241 -25.985 -8.236 1.00 15.35 ? 2 ALA A C 1 ATOM 8 O O . ALA A 1 2 ? -38.043 -24.801 -8.475 1.00 13.55 ? 2 ALA A O 1 ATOM 9 C CB . ALA A 1 2 ? -40.607 -26.893 -8.006 1.00 15.99 ? 2 ALA A CB 1 ATOM 10 N N . ILE A 1 3 ? -37.487 -26.692 -7.373 1.00 14.64 ? 3 ILE A N 1 ATOM 11 C CA . ILE A 1 3 ? -36.379 -26.078 -6.617 1.00 14.82 ? 3 ILE A CA 1 ATOM 12 C C . ILE A 1 3 ? -35.238 -25.655 -7.548 1.00 14.88 ? 3 ILE A C 1 ATOM 13 O O . ILE A 1 3 ? -34.691 -24.561 -7.398 1.00 13.83 ? 3 ILE A O 1 ATOM 14 C CB . ILE A 1 3 ? -35.863 -26.980 -5.398 1.00 14.36 ? 3 ILE A CB 1 ATOM 15 C CG1 . ILE A 1 3 ? -34.721 -26.305 -4.638 1.00 13.81 ? 3 ILE A CG1 1 ATOM 16 C CG2 . ILE A 1 3 ? -35.489 -28.404 -5.845 1.00 14.72 ? 3 ILE A CG2 1 ATOM 17 C CD1 . ILE A 1 3 ? -35.167 -24.982 -3.851 1.00 13.12 ? 3 ILE A CD1 1 ATOM 18 N N . GLU A 1 4 ? -34.887 -26.506 -8.512 1.00 15.95 ? 4 GLU A N 1 ATOM 19 C CA . GLU A 1 4 ? -33.856 -26.140 -9.498 1.00 17.85 ? 4 GLU A CA 1 ATOM 20 C C . GLU A 1 4 ? -34.289 -24.849 -10.240 1.00 17.85 ? 4 GLU A C 1 ATOM 21 O O . GLU A 1 4 ? -33.533 -23.889 -10.351 1.00 17.39 ? 4 GLU A O 1 ATOM 22 C CB . GLU A 1 4 ? -33.630 -27.264 -10.513 1.00 18.32 ? 4 GLU A CB 1 ATOM 23 C CG . GLU A 1 4 ? -32.982 -28.564 -9.962 1.00 21.38 ? 4 GLU A CG 1 ATOM 24 C CD . GLU A 1 4 ? -33.954 -29.455 -9.190 1.00 20.16 ? 4 GLU A CD 1 ATOM 25 O OE1 . GLU A 1 4 ? -35.181 -29.236 -9.287 1.00 18.33 ? 4 GLU A OE1 1 ATOM 26 O OE2 . GLU A 1 4 ? -33.483 -30.384 -8.498 1.00 23.89 ? 4 GLU A OE2 1 ATOM 27 N N . ALA A 1 5 ? -35.520 -24.840 -10.732 1.00 20.22 ? 5 ALA A N 1 ATOM 28 C CA . ALA A 1 5 ? -36.061 -23.686 -11.469 1.00 21.54 ? 5 ALA A CA 1 ATOM 29 C C . ALA A 1 5 ? -35.995 -22.442 -10.599 1.00 18.06 ? 5 ALA A C 1 ATOM 30 O O . ALA A 1 5 ? -35.562 -21.391 -11.052 1.00 17.37 ? 5 ALA A O 1 ATOM 31 C CB . ALA A 1 5 ? -37.505 -23.957 -11.878 1.00 21.75 ? 5 ALA A CB 1 ATOM 32 N N . CYS A 1 6 ? -36.389 -22.587 -9.332 1.00 16.70 ? 6 CYS A N 1 ATOM 33 C CA . CYS A 1 6 ? -36.390 -21.451 -8.393 1.00 17.03 ? 6 CYS A CA 1 ATOM 34 C C . CYS A 1 6 ? -34.995 -20.878 -8.198 1.00 17.25 ? 6 CYS A C 1 ATOM 35 O O . CYS A 1 6 ? -34.821 -19.668 -8.198 1.00 20.50 ? 6 CYS A O 1 ATOM 36 C CB . CYS A 1 6 ? -36.957 -21.851 -7.023 1.00 16.85 ? 6 CYS A CB 1 ATOM 37 S SG . CYS A 1 6 ? -37.133 -20.444 -5.896 0.82 15.81 ? 6 CYS A SG 1 ATOM 38 N N . LEU A 1 7 ? -34.013 -21.753 -7.997 1.00 15.43 ? 7 LEU A N 1 ATOM 39 C CA . LEU A 1 7 ? -32.653 -21.317 -7.767 1.00 15.80 ? 7 LEU A CA 1 ATOM 40 C C . LEU A 1 7 ? -32.077 -20.665 -9.037 1.00 15.50 ? 7 LEU A C 1 ATOM 41 O O . LEU A 1 7 ? -31.409 -19.631 -8.969 1.00 14.94 ? 7 LEU A O 1 ATOM 42 C CB . LEU A 1 7 ? -31.783 -22.510 -7.324 1.00 14.98 ? 7 LEU A CB 1 ATOM 43 C CG . LEU A 1 7 ? -32.072 -23.035 -5.927 1.00 14.63 ? 7 LEU A CG 1 ATOM 44 C CD1 . LEU A 1 7 ? -31.414 -24.404 -5.695 1.00 15.57 ? 7 LEU A CD1 1 ATOM 45 C CD2 . LEU A 1 7 ? -31.693 -22.011 -4.818 1.00 13.70 ? 7 LEU A CD2 1 ATOM 46 N N . SER A 1 8 ? -32.341 -21.278 -10.187 1.00 16.70 ? 8 SER A N 1 ATOM 47 C CA . SER A 1 8 ? -31.815 -20.766 -11.451 1.00 19.61 ? 8 SER A CA 1 ATOM 48 C C . SER A 1 8 ? -32.416 -19.402 -11.818 1.00 20.14 ? 8 SER A C 1 ATOM 49 O O . SER A 1 8 ? -31.694 -18.530 -12.282 1.00 21.58 ? 8 SER A O 1 ATOM 50 C CB . SER A 1 8 ? -32.014 -21.784 -12.559 1.00 21.77 ? 8 SER A CB 1 ATOM 51 O OG . SER A 1 8 ? -30.953 -22.711 -12.522 1.00 28.66 ? 8 SER A OG 1 ATOM 52 N N . ALA A 1 9 ? -33.719 -19.227 -11.575 1.00 19.96 ? 9 ALA A N 1 ATOM 53 C CA . ALA A 1 9 ? -34.418 -17.943 -11.766 1.00 21.05 ? 9 ALA A CA 1 ATOM 54 C C . ALA A 1 9 ? -33.793 -16.816 -10.974 1.00 21.42 ? 9 ALA A C 1 ATOM 55 O O . ALA A 1 9 ? -33.827 -15.671 -11.415 1.00 22.31 ? 9 ALA A O 1 ATOM 56 C CB . ALA A 1 9 ? -35.906 -18.069 -11.381 1.00 19.45 ? 9 ALA A CB 1 ATOM 57 N N . ALA A 1 10 ? -33.223 -17.143 -9.808 1.00 20.58 ? 10 ALA A N 1 ATOM 58 C CA . ALA A 1 10 ? -32.555 -16.152 -8.939 1.00 17.46 ? 10 ALA A CA 1 ATOM 59 C C . ALA A 1 10 ? -31.063 -16.015 -9.193 1.00 16.65 ? 10 ALA A C 1 ATOM 60 O O . ALA A 1 10 ? -30.366 -15.310 -8.456 1.00 17.71 ? 10 ALA A O 1 ATOM 61 C CB . ALA A 1 10 ? -32.809 -16.488 -7.455 1.00 17.54 ? 10 ALA A CB 1 ATOM 62 N N . GLY A 1 11 ? -30.560 -16.661 -10.244 1.00 16.77 ? 11 GLY A N 1 ATOM 63 C CA . GLY A 1 11 ? -29.130 -16.630 -10.554 1.00 16.71 ? 11 GLY A CA 1 ATOM 64 C C . GLY A 1 11 ? -28.228 -17.451 -9.615 1.00 18.40 ? 11 GLY A C 1 ATOM 65 O O . GLY A 1 11 ? -27.009 -17.253 -9.597 1.00 16.90 ? 11 GLY A O 1 ATOM 66 N N . VAL A 1 12 ? -28.805 -18.366 -8.832 1.00 17.55 ? 12 VAL A N 1 ATOM 67 C CA . VAL A 1 12 ? -28.000 -19.161 -7.891 1.00 17.19 ? 12 VAL A CA 1 ATOM 68 C C . VAL A 1 12 ? -27.440 -20.396 -8.593 1.00 16.06 ? 12 VAL A C 1 ATOM 69 O O . VAL A 1 12 ? -28.209 -21.195 -9.108 1.00 15.39 ? 12 VAL A O 1 ATOM 70 C CB . VAL A 1 12 ? -28.823 -19.608 -6.672 1.00 17.41 ? 12 VAL A CB 1 ATOM 71 C CG1 . VAL A 1 12 ? -27.988 -20.506 -5.768 1.00 17.26 ? 12 VAL A CG1 1 ATOM 72 C CG2 . VAL A 1 12 ? -29.327 -18.404 -5.921 1.00 17.00 ? 12 VAL A CG2 1 ATOM 73 N N . PRO A 1 13 ? -26.093 -20.549 -8.626 1.00 15.89 ? 13 PRO A N 1 ATOM 74 C CA . PRO A 1 13 ? -25.521 -21.763 -9.247 1.00 15.51 ? 13 PRO A CA 1 ATOM 75 C C . PRO A 1 13 ? -25.970 -23.021 -8.504 1.00 15.11 ? 13 PRO A C 1 ATOM 76 O O . PRO A 1 13 ? -26.128 -23.016 -7.274 1.00 13.82 ? 13 PRO A O 1 ATOM 77 C CB . PRO A 1 13 ? -24.011 -21.555 -9.135 1.00 14.91 ? 13 PRO A CB 1 ATOM 78 C CG . PRO A 1 13 ? -23.836 -20.062 -8.883 1.00 14.76 ? 13 PRO A CG 1 ATOM 79 C CD . PRO A 1 13 ? -25.052 -19.625 -8.138 1.00 14.15 ? 13 PRO A CD 1 ATOM 80 N N . ILE A 1 14 ? -26.264 -24.066 -9.270 1.00 14.98 ? 14 ILE A N 1 ATOM 81 C CA . ILE A 1 14 ? -26.725 -25.305 -8.696 1.00 15.51 ? 14 ILE A CA 1 ATOM 82 C C . ILE A 1 14 ? -25.820 -26.425 -9.169 1.00 15.51 ? 14 ILE A C 1 ATOM 83 O O . ILE A 1 14 ? -25.248 -26.319 -10.228 1.00 16.49 ? 14 ILE A O 1 ATOM 84 C CB . ILE A 1 14 ? -28.213 -25.580 -9.010 1.00 17.37 ? 14 ILE A CB 1 ATOM 85 C CG1 . ILE A 1 14 ? -28.491 -25.590 -10.518 1.00 18.50 ? 14 ILE A CG1 1 ATOM 86 C CG2 . ILE A 1 14 ? -29.110 -24.556 -8.275 1.00 15.96 ? 14 ILE A CG2 1 ATOM 87 C CD1 . ILE A 1 14 ? -29.856 -26.175 -10.897 1.00 17.87 ? 14 ILE A CD1 1 ATOM 88 N N . ASP A 1 15 ? -25.660 -27.481 -8.374 1.00 14.70 ? 15 ASP A N 1 ATOM 89 C CA . ASP A 1 15 ? -24.891 -28.626 -8.839 1.00 14.95 ? 15 ASP A CA 1 ATOM 90 C C . ASP A 1 15 ? -25.803 -29.533 -9.678 1.00 14.67 ? 15 ASP A C 1 ATOM 91 O O . ASP A 1 15 ? -26.994 -29.639 -9.425 1.00 14.55 ? 15 ASP A O 1 ATOM 92 C CB . ASP A 1 15 ? -24.269 -29.429 -7.677 1.00 13.58 ? 15 ASP A CB 1 ATOM 93 C CG . ASP A 1 15 ? -23.100 -28.726 -7.008 1.00 13.53 ? 15 ASP A CG 1 ATOM 94 O OD1 . ASP A 1 15 ? -22.469 -27.809 -7.586 1.00 12.09 ? 15 ASP A OD1 1 ATOM 95 O OD2 . ASP A 1 15 ? -22.787 -29.119 -5.858 1.00 15.25 ? 15 ASP A OD2 1 ATOM 96 N N . ILE A 1 16 ? -25.213 -30.175 -10.673 1.00 15.50 ? 16 ILE A N 1 ATOM 97 C CA A ILE A 1 16 ? -25.927 -31.064 -11.587 0.50 15.55 ? 16 ILE A CA 1 ATOM 98 C CA B ILE A 1 16 ? -25.939 -31.056 -11.579 0.50 15.39 ? 16 ILE A CA 1 ATOM 99 C C . ILE A 1 16 ? -25.563 -32.492 -11.227 1.00 14.77 ? 16 ILE A C 1 ATOM 100 O O . ILE A 1 16 ? -24.398 -32.862 -11.345 1.00 14.94 ? 16 ILE A O 1 ATOM 101 C CB A ILE A 1 16 ? -25.508 -30.810 -13.068 0.50 15.62 ? 16 ILE A CB 1 ATOM 102 C CB B ILE A 1 16 ? -25.585 -30.763 -13.074 0.50 15.32 ? 16 ILE A CB 1 ATOM 103 C CG1 A ILE A 1 16 ? -25.959 -29.425 -13.523 0.50 16.19 ? 16 ILE A CG1 1 ATOM 104 C CG1 B ILE A 1 16 ? -25.511 -29.255 -13.333 0.50 15.53 ? 16 ILE A CG1 1 ATOM 105 C CG2 A ILE A 1 16 ? -26.073 -31.898 -14.003 0.50 15.40 ? 16 ILE A CG2 1 ATOM 106 C CG2 B ILE A 1 16 ? -26.603 -31.419 -14.018 0.50 15.41 ? 16 ILE A CG2 1 ATOM 107 C CD1 A ILE A 1 16 ? -27.304 -29.038 -12.984 0.50 16.44 ? 16 ILE A CD1 1 ATOM 108 C CD1 B ILE A 1 16 ? -25.212 -28.867 -14.782 0.50 14.77 ? 16 ILE A CD1 1 ATOM 109 N N . PRO A 1 17 ? -26.551 -33.309 -10.781 1.00 16.43 ? 17 PRO A N 1 ATOM 110 C CA . PRO A 1 17 ? -26.166 -34.704 -10.492 1.00 17.73 ? 17 PRO A CA 1 ATOM 111 C C . PRO A 1 17 ? -25.397 -35.322 -11.654 1.00 20.50 ? 17 PRO A C 1 ATOM 112 O O . PRO A 1 17 ? -25.771 -35.123 -12.809 1.00 20.13 ? 17 PRO A O 1 ATOM 113 C CB . PRO A 1 17 ? -27.509 -35.413 -10.287 1.00 17.00 ? 17 PRO A CB 1 ATOM 114 C CG . PRO A 1 17 ? -28.426 -34.334 -9.823 1.00 16.24 ? 17 PRO A CG 1 ATOM 115 C CD . PRO A 1 17 ? -27.992 -33.074 -10.512 1.00 16.26 ? 17 PRO A CD 1 ATOM 116 N N . GLY A 1 18 ? -24.307 -36.017 -11.332 1.00 22.25 ? 18 GLY A N 1 ATOM 117 C CA . GLY A 1 18 ? -23.521 -36.729 -12.323 1.00 23.89 ? 18 GLY A CA 1 ATOM 118 C C . GLY A 1 18 ? -22.242 -35.998 -12.711 1.00 27.36 ? 18 GLY A C 1 ATOM 119 O O . GLY A 1 18 ? -21.404 -36.564 -13.411 1.00 30.18 ? 18 GLY A O 1 ATOM 120 N N . THR A 1 19 ? -22.095 -34.740 -12.277 1.00 22.75 ? 19 THR A N 1 ATOM 121 C CA . THR A 1 19 ? -20.914 -33.945 -12.625 1.00 19.72 ? 19 THR A CA 1 ATOM 122 C C . THR A 1 19 ? -19.895 -33.955 -11.469 1.00 19.91 ? 19 THR A C 1 ATOM 123 O O . THR A 1 19 ? -20.256 -34.240 -10.307 1.00 19.44 ? 19 THR A O 1 ATOM 124 C CB . THR A 1 19 ? -21.278 -32.491 -12.967 1.00 19.24 ? 19 THR A CB 1 ATOM 125 O OG1 . THR A 1 19 ? -21.792 -31.826 -11.808 1.00 17.05 ? 19 THR A OG1 1 ATOM 126 C CG2 . THR A 1 19 ? -22.308 -32.414 -14.084 1.00 19.62 ? 19 THR A CG2 1 ATOM 127 N N . ALA A 1 20 ? -18.647 -33.615 -11.785 1.00 16.27 ? 20 ALA A N 1 ATOM 128 C CA . ALA A 1 20 ? -17.585 -33.544 -10.784 1.00 18.11 ? 20 ALA A CA 1 ATOM 129 C C . ALA A 1 20 ? -17.997 -32.700 -9.578 1.00 17.07 ? 20 ALA A C 1 ATOM 130 O O . ALA A 1 20 ? -17.899 -33.179 -8.454 1.00 20.62 ? 20 ALA A O 1 ATOM 131 C CB . ALA A 1 20 ? -16.270 -33.009 -11.394 1.00 18.59 ? 20 ALA A CB 1 ATOM 132 N N . ASP A 1 21 ? -18.452 -31.466 -9.813 1.00 15.04 ? 21 ASP A N 1 ATOM 133 C CA A ASP A 1 21 ? -18.838 -30.585 -8.717 0.50 14.84 ? 21 ASP A CA 1 ATOM 134 C CA B ASP A 1 21 ? -18.865 -30.567 -8.729 0.50 15.07 ? 21 ASP A CA 1 ATOM 135 C C . ASP A 1 21 ? -19.881 -31.236 -7.810 1.00 14.44 ? 21 ASP A C 1 ATOM 136 O O . ASP A 1 21 ? -19.748 -31.178 -6.601 1.00 13.82 ? 21 ASP A O 1 ATOM 137 C CB A ASP A 1 21 ? -19.325 -29.229 -9.230 0.50 14.50 ? 21 ASP A CB 1 ATOM 138 C CB B ASP A 1 21 ? -19.435 -29.247 -9.270 0.50 14.99 ? 21 ASP A CB 1 ATOM 139 C CG A ASP A 1 21 ? -18.169 -28.276 -9.535 0.50 15.11 ? 21 ASP A CG 1 ATOM 140 C CG B ASP A 1 21 ? -18.418 -28.107 -9.223 0.50 16.24 ? 21 ASP A CG 1 ATOM 141 O OD1 A ASP A 1 21 ? -17.823 -27.448 -8.661 0.50 15.75 ? 21 ASP A OD1 1 ATOM 142 O OD1 B ASP A 1 21 ? -17.241 -28.387 -8.896 0.50 16.97 ? 21 ASP A OD1 1 ATOM 143 O OD2 A ASP A 1 21 ? -17.587 -28.366 -10.636 0.50 14.44 ? 21 ASP A OD2 1 ATOM 144 O OD2 B ASP A 1 21 ? -18.795 -26.936 -9.498 0.50 15.70 ? 21 ASP A OD2 1 ATOM 145 N N . TYR A 1 22 ? -20.889 -31.879 -8.407 1.00 13.23 ? 22 TYR A N 1 ATOM 146 C CA . TYR A 1 22 ? -21.938 -32.521 -7.607 1.00 13.63 ? 22 TYR A CA 1 ATOM 147 C C . TYR A 1 22 ? -21.345 -33.652 -6.755 1.00 14.00 ? 22 TYR A C 1 ATOM 148 O O . TYR A 1 22 ? -21.534 -33.666 -5.539 1.00 12.21 ? 22 TYR A O 1 ATOM 149 C CB . TYR A 1 22 ? -23.092 -33.036 -8.484 1.00 12.79 ? 22 TYR A CB 1 ATOM 150 C CG . TYR A 1 22 ? -24.195 -33.714 -7.696 1.00 12.89 ? 22 TYR A CG 1 ATOM 151 C CD1 . TYR A 1 22 ? -24.128 -35.066 -7.388 1.00 12.73 ? 22 TYR A CD1 1 ATOM 152 C CD2 . TYR A 1 22 ? -25.302 -32.997 -7.264 1.00 12.44 ? 22 TYR A CD2 1 ATOM 153 C CE1 . TYR A 1 22 ? -25.148 -35.690 -6.661 1.00 12.77 ? 22 TYR A CE1 1 ATOM 154 C CE2 . TYR A 1 22 ? -26.301 -33.594 -6.533 1.00 13.14 ? 22 TYR A CE2 1 ATOM 155 C CZ . TYR A 1 22 ? -26.223 -34.941 -6.231 1.00 14.04 ? 22 TYR A CZ 1 ATOM 156 O OH . TYR A 1 22 ? -27.254 -35.534 -5.516 1.00 16.52 ? 22 TYR A OH 1 ATOM 157 N N . GLU A 1 23 ? -20.598 -34.565 -7.398 1.00 13.56 ? 23 GLU A N 1 ATOM 158 C CA . GLU A 1 23 ? -19.960 -35.673 -6.697 1.00 14.54 ? 23 GLU A CA 1 ATOM 159 C C . GLU A 1 23 ? -19.072 -35.199 -5.539 1.00 14.51 ? 23 GLU A C 1 ATOM 160 O O . GLU A 1 23 ? -19.096 -35.797 -4.477 1.00 13.88 ? 23 GLU A O 1 ATOM 161 C CB . GLU A 1 23 ? -19.164 -36.594 -7.647 1.00 15.25 ? 23 GLU A CB 1 ATOM 162 C CG . GLU A 1 23 ? -20.044 -37.343 -8.695 1.00 19.00 ? 23 GLU A CG 1 ATOM 163 C CD . GLU A 1 23 ? -21.042 -38.324 -8.092 0.50 18.71 ? 23 GLU A CD 1 ATOM 164 O OE1 . GLU A 1 23 ? -20.619 -39.199 -7.321 0.50 19.35 ? 23 GLU A OE1 1 ATOM 165 O OE2 . GLU A 1 23 ? -22.253 -38.225 -8.395 0.50 20.44 ? 23 GLU A OE2 1 ATOM 166 N N . ARG A 1 24 ? -18.273 -34.149 -5.768 1.00 15.13 ? 24 ARG A N 1 ATOM 167 C CA . ARG A 1 24 ? -17.458 -33.558 -4.725 1.00 14.29 ? 24 ARG A CA 1 ATOM 168 C C . ARG A 1 24 ? -18.324 -32.975 -3.580 1.00 13.56 ? 24 ARG A C 1 ATOM 169 O O . ARG A 1 24 ? -18.084 -33.261 -2.415 1.00 12.37 ? 24 ARG A O 1 ATOM 170 C CB . ARG A 1 24 ? -16.562 -32.453 -5.302 1.00 16.31 ? 24 ARG A CB 1 ATOM 171 C CG . ARG A 1 24 ? -15.864 -31.610 -4.221 1.00 17.93 ? 24 ARG A CG 1 ATOM 172 C CD . ARG A 1 24 ? -14.941 -30.519 -4.804 1.00 20.05 ? 24 ARG A CD 1 ATOM 173 N NE . ARG A 1 24 ? -14.818 -29.421 -3.849 1.00 23.31 ? 24 ARG A NE 1 ATOM 174 C CZ . ARG A 1 24 ? -13.936 -28.421 -3.938 1.00 27.14 ? 24 ARG A CZ 1 ATOM 175 N NH1 . ARG A 1 24 ? -13.066 -28.395 -4.946 1.00 25.91 ? 24 ARG A NH1 1 ATOM 176 N NH2 . ARG A 1 24 ? -13.922 -27.447 -3.014 1.00 21.19 ? 24 ARG A NH2 1 ATOM 177 N N . ASP A 1 25 ? -19.305 -32.152 -3.928 1.00 12.11 ? 25 ASP A N 1 ATOM 178 C CA . ASP A 1 25 ? -20.086 -31.417 -2.936 1.00 12.02 ? 25 ASP A CA 1 ATOM 179 C C . ASP A 1 25 ? -21.017 -32.321 -2.078 1.00 12.41 ? 25 ASP A C 1 ATOM 180 O O . ASP A 1 25 ? -21.305 -32.005 -0.914 1.00 10.12 ? 25 ASP A O 1 ATOM 181 C CB . ASP A 1 25 ? -20.922 -30.329 -3.614 1.00 11.04 ? 25 ASP A CB 1 ATOM 182 C CG . ASP A 1 25 ? -20.089 -29.119 -4.116 1.00 10.60 ? 25 ASP A CG 1 ATOM 183 O OD1 . ASP A 1 25 ? -18.926 -28.920 -3.720 1.00 10.33 ? 25 ASP A OD1 1 ATOM 184 O OD2 . ASP A 1 25 ? -20.633 -28.333 -4.932 1.00 10.47 ? 25 ASP A OD2 1 ATOM 185 N N . VAL A 1 26 ? -21.479 -33.436 -2.671 1.00 12.13 ? 26 VAL A N 1 ATOM 186 C CA . VAL A 1 26 ? -22.485 -34.279 -2.052 1.00 11.25 ? 26 VAL A CA 1 ATOM 187 C C . VAL A 1 26 ? -21.826 -35.355 -1.153 1.00 11.85 ? 26 VAL A C 1 ATOM 188 O O . VAL A 1 26 ? -22.519 -36.087 -0.422 1.00 9.94 ? 26 VAL A O 1 ATOM 189 C CB . VAL A 1 26 ? -23.400 -34.980 -3.114 1.00 11.54 ? 26 VAL A CB 1 ATOM 190 C CG1 . VAL A 1 26 ? -22.732 -36.262 -3.660 1.00 10.45 ? 26 VAL A CG1 1 ATOM 191 C CG2 . VAL A 1 26 ? -24.747 -35.351 -2.489 1.00 11.01 ? 26 VAL A CG2 1 ATOM 192 N N . GLU A 1 27 ? -20.502 -35.449 -1.228 1.00 11.19 ? 27 GLU A N 1 ATOM 193 C CA . GLU A 1 27 ? -19.787 -36.471 -0.476 1.00 12.72 ? 27 GLU A CA 1 ATOM 194 C C . GLU A 1 27 ? -19.566 -35.995 0.974 1.00 11.53 ? 27 GLU A C 1 ATOM 195 O O . GLU A 1 27 ? -18.941 -34.948 1.186 1.00 11.74 ? 27 GLU A O 1 ATOM 196 C CB . GLU A 1 27 ? -18.431 -36.771 -1.152 1.00 13.16 ? 27 GLU A CB 1 ATOM 197 C CG . GLU A 1 27 ? -17.617 -37.902 -0.481 1.00 15.73 ? 27 GLU A CG 1 ATOM 198 C CD . GLU A 1 27 ? -16.272 -38.153 -1.177 1.00 19.19 ? 27 GLU A CD 1 ATOM 199 O OE1 . GLU A 1 27 ? -15.558 -37.174 -1.505 1.00 18.28 ? 27 GLU A OE1 1 ATOM 200 O OE2 . GLU A 1 27 ? -15.942 -39.342 -1.396 1.00 21.18 ? 27 GLU A OE2 1 ATOM 201 N N . PRO A 1 28 ? -20.073 -36.742 1.966 1.00 11.73 ? 28 PRO A N 1 ATOM 202 C CA . PRO A 1 28 ? -19.858 -36.370 3.405 1.00 11.27 ? 28 PRO A CA 1 ATOM 203 C C . PRO A 1 28 ? -18.427 -36.637 3.824 1.00 12.11 ? 28 PRO A C 1 ATOM 204 O O . PRO A 1 28 ? -17.778 -37.527 3.231 1.00 12.17 ? 28 PRO A O 1 ATOM 205 C CB . PRO A 1 28 ? -20.732 -37.361 4.155 1.00 11.63 ? 28 PRO A CB 1 ATOM 206 C CG . PRO A 1 28 ? -20.768 -38.631 3.213 1.00 10.79 ? 28 PRO A CG 1 ATOM 207 C CD . PRO A 1 28 ? -20.746 -38.054 1.810 1.00 12.16 ? 28 PRO A CD 1 ATOM 208 N N . PHE A 1 29 ? -17.940 -35.946 4.861 1.00 11.05 ? 29 PHE A N 1 ATOM 209 C CA . PHE A 1 29 ? -16.666 -36.344 5.463 1.00 10.92 ? 29 PHE A CA 1 ATOM 210 C C . PHE A 1 29 ? -16.797 -37.761 6.079 1.00 11.13 ? 29 PHE A C 1 ATOM 211 O O . PHE A 1 29 ? -15.887 -38.584 5.965 1.00 10.89 ? 29 PHE A O 1 ATOM 212 C CB . PHE A 1 29 ? -16.180 -35.318 6.524 1.00 10.35 ? 29 PHE A CB 1 ATOM 213 C CG . PHE A 1 29 ? -15.016 -35.818 7.365 1.00 10.68 ? 29 PHE A CG 1 ATOM 214 C CD1 . PHE A 1 29 ? -13.728 -35.959 6.801 1.00 10.71 ? 29 PHE A CD1 1 ATOM 215 C CD2 . PHE A 1 29 ? -15.201 -36.160 8.700 1.00 10.19 ? 29 PHE A CD2 1 ATOM 216 C CE1 . PHE A 1 29 ? -12.657 -36.434 7.579 1.00 11.14 ? 29 PHE A CE1 1 ATOM 217 C CE2 . PHE A 1 29 ? -14.119 -36.655 9.503 1.00 10.33 ? 29 PHE A CE2 1 ATOM 218 C CZ . PHE A 1 29 ? -12.869 -36.781 8.957 1.00 10.31 ? 29 PHE A CZ 1 ATOM 219 N N . ASN A 1 30 ? -17.912 -38.002 6.773 1.00 11.40 ? 30 ASN A N 1 ATOM 220 C CA . ASN A 1 30 ? -18.236 -39.299 7.369 1.00 11.74 ? 30 ASN A CA 1 ATOM 221 C C . ASN A 1 30 ? -19.096 -40.103 6.386 1.00 12.73 ? 30 ASN A C 1 ATOM 222 O O . ASN A 1 30 ? -20.335 -39.909 6.300 1.00 11.22 ? 30 ASN A O 1 ATOM 223 C CB . ASN A 1 30 ? -18.979 -39.146 8.714 1.00 12.12 ? 30 ASN A CB 1 ATOM 224 C CG . ASN A 1 30 ? -18.981 -40.446 9.514 1.00 12.87 ? 30 ASN A CG 1 ATOM 225 O OD1 . ASN A 1 30 ? -18.604 -41.487 8.978 1.00 14.06 ? 30 ASN A OD1 1 ATOM 226 N ND2 . ASN A 1 30 ? -19.373 -40.393 10.786 1.00 11.70 ? 30 ASN A ND2 1 ATOM 227 N N . ILE A 1 31 ? -18.447 -40.989 5.632 1.00 13.65 ? 31 ILE A N 1 ATOM 228 C CA . ILE A 1 31 ? -19.158 -41.762 4.602 1.00 15.03 ? 31 ILE A CA 1 ATOM 229 C C . ILE A 1 31 ? -20.076 -42.836 5.178 1.00 15.13 ? 31 ILE A C 1 ATOM 230 O O . ILE A 1 31 ? -20.853 -43.451 4.446 1.00 14.54 ? 31 ILE A O 1 ATOM 231 C CB . ILE A 1 31 ? -18.211 -42.369 3.571 1.00 17.31 ? 31 ILE A CB 1 ATOM 232 C CG1 . ILE A 1 31 ? -17.236 -43.358 4.250 1.00 18.06 ? 31 ILE A CG1 1 ATOM 233 C CG2 . ILE A 1 31 ? -17.557 -41.249 2.768 1.00 16.93 ? 31 ILE A CG2 1 ATOM 234 C CD1 . ILE A 1 31 ? -16.575 -44.323 3.281 1.00 22.52 ? 31 ILE A CD1 1 ATOM 235 N N . ARG A 1 32 ? -20.005 -43.038 6.496 1.00 13.60 ? 32 ARG A N 1 ATOM 236 C CA . ARG A 1 32 ? -21.000 -43.828 7.175 1.00 13.05 ? 32 ARG A CA 1 ATOM 237 C C . ARG A 1 32 ? -22.361 -43.168 7.019 1.00 13.32 ? 32 ARG A C 1 ATOM 238 O O . ARG A 1 32 ? -23.400 -43.819 7.191 1.00 13.00 ? 32 ARG A O 1 ATOM 239 C CB . ARG A 1 32 ? -20.673 -43.918 8.674 1.00 12.80 ? 32 ARG A CB 1 ATOM 240 C CG . ARG A 1 32 ? -21.531 -44.929 9.438 1.00 13.21 ? 32 ARG A CG 1 ATOM 241 C CD . ARG A 1 32 ? -21.100 -45.077 10.888 1.00 13.51 ? 32 ARG A CD 1 ATOM 242 N NE . ARG A 1 32 ? -21.408 -43.919 11.733 1.00 14.11 ? 32 ARG A NE 1 ATOM 243 C CZ . ARG A 1 32 ? -22.614 -43.626 12.219 1.00 14.56 ? 32 ARG A CZ 1 ATOM 244 N NH1 . ARG A 1 32 ? -22.779 -42.565 13.007 1.00 14.85 ? 32 ARG A NH1 1 ATOM 245 N NH2 . ARG A 1 32 ? -23.663 -44.374 11.913 1.00 14.16 ? 32 ARG A NH2 1 ATOM 246 N N . LEU A 1 33 ? -22.360 -41.857 6.765 1.00 12.13 ? 33 LEU A N 1 ATOM 247 C CA . LEU A 1 33 ? -23.596 -41.084 6.859 1.00 12.18 ? 33 LEU A CA 1 ATOM 248 C C . LEU A 1 33 ? -23.885 -40.203 5.622 1.00 11.82 ? 33 LEU A C 1 ATOM 249 O O . LEU A 1 33 ? -23.900 -38.971 5.751 1.00 11.91 ? 33 LEU A O 1 ATOM 250 C CB . LEU A 1 33 ? -23.594 -40.257 8.167 1.00 11.21 ? 33 LEU A CB 1 ATOM 251 C CG . LEU A 1 33 ? -23.790 -41.023 9.487 1.00 12.17 ? 33 LEU A CG 1 ATOM 252 C CD1 . LEU A 1 33 ? -23.645 -40.114 10.723 1.00 11.74 ? 33 LEU A CD1 1 ATOM 253 C CD2 . LEU A 1 33 ? -25.140 -41.737 9.553 1.00 12.56 ? 33 LEU A CD2 1 ATOM 254 N N . PRO A 1 34 ? -24.112 -40.819 4.429 1.00 11.22 ? 34 PRO A N 1 ATOM 255 C CA . PRO A 1 34 ? -24.489 -39.998 3.284 1.00 11.26 ? 34 PRO A CA 1 ATOM 256 C C . PRO A 1 34 ? -25.951 -39.586 3.321 1.00 11.50 ? 34 PRO A C 1 ATOM 257 O O . PRO A 1 34 ? -26.813 -40.356 3.779 1.00 12.02 ? 34 PRO A O 1 ATOM 258 C CB . PRO A 1 34 ? -24.215 -40.908 2.068 1.00 11.52 ? 34 PRO A CB 1 ATOM 259 C CG . PRO A 1 34 ? -24.434 -42.316 2.582 1.00 11.43 ? 34 PRO A CG 1 ATOM 260 C CD . PRO A 1 34 ? -23.975 -42.248 4.056 1.00 12.50 ? 34 PRO A CD 1 ATOM 261 N N . TYR A 1 35 ? -26.224 -38.362 2.886 1.00 11.19 ? 35 TYR A N 1 ATOM 262 C CA . TYR A 1 35 ? -27.614 -37.920 2.676 1.00 11.64 ? 35 TYR A CA 1 ATOM 263 C C . TYR A 1 35 ? -27.755 -37.337 1.282 1.00 11.64 ? 35 TYR A C 1 ATOM 264 O O . TYR A 1 35 ? -26.746 -36.949 0.669 1.00 10.68 ? 35 TYR A O 1 ATOM 265 C CB . TYR A 1 35 ? -28.089 -36.936 3.752 1.00 10.97 ? 35 TYR A CB 1 ATOM 266 C CG . TYR A 1 35 ? -28.136 -37.565 5.113 1.00 11.48 ? 35 TYR A CG 1 ATOM 267 C CD1 . TYR A 1 35 ? -29.084 -38.547 5.417 1.00 11.38 ? 35 TYR A CD1 1 ATOM 268 C CD2 . TYR A 1 35 ? -27.211 -37.205 6.103 1.00 11.97 ? 35 TYR A CD2 1 ATOM 269 C CE1 . TYR A 1 35 ? -29.113 -39.163 6.679 1.00 12.34 ? 35 TYR A CE1 1 ATOM 270 C CE2 . TYR A 1 35 ? -27.241 -37.793 7.380 1.00 11.47 ? 35 TYR A CE2 1 ATOM 271 C CZ . TYR A 1 35 ? -28.200 -38.771 7.663 1.00 12.84 ? 35 TYR A CZ 1 ATOM 272 O OH . TYR A 1 35 ? -28.218 -39.372 8.914 1.00 12.91 ? 35 TYR A OH 1 ATOM 273 N N . ILE A 1 36 ? -28.994 -37.335 0.780 1.00 11.28 ? 36 ILE A N 1 ATOM 274 C CA . ILE A 1 36 ? -29.290 -36.912 -0.576 1.00 11.95 ? 36 ILE A CA 1 ATOM 275 C C . ILE A 1 36 ? -30.121 -35.632 -0.477 1.00 12.10 ? 36 ILE A C 1 ATOM 276 O O . ILE A 1 36 ? -31.318 -35.671 -0.151 1.00 10.71 ? 36 ILE A O 1 ATOM 277 C CB . ILE A 1 36 ? -30.059 -38.013 -1.378 1.00 12.82 ? 36 ILE A CB 1 ATOM 278 C CG1 . ILE A 1 36 ? -29.429 -39.419 -1.187 1.00 12.46 ? 36 ILE A CG1 1 ATOM 279 C CG2 . ILE A 1 36 ? -30.135 -37.654 -2.856 1.00 12.99 ? 36 ILE A CG2 1 ATOM 280 C CD1 . ILE A 1 36 ? -28.047 -39.625 -1.804 1.00 11.97 ? 36 ILE A CD1 1 ATOM 281 N N . PRO A 1 37 ? -29.488 -34.484 -0.748 1.00 11.79 ? 37 PRO A N 1 ATOM 282 C CA . PRO A 1 37 ? -30.256 -33.231 -0.695 1.00 12.39 ? 37 PRO A CA 1 ATOM 283 C C . PRO A 1 37 ? -31.208 -33.179 -1.878 1.00 12.35 ? 37 PRO A C 1 ATOM 284 O O . PRO A 1 37 ? -30.963 -33.845 -2.893 1.00 12.17 ? 37 PRO A O 1 ATOM 285 C CB . PRO A 1 37 ? -29.194 -32.127 -0.813 1.00 11.30 ? 37 PRO A CB 1 ATOM 286 C CG . PRO A 1 37 ? -27.885 -32.802 -0.663 1.00 13.62 ? 37 PRO A CG 1 ATOM 287 C CD . PRO A 1 37 ? -28.060 -34.266 -1.011 1.00 12.13 ? 37 PRO A CD 1 ATOM 288 N N . THR A 1 38 ? -32.312 -32.446 -1.757 1.00 12.28 ? 38 THR A N 1 ATOM 289 C CA . THR A 1 38 ? -33.136 -32.288 -2.946 1.00 11.91 ? 38 THR A CA 1 ATOM 290 C C . THR A 1 38 ? -32.397 -31.505 -4.052 1.00 12.07 ? 38 THR A C 1 ATOM 291 O O . THR A 1 38 ? -32.598 -31.762 -5.247 1.00 11.16 ? 38 THR A O 1 ATOM 292 C CB . THR A 1 38 ? -34.516 -31.684 -2.664 1.00 12.10 ? 38 THR A CB 1 ATOM 293 O OG1 . THR A 1 38 ? -35.256 -31.703 -3.879 1.00 13.58 ? 38 THR A OG1 1 ATOM 294 C CG2 . THR A 1 38 ? -34.425 -30.250 -2.130 1.00 11.28 ? 38 THR A CG2 1 ATOM 295 N N . ALA A 1 39 ? -31.554 -30.555 -3.633 1.00 10.26 ? 39 ALA A N 1 ATOM 296 C CA . ALA A 1 39 ? -30.732 -29.793 -4.548 1.00 10.50 ? 39 ALA A CA 1 ATOM 297 C C . ALA A 1 39 ? -29.561 -29.189 -3.799 1.00 10.71 ? 39 ALA A C 1 ATOM 298 O O . ALA A 1 39 ? -29.657 -28.970 -2.598 1.00 10.33 ? 39 ALA A O 1 ATOM 299 C CB . ALA A 1 39 ? -31.579 -28.668 -5.242 1.00 9.82 ? 39 ALA A CB 1 ATOM 300 N N . ILE A 1 40 ? -28.464 -28.917 -4.517 1.00 11.06 ? 40 ILE A N 1 ATOM 301 C CA . ILE A 1 40 ? -27.314 -28.248 -3.940 1.00 11.19 ? 40 ILE A CA 1 ATOM 302 C C . ILE A 1 40 ? -27.086 -26.890 -4.617 1.00 12.19 ? 40 ILE A C 1 ATOM 303 O O . ILE A 1 40 ? -26.788 -26.841 -5.817 1.00 12.86 ? 40 ILE A O 1 ATOM 304 C CB . ILE A 1 40 ? -26.047 -29.094 -4.052 1.00 11.32 ? 40 ILE A CB 1 ATOM 305 C CG1 . ILE A 1 40 ? -26.286 -30.539 -3.558 1.00 11.25 ? 40 ILE A CG1 1 ATOM 306 C CG2 . ILE A 1 40 ? -24.884 -28.439 -3.256 1.00 10.42 ? 40 ILE A CG2 1 ATOM 307 C CD1 . ILE A 1 40 ? -24.990 -31.422 -3.639 1.00 11.69 ? 40 ILE A CD1 1 ATOM 308 N N . ALA A 1 41 ? -27.234 -25.804 -3.832 1.00 11.64 ? 41 ALA A N 1 ATOM 309 C CA . ALA A 1 41 ? -26.941 -24.429 -4.251 1.00 11.39 ? 41 ALA A CA 1 ATOM 310 C C . ALA A 1 41 ? -25.482 -24.122 -3.900 1.00 12.17 ? 41 ALA A C 1 ATOM 311 O O . ALA A 1 41 ? -25.125 -24.036 -2.710 1.00 12.28 ? 41 ALA A O 1 ATOM 312 C CB . ALA A 1 41 ? -27.849 -23.437 -3.548 1.00 10.61 ? 41 ALA A CB 1 ATOM 313 N N . GLN A 1 42 ? -24.643 -23.985 -4.925 1.00 11.87 ? 42 GLN A N 1 ATOM 314 C CA . GLN A 1 42 ? -23.214 -23.749 -4.715 1.00 12.92 ? 42 GLN A CA 1 ATOM 315 C C . GLN A 1 42 ? -23.006 -22.226 -4.772 1.00 13.63 ? 42 GLN A C 1 ATOM 316 O O . GLN A 1 42 ? -22.769 -21.656 -5.857 1.00 14.13 ? 42 GLN A O 1 ATOM 317 C CB . GLN A 1 42 ? -22.394 -24.458 -5.788 1.00 12.55 ? 42 GLN A CB 1 ATOM 318 C CG . GLN A 1 42 ? -20.890 -24.535 -5.481 1.00 13.41 ? 42 GLN A CG 1 ATOM 319 C CD . GLN A 1 42 ? -20.076 -25.011 -6.673 1.00 13.71 ? 42 GLN A CD 1 ATOM 320 O OE1 . GLN A 1 42 ? -19.729 -26.207 -6.784 1.00 16.24 ? 42 GLN A OE1 1 ATOM 321 N NE2 . GLN A 1 42 ? -19.762 -24.094 -7.562 1.00 11.73 ? 42 GLN A NE2 1 ATOM 322 N N . THR A 1 43 ? -23.137 -21.573 -3.617 1.00 11.80 ? 43 THR A N 1 ATOM 323 C CA . THR A 1 43 ? -23.265 -20.117 -3.580 1.00 12.28 ? 43 THR A CA 1 ATOM 324 C C . THR A 1 43 ? -21.939 -19.391 -3.758 1.00 12.31 ? 43 THR A C 1 ATOM 325 O O . THR A 1 43 ? -20.909 -19.878 -3.312 1.00 12.52 ? 43 THR A O 1 ATOM 326 C CB . THR A 1 43 ? -23.911 -19.637 -2.257 1.00 12.30 ? 43 THR A CB 1 ATOM 327 O OG1 . THR A 1 43 ? -23.148 -20.106 -1.131 1.00 11.08 ? 43 THR A OG1 1 ATOM 328 C CG2 . THR A 1 43 ? -25.368 -20.126 -2.154 1.00 11.67 ? 43 THR A CG2 1 ATOM 329 N N . GLN A 1 44 ? -21.985 -18.195 -4.336 1.00 12.65 ? 44 GLN A N 1 ATOM 330 C CA . GLN A 1 44 ? -20.799 -17.363 -4.508 1.00 12.26 ? 44 GLN A CA 1 ATOM 331 C C . GLN A 1 44 ? -20.888 -16.055 -3.709 1.00 12.17 ? 44 GLN A C 1 ATOM 332 O O . GLN A 1 44 ? -19.869 -15.441 -3.391 1.00 12.95 ? 44 GLN A O 1 ATOM 333 C CB . GLN A 1 44 ? -20.573 -17.053 -6.014 1.00 12.71 ? 44 GLN A CB 1 ATOM 334 C CG . GLN A 1 44 ? -20.149 -18.278 -6.831 1.00 13.23 ? 44 GLN A CG 1 ATOM 335 C CD . GLN A 1 44 ? -18.704 -18.750 -6.528 1.00 14.68 ? 44 GLN A CD 1 ATOM 336 O OE1 . GLN A 1 44 ? -17.881 -17.983 -6.010 1.00 14.93 ? 44 GLN A OE1 1 ATOM 337 N NE2 . GLN A 1 44 ? -18.405 -20.012 -6.839 1.00 13.29 ? 44 GLN A NE2 1 ATOM 338 N N . THR A 1 45 ? -22.097 -15.627 -3.374 1.00 11.47 ? 45 THR A N 1 ATOM 339 C CA . THR A 1 45 ? -22.297 -14.334 -2.713 1.00 11.53 ? 45 THR A CA 1 ATOM 340 C C . THR A 1 45 ? -23.340 -14.437 -1.592 1.00 11.91 ? 45 THR A C 1 ATOM 341 O O . THR A 1 45 ? -24.100 -15.422 -1.527 1.00 11.28 ? 45 THR A O 1 ATOM 342 C CB . THR A 1 45 ? -22.879 -13.306 -3.699 1.00 11.76 ? 45 THR A CB 1 ATOM 343 O OG1 . THR A 1 45 ? -24.204 -13.727 -4.077 1.00 10.25 ? 45 THR A OG1 1 ATOM 344 C CG2 . THR A 1 45 ? -21.981 -13.136 -4.967 1.00 11.29 ? 45 THR A CG2 1 ATOM 345 N N . THR A 1 46 ? -23.419 -13.394 -0.756 1.00 11.66 ? 46 THR A N 1 ATOM 346 C CA . THR A 1 46 ? -24.442 -13.311 0.276 1.00 12.47 ? 46 THR A CA 1 ATOM 347 C C . THR A 1 46 ? -25.848 -13.368 -0.339 1.00 13.16 ? 46 THR A C 1 ATOM 348 O O . THR A 1 46 ? -26.740 -14.082 0.171 1.00 14.26 ? 46 THR A O 1 ATOM 349 C CB . THR A 1 46 ? -24.254 -12.060 1.158 1.00 13.69 ? 46 THR A CB 1 ATOM 350 O OG1 . THR A 1 46 ? -22.943 -12.114 1.747 1.00 14.42 ? 46 THR A OG1 1 ATOM 351 C CG2 . THR A 1 46 ? -25.309 -12.009 2.302 1.00 11.44 ? 46 THR A CG2 1 ATOM 352 N N . ALA A 1 47 ? -26.020 -12.663 -1.462 1.00 12.44 ? 47 ALA A N 1 ATOM 353 C CA . ALA A 1 47 ? -27.276 -12.597 -2.175 1.00 12.24 ? 47 ALA A CA 1 ATOM 354 C C . ALA A 1 47 ? -27.749 -13.990 -2.635 1.00 12.86 ? 47 ALA A C 1 ATOM 355 O O . ALA A 1 47 ? -28.955 -14.290 -2.597 1.00 15.40 ? 47 ALA A O 1 ATOM 356 C CB . ALA A 1 47 ? -27.136 -11.628 -3.385 1.00 11.80 ? 47 ALA A CB 1 ATOM 357 N N . HIS A 1 48 ? -26.813 -14.836 -3.072 1.00 12.11 ? 48 HIS A N 1 ATOM 358 C CA . HIS A 1 48 ? -27.131 -16.223 -3.409 1.00 12.36 ? 48 HIS A CA 1 ATOM 359 C C . HIS A 1 48 ? -27.703 -16.970 -2.199 1.00 13.33 ? 48 HIS A C 1 ATOM 360 O O . HIS A 1 48 ? -28.716 -17.687 -2.320 1.00 12.73 ? 48 HIS A O 1 ATOM 361 C CB . HIS A 1 48 ? -25.887 -16.960 -3.893 1.00 12.05 ? 48 HIS A CB 1 ATOM 362 C CG . HIS A 1 48 ? -25.436 -16.569 -5.270 1.00 13.14 ? 48 HIS A CG 1 ATOM 363 N ND1 . HIS A 1 48 ? -24.163 -16.846 -5.734 1.00 12.59 ? 48 HIS A ND1 1 ATOM 364 C CD2 . HIS A 1 48 ? -26.082 -15.928 -6.282 1.00 12.47 ? 48 HIS A CD2 1 ATOM 365 C CE1 . HIS A 1 48 ? -24.044 -16.387 -6.974 1.00 13.49 ? 48 HIS A CE1 1 ATOM 366 N NE2 . HIS A 1 48 ? -25.188 -15.818 -7.326 1.00 13.19 ? 48 HIS A NE2 1 ATOM 367 N N . ILE A 1 49 ? -27.024 -16.830 -1.047 1.00 12.57 ? 49 ILE A N 1 ATOM 368 C CA . ILE A 1 49 ? -27.460 -17.480 0.198 1.00 12.31 ? 49 ILE A CA 1 ATOM 369 C C . ILE A 1 49 ? -28.898 -17.047 0.506 1.00 12.75 ? 49 ILE A C 1 ATOM 370 O O . ILE A 1 49 ? -29.772 -17.894 0.766 1.00 13.28 ? 49 ILE A O 1 ATOM 371 C CB . ILE A 1 49 ? -26.492 -17.197 1.401 1.00 11.00 ? 49 ILE A CB 1 ATOM 372 C CG1 . ILE A 1 49 ? -25.064 -17.755 1.106 1.00 10.78 ? 49 ILE A CG1 1 ATOM 373 C CG2 . ILE A 1 49 ? -27.065 -17.802 2.724 1.00 11.40 ? 49 ILE A CG2 1 ATOM 374 C CD1 . ILE A 1 49 ? -23.968 -17.286 2.099 1.00 10.14 ? 49 ILE A CD1 1 ATOM 375 N N . GLN A 1 50 ? -29.125 -15.728 0.453 1.00 11.95 ? 50 GLN A N 1 ATOM 376 C CA . GLN A 1 50 ? -30.444 -15.138 0.629 1.00 12.36 ? 50 GLN A CA 1 ATOM 377 C C . GLN A 1 50 ? -31.504 -15.695 -0.331 1.00 11.43 ? 50 GLN A C 1 ATOM 378 O O . GLN A 1 50 ? -32.586 -16.095 0.085 1.00 11.60 ? 50 GLN A O 1 ATOM 379 C CB . GLN A 1 50 ? -30.344 -13.610 0.463 1.00 12.92 ? 50 GLN A CB 1 ATOM 380 C CG . GLN A 1 50 ? -31.665 -12.859 0.665 1.00 13.35 ? 50 GLN A CG 1 ATOM 381 C CD . GLN A 1 50 ? -31.459 -11.356 0.532 1.00 13.10 ? 50 GLN A CD 1 ATOM 382 O OE1 . GLN A 1 50 ? -30.757 -10.897 -0.364 1.00 12.67 ? 50 GLN A OE1 1 ATOM 383 N NE2 . GLN A 1 50 ? -32.015 -10.603 1.457 1.00 12.07 ? 50 GLN A NE2 1 ATOM 384 N N . SER A 1 51 ? -31.191 -15.732 -1.613 1.00 11.09 ? 51 SER A N 1 ATOM 385 C CA . SER A 1 51 ? -32.126 -16.245 -2.594 1.00 11.16 ? 51 SER A CA 1 ATOM 386 C C . SER A 1 51 ? -32.433 -17.735 -2.345 1.00 11.89 ? 51 SER A C 1 ATOM 387 O O . SER A 1 51 ? -33.577 -18.189 -2.558 1.00 11.06 ? 51 SER A O 1 ATOM 388 C CB . SER A 1 51 ? -31.524 -16.076 -3.993 1.00 12.32 ? 51 SER A CB 1 ATOM 389 O OG . SER A 1 51 ? -31.367 -14.689 -4.289 1.00 13.61 ? 51 SER A OG 1 ATOM 390 N N . ALA A 1 52 ? -31.411 -18.493 -1.924 1.00 10.60 ? 52 ALA A N 1 ATOM 391 C CA . ALA A 1 52 ? -31.609 -19.912 -1.637 1.00 11.34 ? 52 ALA A CA 1 ATOM 392 C C . ALA A 1 52 ? -32.602 -20.064 -0.476 1.00 11.25 ? 52 ALA A C 1 ATOM 393 O O . ALA A 1 52 ? -33.497 -20.873 -0.548 1.00 11.29 ? 52 ALA A O 1 ATOM 394 C CB . ALA A 1 52 ? -30.260 -20.642 -1.344 1.00 10.21 ? 52 ALA A CB 1 ATOM 395 N N . VAL A 1 53 ? -32.450 -19.263 0.569 1.00 11.62 ? 53 VAL A N 1 ATOM 396 C CA . VAL A 1 53 ? -33.382 -19.283 1.702 1.00 11.80 ? 53 VAL A CA 1 ATOM 397 C C . VAL A 1 53 ? -34.816 -18.883 1.255 1.00 14.02 ? 53 VAL A C 1 ATOM 398 O O . VAL A 1 53 ? -35.792 -19.501 1.688 1.00 14.84 ? 53 VAL A O 1 ATOM 399 C CB . VAL A 1 53 ? -32.815 -18.453 2.901 1.00 11.70 ? 53 VAL A CB 1 ATOM 400 C CG1 . VAL A 1 53 ? -33.838 -18.203 4.020 1.00 11.27 ? 53 VAL A CG1 1 ATOM 401 C CG2 . VAL A 1 53 ? -31.562 -19.140 3.471 1.00 11.27 ? 53 VAL A CG2 1 ATOM 402 N N . GLN A 1 54 ? -34.945 -17.902 0.357 1.00 14.28 ? 54 GLN A N 1 ATOM 403 C CA . GLN A 1 54 ? -36.243 -17.579 -0.270 1.00 14.91 ? 54 GLN A CA 1 ATOM 404 C C . GLN A 1 54 ? -36.910 -18.784 -0.980 1.00 15.46 ? 54 GLN A C 1 ATOM 405 O O . GLN A 1 54 ? -38.103 -19.060 -0.771 1.00 15.24 ? 54 GLN A O 1 ATOM 406 C CB . GLN A 1 54 ? -36.062 -16.461 -1.310 1.00 16.73 ? 54 GLN A CB 1 ATOM 407 C CG . GLN A 1 54 ? -36.003 -15.056 -0.782 1.00 16.89 ? 54 GLN A CG 1 ATOM 408 C CD . GLN A 1 54 ? -36.160 -14.045 -1.917 1.00 18.83 ? 54 GLN A CD 1 ATOM 409 O OE1 . GLN A 1 54 ? -35.239 -13.844 -2.738 1.00 18.12 ? 54 GLN A OE1 1 ATOM 410 N NE2 . GLN A 1 54 ? -37.339 -13.413 -1.983 1.00 16.89 ? 54 GLN A NE2 1 ATOM 411 N N . CYS A 1 55 ? -36.158 -19.489 -1.830 1.00 13.79 ? 55 CYS A N 1 ATOM 412 C CA . CYS A 1 55 ? -36.684 -20.696 -2.511 1.00 14.39 ? 55 CYS A CA 1 ATOM 413 C C . CYS A 1 55 ? -37.172 -21.756 -1.518 1.00 14.99 ? 55 CYS A C 1 ATOM 414 O O . CYS A 1 55 ? -38.238 -22.397 -1.715 1.00 14.74 ? 55 CYS A O 1 ATOM 415 C CB . CYS A 1 55 ? -35.606 -21.293 -3.437 1.00 13.86 ? 55 CYS A CB 1 ATOM 416 S SG . CYS A 1 55 ? -35.342 -20.273 -4.902 0.90 13.59 ? 55 CYS A SG 1 ATOM 417 N N . ALA A 1 56 ? -36.388 -21.946 -0.462 1.00 14.77 ? 56 ALA A N 1 ATOM 418 C CA . ALA A 1 56 ? -36.741 -22.920 0.571 1.00 16.47 ? 56 ALA A CA 1 ATOM 419 C C . ALA A 1 56 ? -38.106 -22.541 1.141 1.00 15.62 ? 56 ALA A C 1 ATOM 420 O O . ALA A 1 56 ? -38.998 -23.399 1.255 1.00 15.33 ? 56 ALA A O 1 ATOM 421 C CB . ALA A 1 56 ? -35.687 -22.946 1.666 1.00 14.10 ? 56 ALA A CB 1 ATOM 422 N N . LYS A 1 57 ? -38.274 -21.255 1.474 1.00 16.25 ? 57 LYS A N 1 ATOM 423 C CA . LYS A 1 57 ? -39.569 -20.751 1.988 1.00 18.71 ? 57 LYS A CA 1 ATOM 424 C C . LYS A 1 57 ? -40.718 -20.958 0.985 1.00 18.30 ? 57 LYS A C 1 ATOM 425 O O . LYS A 1 57 ? -41.812 -21.408 1.350 1.00 18.52 ? 57 LYS A O 1 ATOM 426 C CB . LYS A 1 57 ? -39.480 -19.263 2.376 1.00 20.65 ? 57 LYS A CB 1 ATOM 427 C CG . LYS A 1 57 ? -40.841 -18.717 2.843 1.00 21.99 ? 57 LYS A CG 1 ATOM 428 C CD . LYS A 1 57 ? -40.784 -17.243 3.170 1.00 26.40 ? 57 LYS A CD 1 ATOM 429 C CE . LYS A 1 57 ? -42.158 -16.695 3.492 1.00 25.87 ? 57 LYS A CE 1 ATOM 430 N NZ . LYS A 1 57 ? -42.025 -15.278 3.868 1.00 31.60 ? 57 LYS A NZ 1 ATOM 431 N N . LYS A 1 58 ? -40.460 -20.646 -0.284 1.00 19.35 ? 58 LYS A N 1 ATOM 432 C CA . LYS A 1 58 ? -41.468 -20.806 -1.342 1.00 20.89 ? 58 LYS A CA 1 ATOM 433 C C . LYS A 1 58 ? -41.966 -22.257 -1.502 1.00 19.87 ? 58 LYS A C 1 ATOM 434 O O . LYS A 1 58 ? -43.157 -22.490 -1.714 1.00 18.52 ? 58 LYS A O 1 ATOM 435 C CB . LYS A 1 58 ? -40.899 -20.300 -2.673 1.00 24.64 ? 58 LYS A CB 1 ATOM 436 C CG . LYS A 1 58 ? -41.917 -20.246 -3.801 1.00 32.41 ? 58 LYS A CG 1 ATOM 437 C CD . LYS A 1 58 ? -41.244 -20.201 -5.182 1.00 40.04 ? 58 LYS A CD 1 ATOM 438 C CE . LYS A 1 58 ? -42.156 -19.577 -6.249 1.00 41.09 ? 58 LYS A CE 1 ATOM 439 N NZ . LYS A 1 58 ? -42.297 -18.082 -6.041 1.00 45.18 ? 58 LYS A NZ 1 ATOM 440 N N . LEU A 1 59 ? -41.051 -23.227 -1.391 1.00 17.87 ? 59 LEU A N 1 ATOM 441 C CA . LEU A 1 59 ? -41.345 -24.620 -1.706 1.00 17.38 ? 59 LEU A CA 1 ATOM 442 C C . LEU A 1 59 ? -41.547 -25.472 -0.443 1.00 17.85 ? 59 LEU A C 1 ATOM 443 O O . LEU A 1 59 ? -41.617 -26.708 -0.521 1.00 17.55 ? 59 LEU A O 1 ATOM 444 C CB . LEU A 1 59 ? -40.266 -25.206 -2.621 1.00 17.53 ? 59 LEU A CB 1 ATOM 445 C CG . LEU A 1 59 ? -40.121 -24.437 -3.957 1.00 20.72 ? 59 LEU A CG 1 ATOM 446 C CD1 . LEU A 1 59 ? -38.877 -24.864 -4.721 1.00 21.11 ? 59 LEU A CD1 1 ATOM 447 C CD2 . LEU A 1 59 ? -41.359 -24.564 -4.850 1.00 19.82 ? 59 LEU A CD2 1 ATOM 448 N N . ASN A 1 60 ? -41.667 -24.801 0.700 1.00 17.65 ? 60 ASN A N 1 ATOM 449 C CA . ASN A 1 60 ? -41.692 -25.459 2.014 1.00 18.88 ? 60 ASN A CA 1 ATOM 450 C C . ASN A 1 60 ? -40.594 -26.527 2.219 1.00 16.98 ? 60 ASN A C 1 ATOM 451 O O . ASN A 1 60 ? -40.883 -27.675 2.552 1.00 15.86 ? 60 ASN A O 1 ATOM 452 C CB . ASN A 1 60 ? -43.076 -26.048 2.336 1.00 21.85 ? 60 ASN A CB 1 ATOM 453 C CG . ASN A 1 60 ? -43.287 -26.255 3.839 1.00 27.82 ? 60 ASN A CG 1 ATOM 454 O OD1 . ASN A 1 60 ? -42.630 -25.618 4.690 1.00 32.64 ? 60 ASN A OD1 1 ATOM 455 N ND2 . ASN A 1 60 ? -44.189 -27.154 4.171 1.00 30.54 ? 60 ASN A ND2 1 ATOM 456 N N . LEU A 1 61 ? -39.335 -26.139 2.036 1.00 15.17 ? 61 LEU A N 1 ATOM 457 C CA . LEU A 1 61 ? -38.222 -27.060 2.245 1.00 14.46 ? 61 LEU A CA 1 ATOM 458 C C . LEU A 1 61 ? -37.449 -26.671 3.507 1.00 13.94 ? 61 LEU A C 1 ATOM 459 O O . LEU A 1 61 ? -37.408 -25.488 3.865 1.00 14.21 ? 61 LEU A O 1 ATOM 460 C CB . LEU A 1 61 ? -37.291 -27.032 1.031 1.00 13.94 ? 61 LEU A CB 1 ATOM 461 C CG . LEU A 1 61 ? -37.900 -27.319 -0.354 1.00 15.42 ? 61 LEU A CG 1 ATOM 462 C CD1 . LEU A 1 61 ? -36.882 -27.017 -1.478 1.00 13.68 ? 61 LEU A CD1 1 ATOM 463 C CD2 . LEU A 1 61 ? -38.405 -28.788 -0.473 1.00 15.53 ? 61 LEU A CD2 1 ATOM 464 N N . LYS A 1 62 ? -36.812 -27.643 4.155 1.00 13.08 ? 62 LYS A N 1 ATOM 465 C CA . LYS A 1 62 ? -35.788 -27.342 5.166 1.00 13.30 ? 62 LYS A CA 1 ATOM 466 C C . LYS A 1 62 ? -34.491 -26.991 4.432 1.00 14.66 ? 62 LYS A C 1 ATOM 467 O O . LYS A 1 62 ? -34.185 -27.539 3.336 1.00 11.98 ? 62 LYS A O 1 ATOM 468 C CB . LYS A 1 62 ? -35.568 -28.531 6.121 1.00 14.66 ? 62 LYS A CB 1 ATOM 469 C CG . LYS A 1 62 ? -36.862 -29.034 6.823 1.00 14.40 ? 62 LYS A CG 1 ATOM 470 C CD . LYS A 1 62 ? -37.632 -27.861 7.441 1.00 15.00 ? 62 LYS A CD 1 ATOM 471 C CE . LYS A 1 62 ? -38.772 -28.327 8.382 1.00 17.26 ? 62 LYS A CE 1 ATOM 472 N NZ . LYS A 1 62 ? -39.408 -27.190 9.115 1.00 14.92 ? 62 LYS A NZ 1 ATOM 473 N N . VAL A 1 63 ? -33.735 -26.073 5.022 1.00 13.36 ? 63 VAL A N 1 ATOM 474 C CA . VAL A 1 63 ? -32.471 -25.684 4.424 1.00 13.34 ? 63 VAL A CA 1 ATOM 475 C C . VAL A 1 63 ? -31.286 -25.890 5.388 1.00 13.20 ? 63 VAL A C 1 ATOM 476 O O . VAL A 1 63 ? -31.353 -25.539 6.562 1.00 11.89 ? 63 VAL A O 1 ATOM 477 C CB . VAL A 1 63 ? -32.550 -24.271 3.730 1.00 13.85 ? 63 VAL A CB 1 ATOM 478 C CG1 . VAL A 1 63 ? -33.271 -23.293 4.565 1.00 13.58 ? 63 VAL A CG1 1 ATOM 479 C CG2 . VAL A 1 63 ? -31.167 -23.735 3.348 1.00 15.22 ? 63 VAL A CG2 1 ATOM 480 N N . SER A 1 64 ? -30.212 -26.504 4.888 1.00 12.32 ? 64 SER A N 1 ATOM 481 C CA . SER A 1 64 ? -29.034 -26.686 5.732 1.00 11.57 ? 64 SER A CA 1 ATOM 482 C C . SER A 1 64 ? -27.774 -26.158 5.042 1.00 11.26 ? 64 SER A C 1 ATOM 483 O O . SER A 1 64 ? -27.546 -26.430 3.854 1.00 10.09 ? 64 SER A O 1 ATOM 484 C CB . SER A 1 64 ? -28.915 -28.162 6.139 1.00 11.59 ? 64 SER A CB 1 ATOM 485 O OG . SER A 1 64 ? -30.026 -28.543 6.980 1.00 13.92 ? 64 SER A OG 1 ATOM 486 N N . ALA A 1 65 ? -26.954 -25.400 5.781 1.00 11.77 ? 65 ALA A N 1 ATOM 487 C CA . ALA A 1 65 ? -25.650 -24.938 5.231 1.00 10.69 ? 65 ALA A CA 1 ATOM 488 C C . ALA A 1 65 ? -24.535 -25.970 5.449 1.00 10.46 ? 65 ALA A C 1 ATOM 489 O O . ALA A 1 65 ? -24.464 -26.606 6.502 1.00 11.03 ? 65 ALA A O 1 ATOM 490 C CB . ALA A 1 65 ? -25.269 -23.622 5.822 1.00 10.45 ? 65 ALA A CB 1 ATOM 491 N N . LYS A 1 66 ? -23.684 -26.155 4.450 1.00 10.07 ? 66 LYS A N 1 ATOM 492 C CA . LYS A 1 66 ? -22.517 -27.023 4.601 1.00 9.69 ? 66 LYS A CA 1 ATOM 493 C C . LYS A 1 66 ? -21.319 -26.147 4.291 1.00 9.92 ? 66 LYS A C 1 ATOM 494 O O . LYS A 1 66 ? -21.263 -25.564 3.219 1.00 9.40 ? 66 LYS A O 1 ATOM 495 C CB . LYS A 1 66 ? -22.550 -28.238 3.640 1.00 8.73 ? 66 LYS A CB 1 ATOM 496 C CG . LYS A 1 66 ? -21.444 -29.291 3.934 1.00 8.61 ? 66 LYS A CG 1 ATOM 497 C CD . LYS A 1 66 ? -21.842 -30.743 3.502 1.00 8.47 ? 66 LYS A CD 1 ATOM 498 C CE . LYS A 1 66 ? -21.664 -30.954 1.986 1.00 7.99 ? 66 LYS A CE 1 ATOM 499 N NZ . LYS A 1 66 ? -20.269 -30.789 1.550 1.00 7.97 ? 66 LYS A NZ 1 ATOM 500 N N . SER A 1 67 ? -20.382 -26.058 5.238 1.00 9.91 ? 67 SER A N 1 ATOM 501 C CA . SER A 1 67 ? -19.228 -25.190 5.126 1.00 10.30 ? 67 SER A CA 1 ATOM 502 C C . SER A 1 67 ? -18.013 -26.087 4.776 1.00 10.80 ? 67 SER A C 1 ATOM 503 O O . SER A 1 67 ? -17.694 -26.244 3.600 1.00 10.52 ? 67 SER A O 1 ATOM 504 C CB . SER A 1 67 ? -19.060 -24.428 6.452 1.00 10.92 ? 67 SER A CB 1 ATOM 505 O OG . SER A 1 67 ? -17.893 -23.646 6.492 1.00 11.47 ? 67 SER A OG 1 ATOM 506 N N . GLY A 1 68 ? -17.360 -26.698 5.778 1.00 10.30 ? 68 GLY A N 1 ATOM 507 C CA . GLY A 1 68 ? -16.272 -27.650 5.506 1.00 10.00 ? 68 GLY A CA 1 ATOM 508 C C . GLY A 1 68 ? -16.751 -29.100 5.423 1.00 10.59 ? 68 GLY A C 1 ATOM 509 O O . GLY A 1 68 ? -15.987 -29.993 5.022 1.00 10.51 ? 68 GLY A O 1 ATOM 510 N N . GLY A 1 69 ? -17.977 -29.347 5.904 1.00 10.73 ? 69 GLY A N 1 ATOM 511 C CA . GLY A 1 69 ? -18.599 -30.664 5.832 1.00 10.49 ? 69 GLY A CA 1 ATOM 512 C C . GLY A 1 69 ? -18.063 -31.639 6.856 1.00 11.33 ? 69 GLY A C 1 ATOM 513 O O . GLY A 1 69 ? -18.313 -32.856 6.774 1.00 11.16 ? 69 GLY A O 1 ATOM 514 N N . HIS A 1 70 ? -17.367 -31.113 7.853 1.00 10.61 ? 70 HIS A N 1 ATOM 515 C CA . HIS A 1 70 ? -16.815 -31.948 8.909 1.00 10.30 ? 70 HIS A CA 1 ATOM 516 C C . HIS A 1 70 ? -17.766 -32.446 10.006 1.00 10.65 ? 70 HIS A C 1 ATOM 517 O O . HIS A 1 70 ? -17.354 -33.244 10.861 1.00 10.02 ? 70 HIS A O 1 ATOM 518 C CB . HIS A 1 70 ? -15.523 -31.329 9.461 1.00 10.38 ? 70 HIS A CB 1 ATOM 519 C CG . HIS A 1 70 ? -14.319 -31.736 8.672 1.00 10.86 ? 70 HIS A CG 1 ATOM 520 N ND1 . HIS A 1 70 ? -13.464 -32.735 9.089 1.00 10.34 ? 70 HIS A ND1 1 ATOM 521 C CD2 . HIS A 1 70 ? -13.880 -31.344 7.450 1.00 10.67 ? 70 HIS A CD2 1 ATOM 522 C CE1 . HIS A 1 70 ? -12.529 -32.916 8.165 1.00 11.66 ? 70 HIS A CE1 1 ATOM 523 N NE2 . HIS A 1 70 ? -12.757 -32.085 7.164 1.00 11.18 ? 70 HIS A NE2 1 ATOM 524 N N . SER A 1 71 ? -19.038 -32.043 9.959 1.00 9.64 ? 71 SER A N 1 ATOM 525 C CA . SER A 1 71 ? -20.013 -32.632 10.898 1.00 9.44 ? 71 SER A CA 1 ATOM 526 C C . SER A 1 71 ? -19.897 -34.166 10.980 1.00 9.57 ? 71 SER A C 1 ATOM 527 O O . SER A 1 71 ? -20.031 -34.875 9.965 1.00 8.22 ? 71 SER A O 1 ATOM 528 C CB . SER A 1 71 ? -21.438 -32.323 10.514 1.00 8.78 ? 71 SER A CB 1 ATOM 529 O OG . SER A 1 71 ? -22.308 -32.974 11.417 1.00 8.29 ? 71 SER A OG 1 ATOM 530 N N . TYR A 1 72 ? -19.684 -34.672 12.199 1.00 9.81 ? 72 TYR A N 1 ATOM 531 C CA . TYR A 1 72 ? -19.532 -36.119 12.400 1.00 9.66 ? 72 TYR A CA 1 ATOM 532 C C . TYR A 1 72 ? -20.872 -36.782 12.133 1.00 10.04 ? 72 TYR A C 1 ATOM 533 O O . TYR A 1 72 ? -20.936 -37.980 11.871 1.00 10.03 ? 72 TYR A O 1 ATOM 534 C CB . TYR A 1 72 ? -19.065 -36.420 13.816 1.00 9.66 ? 72 TYR A CB 1 ATOM 535 C CG . TYR A 1 72 ? -17.640 -35.995 14.149 1.00 9.89 ? 72 TYR A CG 1 ATOM 536 C CD1 . TYR A 1 72 ? -16.767 -35.489 13.173 1.00 10.13 ? 72 TYR A CD1 1 ATOM 537 C CD2 . TYR A 1 72 ? -17.146 -36.149 15.456 1.00 9.73 ? 72 TYR A CD2 1 ATOM 538 C CE1 . TYR A 1 72 ? -15.434 -35.151 13.498 1.00 10.42 ? 72 TYR A CE1 1 ATOM 539 C CE2 . TYR A 1 72 ? -15.872 -35.808 15.788 1.00 9.85 ? 72 TYR A CE2 1 ATOM 540 C CZ . TYR A 1 72 ? -15.000 -35.312 14.813 1.00 10.50 ? 72 TYR A CZ 1 ATOM 541 O OH . TYR A 1 72 ? -13.710 -34.977 15.185 1.00 10.76 ? 72 TYR A OH 1 ATOM 542 N N . ALA A 1 73 ? -21.946 -35.983 12.193 1.00 9.91 ? 73 ALA A N 1 ATOM 543 C CA . ALA A 1 73 ? -23.311 -36.455 11.938 1.00 10.18 ? 73 ALA A CA 1 ATOM 544 C C . ALA A 1 73 ? -23.845 -36.152 10.523 1.00 10.55 ? 73 ALA A C 1 ATOM 545 O O . ALA A 1 73 ? -25.010 -36.476 10.206 1.00 10.96 ? 73 ALA A O 1 ATOM 546 C CB . ALA A 1 73 ? -24.284 -35.867 13.002 1.00 10.42 ? 73 ALA A CB 1 ATOM 547 N N . SER A 1 74 ? -23.013 -35.550 9.675 1.00 10.01 ? 74 SER A N 1 ATOM 548 C CA . SER A 1 74 ? -23.461 -35.028 8.371 1.00 9.75 ? 74 SER A CA 1 ATOM 549 C C . SER A 1 74 ? -24.594 -34.029 8.502 1.00 10.14 ? 74 SER A C 1 ATOM 550 O O . SER A 1 74 ? -25.491 -34.000 7.640 1.00 10.18 ? 74 SER A O 1 ATOM 551 C CB . SER A 1 74 ? -23.907 -36.162 7.427 1.00 10.15 ? 74 SER A CB 1 ATOM 552 O OG . SER A 1 74 ? -22.826 -37.026 7.186 1.00 11.32 ? 74 SER A OG 1 ATOM 553 N N . PHE A 1 75 ? -24.589 -33.230 9.586 1.00 9.49 ? 75 PHE A N 1 ATOM 554 C CA . PHE A 1 75 ? -25.631 -32.233 9.760 1.00 9.36 ? 75 PHE A CA 1 ATOM 555 C C . PHE A 1 75 ? -25.610 -31.097 8.708 1.00 9.54 ? 75 PHE A C 1 ATOM 556 O O . PHE A 1 75 ? -26.586 -30.355 8.583 1.00 9.36 ? 75 PHE A O 1 ATOM 557 C CB . PHE A 1 75 ? -25.643 -31.681 11.193 1.00 9.08 ? 75 PHE A CB 1 ATOM 558 C CG . PHE A 1 75 ? -26.184 -32.653 12.227 1.00 8.72 ? 75 PHE A CG 1 ATOM 559 C CD1 . PHE A 1 75 ? -27.049 -33.684 11.863 1.00 8.74 ? 75 PHE A CD1 1 ATOM 560 C CD2 . PHE A 1 75 ? -25.845 -32.505 13.575 1.00 8.94 ? 75 PHE A CD2 1 ATOM 561 C CE1 . PHE A 1 75 ? -27.578 -34.573 12.851 1.00 8.98 ? 75 PHE A CE1 1 ATOM 562 C CE2 . PHE A 1 75 ? -26.366 -33.375 14.575 1.00 9.12 ? 75 PHE A CE2 1 ATOM 563 C CZ . PHE A 1 75 ? -27.227 -34.424 14.193 1.00 8.88 ? 75 PHE A CZ 1 ATOM 564 N N . GLY A 1 76 ? -24.514 -30.962 7.952 1.00 9.08 ? 76 GLY A N 1 ATOM 565 C CA . GLY A 1 76 ? -24.460 -29.940 6.904 1.00 9.49 ? 76 GLY A CA 1 ATOM 566 C C . GLY A 1 76 ? -25.464 -30.251 5.789 1.00 10.55 ? 76 GLY A C 1 ATOM 567 O O . GLY A 1 76 ? -25.883 -29.342 5.055 1.00 11.39 ? 76 GLY A O 1 ATOM 568 N N . PHE A 1 77 ? -25.857 -31.528 5.675 1.00 10.25 ? 77 PHE A N 1 ATOM 569 C CA . PHE A 1 77 ? -26.909 -31.986 4.742 1.00 10.38 ? 77 PHE A CA 1 ATOM 570 C C . PHE A 1 77 ? -28.282 -31.818 5.352 1.00 10.44 ? 77 PHE A C 1 ATOM 571 O O . PHE A 1 77 ? -29.307 -31.940 4.672 1.00 11.19 ? 77 PHE A O 1 ATOM 572 C CB . PHE A 1 77 ? -26.735 -33.487 4.411 1.00 9.82 ? 77 PHE A CB 1 ATOM 573 C CG . PHE A 1 77 ? -25.469 -33.808 3.657 1.00 9.68 ? 77 PHE A CG 1 ATOM 574 C CD1 . PHE A 1 77 ? -24.252 -33.935 4.328 1.00 9.27 ? 77 PHE A CD1 1 ATOM 575 C CD2 . PHE A 1 77 ? -25.501 -34.009 2.276 1.00 9.16 ? 77 PHE A CD2 1 ATOM 576 C CE1 . PHE A 1 77 ? -23.114 -34.259 3.625 1.00 9.43 ? 77 PHE A CE1 1 ATOM 577 C CE2 . PHE A 1 77 ? -24.371 -34.338 1.580 1.00 8.94 ? 77 PHE A CE2 1 ATOM 578 C CZ . PHE A 1 77 ? -23.171 -34.458 2.248 1.00 9.11 ? 77 PHE A CZ 1 ATOM 579 N N . GLY A 1 78 ? -28.312 -31.565 6.644 1.00 9.96 ? 78 GLY A N 1 ATOM 580 C CA . GLY A 1 78 ? -29.555 -31.596 7.351 1.00 9.66 ? 78 GLY A CA 1 ATOM 581 C C . GLY A 1 78 ? -29.764 -32.852 8.187 1.00 10.74 ? 78 GLY A C 1 ATOM 582 O O . GLY A 1 78 ? -30.768 -32.945 8.902 1.00 9.66 ? 78 GLY A O 1 ATOM 583 N N . GLY A 1 79 ? -28.836 -33.812 8.113 1.00 10.97 ? 79 GLY A N 1 ATOM 584 C CA . GLY A 1 79 ? -28.961 -35.063 8.905 1.00 11.98 ? 79 GLY A CA 1 ATOM 585 C C . GLY A 1 79 ? -30.108 -35.984 8.495 1.00 12.59 ? 79 GLY A C 1 ATOM 586 O O . GLY A 1 79 ? -30.529 -36.853 9.258 1.00 12.88 ? 79 GLY A O 1 ATOM 587 N N . GLU A 1 80 ? -30.597 -35.793 7.273 1.00 13.13 ? 80 GLU A N 1 ATOM 588 C CA . GLU A 1 80 ? -31.682 -36.583 6.682 1.00 12.80 ? 80 GLU A CA 1 ATOM 589 C C . GLU A 1 80 ? -31.678 -36.199 5.207 1.00 12.33 ? 80 GLU A C 1 ATOM 590 O O . GLU A 1 80 ? -30.953 -35.266 4.814 1.00 12.15 ? 80 GLU A O 1 ATOM 591 C CB . GLU A 1 80 ? -33.034 -36.223 7.315 1.00 14.31 ? 80 GLU A CB 1 ATOM 592 C CG . GLU A 1 80 ? -33.445 -34.758 7.113 1.00 14.34 ? 80 GLU A CG 1 ATOM 593 C CD . GLU A 1 80 ? -34.744 -34.393 7.811 1.00 16.96 ? 80 GLU A CD 1 ATOM 594 O OE1 . GLU A 1 80 ? -35.367 -35.290 8.396 1.00 18.55 ? 80 GLU A OE1 1 ATOM 595 O OE2 . GLU A 1 80 ? -35.136 -33.206 7.795 1.00 18.08 ? 80 GLU A OE2 1 ATOM 596 N N . ASN A 1 81 ? -32.474 -36.889 4.394 1.00 10.70 ? 81 ASN A N 1 ATOM 597 C CA . ASN A 1 81 ? -32.541 -36.585 2.954 1.00 11.10 ? 81 ASN A CA 1 ATOM 598 C C . ASN A 1 81 ? -33.490 -35.453 2.665 1.00 10.56 ? 81 ASN A C 1 ATOM 599 O O . ASN A 1 81 ? -34.409 -35.202 3.456 1.00 10.38 ? 81 ASN A O 1 ATOM 600 C CB . ASN A 1 81 ? -33.011 -37.819 2.174 1.00 10.79 ? 81 ASN A CB 1 ATOM 601 C CG . ASN A 1 81 ? -32.043 -38.976 2.313 1.00 11.05 ? 81 ASN A CG 1 ATOM 602 O OD1 . ASN A 1 81 ? -30.840 -38.775 2.221 1.00 11.19 ? 81 ASN A OD1 1 ATOM 603 N ND2 . ASN A 1 81 ? -32.558 -40.178 2.603 1.00 11.02 ? 81 ASN A ND2 1 ATOM 604 N N . GLY A 1 82 ? -33.301 -34.793 1.526 1.00 9.76 ? 82 GLY A N 1 ATOM 605 C CA . GLY A 1 82 ? -34.340 -33.880 1.010 1.00 10.13 ? 82 GLY A CA 1 ATOM 606 C C . GLY A 1 82 ? -34.306 -32.403 1.381 1.00 11.34 ? 82 GLY A C 1 ATOM 607 O O . GLY A 1 82 ? -35.284 -31.648 1.120 1.00 12.10 ? 82 GLY A O 1 ATOM 608 N N . HIS A 1 83 ? -33.212 -31.956 1.997 1.00 10.59 ? 83 HIS A N 1 ATOM 609 C CA . HIS A 1 83 ? -33.088 -30.533 2.303 1.00 10.62 ? 83 HIS A CA 1 ATOM 610 C C . HIS A 1 83 ? -32.504 -29.841 1.088 1.00 11.00 ? 83 HIS A C 1 ATOM 611 O O . HIS A 1 83 ? -31.841 -30.466 0.237 1.00 10.56 ? 83 HIS A O 1 ATOM 612 C CB . HIS A 1 83 ? -32.150 -30.274 3.507 1.00 9.75 ? 83 HIS A CB 1 ATOM 613 C CG . HIS A 1 83 ? -32.717 -30.688 4.839 1.00 9.75 ? 83 HIS A CG 1 ATOM 614 N ND1 . HIS A 1 83 ? -32.349 -30.075 6.020 1.00 9.16 ? 83 HIS A ND1 1 ATOM 615 C CD2 . HIS A 1 83 ? -33.597 -31.664 5.180 1.00 9.87 ? 83 HIS A CD2 1 ATOM 616 C CE1 . HIS A 1 83 ? -32.987 -30.647 7.031 1.00 9.63 ? 83 HIS A CE1 1 ATOM 617 N NE2 . HIS A 1 83 ? -33.755 -31.610 6.553 1.00 9.97 ? 83 HIS A NE2 1 ATOM 618 N N . LEU A 1 84 ? -32.730 -28.540 1.031 1.00 11.23 ? 84 LEU A N 1 ATOM 619 C CA . LEU A 1 84 ? -31.959 -27.667 0.177 1.00 12.29 ? 84 LEU A CA 1 ATOM 620 C C . LEU A 1 84 ? -30.604 -27.520 0.882 1.00 11.74 ? 84 LEU A C 1 ATOM 621 O O . LEU A 1 84 ? -30.550 -27.126 2.060 1.00 11.82 ? 84 LEU A O 1 ATOM 622 C CB . LEU A 1 84 ? -32.651 -26.292 0.049 1.00 12.52 ? 84 LEU A CB 1 ATOM 623 C CG . LEU A 1 84 ? -31.908 -25.245 -0.795 1.00 12.96 ? 84 LEU A CG 1 ATOM 624 C CD1 . LEU A 1 84 ? -31.485 -25.826 -2.139 1.00 12.73 ? 84 LEU A CD1 1 ATOM 625 C CD2 . LEU A 1 84 ? -32.843 -24.027 -1.035 1.00 13.87 ? 84 LEU A CD2 1 ATOM 626 N N . MET A 1 85 ? -29.524 -27.887 0.201 1.00 10.70 ? 85 MET A N 1 ATOM 627 C CA . MET A 1 85 ? -28.206 -27.745 0.824 1.00 10.66 ? 85 MET A CA 1 ATOM 628 C C . MET A 1 85 ? -27.524 -26.525 0.213 1.00 10.59 ? 85 MET A C 1 ATOM 629 O O . MET A 1 85 ? -27.377 -26.424 -1.006 1.00 10.18 ? 85 MET A O 1 ATOM 630 C CB . MET A 1 85 ? -27.338 -29.027 0.684 1.00 9.73 ? 85 MET A CB 1 ATOM 631 C CG . MET A 1 85 ? -26.063 -29.008 1.578 1.00 9.25 ? 85 MET A CG 1 ATOM 632 S SD . MET A 1 85 ? -25.114 -30.550 1.600 0.93 9.36 ? 85 MET A SD 1 ATOM 633 C CE . MET A 1 85 ? -24.364 -30.534 -0.037 1.00 8.85 ? 85 MET A CE 1 ATOM 634 N N . VAL A 1 86 ? -27.144 -25.594 1.079 1.00 11.56 ? 86 VAL A N 1 ATOM 635 C CA . VAL A 1 86 ? -26.406 -24.398 0.691 1.00 10.77 ? 86 VAL A CA 1 ATOM 636 C C . VAL A 1 86 ? -24.941 -24.716 0.881 1.00 11.69 ? 86 VAL A C 1 ATOM 637 O O . VAL A 1 86 ? -24.440 -24.719 2.026 1.00 12.12 ? 86 VAL A O 1 ATOM 638 C CB . VAL A 1 86 ? -26.815 -23.180 1.540 1.00 11.53 ? 86 VAL A CB 1 ATOM 639 C CG1 . VAL A 1 86 ? -25.994 -21.934 1.184 1.00 10.27 ? 86 VAL A CG1 1 ATOM 640 C CG2 . VAL A 1 86 ? -28.331 -22.902 1.409 1.00 10.59 ? 86 VAL A CG2 1 ATOM 641 N N . GLN A 1 87 ? -24.275 -25.028 -0.245 1.00 11.05 ? 87 GLN A N 1 ATOM 642 C CA . GLN A 1 87 ? -22.885 -25.491 -0.265 1.00 11.59 ? 87 GLN A CA 1 ATOM 643 C C . GLN A 1 87 ? -21.974 -24.243 -0.295 1.00 11.80 ? 87 GLN A C 1 ATOM 644 O O . GLN A 1 87 ? -22.006 -23.491 -1.268 1.00 10.61 ? 87 GLN A O 1 ATOM 645 C CB . GLN A 1 87 ? -22.648 -26.341 -1.514 1.00 11.24 ? 87 GLN A CB 1 ATOM 646 C CG . GLN A 1 87 ? -21.215 -26.768 -1.735 1.00 11.98 ? 87 GLN A CG 1 ATOM 647 C CD . GLN A 1 87 ? -20.673 -27.590 -0.557 1.00 13.23 ? 87 GLN A CD 1 ATOM 648 O OE1 . GLN A 1 87 ? -21.429 -28.277 0.130 1.00 12.77 ? 87 GLN A OE1 1 ATOM 649 N NE2 . GLN A 1 87 ? -19.374 -27.520 -0.334 1.00 13.17 ? 87 GLN A NE2 1 ATOM 650 N N . LEU A 1 88 ? -21.201 -24.022 0.776 1.00 11.17 ? 88 LEU A N 1 ATOM 651 C CA . LEU A 1 88 ? -20.525 -22.730 0.975 1.00 11.47 ? 88 LEU A CA 1 ATOM 652 C C . LEU A 1 88 ? -19.043 -22.723 0.606 1.00 11.49 ? 88 LEU A C 1 ATOM 653 O O . LEU A 1 88 ? -18.416 -21.655 0.549 1.00 12.27 ? 88 LEU A O 1 ATOM 654 C CB . LEU A 1 88 ? -20.684 -22.252 2.434 1.00 10.78 ? 88 LEU A CB 1 ATOM 655 C CG . LEU A 1 88 ? -22.097 -21.946 2.937 1.00 10.57 ? 88 LEU A CG 1 ATOM 656 C CD1 . LEU A 1 88 ? -22.130 -21.705 4.479 1.00 10.05 ? 88 LEU A CD1 1 ATOM 657 C CD2 . LEU A 1 88 ? -22.722 -20.740 2.193 1.00 9.20 ? 88 LEU A CD2 1 ATOM 658 N N . ASP A 1 89 ? -18.488 -23.904 0.352 1.00 11.25 ? 89 ASP A N 1 ATOM 659 C CA . ASP A 1 89 ? -17.045 -24.071 0.336 1.00 11.79 ? 89 ASP A CA 1 ATOM 660 C C . ASP A 1 89 ? -16.276 -23.436 -0.851 1.00 13.28 ? 89 ASP A C 1 ATOM 661 O O . ASP A 1 89 ? -15.041 -23.582 -0.937 1.00 15.07 ? 89 ASP A O 1 ATOM 662 C CB . ASP A 1 89 ? -16.672 -25.551 0.562 1.00 11.19 ? 89 ASP A CB 1 ATOM 663 C CG . ASP A 1 89 ? -16.515 -26.332 -0.741 1.00 10.95 ? 89 ASP A CG 1 ATOM 664 O OD1 . ASP A 1 89 ? -17.254 -26.052 -1.706 1.00 10.94 ? 89 ASP A OD1 1 ATOM 665 O OD2 . ASP A 1 89 ? -15.656 -27.249 -0.779 1.00 10.86 ? 89 ASP A OD2 1 ATOM 666 N N . ARG A 1 90 ? -16.961 -22.735 -1.758 1.00 13.99 ? 90 ARG A N 1 ATOM 667 C CA A ARG A 1 90 ? -16.258 -21.982 -2.808 0.50 14.98 ? 90 ARG A CA 1 ATOM 668 C CA B ARG A 1 90 ? -16.242 -21.988 -2.799 0.50 13.84 ? 90 ARG A CA 1 ATOM 669 C C . ARG A 1 90 ? -16.140 -20.516 -2.384 1.00 14.62 ? 90 ARG A C 1 ATOM 670 O O . ARG A 1 90 ? -15.504 -19.720 -3.065 1.00 14.98 ? 90 ARG A O 1 ATOM 671 C CB A ARG A 1 90 ? -16.959 -22.077 -4.176 0.50 15.87 ? 90 ARG A CB 1 ATOM 672 C CB B ARG A 1 90 ? -16.892 -22.119 -4.190 0.50 13.17 ? 90 ARG A CB 1 ATOM 673 C CG A ARG A 1 90 ? -17.184 -23.482 -4.728 0.50 17.58 ? 90 ARG A CG 1 ATOM 674 C CG B ARG A 1 90 ? -17.324 -23.530 -4.601 0.50 12.95 ? 90 ARG A CG 1 ATOM 675 C CD A ARG A 1 90 ? -15.902 -24.330 -4.752 0.50 19.37 ? 90 ARG A CD 1 ATOM 676 C CD B ARG A 1 90 ? -16.226 -24.595 -4.386 0.50 12.52 ? 90 ARG A CD 1 ATOM 677 N NE A ARG A 1 90 ? -16.012 -25.409 -5.729 0.50 20.82 ? 90 ARG A NE 1 ATOM 678 N NE B ARG A 1 90 ? -16.752 -25.949 -4.574 0.50 12.29 ? 90 ARG A NE 1 ATOM 679 C CZ A ARG A 1 90 ? -16.648 -26.554 -5.499 0.50 22.11 ? 90 ARG A CZ 1 ATOM 680 C CZ B ARG A 1 90 ? -16.703 -26.635 -5.717 0.50 11.69 ? 90 ARG A CZ 1 ATOM 681 N NH1 A ARG A 1 90 ? -17.225 -26.771 -4.322 0.50 22.34 ? 90 ARG A NH1 1 ATOM 682 N NH1 B ARG A 1 90 ? -16.144 -26.109 -6.810 0.50 10.40 ? 90 ARG A NH1 1 ATOM 683 N NH2 A ARG A 1 90 ? -16.708 -27.484 -6.441 0.50 24.03 ? 90 ARG A NH2 1 ATOM 684 N NH2 B ARG A 1 90 ? -17.218 -27.865 -5.767 0.50 11.52 ? 90 ARG A NH2 1 ATOM 685 N N . MET A 1 91 ? -16.774 -20.166 -1.260 1.00 13.26 ? 91 MET A N 1 ATOM 686 C CA . MET A 1 91 ? -16.677 -18.809 -0.703 1.00 13.28 ? 91 MET A CA 1 ATOM 687 C C . MET A 1 91 ? -15.589 -18.817 0.386 1.00 13.91 ? 91 MET A C 1 ATOM 688 O O . MET A 1 91 ? -15.852 -19.092 1.570 1.00 13.26 ? 91 MET A O 1 ATOM 689 C CB . MET A 1 91 ? -18.018 -18.339 -0.134 1.00 13.05 ? 91 MET A CB 1 ATOM 690 C CG . MET A 1 91 ? -19.173 -18.314 -1.160 1.00 13.39 ? 91 MET A CG 1 ATOM 691 S SD . MET A 1 91 ? -20.753 -18.117 -0.316 0.93 15.43 ? 91 MET A SD 1 ATOM 692 C CE . MET A 1 91 ? -20.596 -16.376 0.093 1.00 14.95 ? 91 MET A CE 1 ATOM 693 N N . ILE A 1 92 ? -14.366 -18.516 -0.022 1.00 12.51 ? 92 ILE A N 1 ATOM 694 C CA . ILE A 1 92 ? -13.210 -18.836 0.792 1.00 14.27 ? 92 ILE A CA 1 ATOM 695 C C . ILE A 1 92 ? -12.348 -17.645 1.193 1.00 13.81 ? 92 ILE A C 1 ATOM 696 O O . ILE A 1 92 ? -11.321 -17.829 1.832 1.00 13.97 ? 92 ILE A O 1 ATOM 697 C CB . ILE A 1 92 ? -12.286 -19.878 0.038 1.00 14.76 ? 92 ILE A CB 1 ATOM 698 C CG1 . ILE A 1 92 ? -11.776 -19.297 -1.287 1.00 15.09 ? 92 ILE A CG1 1 ATOM 699 C CG2 . ILE A 1 92 ? -13.019 -21.205 -0.164 1.00 13.38 ? 92 ILE A CG2 1 ATOM 700 C CD1 . ILE A 1 92 ? -10.628 -20.137 -1.935 1.00 16.33 ? 92 ILE A CD1 1 ATOM 701 N N . ASP A 1 93 ? -12.730 -16.437 0.801 1.00 13.47 ? 93 ASP A N 1 ATOM 702 C CA . ASP A 1 93 ? -11.811 -15.302 0.961 1.00 14.53 ? 93 ASP A CA 1 ATOM 703 C C . ASP A 1 93 ? -11.821 -14.668 2.338 1.00 13.69 ? 93 ASP A C 1 ATOM 704 O O . ASP A 1 93 ? -12.875 -14.555 2.972 1.00 11.87 ? 93 ASP A O 1 ATOM 705 C CB . ASP A 1 93 ? -12.176 -14.207 -0.027 1.00 17.78 ? 93 ASP A CB 1 ATOM 706 C CG . ASP A 1 93 ? -11.986 -14.650 -1.471 1.00 19.72 ? 93 ASP A CG 1 ATOM 707 O OD1 . ASP A 1 93 ? -11.211 -15.594 -1.723 1.00 21.26 ? 93 ASP A OD1 1 ATOM 708 O OD2 . ASP A 1 93 ? -12.627 -14.054 -2.342 1.00 24.57 ? 93 ASP A OD2 1 ATOM 709 N N . VAL A 1 94 ? -10.641 -14.239 2.767 1.00 12.81 ? 94 VAL A N 1 ATOM 710 C CA . VAL A 1 94 ? -10.529 -13.111 3.683 1.00 13.66 ? 94 VAL A CA 1 ATOM 711 C C . VAL A 1 94 ? -10.859 -11.838 2.894 1.00 14.41 ? 94 VAL A C 1 ATOM 712 O O . VAL A 1 94 ? -10.067 -11.368 2.042 1.00 15.27 ? 94 VAL A O 1 ATOM 713 C CB . VAL A 1 94 ? -9.146 -13.049 4.343 1.00 13.36 ? 94 VAL A CB 1 ATOM 714 C CG1 . VAL A 1 94 ? -9.047 -11.819 5.233 1.00 13.57 ? 94 VAL A CG1 1 ATOM 715 C CG2 . VAL A 1 94 ? -8.891 -14.366 5.135 1.00 12.55 ? 94 VAL A CG2 1 ATOM 716 N N . ILE A 1 95 ? -12.068 -11.346 3.123 1.00 15.58 ? 95 ILE A N 1 ATOM 717 C CA . ILE A 1 95 ? -12.653 -10.211 2.386 1.00 18.31 ? 95 ILE A CA 1 ATOM 718 C C . ILE A 1 95 ? -11.901 -8.910 2.673 1.00 19.92 ? 95 ILE A C 1 ATOM 719 O O . ILE A 1 95 ? -11.663 -8.121 1.770 1.00 19.32 ? 95 ILE A O 1 ATOM 720 C CB . ILE A 1 95 ? -14.143 -9.996 2.758 1.00 19.13 ? 95 ILE A CB 1 ATOM 721 C CG1 . ILE A 1 95 ? -14.964 -11.272 2.486 1.00 20.45 ? 95 ILE A CG1 1 ATOM 722 C CG2 . ILE A 1 95 ? -14.747 -8.815 1.974 1.00 20.56 ? 95 ILE A CG2 1 ATOM 723 C CD1 . ILE A 1 95 ? -16.315 -11.311 3.279 1.00 21.11 ? 95 ILE A CD1 1 ATOM 724 N N . SER A 1 96 ? -11.540 -8.687 3.933 1.00 18.57 ? 96 SER A N 1 ATOM 725 C CA . SER A 1 96 ? -10.892 -7.439 4.319 1.00 18.07 ? 96 SER A CA 1 ATOM 726 C C . SER A 1 96 ? -10.133 -7.695 5.604 1.00 18.55 ? 96 SER A C 1 ATOM 727 O O . SER A 1 96 ? -10.438 -8.642 6.342 1.00 18.37 ? 96 SER A O 1 ATOM 728 C CB . SER A 1 96 ? -11.928 -6.324 4.524 1.00 19.91 ? 96 SER A CB 1 ATOM 729 O OG . SER A 1 96 ? -12.797 -6.638 5.630 1.00 22.25 ? 96 SER A OG 1 ATOM 730 N N . TYR A 1 97 ? -9.127 -6.866 5.851 1.00 17.19 ? 97 TYR A N 1 ATOM 731 C CA . TYR A 1 97 ? -8.390 -6.901 7.083 1.00 17.21 ? 97 TYR A CA 1 ATOM 732 C C . TYR A 1 97 ? -8.112 -5.456 7.457 1.00 19.61 ? 97 TYR A C 1 ATOM 733 O O . TYR A 1 97 ? -7.649 -4.675 6.630 1.00 18.66 ? 97 TYR A O 1 ATOM 734 C CB . TYR A 1 97 ? -7.082 -7.696 6.948 1.00 15.67 ? 97 TYR A CB 1 ATOM 735 C CG . TYR A 1 97 ? -6.220 -7.554 8.180 1.00 16.30 ? 97 TYR A CG 1 ATOM 736 C CD1 . TYR A 1 97 ? -6.535 -8.241 9.339 1.00 15.30 ? 97 TYR A CD1 1 ATOM 737 C CD2 . TYR A 1 97 ? -5.104 -6.682 8.200 1.00 17.19 ? 97 TYR A CD2 1 ATOM 738 C CE1 . TYR A 1 97 ? -5.774 -8.085 10.515 1.00 15.66 ? 97 TYR A CE1 1 ATOM 739 C CE2 . TYR A 1 97 ? -4.338 -6.517 9.354 1.00 16.13 ? 97 TYR A CE2 1 ATOM 740 C CZ . TYR A 1 97 ? -4.683 -7.224 10.515 1.00 16.90 ? 97 TYR A CZ 1 ATOM 741 O OH . TYR A 1 97 ? -3.953 -7.082 11.669 1.00 15.96 ? 97 TYR A OH 1 ATOM 742 N N . ASN A 1 98 ? -8.423 -5.095 8.693 1.00 19.53 ? 98 ASN A N 1 ATOM 743 C CA . ASN A 1 98 ? -8.171 -3.759 9.176 1.00 20.12 ? 98 ASN A CA 1 ATOM 744 C C . ASN A 1 98 ? -6.926 -3.737 10.044 1.00 20.39 ? 98 ASN A C 1 ATOM 745 O O . ASN A 1 98 ? -6.922 -4.282 11.150 1.00 18.39 ? 98 ASN A O 1 ATOM 746 C CB . ASN A 1 98 ? -9.367 -3.254 9.978 1.00 21.89 ? 98 ASN A CB 1 ATOM 747 C CG . ASN A 1 98 ? -9.250 -1.765 10.337 1.00 25.34 ? 98 ASN A CG 1 ATOM 748 O OD1 . ASN A 1 98 ? -8.177 -1.273 10.685 1.00 23.36 ? 98 ASN A OD1 1 ATOM 749 N ND2 . ASN A 1 98 ? -10.367 -1.062 10.281 1.00 24.61 ? 98 ASN A ND2 1 ATOM 750 N N . ASP A 1 99 ? -5.874 -3.082 9.573 1.00 21.10 ? 99 ASP A N 1 ATOM 751 C CA . ASP A 1 99 ? -4.615 -3.121 10.337 1.00 23.91 ? 99 ASP A CA 1 ATOM 752 C C . ASP A 1 99 ? -4.576 -2.208 11.559 1.00 21.81 ? 99 ASP A C 1 ATOM 753 O O . ASP A 1 99 ? -3.621 -2.248 12.315 1.00 23.49 ? 99 ASP A O 1 ATOM 754 C CB . ASP A 1 99 ? -3.369 -2.936 9.441 1.00 27.36 ? 99 ASP A CB 1 ATOM 755 C CG . ASP A 1 99 ? -3.349 -1.606 8.727 0.80 30.67 ? 99 ASP A CG 1 ATOM 756 O OD1 . ASP A 1 99 ? -4.127 -0.684 9.091 0.80 31.91 ? 99 ASP A OD1 1 ATOM 757 O OD2 . ASP A 1 99 ? -2.544 -1.486 7.780 0.80 35.60 ? 99 ASP A OD2 1 ATOM 758 N N . LYS A 1 100 ? -5.610 -1.398 11.757 1.00 21.93 ? 100 LYS A N 1 ATOM 759 C CA . LYS A 1 100 ? -5.708 -0.621 12.978 1.00 25.29 ? 100 LYS A CA 1 ATOM 760 C C . LYS A 1 100 ? -6.285 -1.491 14.089 1.00 23.84 ? 100 LYS A C 1 ATOM 761 O O . LYS A 1 100 ? -5.913 -1.343 15.249 1.00 24.93 ? 100 LYS A O 1 ATOM 762 C CB . LYS A 1 100 ? -6.587 0.611 12.783 1.00 27.73 ? 100 LYS A CB 1 ATOM 763 C CG . LYS A 1 100 ? -5.944 1.739 12.017 1.00 33.75 ? 100 LYS A CG 1 ATOM 764 C CD . LYS A 1 100 ? -7.036 2.703 11.570 1.00 37.65 ? 100 LYS A CD 1 ATOM 765 C CE . LYS A 1 100 ? -6.569 3.678 10.506 1.00 39.48 ? 100 LYS A CE 1 ATOM 766 N NZ . LYS A 1 100 ? -7.750 4.156 9.720 1.00 42.60 ? 100 LYS A NZ 1 ATOM 767 N N . THR A 1 101 ? -7.194 -2.396 13.741 1.00 21.06 ? 101 THR A N 1 ATOM 768 C CA . THR A 1 101 ? -7.919 -3.160 14.775 1.00 18.54 ? 101 THR A CA 1 ATOM 769 C C . THR A 1 101 ? -7.525 -4.630 14.830 1.00 18.70 ? 101 THR A C 1 ATOM 770 O O . THR A 1 101 ? -7.789 -5.308 15.832 1.00 19.93 ? 101 THR A O 1 ATOM 771 C CB . THR A 1 101 ? -9.402 -3.088 14.537 1.00 18.03 ? 101 THR A CB 1 ATOM 772 O OG1 . THR A 1 101 ? -9.715 -3.692 13.279 1.00 15.97 ? 101 THR A OG1 1 ATOM 773 C CG2 . THR A 1 101 ? -9.861 -1.627 14.499 1.00 21.08 ? 101 THR A CG2 1 ATOM 774 N N . GLY A 1 102 ? -6.918 -5.127 13.754 1.00 16.45 ? 102 GLY A N 1 ATOM 775 C CA . GLY A 1 102 ? -6.576 -6.555 13.652 1.00 16.52 ? 102 GLY A CA 1 ATOM 776 C C . GLY A 1 102 ? -7.795 -7.405 13.292 1.00 17.65 ? 102 GLY A C 1 ATOM 777 O O . GLY A 1 102 ? -7.748 -8.652 13.361 1.00 17.18 ? 102 GLY A O 1 ATOM 778 N N . ILE A 1 103 ? -8.898 -6.748 12.930 1.00 15.49 ? 103 ILE A N 1 ATOM 779 C CA . ILE A 1 103 ? -10.116 -7.483 12.601 1.00 15.41 ? 103 ILE A CA 1 ATOM 780 C C . ILE A 1 103 ? -10.170 -7.869 11.121 1.00 15.41 ? 103 ILE A C 1 ATOM 781 O O . ILE A 1 103 ? -9.890 -7.040 10.237 1.00 14.78 ? 103 ILE A O 1 ATOM 782 C CB . ILE A 1 103 ? -11.388 -6.708 13.041 1.00 16.51 ? 103 ILE A CB 1 ATOM 783 C CG1 . ILE A 1 103 ? -11.393 -6.551 14.576 1.00 16.79 ? 103 ILE A CG1 1 ATOM 784 C CG2 . ILE A 1 103 ? -12.640 -7.416 12.587 1.00 14.22 ? 103 ILE A CG2 1 ATOM 785 C CD1 . ILE A 1 103 ? -12.486 -5.593 15.112 1.00 17.00 ? 103 ILE A CD1 1 ATOM 786 N N . ALA A 1 104 ? -10.541 -9.125 10.867 1.00 14.50 ? 104 ALA A N 1 ATOM 787 C CA . ALA A 1 104 ? -10.673 -9.675 9.509 1.00 15.16 ? 104 ALA A CA 1 ATOM 788 C C . ALA A 1 104 ? -12.117 -10.015 9.246 1.00 15.45 ? 104 ALA A C 1 ATOM 789 O O . ALA A 1 104 ? -12.813 -10.510 10.148 1.00 16.29 ? 104 ALA A O 1 ATOM 790 C CB . ALA A 1 104 ? -9.852 -10.964 9.383 1.00 14.91 ? 104 ALA A CB 1 ATOM 791 N N . HIS A 1 105 ? -12.565 -9.784 8.016 1.00 13.25 ? 105 HIS A N 1 ATOM 792 C CA . HIS A 1 105 ? -13.890 -10.225 7.605 1.00 12.95 ? 105 HIS A CA 1 ATOM 793 C C . HIS A 1 105 ? -13.650 -11.426 6.702 1.00 13.35 ? 105 HIS A C 1 ATOM 794 O O . HIS A 1 105 ? -12.786 -11.360 5.816 1.00 11.65 ? 105 HIS A O 1 ATOM 795 C CB . HIS A 1 105 ? -14.656 -9.113 6.882 1.00 14.98 ? 105 HIS A CB 1 ATOM 796 C CG . HIS A 1 105 ? -15.050 -7.979 7.777 1.00 18.62 ? 105 HIS A CG 1 ATOM 797 N ND1 . HIS A 1 105 ? -16.133 -7.164 7.520 1.00 19.12 ? 105 HIS A ND1 1 ATOM 798 C CD2 . HIS A 1 105 ? -14.542 -7.563 8.965 1.00 19.92 ? 105 HIS A CD2 1 ATOM 799 C CE1 . HIS A 1 105 ? -16.245 -6.270 8.483 1.00 18.78 ? 105 HIS A CE1 1 ATOM 800 N NE2 . HIS A 1 105 ? -15.303 -6.497 9.378 1.00 19.84 ? 105 HIS A NE2 1 ATOM 801 N N . VAL A 1 106 ? -14.383 -12.521 6.963 1.00 10.83 ? 106 VAL A N 1 ATOM 802 C CA . VAL A 1 106 ? -14.149 -13.814 6.303 1.00 10.71 ? 106 VAL A CA 1 ATOM 803 C C . VAL A 1 106 ? -15.425 -14.485 5.780 1.00 10.34 ? 106 VAL A C 1 ATOM 804 O O . VAL A 1 106 ? -16.464 -14.533 6.462 1.00 10.50 ? 106 VAL A O 1 ATOM 805 C CB . VAL A 1 106 ? -13.364 -14.809 7.241 1.00 10.06 ? 106 VAL A CB 1 ATOM 806 C CG1 . VAL A 1 106 ? -12.880 -16.059 6.457 1.00 8.86 ? 106 VAL A CG1 1 ATOM 807 C CG2 . VAL A 1 106 ? -12.171 -14.069 7.889 1.00 9.25 ? 106 VAL A CG2 1 ATOM 808 N N . GLU A 1 107 ? -15.332 -14.999 4.564 1.00 10.25 ? 107 GLU A N 1 ATOM 809 C CA . GLU A 1 107 ? -16.419 -15.757 3.931 1.00 11.20 ? 107 GLU A CA 1 ATOM 810 C C . GLU A 1 107 ? -16.617 -17.101 4.644 1.00 10.86 ? 107 GLU A C 1 ATOM 811 O O . GLU A 1 107 ? -15.678 -17.598 5.259 1.00 10.49 ? 107 GLU A O 1 ATOM 812 C CB . GLU A 1 107 ? -16.113 -15.935 2.438 1.00 11.98 ? 107 GLU A CB 1 ATOM 813 C CG . GLU A 1 107 ? -16.445 -14.662 1.655 1.00 12.74 ? 107 GLU A CG 1 ATOM 814 C CD . GLU A 1 107 ? -16.244 -14.792 0.143 1.00 13.17 ? 107 GLU A CD 1 ATOM 815 O OE1 . GLU A 1 107 ? -15.334 -15.508 -0.325 1.00 12.57 ? 107 GLU A OE1 1 ATOM 816 O OE2 . GLU A 1 107 ? -17.005 -14.149 -0.578 1.00 14.18 ? 107 GLU A OE2 1 ATOM 817 N N . PRO A 1 108 ? -17.835 -17.679 4.570 1.00 10.40 ? 108 PRO A N 1 ATOM 818 C CA . PRO A 1 108 ? -18.215 -18.768 5.473 1.00 9.69 ? 108 PRO A CA 1 ATOM 819 C C . PRO A 1 108 ? -17.797 -20.169 5.010 1.00 10.33 ? 108 PRO A C 1 ATOM 820 O O . PRO A 1 108 ? -18.108 -21.165 5.692 1.00 8.93 ? 108 PRO A O 1 ATOM 821 C CB . PRO A 1 108 ? -19.753 -18.681 5.494 1.00 9.81 ? 108 PRO A CB 1 ATOM 822 C CG . PRO A 1 108 ? -20.133 -18.119 4.158 1.00 9.52 ? 108 PRO A CG 1 ATOM 823 C CD . PRO A 1 108 ? -18.974 -17.218 3.738 1.00 9.78 ? 108 PRO A CD 1 ATOM 824 N N . GLY A 1 109 ? -17.102 -20.228 3.873 1.00 9.75 ? 109 GLY A N 1 ATOM 825 C CA . GLY A 1 109 ? -16.650 -21.482 3.283 1.00 9.98 ? 109 GLY A CA 1 ATOM 826 C C . GLY A 1 109 ? -15.147 -21.700 3.415 1.00 9.47 ? 109 GLY A C 1 ATOM 827 O O . GLY A 1 109 ? -14.642 -22.766 3.036 1.00 8.37 ? 109 GLY A O 1 ATOM 828 N N . ALA A 1 110 ? -14.441 -20.691 3.938 1.00 8.88 ? 110 ALA A N 1 ATOM 829 C CA . ALA A 1 110 ? -13.002 -20.808 4.232 1.00 9.03 ? 110 ALA A CA 1 ATOM 830 C C . ALA A 1 110 ? -12.753 -21.910 5.227 1.00 9.51 ? 110 ALA A C 1 ATOM 831 O O . ALA A 1 110 ? -13.397 -21.957 6.313 1.00 8.99 ? 110 ALA A O 1 ATOM 832 C CB . ALA A 1 110 ? -12.465 -19.517 4.806 1.00 7.88 ? 110 ALA A CB 1 ATOM 833 N N . ARG A 1 111 ? -11.820 -22.787 4.879 1.00 9.59 ? 111 ARG A N 1 ATOM 834 C CA . ARG A 1 111 ? -11.356 -23.829 5.799 1.00 10.52 ? 111 ARG A CA 1 ATOM 835 C C . ARG A 1 111 ? -10.196 -23.360 6.689 1.00 11.75 ? 111 ARG A C 1 ATOM 836 O O . ARG A 1 111 ? -9.449 -22.432 6.331 1.00 12.19 ? 111 ARG A O 1 ATOM 837 C CB . ARG A 1 111 ? -10.996 -25.119 5.030 1.00 10.63 ? 111 ARG A CB 1 ATOM 838 C CG . ARG A 1 111 ? -12.238 -25.758 4.356 1.00 10.50 ? 111 ARG A CG 1 ATOM 839 C CD . ARG A 1 111 ? -11.840 -26.736 3.210 1.00 10.96 ? 111 ARG A CD 1 ATOM 840 N NE . ARG A 1 111 ? -12.977 -27.139 2.379 1.00 10.93 ? 111 ARG A NE 1 ATOM 841 C CZ . ARG A 1 111 ? -13.756 -28.200 2.631 1.00 11.12 ? 111 ARG A CZ 1 ATOM 842 N NH1 . ARG A 1 111 ? -13.527 -28.960 3.696 1.00 9.57 ? 111 ARG A NH1 1 ATOM 843 N NH2 . ARG A 1 111 ? -14.753 -28.507 1.799 1.00 10.17 ? 111 ARG A NH2 1 ATOM 844 N N . LEU A 1 112 ? -10.049 -24.003 7.849 1.00 11.95 ? 112 LEU A N 1 ATOM 845 C CA . LEU A 1 112 ? -9.095 -23.562 8.866 1.00 12.52 ? 112 LEU A CA 1 ATOM 846 C C . LEU A 1 112 ? -7.681 -23.399 8.301 1.00 12.37 ? 112 LEU A C 1 ATOM 847 O O . LEU A 1 112 ? -7.025 -22.393 8.548 1.00 11.37 ? 112 LEU A O 1 ATOM 848 C CB . LEU A 1 112 ? -9.073 -24.511 10.082 1.00 11.52 ? 112 LEU A CB 1 ATOM 849 C CG . LEU A 1 112 ? -10.367 -24.641 10.891 1.00 11.92 ? 112 LEU A CG 1 ATOM 850 C CD1 . LEU A 1 112 ? -10.091 -25.346 12.186 1.00 11.62 ? 112 LEU A CD1 1 ATOM 851 C CD2 . LEU A 1 112 ? -11.057 -23.277 11.202 1.00 12.61 ? 112 LEU A CD2 1 ATOM 852 N N . GLY A 1 113 ? -7.203 -24.395 7.557 1.00 12.90 ? 113 GLY A N 1 ATOM 853 C CA . GLY A 1 113 ? -5.838 -24.306 7.004 1.00 12.47 ? 113 GLY A CA 1 ATOM 854 C C . GLY A 1 113 ? -5.712 -23.123 6.068 1.00 13.19 ? 113 GLY A C 1 ATOM 855 O O . GLY A 1 113 ? -4.688 -22.440 6.065 1.00 13.44 ? 113 GLY A O 1 ATOM 856 N N . HIS A 1 114 ? -6.757 -22.871 5.270 1.00 12.80 ? 114 HIS A N 1 ATOM 857 C CA . HIS A 1 114 ? -6.741 -21.745 4.332 1.00 12.65 ? 114 HIS A CA 1 ATOM 858 C C . HIS A 1 114 ? -6.815 -20.388 5.070 1.00 11.61 ? 114 HIS A C 1 ATOM 859 O O . HIS A 1 114 ? -6.039 -19.467 4.779 1.00 10.62 ? 114 HIS A O 1 ATOM 860 C CB . HIS A 1 114 ? -7.862 -21.903 3.295 1.00 13.02 ? 114 HIS A CB 1 ATOM 861 C CG . HIS A 1 114 ? -8.068 -20.705 2.414 1.00 13.88 ? 114 HIS A CG 1 ATOM 862 N ND1 . HIS A 1 114 ? -7.193 -20.351 1.411 1.00 13.28 ? 114 HIS A ND1 1 ATOM 863 C CD2 . HIS A 1 114 ? -9.064 -19.787 2.382 1.00 14.24 ? 114 HIS A CD2 1 ATOM 864 C CE1 . HIS A 1 114 ? -7.637 -19.271 0.794 1.00 13.65 ? 114 HIS A CE1 1 ATOM 865 N NE2 . HIS A 1 114 ? -8.764 -18.899 1.375 1.00 15.95 ? 114 HIS A NE2 1 ATOM 866 N N . LEU A 1 115 ? -7.751 -20.280 6.012 1.00 11.29 ? 115 LEU A N 1 ATOM 867 C CA . LEU A 1 115 ? -7.851 -19.115 6.903 1.00 11.29 ? 115 LEU A CA 1 ATOM 868 C C . LEU A 1 115 ? -6.482 -18.818 7.520 1.00 11.64 ? 115 LEU A C 1 ATOM 869 O O . LEU A 1 115 ? -5.991 -17.680 7.451 1.00 11.67 ? 115 LEU A O 1 ATOM 870 C CB . LEU A 1 115 ? -8.881 -19.385 8.015 1.00 11.72 ? 115 LEU A CB 1 ATOM 871 C CG . LEU A 1 115 ? -8.942 -18.331 9.117 1.00 11.76 ? 115 LEU A CG 1 ATOM 872 C CD1 . LEU A 1 115 ? -9.409 -16.977 8.510 1.00 12.13 ? 115 LEU A CD1 1 ATOM 873 C CD2 . LEU A 1 115 ? -9.861 -18.798 10.288 1.00 11.30 ? 115 LEU A CD2 1 ATOM 874 N N . ALA A 1 116 ? -5.853 -19.844 8.092 1.00 10.96 ? 116 ALA A N 1 ATOM 875 C CA . ALA A 1 116 ? -4.574 -19.638 8.789 1.00 11.46 ? 116 ALA A CA 1 ATOM 876 C C . ALA A 1 116 ? -3.487 -19.219 7.814 1.00 12.06 ? 116 ALA A C 1 ATOM 877 O O . ALA A 1 116 ? -2.647 -18.379 8.138 1.00 13.31 ? 116 ALA A O 1 ATOM 878 C CB . ALA A 1 116 ? -4.151 -20.863 9.546 1.00 9.95 ? 116 ALA A CB 1 ATOM 879 N N . THR A 1 117 ? -3.479 -19.823 6.632 1.00 12.75 ? 117 THR A N 1 ATOM 880 C CA . THR A 1 117 ? -2.462 -19.486 5.621 1.00 13.33 ? 117 THR A CA 1 ATOM 881 C C . THR A 1 117 ? -2.550 -18.037 5.168 1.00 12.90 ? 117 THR A C 1 ATOM 882 O O . THR A 1 117 ? -1.542 -17.331 5.164 1.00 13.49 ? 117 THR A O 1 ATOM 883 C CB . THR A 1 117 ? -2.549 -20.407 4.399 1.00 12.57 ? 117 THR A CB 1 ATOM 884 O OG1 . THR A 1 117 ? -2.253 -21.737 4.822 1.00 12.69 ? 117 THR A OG1 1 ATOM 885 C CG2 . THR A 1 117 ? -1.500 -19.980 3.350 1.00 12.23 ? 117 THR A CG2 1 ATOM 886 N N . VAL A 1 118 ? -3.759 -17.603 4.810 1.00 13.30 ? 118 VAL A N 1 ATOM 887 C CA . VAL A 1 118 ? -4.008 -16.238 4.341 1.00 14.01 ? 118 VAL A CA 1 ATOM 888 C C . VAL A 1 118 ? -3.697 -15.233 5.434 1.00 15.07 ? 118 VAL A C 1 ATOM 889 O O . VAL A 1 118 ? -2.950 -14.291 5.192 1.00 16.32 ? 118 VAL A O 1 ATOM 890 C CB . VAL A 1 118 ? -5.456 -16.027 3.769 1.00 16.03 ? 118 VAL A CB 1 ATOM 891 C CG1 . VAL A 1 118 ? -5.671 -14.564 3.301 1.00 16.39 ? 118 VAL A CG1 1 ATOM 892 C CG2 . VAL A 1 118 ? -5.719 -16.977 2.598 1.00 15.25 ? 118 VAL A CG2 1 ATOM 893 N N . LEU A 1 119 ? -4.214 -15.437 6.639 1.00 13.83 ? 119 LEU A N 1 ATOM 894 C CA . LEU A 1 119 ? -3.935 -14.486 7.725 1.00 14.75 ? 119 LEU A CA 1 ATOM 895 C C . LEU A 1 119 ? -2.433 -14.408 8.065 1.00 14.49 ? 119 LEU A C 1 ATOM 896 O O . LEU A 1 119 ? -1.904 -13.323 8.323 1.00 14.17 ? 119 LEU A O 1 ATOM 897 C CB . LEU A 1 119 ? -4.727 -14.829 9.006 1.00 14.14 ? 119 LEU A CB 1 ATOM 898 C CG . LEU A 1 119 ? -6.248 -14.628 9.080 1.00 15.35 ? 119 LEU A CG 1 ATOM 899 C CD1 . LEU A 1 119 ? -6.739 -15.065 10.485 1.00 13.96 ? 119 LEU A CD1 1 ATOM 900 C CD2 . LEU A 1 119 ? -6.709 -13.159 8.781 1.00 14.21 ? 119 LEU A CD2 1 ATOM 901 N N . ASN A 1 120 ? -1.741 -15.546 8.067 1.00 13.98 ? 120 ASN A N 1 ATOM 902 C CA . ASN A 1 120 ? -0.282 -15.510 8.305 1.00 16.30 ? 120 ASN A CA 1 ATOM 903 C C . ASN A 1 120 ? 0.526 -14.810 7.171 1.00 16.41 ? 120 ASN A C 1 ATOM 904 O O . ASN A 1 120 ? 1.234 -13.827 7.395 1.00 18.21 ? 120 ASN A O 1 ATOM 905 C CB . ASN A 1 120 ? 0.271 -16.915 8.524 1.00 15.73 ? 120 ASN A CB 1 ATOM 906 C CG . ASN A 1 120 ? 1.754 -16.902 8.779 1.00 16.66 ? 120 ASN A CG 1 ATOM 907 O OD1 . ASN A 1 120 ? 2.550 -17.169 7.860 1.00 17.38 ? 120 ASN A OD1 1 ATOM 908 N ND2 . ASN A 1 120 ? 2.147 -16.535 9.998 1.00 13.18 ? 120 ASN A ND2 1 ATOM 909 N N . ASP A 1 121 ? 0.386 -15.327 5.962 1.00 17.67 ? 121 ASP A N 1 ATOM 910 C CA . ASP A 1 121 ? 1.249 -14.979 4.844 1.00 18.94 ? 121 ASP A CA 1 ATOM 911 C C . ASP A 1 121 ? 0.945 -13.562 4.345 1.00 21.44 ? 121 ASP A C 1 ATOM 912 O O . ASP A 1 121 ? 1.844 -12.808 3.999 1.00 19.82 ? 121 ASP A O 1 ATOM 913 C CB . ASP A 1 121 ? 1.051 -15.980 3.691 1.00 19.72 ? 121 ASP A CB 1 ATOM 914 C CG . ASP A 1 121 ? 1.569 -17.385 4.007 1.00 21.63 ? 121 ASP A CG 1 ATOM 915 O OD1 . ASP A 1 121 ? 2.095 -17.644 5.110 1.00 24.17 ? 121 ASP A OD1 1 ATOM 916 O OD2 . ASP A 1 121 ? 1.434 -18.261 3.129 1.00 24.28 ? 121 ASP A OD2 1 ATOM 917 N N . LYS A 1 122 ? -0.331 -13.209 4.303 1.00 21.27 ? 122 LYS A N 1 ATOM 918 C CA . LYS A 1 122 ? -0.717 -11.902 3.828 1.00 22.55 ? 122 LYS A CA 1 ATOM 919 C C . LYS A 1 122 ? -0.673 -10.853 4.944 1.00 22.39 ? 122 LYS A C 1 ATOM 920 O O . LYS A 1 122 ? -0.331 -9.696 4.689 1.00 22.92 ? 122 LYS A O 1 ATOM 921 C CB . LYS A 1 122 ? -2.103 -11.976 3.171 1.00 24.76 ? 122 LYS A CB 1 ATOM 922 C CG . LYS A 1 122 ? -2.400 -10.856 2.218 1.00 28.37 ? 122 LYS A CG 1 ATOM 923 C CD . LYS A 1 122 ? -3.705 -11.112 1.479 1.00 30.14 ? 122 LYS A CD 1 ATOM 924 C CE . LYS A 1 122 ? -4.244 -9.809 0.902 1.00 36.20 ? 122 LYS A CE 1 ATOM 925 N NZ . LYS A 1 122 ? -3.607 -9.506 -0.413 1.00 42.38 ? 122 LYS A NZ 1 ATOM 926 N N . TYR A 1 123 ? -0.988 -11.225 6.184 1.00 19.69 ? 123 TYR A N 1 ATOM 927 C CA . TYR A 1 123 ? -1.114 -10.169 7.215 1.00 18.05 ? 123 TYR A CA 1 ATOM 928 C C . TYR A 1 123 ? -0.279 -10.297 8.489 1.00 16.28 ? 123 TYR A C 1 ATOM 929 O O . TYR A 1 123 ? -0.290 -9.401 9.327 1.00 15.94 ? 123 TYR A O 1 ATOM 930 C CB . TYR A 1 123 ? -2.578 -9.952 7.591 1.00 18.52 ? 123 TYR A CB 1 ATOM 931 C CG . TYR A 1 123 ? -3.508 -9.681 6.424 1.00 19.13 ? 123 TYR A CG 1 ATOM 932 C CD1 . TYR A 1 123 ? -3.444 -8.473 5.718 1.00 19.02 ? 123 TYR A CD1 1 ATOM 933 C CD2 . TYR A 1 123 ? -4.490 -10.618 6.052 1.00 20.10 ? 123 TYR A CD2 1 ATOM 934 C CE1 . TYR A 1 123 ? -4.329 -8.204 4.666 1.00 17.98 ? 123 TYR A CE1 1 ATOM 935 C CE2 . TYR A 1 123 ? -5.375 -10.363 4.981 1.00 19.15 ? 123 TYR A CE2 1 ATOM 936 C CZ . TYR A 1 123 ? -5.285 -9.150 4.306 1.00 18.22 ? 123 TYR A CZ 1 ATOM 937 O OH . TYR A 1 123 ? -6.142 -8.886 3.265 1.00 19.45 ? 123 TYR A OH 1 ATOM 938 N N . GLY A 1 124 ? 0.441 -11.398 8.621 1.00 14.32 ? 124 GLY A N 1 ATOM 939 C CA . GLY A 1 124 ? 1.206 -11.686 9.810 1.00 14.93 ? 124 GLY A CA 1 ATOM 940 C C . GLY A 1 124 ? 0.355 -11.946 11.047 1.00 16.64 ? 124 GLY A C 1 ATOM 941 O O . GLY A 1 124 ? 0.794 -11.642 12.151 1.00 17.86 ? 124 GLY A O 1 ATOM 942 N N . ARG A 1 125 ? -0.844 -12.521 10.870 1.00 15.21 ? 125 ARG A N 1 ATOM 943 C CA . ARG A 1 125 ? -1.824 -12.624 11.969 1.00 14.74 ? 125 ARG A CA 1 ATOM 944 C C . ARG A 1 125 ? -2.296 -14.065 12.187 1.00 14.94 ? 125 ARG A C 1 ATOM 945 O O . ARG A 1 125 ? -2.088 -14.942 11.321 1.00 12.13 ? 125 ARG A O 1 ATOM 946 C CB . ARG A 1 125 ? -3.036 -11.713 11.720 1.00 15.49 ? 125 ARG A CB 1 ATOM 947 C CG . ARG A 1 125 ? -2.740 -10.216 11.414 1.00 15.37 ? 125 ARG A CG 1 ATOM 948 C CD . ARG A 1 125 ? -2.152 -9.484 12.601 1.00 16.37 ? 125 ARG A CD 1 ATOM 949 N NE . ARG A 1 125 ? -3.117 -9.298 13.688 1.00 17.21 ? 125 ARG A NE 1 ATOM 950 C CZ . ARG A 1 125 ? -2.925 -8.497 14.738 1.00 19.26 ? 125 ARG A CZ 1 ATOM 951 N NH1 . ARG A 1 125 ? -1.798 -7.773 14.848 1.00 17.87 ? 125 ARG A NH1 1 ATOM 952 N NH2 . ARG A 1 125 ? -3.869 -8.398 15.677 1.00 18.73 ? 125 ARG A NH2 1 ATOM 953 N N . ALA A 1 126 ? -2.909 -14.301 13.354 1.00 12.96 ? 126 ALA A N 1 ATOM 954 C CA . ALA A 1 126 ? -3.309 -15.628 13.765 1.00 13.69 ? 126 ALA A CA 1 ATOM 955 C C . ALA A 1 126 ? -4.611 -15.589 14.560 1.00 13.99 ? 126 ALA A C 1 ATOM 956 O O . ALA A 1 126 ? -4.972 -14.559 15.131 1.00 14.71 ? 126 ALA A O 1 ATOM 957 C CB . ALA A 1 126 ? -2.202 -16.286 14.613 1.00 13.73 ? 126 ALA A CB 1 ATOM 958 N N . ILE A 1 127 ? -5.309 -16.719 14.561 1.00 13.49 ? 127 ILE A N 1 ATOM 959 C CA . ILE A 1 127 ? -6.465 -16.970 15.417 1.00 12.44 ? 127 ILE A CA 1 ATOM 960 C C . ILE A 1 127 ? -6.324 -18.339 16.031 1.00 12.42 ? 127 ILE A C 1 ATOM 961 O O . ILE A 1 127 ? -5.785 -19.266 15.409 1.00 11.52 ? 127 ILE A O 1 ATOM 962 C CB . ILE A 1 127 ? -7.799 -16.913 14.609 1.00 12.95 ? 127 ILE A CB 1 ATOM 963 C CG1 . ILE A 1 127 ? -8.088 -15.476 14.161 1.00 12.42 ? 127 ILE A CG1 1 ATOM 964 C CG2 . ILE A 1 127 ? -9.006 -17.468 15.437 1.00 11.23 ? 127 ILE A CG2 1 ATOM 965 C CD1 . ILE A 1 127 ? -9.102 -15.418 13.077 1.00 13.43 ? 127 ILE A CD1 1 ATOM 966 N N . SER A 1 128 ? -6.812 -18.464 17.264 1.00 12.68 ? 128 SER A N 1 ATOM 967 C CA . SER A 1 128 ? -6.812 -19.727 17.960 1.00 12.98 ? 128 SER A CA 1 ATOM 968 C C . SER A 1 128 ? -7.996 -20.599 17.485 1.00 13.14 ? 128 SER A C 1 ATOM 969 O O . SER A 1 128 ? -9.157 -20.280 17.785 1.00 12.68 ? 128 SER A O 1 ATOM 970 C CB . SER A 1 128 ? -6.910 -19.463 19.478 1.00 12.61 ? 128 SER A CB 1 ATOM 971 O OG . SER A 1 128 ? -7.051 -20.668 20.205 1.00 10.56 ? 128 SER A OG 1 ATOM 972 N N . HIS A 1 129 ? -7.709 -21.691 16.767 1.00 11.47 ? 129 HIS A N 1 ATOM 973 C CA . HIS A 1 129 ? -8.767 -22.594 16.271 1.00 12.50 ? 129 HIS A CA 1 ATOM 974 C C . HIS A 1 129 ? -8.255 -24.047 16.251 1.00 13.07 ? 129 HIS A C 1 ATOM 975 O O . HIS A 1 129 ? -7.127 -24.316 16.686 1.00 12.88 ? 129 HIS A O 1 ATOM 976 C CB . HIS A 1 129 ? -9.287 -22.154 14.878 1.00 12.13 ? 129 HIS A CB 1 ATOM 977 C CG . HIS A 1 129 ? -8.197 -21.907 13.871 1.00 12.70 ? 129 HIS A CG 1 ATOM 978 N ND1 . HIS A 1 129 ? -7.408 -22.920 13.362 1.00 12.57 ? 129 HIS A ND1 1 ATOM 979 C CD2 . HIS A 1 129 ? -7.770 -20.763 13.276 1.00 12.52 ? 129 HIS A CD2 1 ATOM 980 C CE1 . HIS A 1 129 ? -6.537 -22.410 12.506 1.00 12.77 ? 129 HIS A CE1 1 ATOM 981 N NE2 . HIS A 1 129 ? -6.747 -21.103 12.425 1.00 12.56 ? 129 HIS A NE2 1 ATOM 982 N N . GLY A 1 130 ? -9.077 -24.960 15.735 1.00 13.16 ? 130 GLY A N 1 ATOM 983 C CA . GLY A 1 130 ? -8.721 -26.375 15.619 1.00 13.51 ? 130 GLY A CA 1 ATOM 984 C C . GLY A 1 130 ? -7.534 -26.687 14.711 1.00 14.68 ? 130 GLY A C 1 ATOM 985 O O . GLY A 1 130 ? -7.033 -25.811 13.982 1.00 13.32 ? 130 GLY A O 1 ATOM 986 N N . THR A 1 131 ? -7.099 -27.943 14.749 1.00 15.05 ? 131 THR A N 1 ATOM 987 C CA . THR A 1 131 ? -5.868 -28.370 14.087 1.00 16.23 ? 131 THR A CA 1 ATOM 988 C C . THR A 1 131 ? -6.080 -28.926 12.679 1.00 17.86 ? 131 THR A C 1 ATOM 989 O O . THR A 1 131 ? -5.128 -29.007 11.925 1.00 19.56 ? 131 THR A O 1 ATOM 990 C CB . THR A 1 131 ? -5.174 -29.503 14.871 1.00 16.56 ? 131 THR A CB 1 ATOM 991 O OG1 . THR A 1 131 ? -6.099 -30.590 15.020 1.00 14.96 ? 131 THR A OG1 1 ATOM 992 C CG2 . THR A 1 131 ? -4.720 -29.029 16.257 1.00 16.58 ? 131 THR A CG2 1 ATOM 993 N N . CYS A 1 132 ? -7.292 -29.376 12.354 1.00 16.92 ? 132 CYS A N 1 ATOM 994 C CA . CYS A 1 132 ? -7.521 -30.035 11.075 1.00 16.44 ? 132 CYS A CA 1 ATOM 995 C C . CYS A 1 132 ? -7.664 -28.996 9.946 1.00 15.17 ? 132 CYS A C 1 ATOM 996 O O . CYS A 1 132 ? -8.541 -28.141 10.004 1.00 14.73 ? 132 CYS A O 1 ATOM 997 C CB . CYS A 1 132 ? -8.774 -30.929 11.172 1.00 18.05 ? 132 CYS A CB 1 ATOM 998 S SG . CYS A 1 132 ? -8.721 -32.144 12.548 0.93 16.36 ? 132 CYS A SG 1 ATOM 999 N N . PRO A 1 133 ? -6.806 -29.063 8.914 1.00 15.28 ? 133 PRO A N 1 ATOM 1000 C CA . PRO A 1 133 ? -6.825 -27.963 7.923 1.00 15.10 ? 133 PRO A CA 1 ATOM 1001 C C . PRO A 1 133 ? -8.101 -27.871 7.037 1.00 14.19 ? 133 PRO A C 1 ATOM 1002 O O . PRO A 1 133 ? -8.422 -26.785 6.567 1.00 13.72 ? 133 PRO A O 1 ATOM 1003 C CB . PRO A 1 133 ? -5.561 -28.212 7.086 1.00 14.93 ? 133 PRO A CB 1 ATOM 1004 C CG . PRO A 1 133 ? -5.279 -29.691 7.250 1.00 15.55 ? 133 PRO A CG 1 ATOM 1005 C CD . PRO A 1 133 ? -5.747 -30.056 8.638 1.00 15.03 ? 133 PRO A CD 1 ATOM 1006 N N . GLY A 1 134 ? -8.819 -28.983 6.856 1.00 13.50 ? 134 GLY A N 1 ATOM 1007 C CA . GLY A 1 134 ? -10.051 -29.018 6.053 1.00 12.42 ? 134 GLY A CA 1 ATOM 1008 C C . GLY A 1 134 ? -11.350 -28.625 6.748 1.00 11.98 ? 134 GLY A C 1 ATOM 1009 O O . GLY A 1 134 ? -12.378 -28.422 6.089 1.00 10.80 ? 134 GLY A O 1 ATOM 1010 N N . VAL A 1 135 ? -11.306 -28.488 8.079 1.00 11.60 ? 135 VAL A N 1 ATOM 1011 C CA . VAL A 1 135 ? -12.482 -28.049 8.830 1.00 10.91 ? 135 VAL A CA 1 ATOM 1012 C C . VAL A 1 135 ? -12.979 -26.686 8.332 1.00 11.11 ? 135 VAL A C 1 ATOM 1013 O O . VAL A 1 135 ? -12.193 -25.784 8.080 1.00 11.34 ? 135 VAL A O 1 ATOM 1014 C CB . VAL A 1 135 ? -12.205 -28.054 10.356 1.00 11.02 ? 135 VAL A CB 1 ATOM 1015 C CG1 . VAL A 1 135 ? -13.323 -27.361 11.141 1.00 10.40 ? 135 VAL A CG1 1 ATOM 1016 C CG2 . VAL A 1 135 ? -12.084 -29.511 10.822 1.00 10.77 ? 135 VAL A CG2 1 ATOM 1017 N N . GLY A 1 136 ? -14.285 -26.551 8.163 1.00 10.75 ? 136 GLY A N 1 ATOM 1018 C CA . GLY A 1 136 ? -14.862 -25.283 7.755 1.00 10.43 ? 136 GLY A CA 1 ATOM 1019 C C . GLY A 1 136 ? -14.920 -24.296 8.920 1.00 10.52 ? 136 GLY A C 1 ATOM 1020 O O . GLY A 1 136 ? -15.192 -24.680 10.070 1.00 9.87 ? 136 GLY A O 1 ATOM 1021 N N . ILE A 1 137 ? -14.634 -23.027 8.615 1.00 9.72 ? 137 ILE A N 1 ATOM 1022 C CA . ILE A 1 137 ? -14.785 -21.936 9.560 1.00 9.65 ? 137 ILE A CA 1 ATOM 1023 C C . ILE A 1 137 ? -16.195 -21.885 10.210 1.00 10.54 ? 137 ILE A C 1 ATOM 1024 O O . ILE A 1 137 ? -16.300 -21.639 11.421 1.00 10.33 ? 137 ILE A O 1 ATOM 1025 C CB . ILE A 1 137 ? -14.431 -20.570 8.905 1.00 9.40 ? 137 ILE A CB 1 ATOM 1026 C CG1 . ILE A 1 137 ? -14.296 -19.478 9.966 1.00 10.06 ? 137 ILE A CG1 1 ATOM 1027 C CG2 . ILE A 1 137 ? -15.412 -20.157 7.799 1.00 8.62 ? 137 ILE A CG2 1 ATOM 1028 C CD1 . ILE A 1 137 ? -14.030 -18.091 9.370 1.00 10.39 ? 137 ILE A CD1 1 ATOM 1029 N N . SER A 1 138 ? -17.262 -22.131 9.429 1.00 9.27 ? 138 SER A N 1 ATOM 1030 C CA . SER A 1 138 ? -18.604 -21.847 9.969 1.00 9.60 ? 138 SER A CA 1 ATOM 1031 C C . SER A 1 138 ? -19.071 -22.848 11.006 1.00 8.93 ? 138 SER A C 1 ATOM 1032 O O . SER A 1 138 ? -19.457 -22.440 12.073 1.00 8.38 ? 138 SER A O 1 ATOM 1033 C CB . SER A 1 138 ? -19.667 -21.629 8.887 1.00 8.93 ? 138 SER A CB 1 ATOM 1034 O OG . SER A 1 138 ? -19.295 -20.552 8.059 1.00 9.21 ? 138 SER A OG 1 ATOM 1035 N N . GLY A 1 139 ? -19.049 -24.149 10.700 1.00 8.98 ? 139 GLY A N 1 ATOM 1036 C CA . GLY A 1 139 ? -19.398 -25.147 11.727 1.00 8.80 ? 139 GLY A CA 1 ATOM 1037 C C . GLY A 1 139 ? -18.524 -25.067 12.966 1.00 8.78 ? 139 GLY A C 1 ATOM 1038 O O . GLY A 1 139 ? -19.000 -25.211 14.097 1.00 10.13 ? 139 GLY A O 1 ATOM 1039 N N . HIS A 1 140 ? -17.239 -24.830 12.751 1.00 8.78 ? 140 HIS A N 1 ATOM 1040 C CA . HIS A 1 140 ? -16.237 -24.809 13.820 1.00 9.07 ? 140 HIS A CA 1 ATOM 1041 C C . HIS A 1 140 ? -16.471 -23.638 14.774 1.00 9.34 ? 140 HIS A C 1 ATOM 1042 O O . HIS A 1 140 ? -16.651 -23.844 15.985 1.00 9.12 ? 140 HIS A O 1 ATOM 1043 C CB . HIS A 1 140 ? -14.834 -24.717 13.211 1.00 8.43 ? 140 HIS A CB 1 ATOM 1044 C CG . HIS A 1 140 ? -13.703 -24.938 14.181 1.00 8.02 ? 140 HIS A CG 1 ATOM 1045 N ND1 . HIS A 1 140 ? -13.413 -26.177 14.716 1.00 7.68 ? 140 HIS A ND1 1 ATOM 1046 C CD2 . HIS A 1 140 ? -12.741 -24.092 14.637 1.00 7.38 ? 140 HIS A CD2 1 ATOM 1047 C CE1 . HIS A 1 140 ? -12.327 -26.083 15.474 1.00 8.14 ? 140 HIS A CE1 1 ATOM 1048 N NE2 . HIS A 1 140 ? -11.917 -24.821 15.461 1.00 7.92 ? 140 HIS A NE2 1 ATOM 1049 N N . PHE A 1 141 ? -16.477 -22.425 14.222 1.00 9.51 ? 141 PHE A N 1 ATOM 1050 C CA . PHE A 1 141 ? -16.613 -21.218 15.041 1.00 10.12 ? 141 PHE A CA 1 ATOM 1051 C C . PHE A 1 141 ? -18.014 -21.094 15.668 1.00 10.48 ? 141 PHE A C 1 ATOM 1052 O O . PHE A 1 141 ? -18.159 -20.551 16.753 1.00 11.66 ? 141 PHE A O 1 ATOM 1053 C CB . PHE A 1 141 ? -16.296 -19.961 14.207 1.00 10.35 ? 141 PHE A CB 1 ATOM 1054 C CG . PHE A 1 141 ? -14.812 -19.711 13.967 1.00 10.10 ? 141 PHE A CG 1 ATOM 1055 C CD1 . PHE A 1 141 ? -14.006 -20.643 13.279 1.00 9.68 ? 141 PHE A CD1 1 ATOM 1056 C CD2 . PHE A 1 141 ? -14.229 -18.518 14.410 1.00 10.56 ? 141 PHE A CD2 1 ATOM 1057 C CE1 . PHE A 1 141 ? -12.652 -20.378 13.049 1.00 10.00 ? 141 PHE A CE1 1 ATOM 1058 C CE2 . PHE A 1 141 ? -12.877 -18.241 14.196 1.00 9.83 ? 141 PHE A CE2 1 ATOM 1059 C CZ . PHE A 1 141 ? -12.084 -19.176 13.490 1.00 10.01 ? 141 PHE A CZ 1 ATOM 1060 N N . ALA A 1 142 ? -19.047 -21.583 14.980 1.00 10.58 ? 142 ALA A N 1 ATOM 1061 C CA . ALA A 1 142 ? -20.420 -21.401 15.474 1.00 10.04 ? 142 ALA A CA 1 ATOM 1062 C C . ALA A 1 142 ? -20.685 -22.175 16.766 1.00 10.35 ? 142 ALA A C 1 ATOM 1063 O O . ALA A 1 142 ? -21.691 -21.911 17.454 1.00 10.03 ? 142 ALA A O 1 ATOM 1064 C CB . ALA A 1 142 ? -21.443 -21.803 14.397 1.00 8.45 ? 142 ALA A CB 1 ATOM 1065 N N . HIS A 1 143 ? -19.826 -23.165 17.054 1.00 9.92 ? 143 HIS A N 1 ATOM 1066 C CA . HIS A 1 143 ? -20.088 -24.090 18.156 1.00 10.70 ? 143 HIS A CA 1 ATOM 1067 C C . HIS A 1 143 ? -18.934 -24.178 19.152 1.00 10.64 ? 143 HIS A C 1 ATOM 1068 O O . HIS A 1 143 ? -18.970 -25.002 20.047 1.00 10.95 ? 143 HIS A O 1 ATOM 1069 C CB . HIS A 1 143 ? -20.501 -25.493 17.645 1.00 10.47 ? 143 HIS A CB 1 ATOM 1070 C CG . HIS A 1 143 ? -21.648 -25.464 16.674 1.00 10.61 ? 143 HIS A CG 1 ATOM 1071 N ND1 . HIS A 1 143 ? -21.470 -25.488 15.298 1.00 11.29 ? 143 HIS A ND1 1 ATOM 1072 C CD2 . HIS A 1 143 ? -22.984 -25.338 16.880 1.00 10.21 ? 143 HIS A CD2 1 ATOM 1073 C CE1 . HIS A 1 143 ? -22.653 -25.421 14.705 1.00 10.65 ? 143 HIS A CE1 1 ATOM 1074 N NE2 . HIS A 1 143 ? -23.586 -25.307 15.645 1.00 10.51 ? 143 HIS A NE2 1 ATOM 1075 N N . GLY A 1 144 ? -17.951 -23.289 19.025 1.00 10.57 ? 144 GLY A N 1 ATOM 1076 C CA . GLY A 1 144 ? -16.796 -23.279 19.940 1.00 11.58 ? 144 GLY A CA 1 ATOM 1077 C C . GLY A 1 144 ? -15.464 -23.225 19.188 1.00 11.29 ? 144 GLY A C 1 ATOM 1078 O O . GLY A 1 144 ? -15.024 -22.139 18.782 1.00 10.34 ? 144 GLY A O 1 ATOM 1079 N N . GLY A 1 145 ? -14.831 -24.395 19.028 1.00 10.56 ? 145 GLY A N 1 ATOM 1080 C CA . GLY A 1 145 ? -13.584 -24.545 18.286 1.00 10.17 ? 145 GLY A CA 1 ATOM 1081 C C . GLY A 1 145 ? -12.372 -24.570 19.193 1.00 11.21 ? 145 GLY A C 1 ATOM 1082 O O . GLY A 1 145 ? -11.892 -23.502 19.647 1.00 11.60 ? 145 GLY A O 1 ATOM 1083 N N . PHE A 1 146 ? -11.854 -25.764 19.456 1.00 9.98 ? 146 PHE A N 1 ATOM 1084 C CA . PHE A 1 146 ? -10.780 -25.929 20.419 1.00 11.23 ? 146 PHE A CA 1 ATOM 1085 C C . PHE A 1 146 ? -9.505 -26.453 19.745 1.00 11.84 ? 146 PHE A C 1 ATOM 1086 O O . PHE A 1 146 ? -9.577 -27.373 18.922 1.00 12.21 ? 146 PHE A O 1 ATOM 1087 C CB . PHE A 1 146 ? -11.220 -26.903 21.546 1.00 11.14 ? 146 PHE A CB 1 ATOM 1088 C CG . PHE A 1 146 ? -10.185 -27.056 22.639 1.00 11.89 ? 146 PHE A CG 1 ATOM 1089 C CD1 . PHE A 1 146 ? -10.192 -26.194 23.744 1.00 11.39 ? 146 PHE A CD1 1 ATOM 1090 C CD2 . PHE A 1 146 ? -9.180 -28.027 22.548 1.00 11.83 ? 146 PHE A CD2 1 ATOM 1091 C CE1 . PHE A 1 146 ? -9.250 -26.332 24.759 1.00 11.27 ? 146 PHE A CE1 1 ATOM 1092 C CE2 . PHE A 1 146 ? -8.206 -28.148 23.524 1.00 11.41 ? 146 PHE A CE2 1 ATOM 1093 C CZ . PHE A 1 146 ? -8.256 -27.298 24.657 1.00 12.27 ? 146 PHE A CZ 1 ATOM 1094 N N . GLY A 1 147 ? -8.347 -25.898 20.110 1.00 11.06 ? 147 GLY A N 1 ATOM 1095 C CA . GLY A 1 147 ? -7.076 -26.377 19.573 1.00 10.98 ? 147 GLY A CA 1 ATOM 1096 C C . GLY A 1 147 ? -5.901 -26.126 20.518 1.00 12.46 ? 147 GLY A C 1 ATOM 1097 O O . GLY A 1 147 ? -6.098 -25.799 21.714 1.00 10.66 ? 147 GLY A O 1 ATOM 1098 N N . PHE A 1 148 ? -4.682 -26.226 19.958 1.00 12.22 ? 148 PHE A N 1 ATOM 1099 C CA . PHE A 1 148 ? -3.443 -26.091 20.723 1.00 12.58 ? 148 PHE A CA 1 ATOM 1100 C C . PHE A 1 148 ? -3.009 -24.649 21.053 1.00 12.87 ? 148 PHE A C 1 ATOM 1101 O O . PHE A 1 148 ? -1.902 -24.446 21.556 1.00 11.98 ? 148 PHE A O 1 ATOM 1102 C CB . PHE A 1 148 ? -2.293 -26.792 19.984 1.00 13.95 ? 148 PHE A CB 1 ATOM 1103 C CG . PHE A 1 148 ? -2.313 -28.271 20.118 1.00 13.89 ? 148 PHE A CG 1 ATOM 1104 C CD1 . PHE A 1 148 ? -1.985 -28.881 21.339 1.00 14.76 ? 148 PHE A CD1 1 ATOM 1105 C CD2 . PHE A 1 148 ? -2.673 -29.075 19.037 1.00 14.14 ? 148 PHE A CD2 1 ATOM 1106 C CE1 . PHE A 1 148 ? -2.010 -30.302 21.480 1.00 14.24 ? 148 PHE A CE1 1 ATOM 1107 C CE2 . PHE A 1 148 ? -2.698 -30.501 19.171 1.00 14.63 ? 148 PHE A CE2 1 ATOM 1108 C CZ . PHE A 1 148 ? -2.356 -31.101 20.390 1.00 13.62 ? 148 PHE A CZ 1 ATOM 1109 N N . SER A 1 149 ? -3.844 -23.654 20.748 1.00 12.51 ? 149 SER A N 1 ATOM 1110 C CA . SER A 1 149 ? -3.656 -22.310 21.306 1.00 12.74 ? 149 SER A CA 1 ATOM 1111 C C . SER A 1 149 ? -4.798 -21.925 22.259 1.00 13.40 ? 149 SER A C 1 ATOM 1112 O O . SER A 1 149 ? -4.822 -20.798 22.770 1.00 14.87 ? 149 SER A O 1 ATOM 1113 C CB . SER A 1 149 ? -3.536 -21.255 20.192 1.00 12.65 ? 149 SER A CB 1 ATOM 1114 O OG . SER A 1 149 ? -2.397 -21.501 19.383 1.00 12.56 ? 149 SER A OG 1 ATOM 1115 N N . SER A 1 150 ? -5.735 -22.837 22.520 1.00 12.05 ? 150 SER A N 1 ATOM 1116 C CA . SER A 1 150 ? -6.912 -22.465 23.316 1.00 13.08 ? 150 SER A CA 1 ATOM 1117 C C . SER A 1 150 ? -6.599 -22.135 24.773 1.00 12.78 ? 150 SER A C 1 ATOM 1118 O O . SER A 1 150 ? -7.242 -21.262 25.333 1.00 13.93 ? 150 SER A O 1 ATOM 1119 C CB . SER A 1 150 ? -8.009 -23.522 23.265 1.00 12.63 ? 150 SER A CB 1 ATOM 1120 O OG . SER A 1 150 ? -8.586 -23.592 21.985 1.00 15.58 ? 150 SER A OG 1 ATOM 1121 N N . HIS A 1 151 ? -5.623 -22.805 25.388 1.00 12.10 ? 151 HIS A N 1 ATOM 1122 C CA . HIS A 1 151 ? -5.332 -22.507 26.806 1.00 12.40 ? 151 HIS A CA 1 ATOM 1123 C C . HIS A 1 151 ? -4.799 -21.056 26.892 1.00 13.19 ? 151 HIS A C 1 ATOM 1124 O O . HIS A 1 151 ? -5.119 -20.293 27.817 1.00 12.48 ? 151 HIS A O 1 ATOM 1125 C CB . HIS A 1 151 ? -4.337 -23.517 27.350 1.00 11.85 ? 151 HIS A CB 1 ATOM 1126 C CG . HIS A 1 151 ? -4.284 -23.609 28.851 1.00 13.65 ? 151 HIS A CG 1 ATOM 1127 N ND1 . HIS A 1 151 ? -3.379 -22.884 29.610 1.00 13.17 ? 151 HIS A ND1 1 ATOM 1128 C CD2 . HIS A 1 151 ? -4.942 -24.419 29.720 1.00 13.65 ? 151 HIS A CD2 1 ATOM 1129 C CE1 . HIS A 1 151 ? -3.533 -23.198 30.887 1.00 16.03 ? 151 HIS A CE1 1 ATOM 1130 N NE2 . HIS A 1 151 ? -4.469 -24.132 30.983 1.00 15.06 ? 151 HIS A NE2 1 ATOM 1131 N N . MET A 1 152 ? -3.972 -20.709 25.909 1.00 13.01 ? 152 MET A N 1 ATOM 1132 C CA . MET A 1 152 ? -3.370 -19.392 25.801 1.00 14.12 ? 152 MET A CA 1 ATOM 1133 C C . MET A 1 152 ? -4.325 -18.292 25.298 1.00 13.70 ? 152 MET A C 1 ATOM 1134 O O . MET A 1 152 ? -4.274 -17.166 25.776 1.00 13.23 ? 152 MET A O 1 ATOM 1135 C CB . MET A 1 152 ? -2.167 -19.484 24.839 1.00 13.93 ? 152 MET A CB 1 ATOM 1136 C CG . MET A 1 152 ? -1.477 -18.156 24.592 1.00 13.93 ? 152 MET A CG 1 ATOM 1137 S SD . MET A 1 152 ? -0.494 -17.669 26.027 1.00 14.84 ? 152 MET A SD 1 ATOM 1138 C CE . MET A 1 152 ? 0.180 -16.091 25.445 1.00 14.97 ? 152 MET A CE 1 ATOM 1139 N N . HIS A 1 153 ? -5.168 -18.603 24.312 1.00 13.45 ? 153 HIS A N 1 ATOM 1140 C CA . HIS A 1 153 ? -5.904 -17.542 23.587 1.00 13.24 ? 153 HIS A CA 1 ATOM 1141 C C . HIS A 1 153 ? -7.402 -17.791 23.438 1.00 12.15 ? 153 HIS A C 1 ATOM 1142 O O . HIS A 1 153 ? -8.079 -17.010 22.790 1.00 12.99 ? 153 HIS A O 1 ATOM 1143 C CB . HIS A 1 153 ? -5.319 -17.351 22.173 1.00 13.97 ? 153 HIS A CB 1 ATOM 1144 C CG . HIS A 1 153 ? -4.051 -16.552 22.128 1.00 15.88 ? 153 HIS A CG 1 ATOM 1145 N ND1 . HIS A 1 153 ? -3.941 -15.285 22.665 1.00 15.03 ? 153 HIS A ND1 1 ATOM 1146 C CD2 . HIS A 1 153 ? -2.849 -16.826 21.564 1.00 15.79 ? 153 HIS A CD2 1 ATOM 1147 C CE1 . HIS A 1 153 ? -2.715 -14.833 22.477 1.00 14.32 ? 153 HIS A CE1 1 ATOM 1148 N NE2 . HIS A 1 153 ? -2.035 -15.750 21.813 1.00 16.48 ? 153 HIS A NE2 1 ATOM 1149 N N . GLY A 1 154 ? -7.909 -18.889 23.974 1.00 11.24 ? 154 GLY A N 1 ATOM 1150 C CA . GLY A 1 154 ? -9.358 -19.132 23.978 1.00 11.88 ? 154 GLY A CA 1 ATOM 1151 C C . GLY A 1 154 ? -9.880 -19.874 22.753 1.00 12.19 ? 154 GLY A C 1 ATOM 1152 O O . GLY A 1 154 ? -9.099 -20.342 21.912 1.00 11.57 ? 154 GLY A O 1 ATOM 1153 N N . LEU A 1 155 ? -11.206 -20.025 22.682 1.00 12.23 ? 155 LEU A N 1 ATOM 1154 C CA . LEU A 1 155 ? -11.866 -20.745 21.577 1.00 10.88 ? 155 LEU A CA 1 ATOM 1155 C C . LEU A 1 155 ? -11.883 -19.922 20.290 1.00 11.38 ? 155 LEU A C 1 ATOM 1156 O O . LEU A 1 155 ? -11.813 -18.669 20.323 1.00 11.24 ? 155 LEU A O 1 ATOM 1157 C CB . LEU A 1 155 ? -13.299 -21.112 21.976 1.00 10.51 ? 155 LEU A CB 1 ATOM 1158 C CG . LEU A 1 155 ? -13.471 -21.940 23.296 1.00 10.21 ? 155 LEU A CG 1 ATOM 1159 C CD1 . LEU A 1 155 ? -14.937 -22.180 23.558 1.00 10.14 ? 155 LEU A CD1 1 ATOM 1160 C CD2 . LEU A 1 155 ? -12.737 -23.293 23.262 1.00 9.73 ? 155 LEU A CD2 1 ATOM 1161 N N . ALA A 1 156 ? -12.015 -20.615 19.162 1.00 10.87 ? 156 ALA A N 1 ATOM 1162 C CA . ALA A 1 156 ? -12.257 -19.958 17.884 1.00 11.52 ? 156 ALA A CA 1 ATOM 1163 C C . ALA A 1 156 ? -13.421 -18.982 18.041 1.00 11.69 ? 156 ALA A C 1 ATOM 1164 O O . ALA A 1 156 ? -13.324 -17.841 17.614 1.00 12.67 ? 156 ALA A O 1 ATOM 1165 C CB . ALA A 1 156 ? -12.529 -20.994 16.757 1.00 11.34 ? 156 ALA A CB 1 ATOM 1166 N N . VAL A 1 157 ? -14.497 -19.436 18.678 1.00 11.57 ? 157 VAL A N 1 ATOM 1167 C CA . VAL A 1 157 ? -15.675 -18.609 18.921 1.00 11.54 ? 157 VAL A CA 1 ATOM 1168 C C . VAL A 1 157 ? -15.358 -17.296 19.672 1.00 11.63 ? 157 VAL A C 1 ATOM 1169 O O . VAL A 1 157 ? -16.010 -16.280 19.440 1.00 11.42 ? 157 VAL A O 1 ATOM 1170 C CB . VAL A 1 157 ? -16.834 -19.399 19.607 1.00 10.82 ? 157 VAL A CB 1 ATOM 1171 C CG1 . VAL A 1 157 ? -16.565 -19.668 21.093 1.00 10.10 ? 157 VAL A CG1 1 ATOM 1172 C CG2 . VAL A 1 157 ? -18.158 -18.663 19.450 1.00 9.74 ? 157 VAL A CG2 1 ATOM 1173 N N . ASP A 1 158 ? -14.355 -17.327 20.544 1.00 11.27 ? 158 ASP A N 1 ATOM 1174 C CA . ASP A 1 158 ? -13.957 -16.147 21.302 1.00 11.56 ? 158 ASP A CA 1 ATOM 1175 C C . ASP A 1 158 ? -13.275 -15.053 20.448 1.00 12.33 ? 158 ASP A C 1 ATOM 1176 O O . ASP A 1 158 ? -13.164 -13.925 20.893 1.00 12.12 ? 158 ASP A O 1 ATOM 1177 C CB . ASP A 1 158 ? -13.082 -16.574 22.480 1.00 12.16 ? 158 ASP A CB 1 ATOM 1178 C CG . ASP A 1 158 ? -13.841 -17.448 23.480 1.00 12.77 ? 158 ASP A CG 1 ATOM 1179 O OD1 . ASP A 1 158 ? -15.064 -17.194 23.675 1.00 12.50 ? 158 ASP A OD1 1 ATOM 1180 O OD2 . ASP A 1 158 ? -13.217 -18.396 24.042 1.00 12.90 ? 158 ASP A OD2 1 ATOM 1181 N N . SER A 1 159 ? -12.845 -15.371 19.226 1.00 11.15 ? 159 SER A N 1 ATOM 1182 C CA . SER A 1 159 ? -12.346 -14.336 18.312 1.00 11.86 ? 159 SER A CA 1 ATOM 1183 C C . SER A 1 159 ? -13.483 -13.562 17.601 1.00 11.13 ? 159 SER A C 1 ATOM 1184 O O . SER A 1 159 ? -13.242 -12.557 16.966 1.00 10.89 ? 159 SER A O 1 ATOM 1185 C CB . SER A 1 159 ? -11.435 -14.976 17.238 1.00 11.90 ? 159 SER A CB 1 ATOM 1186 O OG . SER A 1 159 ? -12.242 -15.614 16.269 1.00 11.70 ? 159 SER A OG 1 ATOM 1187 N N . VAL A 1 160 ? -14.709 -14.067 17.676 1.00 11.75 ? 160 VAL A N 1 ATOM 1188 C CA . VAL A 1 160 ? -15.816 -13.505 16.910 1.00 12.21 ? 160 VAL A CA 1 ATOM 1189 C C . VAL A 1 160 ? -16.290 -12.193 17.540 1.00 12.66 ? 160 VAL A C 1 ATOM 1190 O O . VAL A 1 160 ? -16.744 -12.174 18.700 1.00 14.18 ? 160 VAL A O 1 ATOM 1191 C CB . VAL A 1 160 ? -17.012 -14.515 16.796 1.00 12.02 ? 160 VAL A CB 1 ATOM 1192 C CG1 . VAL A 1 160 ? -18.177 -13.916 16.016 1.00 10.46 ? 160 VAL A CG1 1 ATOM 1193 C CG2 . VAL A 1 160 ? -16.562 -15.879 16.180 1.00 10.59 ? 160 VAL A CG2 1 ATOM 1194 N N . VAL A 1 161 ? -16.177 -11.106 16.786 1.00 12.93 ? 161 VAL A N 1 ATOM 1195 C CA . VAL A 1 161 ? -16.653 -9.779 17.241 1.00 14.58 ? 161 VAL A CA 1 ATOM 1196 C C . VAL A 1 161 ? -17.854 -9.297 16.428 1.00 15.59 ? 161 VAL A C 1 ATOM 1197 O O . VAL A 1 161 ? -18.476 -8.287 16.772 1.00 18.98 ? 161 VAL A O 1 ATOM 1198 C CB . VAL A 1 161 ? -15.537 -8.699 17.246 1.00 14.31 ? 161 VAL A CB 1 ATOM 1199 C CG1 . VAL A 1 161 ? -14.431 -9.112 18.220 1.00 14.31 ? 161 VAL A CG1 1 ATOM 1200 C CG2 . VAL A 1 161 ? -14.955 -8.460 15.810 1.00 13.33 ? 161 VAL A CG2 1 ATOM 1201 N N . GLY A 1 162 ? -18.181 -10.004 15.352 1.00 14.87 ? 162 GLY A N 1 ATOM 1202 C CA . GLY A 1 162 ? -19.423 -9.721 14.627 1.00 15.01 ? 162 GLY A CA 1 ATOM 1203 C C . GLY A 1 162 ? -19.729 -10.726 13.524 1.00 14.14 ? 162 GLY A C 1 ATOM 1204 O O . GLY A 1 162 ? -18.845 -11.483 13.103 1.00 12.27 ? 162 GLY A O 1 ATOM 1205 N N . VAL A 1 163 ? -20.980 -10.731 13.059 1.00 12.63 ? 163 VAL A N 1 ATOM 1206 C CA . VAL A 1 163 ? -21.378 -11.570 11.928 1.00 12.96 ? 163 VAL A CA 1 ATOM 1207 C C . VAL A 1 163 ? -22.416 -10.850 11.076 1.00 14.32 ? 163 VAL A C 1 ATOM 1208 O O . VAL A 1 163 ? -23.170 -10.004 11.578 1.00 14.75 ? 163 VAL A O 1 ATOM 1209 C CB . VAL A 1 163 ? -21.953 -12.965 12.363 1.00 12.55 ? 163 VAL A CB 1 ATOM 1210 C CG1 . VAL A 1 163 ? -20.824 -13.915 12.821 1.00 11.75 ? 163 VAL A CG1 1 ATOM 1211 C CG2 . VAL A 1 163 ? -23.036 -12.825 13.465 1.00 13.06 ? 163 VAL A CG2 1 ATOM 1212 N N . THR A 1 164 ? -22.424 -11.176 9.788 1.00 12.39 ? 164 THR A N 1 ATOM 1213 C CA . THR A 1 164 ? -23.536 -10.880 8.919 1.00 12.77 ? 164 THR A CA 1 ATOM 1214 C C . THR A 1 164 ? -24.308 -12.184 8.818 1.00 12.09 ? 164 THR A C 1 ATOM 1215 O O . THR A 1 164 ? -23.722 -13.253 8.626 1.00 11.55 ? 164 THR A O 1 ATOM 1216 C CB . THR A 1 164 ? -23.041 -10.419 7.529 1.00 12.18 ? 164 THR A CB 1 ATOM 1217 O OG1 . THR A 1 164 ? -22.217 -9.253 7.704 1.00 14.58 ? 164 THR A OG1 1 ATOM 1218 C CG2 . THR A 1 164 ? -24.211 -10.052 6.616 1.00 11.66 ? 164 THR A CG2 1 ATOM 1219 N N . VAL A 1 165 ? -25.617 -12.128 8.977 1.00 12.29 ? 165 VAL A N 1 ATOM 1220 C CA . VAL A 1 165 ? -26.386 -13.383 9.042 1.00 11.63 ? 165 VAL A CA 1 ATOM 1221 C C . VAL A 1 165 ? -27.590 -13.290 8.119 1.00 12.17 ? 165 VAL A C 1 ATOM 1222 O O . VAL A 1 165 ? -28.307 -12.280 8.124 1.00 13.55 ? 165 VAL A O 1 ATOM 1223 C CB . VAL A 1 165 ? -26.873 -13.663 10.478 1.00 11.81 ? 165 VAL A CB 1 ATOM 1224 C CG1 . VAL A 1 165 ? -27.485 -15.066 10.597 1.00 11.85 ? 165 VAL A CG1 1 ATOM 1225 C CG2 . VAL A 1 165 ? -25.762 -13.486 11.477 1.00 11.73 ? 165 VAL A CG2 1 ATOM 1226 N N . VAL A 1 166 ? -27.830 -14.348 7.351 1.00 12.29 ? 166 VAL A N 1 ATOM 1227 C CA . VAL A 1 166 ? -29.089 -14.513 6.597 1.00 11.38 ? 166 VAL A CA 1 ATOM 1228 C C . VAL A 1 166 ? -30.088 -15.246 7.481 1.00 11.25 ? 166 VAL A C 1 ATOM 1229 O O . VAL A 1 166 ? -29.829 -16.400 7.897 1.00 10.53 ? 166 VAL A O 1 ATOM 1230 C CB . VAL A 1 166 ? -28.862 -15.313 5.280 1.00 11.97 ? 166 VAL A CB 1 ATOM 1231 C CG1 . VAL A 1 166 ? -30.202 -15.533 4.519 1.00 11.54 ? 166 VAL A CG1 1 ATOM 1232 C CG2 . VAL A 1 166 ? -27.860 -14.616 4.410 1.00 10.78 ? 166 VAL A CG2 1 ATOM 1233 N N . LEU A 1 167 ? -31.216 -14.597 7.783 1.00 11.46 ? 167 LEU A N 1 ATOM 1234 C CA . LEU A 1 167 ? -32.234 -15.199 8.661 1.00 13.06 ? 167 LEU A CA 1 ATOM 1235 C C . LEU A 1 167 ? -33.198 -16.084 7.893 1.00 13.19 ? 167 LEU A C 1 ATOM 1236 O O . LEU A 1 167 ? -33.233 -16.015 6.663 1.00 12.01 ? 167 LEU A O 1 ATOM 1237 C CB . LEU A 1 167 ? -33.025 -14.125 9.437 1.00 12.29 ? 167 LEU A CB 1 ATOM 1238 C CG . LEU A 1 167 ? -32.206 -13.166 10.297 1.00 13.00 ? 167 LEU A CG 1 ATOM 1239 C CD1 . LEU A 1 167 ? -33.116 -12.184 11.071 1.00 12.55 ? 167 LEU A CD1 1 ATOM 1240 C CD2 . LEU A 1 167 ? -31.246 -13.912 11.252 1.00 12.55 ? 167 LEU A CD2 1 ATOM 1241 N N . ALA A 1 168 ? -34.032 -16.836 8.629 1.00 14.33 ? 168 ALA A N 1 ATOM 1242 C CA . ALA A 1 168 ? -35.035 -17.746 8.024 1.00 15.48 ? 168 ALA A CA 1 ATOM 1243 C C . ALA A 1 168 ? -36.075 -17.053 7.130 1.00 15.99 ? 168 ALA A C 1 ATOM 1244 O O . ALA A 1 168 ? -36.587 -17.646 6.159 1.00 16.30 ? 168 ALA A O 1 ATOM 1245 C CB . ALA A 1 168 ? -35.733 -18.586 9.116 1.00 15.96 ? 168 ALA A CB 1 ATOM 1246 N N . ASP A 1 169 ? -36.371 -15.797 7.441 1.00 16.84 ? 169 ASP A N 1 ATOM 1247 C CA . ASP A 1 169 ? -37.320 -15.023 6.646 1.00 17.49 ? 169 ASP A CA 1 ATOM 1248 C C . ASP A 1 169 ? -36.686 -14.354 5.426 1.00 19.31 ? 169 ASP A C 1 ATOM 1249 O O . ASP A 1 169 ? -37.367 -13.611 4.703 1.00 20.95 ? 169 ASP A O 1 ATOM 1250 C CB . ASP A 1 169 ? -38.047 -13.992 7.518 1.00 19.09 ? 169 ASP A CB 1 ATOM 1251 C CG . ASP A 1 169 ? -37.121 -12.884 8.074 1.00 19.17 ? 169 ASP A CG 1 ATOM 1252 O OD1 . ASP A 1 169 ? -35.898 -12.846 7.791 1.00 16.37 ? 169 ASP A OD1 1 ATOM 1253 O OD2 . ASP A 1 169 ? -37.657 -12.023 8.810 1.00 19.83 ? 169 ASP A OD2 1 ATOM 1254 N N . GLY A 1 170 ? -35.385 -14.584 5.216 1.00 17.04 ? 170 GLY A N 1 ATOM 1255 C CA . GLY A 1 170 ? -34.673 -13.993 4.071 1.00 16.57 ? 170 GLY A CA 1 ATOM 1256 C C . GLY A 1 170 ? -33.946 -12.661 4.312 1.00 15.85 ? 170 GLY A C 1 ATOM 1257 O O . GLY A 1 170 ? -33.182 -12.192 3.453 1.00 15.01 ? 170 GLY A O 1 ATOM 1258 N N . ARG A 1 171 ? -34.184 -12.029 5.457 1.00 13.67 ? 171 ARG A N 1 ATOM 1259 C CA . ARG A 1 171 ? -33.465 -10.794 5.776 1.00 14.38 ? 171 ARG A CA 1 ATOM 1260 C C . ARG A 1 171 ? -31.976 -11.006 6.073 1.00 15.48 ? 171 ARG A C 1 ATOM 1261 O O . ARG A 1 171 ? -31.553 -12.045 6.604 1.00 16.02 ? 171 ARG A O 1 ATOM 1262 C CB . ARG A 1 171 ? -34.110 -10.069 6.952 1.00 14.33 ? 171 ARG A CB 1 ATOM 1263 C CG . ARG A 1 171 ? -35.489 -9.517 6.648 1.00 14.03 ? 171 ARG A CG 1 ATOM 1264 C CD . ARG A 1 171 ? -35.995 -8.706 7.803 1.00 14.42 ? 171 ARG A CD 1 ATOM 1265 N NE . ARG A 1 171 ? -36.240 -9.519 9.002 1.00 15.30 ? 171 ARG A NE 1 ATOM 1266 C CZ . ARG A 1 171 ? -35.732 -9.264 10.207 1.00 16.25 ? 171 ARG A CZ 1 ATOM 1267 N NH1 . ARG A 1 171 ? -34.900 -8.229 10.390 1.00 14.90 ? 171 ARG A NH1 1 ATOM 1268 N NH2 . ARG A 1 171 ? -36.051 -10.054 11.236 1.00 18.08 ? 171 ARG A NH2 1 ATOM 1269 N N . ILE A 1 172 ? -31.180 -10.021 5.719 1.00 14.84 ? 172 ILE A N 1 ATOM 1270 C CA . ILE A 1 172 ? -29.767 -10.040 6.076 1.00 14.10 ? 172 ILE A CA 1 ATOM 1271 C C . ILE A 1 172 ? -29.587 -9.052 7.224 1.00 14.83 ? 172 ILE A C 1 ATOM 1272 O O . ILE A 1 172 ? -30.025 -7.907 7.108 1.00 14.65 ? 172 ILE A O 1 ATOM 1273 C CB . ILE A 1 172 ? -28.910 -9.622 4.885 1.00 14.24 ? 172 ILE A CB 1 ATOM 1274 C CG1 . ILE A 1 172 ? -29.104 -10.614 3.713 1.00 13.88 ? 172 ILE A CG1 1 ATOM 1275 C CG2 . ILE A 1 172 ? -27.431 -9.460 5.332 1.00 12.99 ? 172 ILE A CG2 1 ATOM 1276 C CD1 . ILE A 1 172 ? -28.599 -10.094 2.350 1.00 15.06 ? 172 ILE A CD1 1 ATOM 1277 N N . VAL A 1 173 ? -28.992 -9.500 8.334 1.00 14.16 ? 173 VAL A N 1 ATOM 1278 C CA . VAL A 1 173 ? -28.799 -8.634 9.505 1.00 14.87 ? 173 VAL A CA 1 ATOM 1279 C C . VAL A 1 173 ? -27.377 -8.742 10.044 1.00 15.75 ? 173 VAL A C 1 ATOM 1280 O O . VAL A 1 173 ? -26.693 -9.757 9.837 1.00 14.36 ? 173 VAL A O 1 ATOM 1281 C CB . VAL A 1 173 ? -29.810 -8.946 10.672 1.00 14.98 ? 173 VAL A CB 1 ATOM 1282 C CG1 . VAL A 1 173 ? -31.260 -8.826 10.207 1.00 14.51 ? 173 VAL A CG1 1 ATOM 1283 C CG2 . VAL A 1 173 ? -29.530 -10.318 11.326 1.00 12.93 ? 173 VAL A CG2 1 ATOM 1284 N N . GLU A 1 174 ? -26.931 -7.690 10.718 1.00 17.54 ? 174 GLU A N 1 ATOM 1285 C CA . GLU A 1 174 ? -25.671 -7.714 11.444 1.00 18.70 ? 174 GLU A CA 1 ATOM 1286 C C . GLU A 1 174 ? -25.950 -8.074 12.906 1.00 18.92 ? 174 GLU A C 1 ATOM 1287 O O . GLU A 1 174 ? -27.007 -7.735 13.458 1.00 16.94 ? 174 GLU A O 1 ATOM 1288 C CB . GLU A 1 174 ? -24.987 -6.345 11.381 1.00 21.96 ? 174 GLU A CB 1 ATOM 1289 C CG . GLU A 1 174 ? -24.794 -5.769 9.979 1.00 26.89 ? 174 GLU A CG 1 ATOM 1290 C CD . GLU A 1 174 ? -23.896 -6.627 9.103 1.00 30.72 ? 174 GLU A CD 1 ATOM 1291 O OE1 . GLU A 1 174 ? -22.938 -7.226 9.626 1.00 31.08 ? 174 GLU A OE1 1 ATOM 1292 O OE2 . GLU A 1 174 ? -24.163 -6.707 7.894 1.00 36.94 ? 174 GLU A OE2 1 ATOM 1293 N N . ALA A 1 175 ? -24.999 -8.773 13.517 1.00 17.76 ? 175 ALA A N 1 ATOM 1294 C CA . ALA A 1 175 ? -25.052 -9.094 14.933 1.00 16.31 ? 175 ALA A CA 1 ATOM 1295 C C . ALA A 1 175 ? -23.691 -8.869 15.569 1.00 17.14 ? 175 ALA A C 1 ATOM 1296 O O . ALA A 1 175 ? -22.656 -9.156 14.969 1.00 16.38 ? 175 ALA A O 1 ATOM 1297 C CB . ALA A 1 175 ? -25.537 -10.527 15.172 1.00 16.37 ? 175 ALA A CB 1 ATOM 1298 N N . SER A 1 176 ? -23.692 -8.351 16.795 1.00 16.04 ? 176 SER A N 1 ATOM 1299 C CA . SER A 1 176 ? -22.454 -7.997 17.467 1.00 16.80 ? 176 SER A CA 1 ATOM 1300 C C . SER A 1 176 ? -22.848 -7.631 18.869 1.00 16.22 ? 176 SER A C 1 ATOM 1301 O O . SER A 1 176 ? -24.022 -7.735 19.210 1.00 16.22 ? 176 SER A O 1 ATOM 1302 C CB . SER A 1 176 ? -21.746 -6.808 16.771 1.00 17.60 ? 176 SER A CB 1 ATOM 1303 O OG . SER A 1 176 ? -22.379 -5.582 17.127 1.00 19.06 ? 176 SER A OG 1 ATOM 1304 N N . ALA A 1 177 ? -21.882 -7.196 19.684 1.00 16.97 ? 177 ALA A N 1 ATOM 1305 C CA . ALA A 1 177 ? -22.203 -6.705 21.043 1.00 18.26 ? 177 ALA A CA 1 ATOM 1306 C C . ALA A 1 177 ? -23.196 -5.519 21.054 1.00 20.34 ? 177 ALA A C 1 ATOM 1307 O O . ALA A 1 177 ? -23.979 -5.369 21.983 1.00 25.07 ? 177 ALA A O 1 ATOM 1308 C CB . ALA A 1 177 ? -20.911 -6.355 21.827 1.00 15.42 ? 177 ALA A CB 1 ATOM 1309 N N . THR A 1 178 ? -23.182 -4.710 20.009 1.00 23.28 ? 178 THR A N 1 ATOM 1310 C CA . THR A 1 178 ? -23.947 -3.458 19.958 1.00 28.26 ? 178 THR A CA 1 ATOM 1311 C C . THR A 1 178 ? -25.165 -3.524 19.016 1.00 31.09 ? 178 THR A C 1 ATOM 1312 O O . THR A 1 178 ? -25.835 -2.519 18.785 1.00 36.33 ? 178 THR A O 1 ATOM 1313 C CB . THR A 1 178 ? -23.053 -2.283 19.467 1.00 28.80 ? 178 THR A CB 1 ATOM 1314 O OG1 . THR A 1 178 ? -22.489 -2.601 18.176 1.00 31.22 ? 178 THR A OG1 1 ATOM 1315 C CG2 . THR A 1 178 ? -21.943 -1.989 20.461 1.00 25.22 ? 178 THR A CG2 1 ATOM 1316 N N . GLU A 1 179 ? -25.443 -4.692 18.455 1.00 27.25 ? 179 GLU A N 1 ATOM 1317 C CA . GLU A 1 179 ? -26.533 -4.802 17.501 1.00 24.37 ? 179 GLU A CA 1 ATOM 1318 C C . GLU A 1 179 ? -26.999 -6.251 17.436 1.00 22.68 ? 179 GLU A C 1 ATOM 1319 O O . GLU A 1 179 ? -26.193 -7.159 17.153 1.00 20.18 ? 179 GLU A O 1 ATOM 1320 C CB . GLU A 1 179 ? -26.066 -4.332 16.120 1.00 21.65 ? 179 GLU A CB 1 ATOM 1321 C CG . GLU A 1 179 ? -27.201 -4.106 15.157 1.00 20.03 ? 179 GLU A CG 1 ATOM 1322 C CD . GLU A 1 179 ? -26.747 -3.761 13.728 0.50 18.65 ? 179 GLU A CD 1 ATOM 1323 O OE1 . GLU A 1 179 ? -25.526 -3.531 13.472 0.50 16.50 ? 179 GLU A OE1 1 ATOM 1324 O OE2 . GLU A 1 179 ? -27.639 -3.726 12.863 0.50 16.62 ? 179 GLU A OE2 1 ATOM 1325 N N . ASN A 1 180 ? -28.291 -6.467 17.675 1.00 20.73 ? 180 ASN A N 1 ATOM 1326 C CA . ASN A 1 180 ? -28.820 -7.829 17.769 1.00 20.11 ? 180 ASN A CA 1 ATOM 1327 C C . ASN A 1 180 ? -27.893 -8.683 18.669 1.00 18.54 ? 180 ASN A C 1 ATOM 1328 O O . ASN A 1 180 ? -27.459 -9.775 18.269 1.00 19.58 ? 180 ASN A O 1 ATOM 1329 C CB . ASN A 1 180 ? -28.949 -8.457 16.360 1.00 19.72 ? 180 ASN A CB 1 ATOM 1330 C CG . ASN A 1 180 ? -30.040 -7.792 15.511 1.00 20.46 ? 180 ASN A CG 1 ATOM 1331 O OD1 . ASN A 1 180 ? -31.185 -7.680 15.946 1.00 20.02 ? 180 ASN A OD1 1 ATOM 1332 N ND2 . ASN A 1 180 ? -29.686 -7.363 14.294 1.00 18.46 ? 180 ASN A ND2 1 ATOM 1333 N N . ALA A 1 181 ? -27.581 -8.164 19.860 1.00 14.62 ? 181 ALA A N 1 ATOM 1334 C CA . ALA A 1 181 ? -26.712 -8.852 20.821 1.00 15.09 ? 181 ALA A CA 1 ATOM 1335 C C . ALA A 1 181 ? -27.264 -10.213 21.284 1.00 15.26 ? 181 ALA A C 1 ATOM 1336 O O . ALA A 1 181 ? -26.480 -11.120 21.642 1.00 15.51 ? 181 ALA A O 1 ATOM 1337 C CB . ALA A 1 181 ? -26.339 -7.919 22.027 1.00 13.90 ? 181 ALA A CB 1 ATOM 1338 N N . ASP A 1 182 ? -28.596 -10.367 21.216 1.00 14.22 ? 182 ASP A N 1 ATOM 1339 C CA . ASP A 1 182 ? -29.240 -11.628 21.517 1.00 13.77 ? 182 ASP A CA 1 ATOM 1340 C C . ASP A 1 182 ? -28.944 -12.691 20.445 1.00 14.44 ? 182 ASP A C 1 ATOM 1341 O O . ASP A 1 182 ? -28.656 -13.862 20.782 1.00 13.87 ? 182 ASP A O 1 ATOM 1342 C CB . ASP A 1 182 ? -30.761 -11.476 21.766 1.00 14.42 ? 182 ASP A CB 1 ATOM 1343 C CG . ASP A 1 182 ? -31.542 -10.862 20.564 1.00 17.12 ? 182 ASP A CG 1 ATOM 1344 O OD1 . ASP A 1 182 ? -30.983 -10.107 19.712 1.00 18.68 ? 182 ASP A OD1 1 ATOM 1345 O OD2 . ASP A 1 182 ? -32.751 -11.118 20.503 1.00 17.05 ? 182 ASP A OD2 1 ATOM 1346 N N . LEU A 1 183 ? -28.999 -12.280 19.173 1.00 13.26 ? 183 LEU A N 1 ATOM 1347 C CA . LEU A 1 183 ? -28.652 -13.159 18.059 1.00 12.84 ? 183 LEU A CA 1 ATOM 1348 C C . LEU A 1 183 ? -27.172 -13.524 18.156 1.00 13.18 ? 183 LEU A C 1 ATOM 1349 O O . LEU A 1 183 ? -26.805 -14.698 18.026 1.00 14.22 ? 183 LEU A O 1 ATOM 1350 C CB . LEU A 1 183 ? -28.929 -12.479 16.722 1.00 11.64 ? 183 LEU A CB 1 ATOM 1351 C CG . LEU A 1 183 ? -28.573 -13.240 15.443 1.00 12.57 ? 183 LEU A CG 1 ATOM 1352 C CD1 . LEU A 1 183 ? -29.165 -14.652 15.431 1.00 11.34 ? 183 LEU A CD1 1 ATOM 1353 C CD2 . LEU A 1 183 ? -29.041 -12.450 14.207 1.00 12.51 ? 183 LEU A CD2 1 ATOM 1354 N N . PHE A 1 184 ? -26.351 -12.502 18.392 1.00 12.75 ? 184 PHE A N 1 ATOM 1355 C CA . PHE A 1 184 ? -24.896 -12.625 18.561 1.00 13.23 ? 184 PHE A CA 1 ATOM 1356 C C . PHE A 1 184 ? -24.535 -13.691 19.613 1.00 13.76 ? 184 PHE A C 1 ATOM 1357 O O . PHE A 1 184 ? -23.629 -14.522 19.404 1.00 13.90 ? 184 PHE A O 1 ATOM 1358 C CB . PHE A 1 184 ? -24.313 -11.253 18.945 1.00 12.45 ? 184 PHE A CB 1 ATOM 1359 C CG . PHE A 1 184 ? -22.825 -11.162 18.838 1.00 12.37 ? 184 PHE A CG 1 ATOM 1360 C CD1 . PHE A 1 184 ? -22.176 -11.458 17.634 1.00 13.29 ? 184 PHE A CD1 1 ATOM 1361 C CD2 . PHE A 1 184 ? -22.073 -10.768 19.922 1.00 12.21 ? 184 PHE A CD2 1 ATOM 1362 C CE1 . PHE A 1 184 ? -20.799 -11.380 17.532 1.00 13.12 ? 184 PHE A CE1 1 ATOM 1363 C CE2 . PHE A 1 184 ? -20.702 -10.677 19.834 1.00 12.14 ? 184 PHE A CE2 1 ATOM 1364 C CZ . PHE A 1 184 ? -20.063 -10.952 18.630 1.00 12.22 ? 184 PHE A CZ 1 ATOM 1365 N N . TRP A 1 185 ? -25.263 -13.672 20.726 1.00 12.80 ? 185 TRP A N 1 ATOM 1366 C CA . TRP A 1 185 ? -25.056 -14.615 21.822 1.00 12.64 ? 185 TRP A CA 1 ATOM 1367 C C . TRP A 1 185 ? -25.295 -16.063 21.349 1.00 12.76 ? 185 TRP A C 1 ATOM 1368 O O . TRP A 1 185 ? -24.461 -16.957 21.583 1.00 11.23 ? 185 TRP A O 1 ATOM 1369 C CB . TRP A 1 185 ? -26.009 -14.251 22.983 1.00 13.31 ? 185 TRP A CB 1 ATOM 1370 C CG . TRP A 1 185 ? -25.858 -15.075 24.230 1.00 12.62 ? 185 TRP A CG 1 ATOM 1371 C CD1 . TRP A 1 185 ? -25.017 -14.820 25.276 1.00 12.93 ? 185 TRP A CD1 1 ATOM 1372 C CD2 . TRP A 1 185 ? -26.564 -16.278 24.573 1.00 13.25 ? 185 TRP A CD2 1 ATOM 1373 N NE1 . TRP A 1 185 ? -25.164 -15.780 26.248 1.00 12.14 ? 185 TRP A NE1 1 ATOM 1374 C CE2 . TRP A 1 185 ? -26.109 -16.682 25.853 1.00 12.19 ? 185 TRP A CE2 1 ATOM 1375 C CE3 . TRP A 1 185 ? -27.559 -17.039 23.941 1.00 13.40 ? 185 TRP A CE3 1 ATOM 1376 C CZ2 . TRP A 1 185 ? -26.616 -17.821 26.520 1.00 12.85 ? 185 TRP A CZ2 1 ATOM 1377 C CZ3 . TRP A 1 185 ? -28.083 -18.177 24.620 1.00 11.95 ? 185 TRP A CZ3 1 ATOM 1378 C CH2 . TRP A 1 185 ? -27.586 -18.562 25.872 1.00 12.63 ? 185 TRP A CH2 1 ATOM 1379 N N . GLY A 1 186 ? -26.431 -16.280 20.668 1.00 13.52 ? 186 GLY A N 1 ATOM 1380 C CA . GLY A 1 186 ? -26.748 -17.577 20.090 1.00 13.05 ? 186 GLY A CA 1 ATOM 1381 C C . GLY A 1 186 ? -25.784 -18.024 19.009 1.00 14.27 ? 186 GLY A C 1 ATOM 1382 O O . GLY A 1 186 ? -25.462 -19.212 18.921 1.00 14.31 ? 186 GLY A O 1 ATOM 1383 N N . ILE A 1 187 ? -25.320 -17.087 18.170 1.00 13.73 ? 187 ILE A N 1 ATOM 1384 C CA . ILE A 1 187 ? -24.414 -17.462 17.093 1.00 13.81 ? 187 ILE A CA 1 ATOM 1385 C C . ILE A 1 187 ? -23.115 -18.001 17.706 1.00 12.92 ? 187 ILE A C 1 ATOM 1386 O O . ILE A 1 187 ? -22.512 -18.969 17.183 1.00 11.93 ? 187 ILE A O 1 ATOM 1387 C CB . ILE A 1 187 ? -24.119 -16.279 16.128 1.00 13.55 ? 187 ILE A CB 1 ATOM 1388 C CG1 . ILE A 1 187 ? -25.364 -15.888 15.310 1.00 13.90 ? 187 ILE A CG1 1 ATOM 1389 C CG2 . ILE A 1 187 ? -22.911 -16.540 15.235 1.00 12.80 ? 187 ILE A CG2 1 ATOM 1390 C CD1 . ILE A 1 187 ? -25.943 -16.935 14.394 1.00 15.41 ? 187 ILE A CD1 1 ATOM 1391 N N . LYS A 1 188 ? -22.726 -17.403 18.833 1.00 11.38 ? 188 LYS A N 1 ATOM 1392 C CA . LYS A 1 188 ? -21.487 -17.771 19.506 1.00 12.14 ? 188 LYS A CA 1 ATOM 1393 C C . LYS A 1 188 ? -21.608 -18.994 20.415 1.00 12.12 ? 188 LYS A C 1 ATOM 1394 O O . LYS A 1 188 ? -21.511 -18.901 21.646 1.00 12.33 ? 188 LYS A O 1 ATOM 1395 C CB . LYS A 1 188 ? -20.850 -16.568 20.211 1.00 11.47 ? 188 LYS A CB 1 ATOM 1396 C CG . LYS A 1 188 ? -20.332 -15.529 19.227 1.00 11.97 ? 188 LYS A CG 1 ATOM 1397 C CD . LYS A 1 188 ? -19.755 -14.270 19.902 1.00 12.83 ? 188 LYS A CD 1 ATOM 1398 C CE . LYS A 1 188 ? -18.535 -14.649 20.744 1.00 13.57 ? 188 LYS A CE 1 ATOM 1399 N NZ . LYS A 1 188 ? -17.844 -13.455 21.207 1.00 14.26 ? 188 LYS A NZ 1 ATOM 1400 N N . GLY A 1 189 ? -21.817 -20.152 19.780 1.00 12.10 ? 189 GLY A N 1 ATOM 1401 C CA . GLY A 1 189 ? -21.820 -21.438 20.476 1.00 11.03 ? 189 GLY A CA 1 ATOM 1402 C C . GLY A 1 189 ? -22.918 -22.383 20.015 1.00 10.95 ? 189 GLY A C 1 ATOM 1403 O O . GLY A 1 189 ? -22.852 -23.593 20.251 1.00 10.01 ? 189 GLY A O 1 ATOM 1404 N N . ALA A 1 190 ? -23.933 -21.833 19.351 1.00 10.67 ? 190 ALA A N 1 ATOM 1405 C CA . ALA A 1 190 ? -25.051 -22.635 18.890 1.00 10.25 ? 190 ALA A CA 1 ATOM 1406 C C . ALA A 1 190 ? -25.488 -22.142 17.525 1.00 10.54 ? 190 ALA A C 1 ATOM 1407 O O . ALA A 1 190 ? -26.653 -22.264 17.156 1.00 10.86 ? 190 ALA A O 1 ATOM 1408 C CB . ALA A 1 190 ? -26.231 -22.580 19.941 1.00 10.87 ? 190 ALA A CB 1 ATOM 1409 N N . GLY A 1 191 ? -24.513 -21.641 16.750 1.00 12.07 ? 191 GLY A N 1 ATOM 1410 C CA . GLY A 1 191 ? -24.763 -20.812 15.578 1.00 11.98 ? 191 GLY A CA 1 ATOM 1411 C C . GLY A 1 191 ? -25.562 -21.457 14.464 1.00 14.33 ? 191 GLY A C 1 ATOM 1412 O O . GLY A 1 191 ? -26.245 -20.760 13.703 1.00 16.71 ? 191 GLY A O 1 ATOM 1413 N N . SER A 1 192 ? -25.517 -22.784 14.379 1.00 12.04 ? 192 SER A N 1 ATOM 1414 C CA . SER A 1 192 ? -26.248 -23.480 13.337 1.00 11.97 ? 192 SER A CA 1 ATOM 1415 C C . SER A 1 192 ? -27.757 -23.307 13.467 1.00 12.13 ? 192 SER A C 1 ATOM 1416 O O . SER A 1 192 ? -28.484 -23.570 12.521 1.00 12.12 ? 192 SER A O 1 ATOM 1417 C CB . SER A 1 192 ? -25.900 -24.975 13.344 1.00 11.49 ? 192 SER A CB 1 ATOM 1418 O OG . SER A 1 192 ? -26.024 -25.528 14.648 1.00 10.53 ? 192 SER A OG 1 ATOM 1419 N N . ASN A 1 193 ? -28.212 -22.925 14.667 1.00 12.60 ? 193 ASN A N 1 ATOM 1420 C CA . ASN A 1 193 ? -29.638 -22.771 14.977 1.00 11.54 ? 193 ASN A CA 1 ATOM 1421 C C . ASN A 1 193 ? -30.355 -21.531 14.426 1.00 11.29 ? 193 ASN A C 1 ATOM 1422 O O . ASN A 1 193 ? -31.589 -21.556 14.264 1.00 10.42 ? 193 ASN A O 1 ATOM 1423 C CB . ASN A 1 193 ? -29.849 -22.867 16.508 1.00 11.83 ? 193 ASN A CB 1 ATOM 1424 C CG . ASN A 1 193 ? -29.750 -24.271 16.994 1.00 11.71 ? 193 ASN A CG 1 ATOM 1425 O OD1 . ASN A 1 193 ? -30.636 -25.081 16.724 1.00 11.61 ? 193 ASN A OD1 1 ATOM 1426 N ND2 . ASN A 1 193 ? -28.634 -24.607 17.666 1.00 11.74 ? 193 ASN A ND2 1 ATOM 1427 N N . PHE A 1 194 ? -29.608 -20.472 14.103 1.00 10.14 ? 194 PHE A N 1 ATOM 1428 C CA . PHE A 1 194 ? -30.239 -19.145 13.982 1.00 9.94 ? 194 PHE A CA 1 ATOM 1429 C C . PHE A 1 194 ? -30.242 -18.465 12.635 1.00 10.24 ? 194 PHE A C 1 ATOM 1430 O O . PHE A 1 194 ? -30.895 -17.438 12.476 1.00 10.30 ? 194 PHE A O 1 ATOM 1431 C CB . PHE A 1 194 ? -29.708 -18.213 15.073 1.00 9.26 ? 194 PHE A CB 1 ATOM 1432 C CG . PHE A 1 194 ? -29.835 -18.823 16.458 1.00 9.73 ? 194 PHE A CG 1 ATOM 1433 C CD1 . PHE A 1 194 ? -31.100 -19.023 17.016 1.00 9.27 ? 194 PHE A CD1 1 ATOM 1434 C CD2 . PHE A 1 194 ? -28.688 -19.269 17.160 1.00 9.51 ? 194 PHE A CD2 1 ATOM 1435 C CE1 . PHE A 1 194 ? -31.247 -19.639 18.282 1.00 9.81 ? 194 PHE A CE1 1 ATOM 1436 C CE2 . PHE A 1 194 ? -28.825 -19.900 18.438 1.00 9.36 ? 194 PHE A CE2 1 ATOM 1437 C CZ . PHE A 1 194 ? -30.106 -20.068 18.988 1.00 9.93 ? 194 PHE A CZ 1 ATOM 1438 N N . GLY A 1 195 ? -29.521 -19.038 11.670 1.00 10.73 ? 195 GLY A N 1 ATOM 1439 C CA . GLY A 1 195 ? -29.520 -18.526 10.291 1.00 9.31 ? 195 GLY A CA 1 ATOM 1440 C C . GLY A 1 195 ? -28.324 -19.082 9.599 1.00 8.81 ? 195 GLY A C 1 ATOM 1441 O O . GLY A 1 195 ? -27.719 -20.040 10.094 1.00 9.41 ? 195 GLY A O 1 ATOM 1442 N N . ILE A 1 196 ? -27.952 -18.502 8.456 1.00 8.71 ? 196 ILE A N 1 ATOM 1443 C CA . ILE A 1 196 ? -26.719 -18.936 7.771 1.00 8.15 ? 196 ILE A CA 1 ATOM 1444 C C . ILE A 1 196 ? -25.750 -17.747 7.871 1.00 8.08 ? 196 ILE A C 1 ATOM 1445 O O . ILE A 1 196 ? -26.037 -16.654 7.331 1.00 8.37 ? 196 ILE A O 1 ATOM 1446 C CB . ILE A 1 196 ? -27.001 -19.366 6.324 1.00 8.04 ? 196 ILE A CB 1 ATOM 1447 C CG1 . ILE A 1 196 ? -27.993 -20.532 6.330 1.00 8.54 ? 196 ILE A CG1 1 ATOM 1448 C CG2 . ILE A 1 196 ? -25.675 -19.715 5.571 1.00 7.85 ? 196 ILE A CG2 1 ATOM 1449 C CD1 . ILE A 1 196 ? -28.493 -20.977 4.976 1.00 9.37 ? 196 ILE A CD1 1 ATOM 1450 N N . VAL A 1 197 ? -24.657 -17.921 8.608 1.00 7.33 ? 197 VAL A N 1 ATOM 1451 C CA . VAL A 1 197 ? -23.669 -16.846 8.717 1.00 7.79 ? 197 VAL A CA 1 ATOM 1452 C C . VAL A 1 197 ? -23.021 -16.665 7.346 1.00 8.49 ? 197 VAL A C 1 ATOM 1453 O O . VAL A 1 197 ? -22.554 -17.647 6.731 1.00 7.95 ? 197 VAL A O 1 ATOM 1454 C CB . VAL A 1 197 ? -22.584 -17.111 9.787 1.00 7.32 ? 197 VAL A CB 1 ATOM 1455 C CG1 . VAL A 1 197 ? -21.517 -15.954 9.788 1.00 7.00 ? 197 VAL A CG1 1 ATOM 1456 C CG2 . VAL A 1 197 ? -23.236 -17.273 11.185 1.00 6.90 ? 197 VAL A CG2 1 ATOM 1457 N N . ALA A 1 198 ? -23.021 -15.415 6.868 1.00 9.20 ? 198 ALA A N 1 ATOM 1458 C CA . ALA A 1 198 ? -22.534 -15.057 5.519 1.00 9.68 ? 198 ALA A CA 1 ATOM 1459 C C . ALA A 1 198 ? -21.171 -14.355 5.578 1.00 10.34 ? 198 ALA A C 1 ATOM 1460 O O . ALA A 1 198 ? -20.420 -14.374 4.597 1.00 10.44 ? 198 ALA A O 1 ATOM 1461 C CB . ALA A 1 198 ? -23.563 -14.134 4.802 1.00 9.22 ? 198 ALA A CB 1 ATOM 1462 N N . VAL A 1 199 ? -20.871 -13.720 6.715 1.00 10.33 ? 199 VAL A N 1 ATOM 1463 C CA . VAL A 1 199 ? -19.535 -13.135 6.951 1.00 9.87 ? 199 VAL A CA 1 ATOM 1464 C C . VAL A 1 199 ? -19.202 -13.308 8.431 1.00 9.88 ? 199 VAL A C 1 ATOM 1465 O O . VAL A 1 199 ? -20.041 -12.996 9.307 1.00 9.30 ? 199 VAL A O 1 ATOM 1466 C CB . VAL A 1 199 ? -19.472 -11.608 6.612 1.00 10.07 ? 199 VAL A CB 1 ATOM 1467 C CG1 . VAL A 1 199 ? -18.059 -11.030 6.824 1.00 9.68 ? 199 VAL A CG1 1 ATOM 1468 C CG2 . VAL A 1 199 ? -19.951 -11.320 5.175 1.00 10.95 ? 199 VAL A CG2 1 ATOM 1469 N N . TRP A 1 200 ? -17.998 -13.803 8.718 1.00 10.30 ? 200 TRP A N 1 ATOM 1470 C CA . TRP A 1 200 ? -17.467 -13.791 10.106 1.00 10.85 ? 200 TRP A CA 1 ATOM 1471 C C . TRP A 1 200 ? -16.562 -12.585 10.308 1.00 11.29 ? 200 TRP A C 1 ATOM 1472 O O . TRP A 1 200 ? -15.679 -12.333 9.487 1.00 11.33 ? 200 TRP A O 1 ATOM 1473 C CB . TRP A 1 200 ? -16.666 -15.061 10.410 1.00 10.02 ? 200 TRP A CB 1 ATOM 1474 C CG . TRP A 1 200 ? -17.500 -16.300 10.358 1.00 10.32 ? 200 TRP A CG 1 ATOM 1475 C CD1 . TRP A 1 200 ? -17.738 -17.106 9.265 1.00 9.94 ? 200 TRP A CD1 1 ATOM 1476 C CD2 . TRP A 1 200 ? -18.251 -16.856 11.445 1.00 10.04 ? 200 TRP A CD2 1 ATOM 1477 N NE1 . TRP A 1 200 ? -18.603 -18.126 9.622 1.00 9.61 ? 200 TRP A NE1 1 ATOM 1478 C CE2 . TRP A 1 200 ? -18.916 -18.003 10.955 1.00 9.68 ? 200 TRP A CE2 1 ATOM 1479 C CE3 . TRP A 1 200 ? -18.413 -16.497 12.793 1.00 9.58 ? 200 TRP A CE3 1 ATOM 1480 C CZ2 . TRP A 1 200 ? -19.762 -18.794 11.773 1.00 9.59 ? 200 TRP A CZ2 1 ATOM 1481 C CZ3 . TRP A 1 200 ? -19.231 -17.279 13.600 1.00 9.07 ? 200 TRP A CZ3 1 ATOM 1482 C CH2 . TRP A 1 200 ? -19.897 -18.417 13.091 1.00 8.98 ? 200 TRP A CH2 1 ATOM 1483 N N . LYS A 1 201 ? -16.745 -11.864 11.410 1.00 11.95 ? 201 LYS A N 1 ATOM 1484 C CA . LYS A 1 201 ? -15.833 -10.741 11.721 1.00 12.69 ? 201 LYS A CA 1 ATOM 1485 C C . LYS A 1 201 ? -14.996 -11.119 12.924 1.00 11.39 ? 201 LYS A C 1 ATOM 1486 O O . LYS A 1 201 ? -15.512 -11.368 14.011 1.00 9.60 ? 201 LYS A O 1 ATOM 1487 C CB . LYS A 1 201 ? -16.606 -9.423 11.876 1.00 13.76 ? 201 LYS A CB 1 ATOM 1488 C CG . LYS A 1 201 ? -17.597 -9.197 10.720 1.00 16.11 ? 201 LYS A CG 1 ATOM 1489 C CD . LYS A 1 201 ? -18.432 -7.968 10.922 1.00 22.57 ? 201 LYS A CD 1 ATOM 1490 C CE . LYS A 1 201 ? -19.538 -7.826 9.862 1.00 26.65 ? 201 LYS A CE 1 ATOM 1491 N NZ . LYS A 1 201 ? -20.626 -6.893 10.405 1.00 28.17 ? 201 LYS A NZ 1 ATOM 1492 N N . LEU A 1 202 ? -13.689 -11.200 12.711 1.00 11.71 ? 202 LEU A N 1 ATOM 1493 C CA . LEU A 1 202 ? -12.828 -11.935 13.657 1.00 13.59 ? 202 LEU A CA 1 ATOM 1494 C C . LEU A 1 202 ? -11.655 -11.114 14.140 1.00 14.39 ? 202 LEU A C 1 ATOM 1495 O O . LEU A 1 202 ? -10.893 -10.603 13.305 1.00 16.42 ? 202 LEU A O 1 ATOM 1496 C CB . LEU A 1 202 ? -12.271 -13.206 12.984 1.00 12.79 ? 202 LEU A CB 1 ATOM 1497 C CG . LEU A 1 202 ? -13.274 -14.214 12.395 1.00 13.41 ? 202 LEU A CG 1 ATOM 1498 C CD1 . LEU A 1 202 ? -12.538 -15.434 11.749 1.00 11.92 ? 202 LEU A CD1 1 ATOM 1499 C CD2 . LEU A 1 202 ? -14.272 -14.690 13.462 1.00 12.07 ? 202 LEU A CD2 1 ATOM 1500 N N . ALA A 1 203 ? -11.486 -11.019 15.461 1.00 12.91 ? 203 ALA A N 1 ATOM 1501 C CA . ALA A 1 203 ? -10.291 -10.401 16.054 1.00 14.16 ? 203 ALA A CA 1 ATOM 1502 C C . ALA A 1 203 ? -9.127 -11.357 15.843 1.00 15.04 ? 203 ALA A C 1 ATOM 1503 O O . ALA A 1 203 ? -9.299 -12.568 16.005 1.00 17.73 ? 203 ALA A O 1 ATOM 1504 C CB . ALA A 1 203 ? -10.484 -10.156 17.586 1.00 11.59 ? 203 ALA A CB 1 ATOM 1505 N N . THR A 1 204 ? -7.951 -10.826 15.510 1.00 15.09 ? 204 THR A N 1 ATOM 1506 C CA . THR A 1 204 ? -6.760 -11.660 15.329 1.00 15.19 ? 204 THR A CA 1 ATOM 1507 C C . THR A 1 204 ? -5.667 -11.188 16.301 1.00 16.28 ? 204 THR A C 1 ATOM 1508 O O . THR A 1 204 ? -5.789 -10.094 16.862 1.00 15.52 ? 204 THR A O 1 ATOM 1509 C CB . THR A 1 204 ? -6.225 -11.598 13.881 1.00 15.11 ? 204 THR A CB 1 ATOM 1510 O OG1 . THR A 1 204 ? -5.714 -10.274 13.604 1.00 14.50 ? 204 THR A OG1 1 ATOM 1511 C CG2 . THR A 1 204 ? -7.324 -11.953 12.894 1.00 13.18 ? 204 THR A CG2 1 ATOM 1512 N N . PHE A 1 205 ? -4.630 -12.012 16.497 1.00 14.89 ? 205 PHE A N 1 ATOM 1513 C CA . PHE A 1 205 ? -3.401 -11.609 17.213 1.00 16.58 ? 205 PHE A CA 1 ATOM 1514 C C . PHE A 1 205 ? -2.162 -11.743 16.296 1.00 18.87 ? 205 PHE A C 1 ATOM 1515 O O . PHE A 1 205 ? -2.214 -12.480 15.296 1.00 17.12 ? 205 PHE A O 1 ATOM 1516 C CB . PHE A 1 205 ? -3.208 -12.380 18.537 1.00 15.80 ? 205 PHE A CB 1 ATOM 1517 C CG . PHE A 1 205 ? -3.297 -13.900 18.415 1.00 16.22 ? 205 PHE A CG 1 ATOM 1518 C CD1 . PHE A 1 205 ? -2.145 -14.680 18.206 1.00 16.54 ? 205 PHE A CD1 1 ATOM 1519 C CD2 . PHE A 1 205 ? -4.524 -14.552 18.602 1.00 15.32 ? 205 PHE A CD2 1 ATOM 1520 C CE1 . PHE A 1 205 ? -2.218 -16.075 18.124 1.00 15.00 ? 205 PHE A CE1 1 ATOM 1521 C CE2 . PHE A 1 205 ? -4.626 -15.933 18.539 1.00 14.03 ? 205 PHE A CE2 1 ATOM 1522 C CZ . PHE A 1 205 ? -3.474 -16.711 18.288 1.00 16.38 ? 205 PHE A CZ 1 ATOM 1523 N N . PRO A 1 206 ? -1.052 -11.026 16.626 1.00 19.24 ? 206 PRO A N 1 ATOM 1524 C CA . PRO A 1 206 ? 0.165 -11.176 15.808 1.00 17.15 ? 206 PRO A CA 1 ATOM 1525 C C . PRO A 1 206 ? 0.603 -12.638 15.847 1.00 17.35 ? 206 PRO A C 1 ATOM 1526 O O . PRO A 1 206 ? 0.584 -13.261 16.920 1.00 17.31 ? 206 PRO A O 1 ATOM 1527 C CB . PRO A 1 206 ? 1.207 -10.269 16.509 1.00 16.72 ? 206 PRO A CB 1 ATOM 1528 C CG . PRO A 1 206 ? 0.402 -9.335 17.402 1.00 16.16 ? 206 PRO A CG 1 ATOM 1529 C CD . PRO A 1 206 ? -0.849 -10.120 17.777 1.00 17.27 ? 206 PRO A CD 1 ATOM 1530 N N . ALA A 1 207 ? 0.956 -13.177 14.684 1.00 16.58 ? 207 ALA A N 1 ATOM 1531 C CA . ALA A 1 207 ? 1.371 -14.565 14.573 1.00 17.94 ? 207 ALA A CA 1 ATOM 1532 C C . ALA A 1 207 ? 2.596 -14.770 15.457 1.00 18.62 ? 207 ALA A C 1 ATOM 1533 O O . ALA A 1 207 ? 3.561 -14.066 15.297 1.00 18.97 ? 207 ALA A O 1 ATOM 1534 C CB . ALA A 1 207 ? 1.676 -14.915 13.105 1.00 15.89 ? 207 ALA A CB 1 ATOM 1535 N N . PRO A 1 208 ? 2.544 -15.721 16.413 1.00 20.93 ? 208 PRO A N 1 ATOM 1536 C CA . PRO A 1 208 ? 3.667 -15.913 17.357 1.00 20.69 ? 208 PRO A CA 1 ATOM 1537 C C . PRO A 1 208 ? 4.927 -16.339 16.637 1.00 21.04 ? 208 PRO A C 1 ATOM 1538 O O . PRO A 1 208 ? 4.853 -17.113 15.665 1.00 18.21 ? 208 PRO A O 1 ATOM 1539 C CB . PRO A 1 208 ? 3.206 -17.077 18.240 1.00 19.82 ? 208 PRO A CB 1 ATOM 1540 C CG . PRO A 1 208 ? 1.761 -17.152 18.082 1.00 20.08 ? 208 PRO A CG 1 ATOM 1541 C CD . PRO A 1 208 ? 1.357 -16.507 16.794 1.00 20.42 ? 208 PRO A CD 1 ATOM 1542 N N . LYS A 1 209 ? 6.073 -15.843 17.105 1.00 22.07 ? 209 LYS A N 1 ATOM 1543 C CA . LYS A 1 209 ? 7.359 -16.184 16.492 1.00 22.86 ? 209 LYS A CA 1 ATOM 1544 C C . LYS A 1 209 ? 8.036 -17.350 17.208 1.00 21.33 ? 209 LYS A C 1 ATOM 1545 O O . LYS A 1 209 ? 8.802 -18.095 16.613 1.00 22.09 ? 209 LYS A O 1 ATOM 1546 C CB . LYS A 1 209 ? 8.277 -14.961 16.517 1.00 28.55 ? 209 LYS A CB 1 ATOM 1547 C CG . LYS A 1 209 ? 7.829 -13.819 15.607 1.00 31.22 ? 209 LYS A CG 1 ATOM 1548 C CD . LYS A 1 209 ? 8.821 -12.661 15.664 1.00 35.18 ? 209 LYS A CD 1 ATOM 1549 C CE . LYS A 1 209 ? 8.367 -11.502 14.788 1.00 44.11 ? 209 LYS A CE 1 ATOM 1550 N NZ . LYS A 1 209 ? 8.197 -11.931 13.366 1.00 50.17 ? 209 LYS A NZ 1 ATOM 1551 N N . VAL A 1 210 ? 7.769 -17.492 18.499 1.00 19.68 ? 210 VAL A N 1 ATOM 1552 C CA . VAL A 1 210 ? 8.471 -18.465 19.330 1.00 19.01 ? 210 VAL A CA 1 ATOM 1553 C C . VAL A 1 210 ? 7.468 -19.439 19.967 1.00 18.92 ? 210 VAL A C 1 ATOM 1554 O O . VAL A 1 210 ? 6.679 -19.064 20.854 1.00 16.91 ? 210 VAL A O 1 ATOM 1555 C CB . VAL A 1 210 ? 9.351 -17.741 20.405 1.00 20.57 ? 210 VAL A CB 1 ATOM 1556 C CG1 . VAL A 1 210 ? 10.077 -18.723 21.304 1.00 21.98 ? 210 VAL A CG1 1 ATOM 1557 C CG2 . VAL A 1 210 ? 10.361 -16.820 19.738 1.00 21.93 ? 210 VAL A CG2 1 ATOM 1558 N N . LEU A 1 211 ? 7.504 -20.691 19.506 1.00 17.13 ? 211 LEU A N 1 ATOM 1559 C CA . LEU A 1 211 ? 6.603 -21.739 20.007 1.00 16.33 ? 211 LEU A CA 1 ATOM 1560 C C . LEU A 1 211 ? 7.388 -23.023 20.154 1.00 17.28 ? 211 LEU A C 1 ATOM 1561 O O . LEU A 1 211 ? 8.333 -23.295 19.377 1.00 16.75 ? 211 LEU A O 1 ATOM 1562 C CB . LEU A 1 211 ? 5.439 -21.984 19.043 1.00 15.74 ? 211 LEU A CB 1 ATOM 1563 C CG . LEU A 1 211 ? 4.453 -20.839 18.801 1.00 16.45 ? 211 LEU A CG 1 ATOM 1564 C CD1 . LEU A 1 211 ? 3.602 -21.080 17.556 1.00 14.96 ? 211 LEU A CD1 1 ATOM 1565 C CD2 . LEU A 1 211 ? 3.579 -20.494 20.052 1.00 15.58 ? 211 LEU A CD2 1 ATOM 1566 N N . THR A 1 212 ? 6.990 -23.821 21.133 1.00 15.87 ? 212 THR A N 1 ATOM 1567 C CA . THR A 1 212 ? 7.617 -25.109 21.338 1.00 18.07 ? 212 THR A CA 1 ATOM 1568 C C . THR A 1 212 ? 6.570 -26.233 21.341 1.00 19.03 ? 212 THR A C 1 ATOM 1569 O O . THR A 1 212 ? 5.630 -26.255 22.163 1.00 18.10 ? 212 THR A O 1 ATOM 1570 C CB . THR A 1 212 ? 8.379 -25.138 22.681 1.00 16.68 ? 212 THR A CB 1 ATOM 1571 O OG1 . THR A 1 212 ? 9.409 -24.156 22.660 1.00 16.01 ? 212 THR A OG1 1 ATOM 1572 C CG2 . THR A 1 212 ? 9.001 -26.493 22.911 1.00 17.62 ? 212 THR A CG2 1 ATOM 1573 N N . ARG A 1 213 ? 6.754 -27.169 20.431 1.00 18.39 ? 213 ARG A N 1 ATOM 1574 C CA . ARG A 1 213 ? 5.979 -28.383 20.452 1.00 18.71 ? 213 ARG A CA 1 ATOM 1575 C C . ARG A 1 213 ? 6.634 -29.350 21.419 1.00 17.99 ? 213 ARG A C 1 ATOM 1576 O O . ARG A 1 213 ? 7.845 -29.526 21.400 1.00 15.30 ? 213 ARG A O 1 ATOM 1577 C CB . ARG A 1 213 ? 5.911 -29.026 19.082 1.00 18.65 ? 213 ARG A CB 1 ATOM 1578 C CG . ARG A 1 213 ? 5.340 -30.436 19.133 1.00 20.19 ? 213 ARG A CG 1 ATOM 1579 C CD . ARG A 1 213 ? 4.906 -30.898 17.752 1.00 22.16 ? 213 ARG A CD 1 ATOM 1580 N NE . ARG A 1 213 ? 4.239 -32.184 17.894 1.00 26.29 ? 213 ARG A NE 1 ATOM 1581 C CZ . ARG A 1 213 ? 3.482 -32.750 16.967 1.00 25.48 ? 213 ARG A CZ 1 ATOM 1582 N NH1 . ARG A 1 213 ? 3.267 -32.147 15.804 1.00 23.27 ? 213 ARG A NH1 1 ATOM 1583 N NH2 . ARG A 1 213 ? 2.927 -33.927 17.218 1.00 27.05 ? 213 ARG A NH2 1 ATOM 1584 N N . PHE A 1 214 ? 5.816 -29.982 22.253 1.00 16.00 ? 214 PHE A N 1 ATOM 1585 C CA . PHE A 1 214 ? 6.343 -30.913 23.222 1.00 15.04 ? 214 PHE A CA 1 ATOM 1586 C C . PHE A 1 214 ? 5.503 -32.169 23.288 1.00 14.87 ? 214 PHE A C 1 ATOM 1587 O O . PHE A 1 214 ? 4.365 -32.206 22.779 1.00 13.84 ? 214 PHE A O 1 ATOM 1588 C CB . PHE A 1 214 ? 6.492 -30.237 24.600 1.00 13.95 ? 214 PHE A CB 1 ATOM 1589 C CG . PHE A 1 214 ? 5.201 -29.810 25.225 1.00 13.69 ? 214 PHE A CG 1 ATOM 1590 C CD1 . PHE A 1 214 ? 4.500 -30.679 26.063 1.00 14.43 ? 214 PHE A CD1 1 ATOM 1591 C CD2 . PHE A 1 214 ? 4.706 -28.537 25.017 1.00 12.86 ? 214 PHE A CD2 1 ATOM 1592 C CE1 . PHE A 1 214 ? 3.324 -30.279 26.705 1.00 14.24 ? 214 PHE A CE1 1 ATOM 1593 C CE2 . PHE A 1 214 ? 3.531 -28.128 25.621 1.00 13.55 ? 214 PHE A CE2 1 ATOM 1594 C CZ . PHE A 1 214 ? 2.825 -28.992 26.465 1.00 14.53 ? 214 PHE A CZ 1 ATOM 1595 N N . GLY A 1 215 ? 6.077 -33.201 23.908 1.00 15.03 ? 215 GLY A N 1 ATOM 1596 C CA . GLY A 1 215 ? 5.456 -34.503 23.950 1.00 16.77 ? 215 GLY A CA 1 ATOM 1597 C C . GLY A 1 215 ? 6.075 -35.340 25.059 1.00 19.84 ? 215 GLY A C 1 ATOM 1598 O O . GLY A 1 215 ? 7.271 -35.189 25.353 1.00 17.37 ? 215 GLY A O 1 ATOM 1599 N N . VAL A 1 216 ? 5.250 -36.193 25.675 1.00 17.13 ? 216 VAL A N 1 ATOM 1600 C CA . VAL A 1 216 ? 5.694 -37.118 26.720 1.00 19.22 ? 216 VAL A CA 1 ATOM 1601 C C . VAL A 1 216 ? 5.062 -38.490 26.487 1.00 18.75 ? 216 VAL A C 1 ATOM 1602 O O . VAL A 1 216 ? 3.839 -38.620 26.517 1.00 19.50 ? 216 VAL A O 1 ATOM 1603 C CB . VAL A 1 216 ? 5.285 -36.634 28.151 1.00 18.17 ? 216 VAL A CB 1 ATOM 1604 C CG1 . VAL A 1 216 ? 5.764 -37.633 29.202 1.00 16.80 ? 216 VAL A CG1 1 ATOM 1605 C CG2 . VAL A 1 216 ? 5.832 -35.218 28.434 1.00 15.74 ? 216 VAL A CG2 1 ATOM 1606 N N . THR A 1 217 ? 5.891 -39.503 26.243 1.00 16.95 ? 217 THR A N 1 ATOM 1607 C CA . THR A 1 217 ? 5.422 -40.881 26.204 1.00 16.69 ? 217 THR A CA 1 ATOM 1608 C C . THR A 1 217 ? 5.191 -41.330 27.647 1.00 16.08 ? 217 THR A C 1 ATOM 1609 O O . THR A 1 217 ? 6.136 -41.404 28.429 1.00 16.99 ? 217 THR A O 1 ATOM 1610 C CB . THR A 1 217 ? 6.480 -41.772 25.532 1.00 18.96 ? 217 THR A CB 1 ATOM 1611 O OG1 . THR A 1 217 ? 6.942 -41.134 24.337 1.00 21.56 ? 217 THR A OG1 1 ATOM 1612 C CG2 . THR A 1 217 ? 5.919 -43.145 25.183 1.00 19.98 ? 217 THR A CG2 1 ATOM 1613 N N . LEU A 1 218 ? 3.943 -41.605 28.014 1.00 14.59 ? 218 LEU A N 1 ATOM 1614 C CA . LEU A 1 218 ? 3.592 -41.752 29.419 1.00 14.99 ? 218 LEU A CA 1 ATOM 1615 C C . LEU A 1 218 ? 4.035 -43.082 30.001 1.00 17.21 ? 218 LEU A C 1 ATOM 1616 O O . LEU A 1 218 ? 4.379 -43.154 31.176 1.00 16.51 ? 218 LEU A O 1 ATOM 1617 C CB . LEU A 1 218 ? 2.089 -41.548 29.650 1.00 13.31 ? 218 LEU A CB 1 ATOM 1618 C CG . LEU A 1 218 ? 1.651 -40.105 29.368 1.00 13.72 ? 218 LEU A CG 1 ATOM 1619 C CD1 . LEU A 1 218 ? 0.130 -40.008 29.184 1.00 12.65 ? 218 LEU A CD1 1 ATOM 1620 C CD2 . LEU A 1 218 ? 2.156 -39.197 30.511 1.00 13.22 ? 218 LEU A CD2 1 ATOM 1621 N N . ASN A 1 219 ? 4.020 -44.113 29.160 1.00 17.16 ? 219 ASN A N 1 ATOM 1622 C CA . ASN A 1 219 ? 4.218 -45.502 29.570 1.00 20.01 ? 219 ASN A CA 1 ATOM 1623 C C . ASN A 1 219 ? 3.354 -46.000 30.740 1.00 22.44 ? 219 ASN A C 1 ATOM 1624 O O . ASN A 1 219 ? 3.875 -46.623 31.657 1.00 24.07 ? 219 ASN A O 1 ATOM 1625 C CB . ASN A 1 219 ? 5.705 -45.795 29.793 1.00 19.08 ? 219 ASN A CB 1 ATOM 1626 C CG . ASN A 1 219 ? 6.508 -45.613 28.531 1.00 18.54 ? 219 ASN A CG 1 ATOM 1627 O OD1 . ASN A 1 219 ? 6.161 -46.165 27.491 1.00 21.28 ? 219 ASN A OD1 1 ATOM 1628 N ND2 . ASN A 1 219 ? 7.560 -44.819 28.597 1.00 18.40 ? 219 ASN A ND2 1 ATOM 1629 N N . TRP A 1 220 ? 2.041 -45.725 30.693 1.00 21.47 ? 220 TRP A N 1 ATOM 1630 C CA . TRP A 1 220 ? 1.095 -46.294 31.654 1.00 22.18 ? 220 TRP A CA 1 ATOM 1631 C C . TRP A 1 220 ? 0.739 -47.728 31.213 1.00 26.78 ? 220 TRP A C 1 ATOM 1632 O O . TRP A 1 220 ? -0.097 -47.921 30.319 1.00 30.40 ? 220 TRP A O 1 ATOM 1633 C CB . TRP A 1 220 ? -0.171 -45.422 31.776 1.00 20.48 ? 220 TRP A CB 1 ATOM 1634 C CG . TRP A 1 220 ? 0.079 -44.004 32.206 1.00 19.07 ? 220 TRP A CG 1 ATOM 1635 C CD1 . TRP A 1 220 ? 1.186 -43.523 32.846 1.00 19.32 ? 220 TRP A CD1 1 ATOM 1636 C CD2 . TRP A 1 220 ? -0.789 -42.881 32.012 1.00 20.08 ? 220 TRP A CD2 1 ATOM 1637 N NE1 . TRP A 1 220 ? 1.065 -42.174 33.074 1.00 19.85 ? 220 TRP A NE1 1 ATOM 1638 C CE2 . TRP A 1 220 ? -0.146 -41.752 32.583 1.00 20.27 ? 220 TRP A CE2 1 ATOM 1639 C CE3 . TRP A 1 220 ? -2.061 -42.720 31.434 1.00 18.87 ? 220 TRP A CE3 1 ATOM 1640 C CZ2 . TRP A 1 220 ? -0.731 -40.475 32.586 1.00 19.25 ? 220 TRP A CZ2 1 ATOM 1641 C CZ3 . TRP A 1 220 ? -2.639 -41.460 31.436 1.00 19.59 ? 220 TRP A CZ3 1 ATOM 1642 C CH2 . TRP A 1 220 ? -1.968 -40.345 32.001 1.00 20.99 ? 220 TRP A CH2 1 ATOM 1643 N N . LYS A 1 221 ? 1.396 -48.714 31.820 1.00 29.02 ? 221 LYS A N 1 ATOM 1644 C CA . LYS A 1 221 ? 1.257 -50.119 31.425 1.00 28.89 ? 221 LYS A CA 1 ATOM 1645 C C . LYS A 1 221 ? 0.132 -50.821 32.156 1.00 29.37 ? 221 LYS A C 1 ATOM 1646 O O . LYS A 1 221 ? -0.212 -51.943 31.806 1.00 31.17 ? 221 LYS A O 1 ATOM 1647 C CB . LYS A 1 221 ? 2.569 -50.897 31.671 1.00 34.55 ? 221 LYS A CB 1 ATOM 1648 C CG . LYS A 1 221 ? 3.833 -50.317 30.997 1.00 34.63 ? 221 LYS A CG 1 ATOM 1649 C CD . LYS A 1 221 ? 3.581 -50.030 29.520 1.00 36.25 ? 221 LYS A CD 1 ATOM 1650 C CE . LYS A 1 221 ? 4.869 -49.753 28.775 1.00 43.31 ? 221 LYS A CE 1 ATOM 1651 N NZ . LYS A 1 221 ? 4.545 -49.143 27.456 1.00 40.41 ? 221 LYS A NZ 1 ATOM 1652 N N . ASN A 1 222 ? -0.447 -50.180 33.171 1.00 27.22 ? 222 ASN A N 1 ATOM 1653 C CA . ASN A 1 222 ? -1.554 -50.798 33.896 1.00 26.37 ? 222 ASN A CA 1 ATOM 1654 C C . ASN A 1 222 ? -2.519 -49.798 34.512 1.00 25.04 ? 222 ASN A C 1 ATOM 1655 O O . ASN A 1 222 ? -2.249 -48.592 34.531 1.00 23.83 ? 222 ASN A O 1 ATOM 1656 C CB . ASN A 1 222 ? -1.035 -51.770 34.964 1.00 31.24 ? 222 ASN A CB 1 ATOM 1657 C CG . ASN A 1 222 ? -0.135 -51.093 35.994 1.00 34.90 ? 222 ASN A CG 1 ATOM 1658 O OD1 . ASN A 1 222 ? -0.433 -49.994 36.487 1.00 36.03 ? 222 ASN A OD1 1 ATOM 1659 N ND2 . ASN A 1 222 ? 0.971 -51.758 36.334 1.00 35.12 ? 222 ASN A ND2 1 ATOM 1660 N N . LYS A 1 223 ? -3.639 -50.313 35.007 1.00 21.58 ? 223 LYS A N 1 ATOM 1661 C CA . LYS A 1 223 ? -4.690 -49.495 35.589 1.00 21.34 ? 223 LYS A CA 1 ATOM 1662 C C . LYS A 1 223 ? -4.162 -48.527 36.636 1.00 20.99 ? 223 LYS A C 1 ATOM 1663 O O . LYS A 1 223 ? -4.527 -47.336 36.624 1.00 18.86 ? 223 LYS A O 1 ATOM 1664 C CB . LYS A 1 223 ? -5.803 -50.373 36.188 1.00 18.99 ? 223 LYS A CB 1 ATOM 1665 C CG . LYS A 1 223 ? -6.718 -51.024 35.138 1.00 17.54 ? 223 LYS A CG 1 ATOM 1666 C CD . LYS A 1 223 ? -7.585 -52.070 35.827 1.00 18.56 ? 223 LYS A CD 1 ATOM 1667 C CE . LYS A 1 223 ? -8.321 -52.967 34.878 1.00 17.64 ? 223 LYS A CE 1 ATOM 1668 N NZ . LYS A 1 223 ? -9.610 -53.374 35.481 1.00 19.21 ? 223 LYS A NZ 1 ATOM 1669 N N . THR A 1 224 ? -3.306 -49.032 37.533 1.00 19.81 ? 224 THR A N 1 ATOM 1670 C CA . THR A 1 224 ? -2.823 -48.220 38.655 1.00 21.37 ? 224 THR A CA 1 ATOM 1671 C C . THR A 1 224 ? -2.042 -47.000 38.210 1.00 19.24 ? 224 THR A C 1 ATOM 1672 O O . THR A 1 224 ? -2.355 -45.899 38.673 1.00 17.90 ? 224 THR A O 1 ATOM 1673 C CB . THR A 1 224 ? -2.093 -49.057 39.749 1.00 25.77 ? 224 THR A CB 1 ATOM 1674 O OG1 . THR A 1 224 ? -3.057 -49.914 40.359 1.00 30.09 ? 224 THR A OG1 1 ATOM 1675 C CG2 . THR A 1 224 ? -1.517 -48.161 40.851 1.00 25.84 ? 224 THR A CG2 1 ATOM 1676 N N . SER A 1 225 ? -1.083 -47.193 37.293 1.00 17.81 ? 225 SER A N 1 ATOM 1677 C CA A SER A 1 225 ? -0.306 -46.095 36.720 0.50 18.27 ? 225 SER A CA 1 ATOM 1678 C CA B SER A 1 225 ? -0.309 -46.096 36.710 0.50 18.49 ? 225 SER A CA 1 ATOM 1679 C C . SER A 1 225 ? -1.201 -45.084 35.987 1.00 19.76 ? 225 SER A C 1 ATOM 1680 O O . SER A 1 225 ? -1.029 -43.852 36.137 1.00 18.48 ? 225 SER A O 1 ATOM 1681 C CB A SER A 1 225 ? 0.769 -46.639 35.767 0.50 18.44 ? 225 SER A CB 1 ATOM 1682 C CB B SER A 1 225 ? 0.724 -46.644 35.723 0.50 18.95 ? 225 SER A CB 1 ATOM 1683 O OG A SER A 1 225 ? 1.613 -47.585 36.414 0.50 17.69 ? 225 SER A OG 1 ATOM 1684 O OG B SER A 1 225 ? 0.083 -47.327 34.659 0.50 18.96 ? 225 SER A OG 1 ATOM 1685 N N . ALA A 1 226 ? -2.160 -45.593 35.202 1.00 18.32 ? 226 ALA A N 1 ATOM 1686 C CA . ALA A 1 226 ? -3.074 -44.722 34.457 1.00 20.62 ? 226 ALA A CA 1 ATOM 1687 C C . ALA A 1 226 ? -3.957 -43.880 35.389 1.00 21.97 ? 226 ALA A C 1 ATOM 1688 O O . ALA A 1 226 ? -4.207 -42.699 35.123 1.00 23.51 ? 226 ALA A O 1 ATOM 1689 C CB . ALA A 1 226 ? -3.943 -45.547 33.508 1.00 20.68 ? 226 ALA A CB 1 ATOM 1690 N N . LEU A 1 227 ? -4.419 -44.499 36.473 1.00 20.39 ? 227 LEU A N 1 ATOM 1691 C CA . LEU A 1 227 ? -5.253 -43.848 37.481 1.00 22.46 ? 227 LEU A CA 1 ATOM 1692 C C . LEU A 1 227 ? -4.474 -42.713 38.165 1.00 23.42 ? 227 LEU A C 1 ATOM 1693 O O . LEU A 1 227 ? -4.981 -41.586 38.297 1.00 21.61 ? 227 LEU A O 1 ATOM 1694 C CB . LEU A 1 227 ? -5.644 -44.904 38.506 1.00 26.52 ? 227 LEU A CB 1 ATOM 1695 C CG . LEU A 1 227 ? -7.004 -45.084 39.180 1.00 34.19 ? 227 LEU A CG 1 ATOM 1696 C CD1 . LEU A 1 227 ? -8.173 -44.812 38.267 1.00 31.99 ? 227 LEU A CD1 1 ATOM 1697 C CD2 . LEU A 1 227 ? -7.070 -46.517 39.765 1.00 34.95 ? 227 LEU A CD2 1 ATOM 1698 N N . LYS A 1 228 ? -3.235 -43.007 38.576 1.00 21.71 ? 228 LYS A N 1 ATOM 1699 C CA . LYS A 1 228 ? -2.365 -42.003 39.193 1.00 21.52 ? 228 LYS A CA 1 ATOM 1700 C C . LYS A 1 228 ? -1.948 -40.908 38.209 1.00 19.41 ? 228 LYS A C 1 ATOM 1701 O O . LYS A 1 228 ? -1.761 -39.772 38.610 1.00 19.30 ? 228 LYS A O 1 ATOM 1702 C CB . LYS A 1 228 ? -1.098 -42.640 39.781 1.00 24.07 ? 228 LYS A CB 1 ATOM 1703 C CG . LYS A 1 228 ? -1.289 -43.513 41.026 1.00 28.10 ? 228 LYS A CG 1 ATOM 1704 C CD . LYS A 1 228 ? 0.098 -43.964 41.559 1.00 33.76 ? 228 LYS A CD 1 ATOM 1705 C CE . LYS A 1 228 ? 0.129 -45.403 42.136 1.00 39.36 ? 228 LYS A CE 1 ATOM 1706 N NZ . LYS A 1 228 ? -0.815 -45.640 43.282 1.00 34.89 ? 228 LYS A NZ 1 ATOM 1707 N N . GLY A 1 229 ? -1.767 -41.258 36.934 1.00 16.84 ? 229 GLY A N 1 ATOM 1708 C CA . GLY A 1 229 ? -1.299 -40.292 35.951 1.00 16.52 ? 229 GLY A CA 1 ATOM 1709 C C . GLY A 1 229 ? -2.400 -39.304 35.590 1.00 16.32 ? 229 GLY A C 1 ATOM 1710 O O . GLY A 1 229 ? -2.179 -38.104 35.572 1.00 17.00 ? 229 GLY A O 1 ATOM 1711 N N . ILE A 1 230 ? -3.596 -39.815 35.326 1.00 16.23 ? 230 ILE A N 1 ATOM 1712 C CA . ILE A 1 230 ? -4.726 -38.957 35.040 1.00 16.10 ? 230 ILE A CA 1 ATOM 1713 C C . ILE A 1 230 ? -5.058 -38.049 36.230 1.00 17.91 ? 230 ILE A C 1 ATOM 1714 O O . ILE A 1 230 ? -5.396 -36.886 36.020 1.00 18.28 ? 230 ILE A O 1 ATOM 1715 C CB . ILE A 1 230 ? -5.982 -39.755 34.585 1.00 14.83 ? 230 ILE A CB 1 ATOM 1716 C CG1 . ILE A 1 230 ? -5.694 -40.467 33.259 1.00 13.74 ? 230 ILE A CG1 1 ATOM 1717 C CG2 . ILE A 1 230 ? -7.232 -38.794 34.483 1.00 13.80 ? 230 ILE A CG2 1 ATOM 1718 C CD1 . ILE A 1 230 ? -6.609 -41.662 32.983 1.00 13.89 ? 230 ILE A CD1 1 ATOM 1719 N N . GLU A 1 231 ? -4.939 -38.559 37.465 1.00 18.05 ? 231 GLU A N 1 ATOM 1720 C CA . GLU A 1 231 ? -5.173 -37.715 38.660 1.00 16.49 ? 231 GLU A CA 1 ATOM 1721 C C . GLU A 1 231 ? -4.138 -36.585 38.645 1.00 15.70 ? 231 GLU A C 1 ATOM 1722 O O . GLU A 1 231 ? -4.468 -35.415 38.849 1.00 17.60 ? 231 GLU A O 1 ATOM 1723 C CB . GLU A 1 231 ? -5.068 -38.539 39.981 1.00 17.53 ? 231 GLU A CB 1 ATOM 1724 C CG . GLU A 1 231 ? -4.678 -37.675 41.257 1.00 17.10 ? 231 GLU A CG 1 ATOM 1725 C CD . GLU A 1 231 ? -5.925 -37.041 41.909 1.00 18.14 ? 231 GLU A CD 1 ATOM 1726 O OE1 . GLU A 1 231 ? -7.048 -37.507 41.604 1.00 19.39 ? 231 GLU A OE1 1 ATOM 1727 O OE2 . GLU A 1 231 ? -5.801 -36.089 42.712 1.00 16.44 ? 231 GLU A OE2 1 ATOM 1728 N N . ALA A 1 232 ? -2.879 -36.935 38.395 1.00 14.42 ? 232 ALA A N 1 ATOM 1729 C CA . ALA A 1 232 ? -1.795 -35.945 38.434 1.00 13.47 ? 232 ALA A CA 1 ATOM 1730 C C . ALA A 1 232 ? -1.981 -34.867 37.361 1.00 12.93 ? 232 ALA A C 1 ATOM 1731 O O . ALA A 1 232 ? -1.713 -33.689 37.584 1.00 12.75 ? 232 ALA A O 1 ATOM 1732 C CB . ALA A 1 232 ? -0.409 -36.647 38.278 1.00 12.62 ? 232 ALA A CB 1 ATOM 1733 N N . VAL A 1 233 ? -2.458 -35.268 36.191 1.00 12.41 ? 233 VAL A N 1 ATOM 1734 C CA . VAL A 1 233 ? -2.655 -34.294 35.110 1.00 11.12 ? 233 VAL A CA 1 ATOM 1735 C C . VAL A 1 233 ? -3.815 -33.368 35.475 1.00 11.94 ? 233 VAL A C 1 ATOM 1736 O O . VAL A 1 233 ? -3.729 -32.167 35.239 1.00 11.70 ? 233 VAL A O 1 ATOM 1737 C CB . VAL A 1 233 ? -2.865 -34.971 33.744 1.00 10.85 ? 233 VAL A CB 1 ATOM 1738 C CG1 . VAL A 1 233 ? -3.145 -33.908 32.635 1.00 9.76 ? 233 VAL A CG1 1 ATOM 1739 C CG2 . VAL A 1 233 ? -1.634 -35.857 33.380 1.00 9.97 ? 233 VAL A CG2 1 ATOM 1740 N N . GLU A 1 234 ? -4.868 -33.894 36.111 1.00 12.44 ? 234 GLU A N 1 ATOM 1741 C CA . GLU A 1 234 ? -5.981 -33.015 36.458 1.00 12.99 ? 234 GLU A CA 1 ATOM 1742 C C . GLU A 1 234 ? -5.542 -31.965 37.469 1.00 13.10 ? 234 GLU A C 1 ATOM 1743 O O . GLU A 1 234 ? -5.958 -30.786 37.360 1.00 13.17 ? 234 GLU A O 1 ATOM 1744 C CB . GLU A 1 234 ? -7.229 -33.746 36.951 1.00 14.10 ? 234 GLU A CB 1 ATOM 1745 C CG . GLU A 1 234 ? -8.317 -32.719 37.370 1.00 13.44 ? 234 GLU A CG 1 ATOM 1746 C CD . GLU A 1 234 ? -9.696 -33.318 37.595 1.00 15.59 ? 234 GLU A CD 1 ATOM 1747 O OE1 . GLU A 1 234 ? -10.069 -34.255 36.826 1.00 16.55 ? 234 GLU A OE1 1 ATOM 1748 O OE2 . GLU A 1 234 ? -10.425 -32.845 38.532 1.00 14.20 ? 234 GLU A OE2 1 ATOM 1749 N N . ASP A 1 235 ? -4.689 -32.375 38.421 1.00 12.07 ? 235 ASP A N 1 ATOM 1750 C CA . ASP A 1 235 ? -4.174 -31.453 39.443 1.00 13.02 ? 235 ASP A CA 1 ATOM 1751 C C . ASP A 1 235 ? -3.425 -30.301 38.796 1.00 13.04 ? 235 ASP A C 1 ATOM 1752 O O . ASP A 1 235 ? -3.645 -29.122 39.126 1.00 13.73 ? 235 ASP A O 1 ATOM 1753 C CB . ASP A 1 235 ? -3.203 -32.158 40.433 1.00 12.19 ? 235 ASP A CB 1 ATOM 1754 C CG . ASP A 1 235 ? -3.903 -33.147 41.352 1.00 11.42 ? 235 ASP A CG 1 ATOM 1755 O OD1 . ASP A 1 235 ? -5.125 -33.025 41.560 1.00 11.17 ? 235 ASP A OD1 1 ATOM 1756 O OD2 . ASP A 1 235 ? -3.217 -34.049 41.886 1.00 11.74 ? 235 ASP A OD2 1 ATOM 1757 N N . TYR A 1 236 ? -2.494 -30.663 37.918 1.00 12.93 ? 236 TYR A N 1 ATOM 1758 C CA . TYR A 1 236 ? -1.659 -29.686 37.242 1.00 13.70 ? 236 TYR A CA 1 ATOM 1759 C C . TYR A 1 236 ? -2.563 -28.766 36.405 1.00 14.15 ? 236 TYR A C 1 ATOM 1760 O O . TYR A 1 236 ? -2.416 -27.535 36.422 1.00 14.62 ? 236 TYR A O 1 ATOM 1761 C CB . TYR A 1 236 ? -0.613 -30.409 36.378 1.00 13.23 ? 236 TYR A CB 1 ATOM 1762 C CG . TYR A 1 236 ? 0.259 -29.478 35.566 1.00 14.54 ? 236 TYR A CG 1 ATOM 1763 C CD1 . TYR A 1 236 ? 1.340 -28.786 36.156 1.00 14.22 ? 236 TYR A CD1 1 ATOM 1764 C CD2 . TYR A 1 236 ? 0.039 -29.312 34.197 1.00 13.08 ? 236 TYR A CD2 1 ATOM 1765 C CE1 . TYR A 1 236 ? 2.159 -27.930 35.388 1.00 13.35 ? 236 TYR A CE1 1 ATOM 1766 C CE2 . TYR A 1 236 ? 0.861 -28.488 33.424 1.00 13.31 ? 236 TYR A CE2 1 ATOM 1767 C CZ . TYR A 1 236 ? 1.914 -27.797 34.018 1.00 13.84 ? 236 TYR A CZ 1 ATOM 1768 O OH . TYR A 1 236 ? 2.686 -26.952 33.242 1.00 12.99 ? 236 TYR A OH 1 ATOM 1769 N N . ALA A 1 237 ? -3.523 -29.363 35.703 1.00 14.29 ? 237 ALA A N 1 ATOM 1770 C CA . ALA A 1 237 ? -4.457 -28.586 34.882 1.00 14.86 ? 237 ALA A CA 1 ATOM 1771 C C . ALA A 1 237 ? -5.238 -27.594 35.765 1.00 15.52 ? 237 ALA A C 1 ATOM 1772 O O . ALA A 1 237 ? -5.295 -26.386 35.476 1.00 14.92 ? 237 ALA A O 1 ATOM 1773 C CB . ALA A 1 237 ? -5.415 -29.526 34.127 1.00 13.68 ? 237 ALA A CB 1 ATOM 1774 N N . ARG A 1 238 ? -5.810 -28.093 36.860 1.00 14.90 ? 238 ARG A N 1 ATOM 1775 C CA . ARG A 1 238 ? -6.731 -27.265 37.626 1.00 14.80 ? 238 ARG A CA 1 ATOM 1776 C C . ARG A 1 238 ? -6.010 -26.109 38.305 1.00 14.29 ? 238 ARG A C 1 ATOM 1777 O O . ARG A 1 238 ? -6.459 -24.969 38.234 1.00 14.87 ? 238 ARG A O 1 ATOM 1778 C CB . ARG A 1 238 ? -7.502 -28.099 38.649 1.00 15.65 ? 238 ARG A CB 1 ATOM 1779 C CG . ARG A 1 238 ? -8.523 -27.299 39.437 1.00 17.55 ? 238 ARG A CG 1 ATOM 1780 C CD . ARG A 1 238 ? -9.335 -28.197 40.351 1.00 20.05 ? 238 ARG A CD 1 ATOM 1781 N NE . ARG A 1 238 ? -9.986 -29.327 39.677 1.00 20.83 ? 238 ARG A NE 1 ATOM 1782 C CZ . ARG A 1 238 ? -11.045 -29.215 38.860 1.00 20.43 ? 238 ARG A CZ 1 ATOM 1783 N NH1 . ARG A 1 238 ? -11.558 -28.027 38.572 1.00 19.35 ? 238 ARG A NH1 1 ATOM 1784 N NH2 . ARG A 1 238 ? -11.595 -30.293 38.325 1.00 18.07 ? 238 ARG A NH2 1 ATOM 1785 N N . TRP A 1 239 ? -4.856 -26.394 38.893 1.00 14.50 ? 239 TRP A N 1 ATOM 1786 C CA . TRP A 1 239 ? -4.226 -25.443 39.805 1.00 15.85 ? 239 TRP A CA 1 ATOM 1787 C C . TRP A 1 239 ? -2.907 -24.790 39.413 1.00 17.09 ? 239 TRP A C 1 ATOM 1788 O O . TRP A 1 239 ? -2.530 -23.802 40.035 1.00 18.43 ? 239 TRP A O 1 ATOM 1789 C CB . TRP A 1 239 ? -4.048 -26.124 41.162 1.00 15.19 ? 239 TRP A CB 1 ATOM 1790 C CG . TRP A 1 239 ? -5.358 -26.395 41.876 1.00 15.90 ? 239 TRP A CG 1 ATOM 1791 C CD1 . TRP A 1 239 ? -6.298 -25.466 42.273 1.00 15.75 ? 239 TRP A CD1 1 ATOM 1792 C CD2 . TRP A 1 239 ? -5.843 -27.674 42.312 1.00 15.98 ? 239 TRP A CD2 1 ATOM 1793 N NE1 . TRP A 1 239 ? -7.344 -26.104 42.939 1.00 15.37 ? 239 TRP A NE1 1 ATOM 1794 C CE2 . TRP A 1 239 ? -7.082 -27.456 42.974 1.00 15.69 ? 239 TRP A CE2 1 ATOM 1795 C CE3 . TRP A 1 239 ? -5.343 -28.990 42.215 1.00 17.08 ? 239 TRP A CE3 1 ATOM 1796 C CZ2 . TRP A 1 239 ? -7.840 -28.512 43.522 1.00 15.47 ? 239 TRP A CZ2 1 ATOM 1797 C CZ3 . TRP A 1 239 ? -6.093 -30.043 42.771 1.00 15.38 ? 239 TRP A CZ3 1 ATOM 1798 C CH2 . TRP A 1 239 ? -7.333 -29.790 43.417 1.00 16.80 ? 239 TRP A CH2 1 ATOM 1799 N N . VAL A 1 240 ? -2.197 -25.343 38.420 1.00 17.59 ? 240 VAL A N 1 ATOM 1800 C CA . VAL A 1 240 ? -0.801 -24.975 38.164 1.00 16.19 ? 240 VAL A CA 1 ATOM 1801 C C . VAL A 1 240 ? -0.515 -24.519 36.735 1.00 16.71 ? 240 VAL A C 1 ATOM 1802 O O . VAL A 1 240 ? 0.181 -23.513 36.534 1.00 14.36 ? 240 VAL A O 1 ATOM 1803 C CB . VAL A 1 240 ? 0.167 -26.160 38.494 1.00 18.05 ? 240 VAL A CB 1 ATOM 1804 C CG1 . VAL A 1 240 ? 1.666 -25.727 38.360 1.00 17.89 ? 240 VAL A CG1 1 ATOM 1805 C CG2 . VAL A 1 240 ? -0.104 -26.717 39.908 1.00 17.19 ? 240 VAL A CG2 1 ATOM 1806 N N . ALA A 1 241 ? -0.994 -25.287 35.746 1.00 15.76 ? 241 ALA A N 1 ATOM 1807 C CA . ALA A 1 241 ? -0.669 -25.043 34.335 1.00 15.03 ? 241 ALA A CA 1 ATOM 1808 C C . ALA A 1 241 ? -0.739 -23.547 33.936 1.00 16.03 ? 241 ALA A C 1 ATOM 1809 O O . ALA A 1 241 ? -1.817 -22.924 33.966 1.00 16.08 ? 241 ALA A O 1 ATOM 1810 C CB . ALA A 1 241 ? -1.564 -25.899 33.408 1.00 14.68 ? 241 ALA A CB 1 ATOM 1811 N N . PRO A 1 242 ? 0.420 -22.951 33.587 1.00 16.03 ? 242 PRO A N 1 ATOM 1812 C CA . PRO A 1 242 ? 0.400 -21.566 33.145 1.00 16.56 ? 242 PRO A CA 1 ATOM 1813 C C . PRO A 1 242 ? -0.425 -21.431 31.868 1.00 15.55 ? 242 PRO A C 1 ATOM 1814 O O . PRO A 1 242 ? -0.650 -22.409 31.168 1.00 13.95 ? 242 PRO A O 1 ATOM 1815 C CB . PRO A 1 242 ? 1.880 -21.261 32.876 1.00 19.00 ? 242 PRO A CB 1 ATOM 1816 C CG . PRO A 1 242 ? 2.604 -22.216 33.793 1.00 20.15 ? 242 PRO A CG 1 ATOM 1817 C CD . PRO A 1 242 ? 1.789 -23.469 33.701 1.00 16.95 ? 242 PRO A CD 1 ATOM 1818 N N . ARG A 1 243 ? -0.888 -20.220 31.618 1.00 16.21 ? 243 ARG A N 1 ATOM 1819 C CA . ARG A 1 243 ? -1.582 -19.841 30.391 1.00 16.95 ? 243 ARG A CA 1 ATOM 1820 C C . ARG A 1 243 ? -0.878 -20.341 29.130 1.00 15.56 ? 243 ARG A C 1 ATOM 1821 O O . ARG A 1 243 ? -1.529 -20.878 28.238 1.00 14.40 ? 243 ARG A O 1 ATOM 1822 C CB . ARG A 1 243 ? -1.669 -18.312 30.344 1.00 18.98 ? 243 ARG A CB 1 ATOM 1823 C CG . ARG A 1 243 ? -2.631 -17.784 29.322 1.00 21.84 ? 243 ARG A CG 1 ATOM 1824 C CD . ARG A 1 243 ? -2.547 -16.248 29.229 1.00 22.83 ? 243 ARG A CD 1 ATOM 1825 N NE . ARG A 1 243 ? -3.363 -15.791 28.115 1.00 25.71 ? 243 ARG A NE 1 ATOM 1826 C CZ . ARG A 1 243 ? -3.202 -14.644 27.464 1.00 32.73 ? 243 ARG A CZ 1 ATOM 1827 N NH1 . ARG A 1 243 ? -2.223 -13.799 27.799 1.00 33.55 ? 243 ARG A NH1 1 ATOM 1828 N NH2 . ARG A 1 243 ? -4.020 -14.349 26.458 1.00 31.55 ? 243 ARG A NH2 1 ATOM 1829 N N . GLU A 1 244 ? 0.445 -20.180 29.075 1.00 15.04 ? 244 GLU A N 1 ATOM 1830 C CA . GLU A 1 244 ? 1.241 -20.514 27.883 1.00 15.55 ? 244 GLU A CA 1 ATOM 1831 C C . GLU A 1 244 ? 1.250 -22.024 27.494 1.00 15.36 ? 244 GLU A C 1 ATOM 1832 O O . GLU A 1 244 ? 1.731 -22.387 26.409 1.00 14.20 ? 244 GLU A O 1 ATOM 1833 C CB . GLU A 1 244 ? 2.705 -20.066 28.072 1.00 16.38 ? 244 GLU A CB 1 ATOM 1834 C CG . GLU A 1 244 ? 2.960 -18.556 28.103 1.00 17.63 ? 244 GLU A CG 1 ATOM 1835 C CD . GLU A 1 244 ? 2.466 -17.903 29.414 1.00 19.49 ? 244 GLU A CD 1 ATOM 1836 O OE1 . GLU A 1 244 ? 2.399 -18.598 30.462 1.00 16.90 ? 244 GLU A OE1 1 ATOM 1837 O OE2 . GLU A 1 244 ? 2.154 -16.695 29.373 1.00 19.52 ? 244 GLU A OE2 1 ATOM 1838 N N . VAL A 1 245 ? 0.785 -22.900 28.384 1.00 14.01 ? 245 VAL A N 1 ATOM 1839 C CA A VAL A 1 245 ? 0.851 -24.330 28.087 0.50 14.25 ? 245 VAL A CA 1 ATOM 1840 C CA B VAL A 1 245 ? 0.847 -24.350 28.148 0.50 13.95 ? 245 VAL A CA 1 ATOM 1841 C C . VAL A 1 245 ? -0.493 -24.840 27.573 1.00 13.64 ? 245 VAL A C 1 ATOM 1842 O O . VAL A 1 245 ? -1.536 -24.597 28.164 1.00 12.44 ? 245 VAL A O 1 ATOM 1843 C CB A VAL A 1 245 ? 1.423 -25.177 29.249 0.50 13.99 ? 245 VAL A CB 1 ATOM 1844 C CB B VAL A 1 245 ? 1.197 -25.138 29.440 0.50 13.56 ? 245 VAL A CB 1 ATOM 1845 C CG1 A VAL A 1 245 ? 0.345 -25.565 30.258 0.50 15.16 ? 245 VAL A CG1 1 ATOM 1846 C CG1 B VAL A 1 245 ? 1.311 -26.626 29.156 0.50 14.29 ? 245 VAL A CG1 1 ATOM 1847 C CG2 A VAL A 1 245 ? 2.097 -26.416 28.701 0.50 14.73 ? 245 VAL A CG2 1 ATOM 1848 C CG2 B VAL A 1 245 ? 2.488 -24.625 30.099 0.50 13.47 ? 245 VAL A CG2 1 ATOM 1849 N N . ASN A 1 246 ? -0.451 -25.515 26.424 1.00 12.91 ? 246 ASN A N 1 ATOM 1850 C CA . ASN A 1 246 ? -1.674 -26.048 25.796 1.00 12.47 ? 246 ASN A CA 1 ATOM 1851 C C . ASN A 1 246 ? -1.438 -27.514 25.594 1.00 13.16 ? 246 ASN A C 1 ATOM 1852 O O . ASN A 1 246 ? -0.434 -27.889 24.951 1.00 13.72 ? 246 ASN A O 1 ATOM 1853 C CB . ASN A 1 246 ? -1.943 -25.413 24.424 1.00 12.61 ? 246 ASN A CB 1 ATOM 1854 C CG . ASN A 1 246 ? -1.953 -23.906 24.456 1.00 12.81 ? 246 ASN A CG 1 ATOM 1855 O OD1 . ASN A 1 246 ? -3.016 -23.285 24.420 1.00 14.31 ? 246 ASN A OD1 1 ATOM 1856 N ND2 . ASN A 1 246 ? -0.774 -23.307 24.501 1.00 11.42 ? 246 ASN A ND2 1 ATOM 1857 N N . PHE A 1 247 ? -2.288 -28.373 26.142 1.00 12.02 ? 247 PHE A N 1 ATOM 1858 C CA . PHE A 1 247 ? -1.999 -29.797 25.933 1.00 12.70 ? 247 PHE A CA 1 ATOM 1859 C C . PHE A 1 247 ? -3.189 -30.718 26.120 1.00 11.60 ? 247 PHE A C 1 ATOM 1860 O O . PHE A 1 247 ? -4.276 -30.296 26.584 1.00 11.87 ? 247 PHE A O 1 ATOM 1861 C CB . PHE A 1 247 ? -0.784 -30.247 26.799 1.00 13.18 ? 247 PHE A CB 1 ATOM 1862 C CG . PHE A 1 247 ? -1.094 -30.443 28.282 1.00 12.92 ? 247 PHE A CG 1 ATOM 1863 C CD1 . PHE A 1 247 ? -1.261 -29.358 29.134 1.00 12.85 ? 247 PHE A CD1 1 ATOM 1864 C CD2 . PHE A 1 247 ? -1.185 -31.719 28.812 1.00 14.17 ? 247 PHE A CD2 1 ATOM 1865 C CE1 . PHE A 1 247 ? -1.512 -29.544 30.519 1.00 14.10 ? 247 PHE A CE1 1 ATOM 1866 C CE2 . PHE A 1 247 ? -1.451 -31.928 30.206 1.00 13.97 ? 247 PHE A CE2 1 ATOM 1867 C CZ . PHE A 1 247 ? -1.606 -30.844 31.041 1.00 13.76 ? 247 PHE A CZ 1 ATOM 1868 N N . ARG A 1 248 ? -2.935 -31.977 25.802 1.00 11.74 ? 248 ARG A N 1 ATOM 1869 C CA A ARG A 1 248 ? -3.899 -33.060 26.010 0.50 13.06 ? 248 ARG A CA 1 ATOM 1870 C CA B ARG A 1 248 ? -3.904 -33.081 25.925 0.50 12.16 ? 248 ARG A CA 1 ATOM 1871 C C . ARG A 1 248 ? -3.204 -34.402 26.250 1.00 12.91 ? 248 ARG A C 1 ATOM 1872 O O . ARG A 1 248 ? -2.028 -34.559 25.947 1.00 14.87 ? 248 ARG A O 1 ATOM 1873 C CB A ARG A 1 248 ? -4.869 -33.175 24.820 0.50 13.46 ? 248 ARG A CB 1 ATOM 1874 C CB B ARG A 1 248 ? -4.685 -33.259 24.609 0.50 11.30 ? 248 ARG A CB 1 ATOM 1875 C CG A ARG A 1 248 ? -4.231 -33.252 23.405 0.50 15.16 ? 248 ARG A CG 1 ATOM 1876 C CG B ARG A 1 248 ? -3.878 -33.854 23.393 0.50 10.75 ? 248 ARG A CG 1 ATOM 1877 C CD A ARG A 1 248 ? -5.266 -33.820 22.402 0.50 16.35 ? 248 ARG A CD 1 ATOM 1878 C CD B ARG A 1 248 ? -4.714 -33.809 22.071 0.50 10.71 ? 248 ARG A CD 1 ATOM 1879 N NE A ARG A 1 248 ? -4.972 -33.549 20.997 0.50 16.99 ? 248 ARG A NE 1 ATOM 1880 N NE B ARG A 1 248 ? -3.983 -34.274 20.888 0.50 10.04 ? 248 ARG A NE 1 ATOM 1881 C CZ A ARG A 1 248 ? -5.697 -32.738 20.223 0.50 17.83 ? 248 ARG A CZ 1 ATOM 1882 C CZ B ARG A 1 248 ? -4.284 -33.958 19.629 0.50 9.91 ? 248 ARG A CZ 1 ATOM 1883 N NH1 A ARG A 1 248 ? -5.361 -32.566 18.951 0.50 18.12 ? 248 ARG A NH1 1 ATOM 1884 N NH1 B ARG A 1 248 ? -3.559 -34.435 18.635 0.50 9.47 ? 248 ARG A NH1 1 ATOM 1885 N NH2 A ARG A 1 248 ? -6.759 -32.102 20.713 0.50 17.55 ? 248 ARG A NH2 1 ATOM 1886 N NH2 B ARG A 1 248 ? -5.312 -33.165 19.355 0.50 10.39 ? 248 ARG A NH2 1 ATOM 1887 N N . ILE A 1 249 ? -3.942 -35.358 26.812 1.00 13.18 ? 249 ILE A N 1 ATOM 1888 C CA . ILE A 1 249 ? -3.524 -36.764 26.813 1.00 13.09 ? 249 ILE A CA 1 ATOM 1889 C C . ILE A 1 249 ? -4.244 -37.397 25.632 1.00 14.73 ? 249 ILE A C 1 ATOM 1890 O O . ILE A 1 249 ? -5.456 -37.198 25.451 1.00 14.29 ? 249 ILE A O 1 ATOM 1891 C CB . ILE A 1 249 ? -3.959 -37.538 28.078 1.00 12.90 ? 249 ILE A CB 1 ATOM 1892 C CG1 . ILE A 1 249 ? -3.398 -36.895 29.348 1.00 13.43 ? 249 ILE A CG1 1 ATOM 1893 C CG2 . ILE A 1 249 ? -3.545 -39.033 27.996 1.00 11.76 ? 249 ILE A CG2 1 ATOM 1894 C CD1 . ILE A 1 249 ? -4.206 -37.233 30.623 1.00 12.89 ? 249 ILE A CD1 1 ATOM 1895 N N . GLY A 1 250 ? -3.507 -38.163 24.829 1.00 15.54 ? 250 GLY A N 1 ATOM 1896 C CA . GLY A 1 250 ? -4.086 -38.867 23.701 1.00 16.40 ? 250 GLY A CA 1 ATOM 1897 C C . GLY A 1 250 ? -3.505 -40.266 23.639 1.00 16.93 ? 250 GLY A C 1 ATOM 1898 O O . GLY A 1 250 ? -2.360 -40.461 24.016 1.00 16.74 ? 250 GLY A O 1 ATOM 1899 N N . ASP A 1 251 ? -4.310 -41.230 23.195 1.00 15.90 ? 251 ASP A N 1 ATOM 1900 C CA . ASP A 1 251 ? -3.835 -42.579 22.900 1.00 15.97 ? 251 ASP A CA 1 ATOM 1901 C C . ASP A 1 251 ? -4.362 -43.025 21.539 1.00 15.95 ? 251 ASP A C 1 ATOM 1902 O O . ASP A 1 251 ? -5.572 -43.191 21.370 1.00 16.40 ? 251 ASP A O 1 ATOM 1903 C CB . ASP A 1 251 ? -4.288 -43.551 23.975 1.00 14.75 ? 251 ASP A CB 1 ATOM 1904 C CG . ASP A 1 251 ? -3.599 -44.927 23.866 1.00 16.02 ? 251 ASP A CG 1 ATOM 1905 O OD1 . ASP A 1 251 ? -2.782 -45.157 22.926 1.00 14.23 ? 251 ASP A OD1 1 ATOM 1906 O OD2 . ASP A 1 251 ? -3.893 -45.769 24.748 1.00 15.25 ? 251 ASP A OD2 1 ATOM 1907 N N . TYR A 1 252 ? -3.438 -43.195 20.594 1.00 15.47 ? 252 TYR A N 1 ATOM 1908 C CA . TYR A 1 252 ? -3.705 -43.669 19.242 1.00 16.62 ? 252 TYR A CA 1 ATOM 1909 C C . TYR A 1 252 ? -3.127 -45.082 19.024 1.00 16.60 ? 252 TYR A C 1 ATOM 1910 O O . TYR A 1 252 ? -3.171 -45.603 17.911 1.00 16.34 ? 252 TYR A O 1 ATOM 1911 C CB . TYR A 1 252 ? -3.098 -42.688 18.220 1.00 16.19 ? 252 TYR A CB 1 ATOM 1912 C CG . TYR A 1 252 ? -3.356 -41.257 18.642 1.00 18.27 ? 252 TYR A CG 1 ATOM 1913 C CD1 . TYR A 1 252 ? -4.630 -40.681 18.466 1.00 16.49 ? 252 TYR A CD1 1 ATOM 1914 C CD2 . TYR A 1 252 ? -2.368 -40.503 19.276 1.00 16.83 ? 252 TYR A CD2 1 ATOM 1915 C CE1 . TYR A 1 252 ? -4.901 -39.397 18.891 1.00 16.35 ? 252 TYR A CE1 1 ATOM 1916 C CE2 . TYR A 1 252 ? -2.639 -39.198 19.709 1.00 17.05 ? 252 TYR A CE2 1 ATOM 1917 C CZ . TYR A 1 252 ? -3.908 -38.661 19.501 1.00 17.28 ? 252 TYR A CZ 1 ATOM 1918 O OH . TYR A 1 252 ? -4.207 -37.390 19.911 1.00 17.95 ? 252 TYR A OH 1 ATOM 1919 N N . GLY A 1 253 ? -2.610 -45.683 20.093 1.00 16.51 ? 253 GLY A N 1 ATOM 1920 C CA . GLY A 1 253 ? -1.914 -46.979 20.031 1.00 18.40 ? 253 GLY A CA 1 ATOM 1921 C C . GLY A 1 253 ? -2.509 -48.051 20.934 1.00 18.80 ? 253 GLY A C 1 ATOM 1922 O O . GLY A 1 253 ? -1.801 -48.957 21.354 1.00 20.74 ? 253 GLY A O 1 ATOM 1923 N N . ALA A 1 254 ? -3.807 -47.953 21.238 1.00 17.62 ? 254 ALA A N 1 ATOM 1924 C CA . ALA A 1 254 ? -4.491 -48.951 22.070 1.00 18.80 ? 254 ALA A CA 1 ATOM 1925 C C . ALA A 1 254 ? -3.617 -49.364 23.247 1.00 20.57 ? 254 ALA A C 1 ATOM 1926 O O . ALA A 1 254 ? -3.370 -50.564 23.441 1.00 19.67 ? 254 ALA A O 1 ATOM 1927 C CB . ALA A 1 254 ? -4.863 -50.208 21.223 1.00 20.76 ? 254 ALA A CB 1 ATOM 1928 N N . GLY A 1 255 ? -3.111 -48.374 23.991 1.00 18.70 ? 255 GLY A N 1 ATOM 1929 C CA . GLY A 1 255 ? -2.309 -48.639 25.181 1.00 17.69 ? 255 GLY A CA 1 ATOM 1930 C C . GLY A 1 255 ? -0.981 -47.915 25.216 1.00 17.95 ? 255 GLY A C 1 ATOM 1931 O O . GLY A 1 255 ? -0.125 -48.253 26.025 1.00 19.15 ? 255 GLY A O 1 ATOM 1932 N N . ASN A 1 256 ? -0.803 -46.929 24.340 1.00 16.32 ? 256 ASN A N 1 ATOM 1933 C CA A ASN A 1 256 ? 0.415 -46.112 24.314 0.50 15.63 ? 256 ASN A CA 1 ATOM 1934 C CA B ASN A 1 256 ? 0.405 -46.123 24.325 0.50 16.52 ? 256 ASN A CA 1 ATOM 1935 C C . ASN A 1 256 ? 0.100 -44.626 24.544 1.00 15.86 ? 256 ASN A C 1 ATOM 1936 O O . ASN A 1 256 ? 0.403 -43.776 23.695 1.00 16.19 ? 256 ASN A O 1 ATOM 1937 C CB A ASN A 1 256 ? 1.170 -46.312 22.986 0.50 15.54 ? 256 ASN A CB 1 ATOM 1938 C CB B ASN A 1 256 ? 1.197 -46.389 23.035 0.50 18.05 ? 256 ASN A CB 1 ATOM 1939 C CG A ASN A 1 256 ? 2.597 -45.751 23.012 0.50 15.42 ? 256 ASN A CG 1 ATOM 1940 C CG B ASN A 1 256 ? 1.744 -47.823 22.968 0.50 19.86 ? 256 ASN A CG 1 ATOM 1941 O OD1 A ASN A 1 256 ? 3.238 -45.661 24.066 0.50 14.65 ? 256 ASN A OD1 1 ATOM 1942 O OD1 B ASN A 1 256 ? 2.925 -48.057 23.261 0.50 20.97 ? 256 ASN A OD1 1 ATOM 1943 N ND2 A ASN A 1 256 ? 3.093 -45.370 21.842 0.50 15.14 ? 256 ASN A ND2 1 ATOM 1944 N ND2 B ASN A 1 256 ? 0.878 -48.793 22.610 0.50 18.31 ? 256 ASN A ND2 1 ATOM 1945 N N . PRO A 1 257 ? -0.500 -44.285 25.704 1.00 15.17 ? 257 PRO A N 1 ATOM 1946 C CA . PRO A 1 257 ? -0.846 -42.864 25.878 1.00 14.54 ? 257 PRO A CA 1 ATOM 1947 C C . PRO A 1 257 ? 0.361 -41.882 25.896 1.00 15.32 ? 257 PRO A C 1 ATOM 1948 O O . PRO A 1 257 ? 1.488 -42.225 26.318 1.00 13.45 ? 257 PRO A O 1 ATOM 1949 C CB . PRO A 1 257 ? -1.569 -42.836 27.234 1.00 15.22 ? 257 PRO A CB 1 ATOM 1950 C CG . PRO A 1 257 ? -1.028 -44.013 27.986 1.00 15.21 ? 257 PRO A CG 1 ATOM 1951 C CD . PRO A 1 257 ? -0.803 -45.079 26.917 1.00 14.97 ? 257 PRO A CD 1 ATOM 1952 N N . GLY A 1 258 ? 0.115 -40.665 25.433 1.00 13.24 ? 258 GLY A N 1 ATOM 1953 C CA . GLY A 1 258 ? 1.140 -39.643 25.464 1.00 13.00 ? 258 GLY A CA 1 ATOM 1954 C C . GLY A 1 258 ? 0.510 -38.305 25.792 1.00 13.23 ? 258 GLY A C 1 ATOM 1955 O O . GLY A 1 258 ? -0.680 -38.109 25.570 1.00 13.43 ? 258 GLY A O 1 ATOM 1956 N N . ILE A 1 259 ? 1.302 -37.399 26.350 1.00 13.63 ? 259 ILE A N 1 ATOM 1957 C CA . ILE A 1 259 ? 0.929 -35.999 26.357 1.00 15.29 ? 259 ILE A CA 1 ATOM 1958 C C . ILE A 1 259 ? 1.420 -35.369 25.048 1.00 15.43 ? 259 ILE A C 1 ATOM 1959 O O . ILE A 1 259 ? 2.571 -35.568 24.660 1.00 16.17 ? 259 ILE A O 1 ATOM 1960 C CB . ILE A 1 259 ? 1.522 -35.267 27.585 1.00 15.24 ? 259 ILE A CB 1 ATOM 1961 C CG1 . ILE A 1 259 ? 0.756 -35.672 28.863 1.00 15.62 ? 259 ILE A CG1 1 ATOM 1962 C CG2 . ILE A 1 259 ? 1.552 -33.767 27.360 1.00 15.58 ? 259 ILE A CG2 1 ATOM 1963 C CD1 . ILE A 1 259 ? 1.428 -35.218 30.213 1.00 14.66 ? 259 ILE A CD1 1 ATOM 1964 N N . GLU A 1 260 ? 0.550 -34.629 24.362 1.00 15.36 ? 260 GLU A N 1 ATOM 1965 C CA . GLU A 1 260 ? 1.031 -33.737 23.297 1.00 16.74 ? 260 GLU A CA 1 ATOM 1966 C C . GLU A 1 260 ? 0.599 -32.321 23.595 1.00 14.75 ? 260 GLU A C 1 ATOM 1967 O O . GLU A 1 260 ? -0.519 -32.080 24.051 1.00 13.54 ? 260 GLU A O 1 ATOM 1968 C CB . GLU A 1 260 ? 0.446 -34.049 21.909 1.00 17.74 ? 260 GLU A CB 1 ATOM 1969 C CG . GLU A 1 260 ? 0.112 -35.456 21.585 1.00 19.33 ? 260 GLU A CG 1 ATOM 1970 C CD . GLU A 1 260 ? -0.630 -35.526 20.242 0.50 17.72 ? 260 GLU A CD 1 ATOM 1971 O OE1 . GLU A 1 260 ? -1.793 -35.960 20.225 0.50 16.92 ? 260 GLU A OE1 1 ATOM 1972 O OE2 . GLU A 1 260 ? -0.058 -35.088 19.223 0.50 17.36 ? 260 GLU A OE2 1 ATOM 1973 N N . GLY A 1 261 ? 1.449 -31.381 23.231 1.00 15.30 ? 261 GLY A N 1 ATOM 1974 C CA . GLY A 1 261 ? 1.195 -30.008 23.570 1.00 14.20 ? 261 GLY A CA 1 ATOM 1975 C C . GLY A 1 261 ? 1.941 -29.007 22.747 1.00 14.32 ? 261 GLY A C 1 ATOM 1976 O O . GLY A 1 261 ? 2.823 -29.353 21.918 1.00 14.13 ? 261 GLY A O 1 ATOM 1977 N N . LEU A 1 262 ? 1.551 -27.760 22.988 1.00 13.91 ? 262 LEU A N 1 ATOM 1978 C CA . LEU A 1 262 ? 2.123 -26.575 22.391 1.00 15.42 ? 262 LEU A CA 1 ATOM 1979 C C . LEU A 1 262 ? 2.341 -25.529 23.490 1.00 15.36 ? 262 LEU A C 1 ATOM 1980 O O . LEU A 1 262 ? 1.419 -25.201 24.248 1.00 15.71 ? 262 LEU A O 1 ATOM 1981 C CB . LEU A 1 262 ? 1.194 -26.005 21.306 1.00 14.23 ? 262 LEU A CB 1 ATOM 1982 C CG . LEU A 1 262 ? 1.853 -24.909 20.444 1.00 15.09 ? 262 LEU A CG 1 ATOM 1983 C CD1 . LEU A 1 262 ? 3.068 -25.464 19.686 1.00 14.79 ? 262 LEU A CD1 1 ATOM 1984 C CD2 . LEU A 1 262 ? 0.873 -24.165 19.455 1.00 14.25 ? 262 LEU A CD2 1 ATOM 1985 N N . TYR A 1 263 ? 3.566 -25.027 23.574 1.00 16.14 ? 263 TYR A N 1 ATOM 1986 C CA . TYR A 1 263 ? 3.941 -24.037 24.590 1.00 15.62 ? 263 TYR A CA 1 ATOM 1987 C C . TYR A 1 263 ? 4.291 -22.701 23.946 1.00 16.47 ? 263 TYR A C 1 ATOM 1988 O O . TYR A 1 263 ? 5.111 -22.646 22.992 1.00 15.15 ? 263 TYR A O 1 ATOM 1989 C CB . TYR A 1 263 ? 5.117 -24.537 25.442 1.00 16.29 ? 263 TYR A CB 1 ATOM 1990 C CG . TYR A 1 263 ? 5.513 -23.541 26.530 1.00 17.25 ? 263 TYR A CG 1 ATOM 1991 C CD1 . TYR A 1 263 ? 4.773 -23.450 27.707 1.00 17.00 ? 263 TYR A CD1 1 ATOM 1992 C CD2 . TYR A 1 263 ? 6.620 -22.695 26.372 1.00 17.47 ? 263 TYR A CD2 1 ATOM 1993 C CE1 . TYR A 1 263 ? 5.097 -22.546 28.702 1.00 18.67 ? 263 TYR A CE1 1 ATOM 1994 C CE2 . TYR A 1 263 ? 6.969 -21.770 27.375 1.00 19.00 ? 263 TYR A CE2 1 ATOM 1995 C CZ . TYR A 1 263 ? 6.189 -21.699 28.535 1.00 20.11 ? 263 TYR A CZ 1 ATOM 1996 O OH . TYR A 1 263 ? 6.491 -20.805 29.534 1.00 20.64 ? 263 TYR A OH 1 ATOM 1997 N N . TYR A 1 264 ? 3.666 -21.631 24.442 1.00 15.50 ? 264 TYR A N 1 ATOM 1998 C CA . TYR A 1 264 ? 3.998 -20.274 23.994 1.00 15.92 ? 264 TYR A CA 1 ATOM 1999 C C . TYR A 1 264 ? 5.271 -19.790 24.681 1.00 18.74 ? 264 TYR A C 1 ATOM 2000 O O . TYR A 1 264 ? 5.222 -19.229 25.793 1.00 16.14 ? 264 TYR A O 1 ATOM 2001 C CB . TYR A 1 264 ? 2.838 -19.305 24.246 1.00 14.68 ? 264 TYR A CB 1 ATOM 2002 C CG . TYR A 1 264 ? 1.833 -19.301 23.124 1.00 14.75 ? 264 TYR A CG 1 ATOM 2003 C CD1 . TYR A 1 264 ? 1.021 -20.426 22.879 1.00 15.09 ? 264 TYR A CD1 1 ATOM 2004 C CD2 . TYR A 1 264 ? 1.707 -18.191 22.284 1.00 14.50 ? 264 TYR A CD2 1 ATOM 2005 C CE1 . TYR A 1 264 ? 0.091 -20.450 21.808 1.00 15.52 ? 264 TYR A CE1 1 ATOM 2006 C CE2 . TYR A 1 264 ? 0.783 -18.182 21.230 1.00 16.18 ? 264 TYR A CE2 1 ATOM 2007 C CZ . TYR A 1 264 ? -0.022 -19.322 20.994 1.00 15.43 ? 264 TYR A CZ 1 ATOM 2008 O OH . TYR A 1 264 ? -0.916 -19.305 19.972 1.00 14.56 ? 264 TYR A OH 1 ATOM 2009 N N . GLY A 1 265 ? 6.405 -20.025 24.015 1.00 19.36 ? 265 GLY A N 1 ATOM 2010 C CA . GLY A 1 265 ? 7.728 -19.686 24.559 1.00 20.75 ? 265 GLY A CA 1 ATOM 2011 C C . GLY A 1 265 ? 8.771 -20.736 24.176 1.00 22.10 ? 265 GLY A C 1 ATOM 2012 O O . GLY A 1 265 ? 8.532 -21.586 23.293 1.00 20.83 ? 265 GLY A O 1 ATOM 2013 N N . THR A 1 266 ? 9.933 -20.667 24.823 1.00 21.66 ? 266 THR A N 1 ATOM 2014 C CA . THR A 1 266 ? 11.102 -21.472 24.416 1.00 21.99 ? 266 THR A CA 1 ATOM 2015 C C . THR A 1 266 ? 11.066 -22.871 25.033 1.00 20.65 ? 266 THR A C 1 ATOM 2016 O O . THR A 1 266 ? 10.358 -23.098 26.032 1.00 19.74 ? 266 THR A O 1 ATOM 2017 C CB . THR A 1 266 ? 12.414 -20.786 24.866 1.00 22.65 ? 266 THR A CB 1 ATOM 2018 O OG1 . THR A 1 266 ? 12.473 -20.806 26.299 1.00 23.13 ? 266 THR A OG1 1 ATOM 2019 C CG2 . THR A 1 266 ? 12.473 -19.321 24.355 1.00 22.16 ? 266 THR A CG2 1 ATOM 2020 N N . PRO A 1 267 ? 11.851 -23.811 24.470 1.00 21.40 ? 267 PRO A N 1 ATOM 2021 C CA . PRO A 1 267 ? 11.944 -25.148 25.072 1.00 19.76 ? 267 PRO A CA 1 ATOM 2022 C C . PRO A 1 267 ? 12.354 -25.163 26.557 1.00 22.34 ? 267 PRO A C 1 ATOM 2023 O O . PRO A 1 267 ? 11.879 -26.023 27.330 1.00 21.52 ? 267 PRO A O 1 ATOM 2024 C CB . PRO A 1 267 ? 12.998 -25.848 24.213 1.00 20.52 ? 267 PRO A CB 1 ATOM 2025 C CG . PRO A 1 267 ? 12.939 -25.136 22.879 1.00 19.43 ? 267 PRO A CG 1 ATOM 2026 C CD . PRO A 1 267 ? 12.597 -23.715 23.186 1.00 19.62 ? 267 PRO A CD 1 ATOM 2027 N N . GLU A 1 268 ? 13.207 -24.225 26.963 1.00 22.05 ? 268 GLU A N 1 ATOM 2028 C CA . GLU A 1 268 ? 13.677 -24.186 28.362 1.00 23.37 ? 268 GLU A CA 1 ATOM 2029 C C . GLU A 1 268 ? 12.565 -23.657 29.270 1.00 22.19 ? 268 GLU A C 1 ATOM 2030 O O . GLU A 1 268 ? 12.396 -24.143 30.390 1.00 19.27 ? 268 GLU A O 1 ATOM 2031 C CB . GLU A 1 268 ? 14.955 -23.328 28.508 1.00 26.60 ? 268 GLU A CB 1 ATOM 2032 C CG . GLU A 1 268 ? 16.216 -23.865 27.758 1.00 29.64 ? 268 GLU A CG 1 ATOM 2033 C CD . GLU A 1 268 ? 16.130 -23.814 26.201 1.00 33.91 ? 268 GLU A CD 1 ATOM 2034 O OE1 . GLU A 1 268 ? 15.432 -22.943 25.607 1.00 30.02 ? 268 GLU A OE1 1 ATOM 2035 O OE2 . GLU A 1 268 ? 16.789 -24.663 25.562 1.00 37.62 ? 268 GLU A OE2 1 ATOM 2036 N N . GLN A 1 269 ? 11.812 -22.657 28.785 1.00 21.41 ? 269 GLN A N 1 ATOM 2037 C CA . GLN A 1 269 ? 10.658 -22.149 29.527 1.00 20.93 ? 269 GLN A CA 1 ATOM 2038 C C . GLN A 1 269 ? 9.578 -23.227 29.620 1.00 22.16 ? 269 GLN A C 1 ATOM 2039 O O . GLN A 1 269 ? 8.928 -23.369 30.659 1.00 22.70 ? 269 GLN A O 1 ATOM 2040 C CB . GLN A 1 269 ? 10.086 -20.898 28.882 1.00 22.39 ? 269 GLN A CB 1 ATOM 2041 C CG . GLN A 1 269 ? 10.954 -19.672 29.049 1.00 23.47 ? 269 GLN A CG 1 ATOM 2042 C CD . GLN A 1 269 ? 10.604 -18.565 28.091 1.00 26.29 ? 269 GLN A CD 1 ATOM 2043 O OE1 . GLN A 1 269 ? 10.226 -18.800 26.942 1.00 27.40 ? 269 GLN A OE1 1 ATOM 2044 N NE2 . GLN A 1 269 ? 10.754 -17.335 28.553 1.00 28.35 ? 269 GLN A NE2 1 ATOM 2045 N N . TRP A 1 270 ? 9.400 -24.000 28.549 1.00 21.45 ? 270 TRP A N 1 ATOM 2046 C CA . TRP A 1 270 ? 8.425 -25.093 28.599 1.00 20.26 ? 270 TRP A CA 1 ATOM 2047 C C . TRP A 1 270 ? 8.778 -26.055 29.740 1.00 20.78 ? 270 TRP A C 1 ATOM 2048 O O . TRP A 1 270 ? 7.938 -26.343 30.618 1.00 22.28 ? 270 TRP A O 1 ATOM 2049 C CB . TRP A 1 270 ? 8.272 -25.865 27.257 1.00 16.68 ? 270 TRP A CB 1 ATOM 2050 C CG . TRP A 1 270 ? 7.506 -27.139 27.533 1.00 15.93 ? 270 TRP A CG 1 ATOM 2051 C CD1 . TRP A 1 270 ? 6.173 -27.245 27.838 1.00 16.27 ? 270 TRP A CD1 1 ATOM 2052 C CD2 . TRP A 1 270 ? 8.052 -28.449 27.672 1.00 16.42 ? 270 TRP A CD2 1 ATOM 2053 N NE1 . TRP A 1 270 ? 5.843 -28.553 28.119 1.00 16.22 ? 270 TRP A NE1 1 ATOM 2054 C CE2 . TRP A 1 270 ? 6.979 -29.316 28.025 1.00 15.99 ? 270 TRP A CE2 1 ATOM 2055 C CE3 . TRP A 1 270 ? 9.339 -28.989 27.503 1.00 15.56 ? 270 TRP A CE3 1 ATOM 2056 C CZ2 . TRP A 1 270 ? 7.154 -30.680 28.210 1.00 15.59 ? 270 TRP A CZ2 1 ATOM 2057 C CZ3 . TRP A 1 270 ? 9.520 -30.347 27.678 1.00 15.80 ? 270 TRP A CZ3 1 ATOM 2058 C CH2 . TRP A 1 270 ? 8.431 -31.191 28.028 1.00 16.56 ? 270 TRP A CH2 1 ATOM 2059 N N . ARG A 1 271 ? 10.015 -26.557 29.718 1.00 20.00 ? 271 ARG A N 1 ATOM 2060 C CA . ARG A 1 271 ? 10.446 -27.555 30.693 1.00 20.32 ? 271 ARG A CA 1 ATOM 2061 C C . ARG A 1 271 ? 10.242 -27.073 32.132 1.00 20.01 ? 271 ARG A C 1 ATOM 2062 O O . ARG A 1 271 ? 9.676 -27.793 32.958 1.00 21.39 ? 271 ARG A O 1 ATOM 2063 C CB . ARG A 1 271 ? 11.895 -28.007 30.445 1.00 21.98 ? 271 ARG A CB 1 ATOM 2064 C CG . ARG A 1 271 ? 12.372 -29.108 31.380 1.00 23.49 ? 271 ARG A CG 1 ATOM 2065 C CD . ARG A 1 271 ? 11.522 -30.359 31.180 1.00 23.97 ? 271 ARG A CD 1 ATOM 2066 N NE . ARG A 1 271 ? 11.945 -31.528 31.953 1.00 24.63 ? 271 ARG A NE 1 ATOM 2067 C CZ . ARG A 1 271 ? 12.610 -32.564 31.444 1.00 26.51 ? 271 ARG A CZ 1 ATOM 2068 N NH1 . ARG A 1 271 ? 12.978 -32.570 30.164 1.00 25.45 ? 271 ARG A NH1 1 ATOM 2069 N NH2 . ARG A 1 271 ? 12.923 -33.599 32.219 1.00 27.02 ? 271 ARG A NH2 1 ATOM 2070 N N . ALA A 1 272 ? 10.666 -25.846 32.418 1.00 20.26 ? 272 ALA A N 1 ATOM 2071 C CA . ALA A 1 272 ? 10.486 -25.271 33.740 1.00 19.82 ? 272 ALA A CA 1 ATOM 2072 C C . ALA A 1 272 ? 8.993 -25.233 34.086 1.00 20.55 ? 272 ALA A C 1 ATOM 2073 O O . ALA A 1 272 ? 8.604 -25.595 35.180 1.00 19.15 ? 272 ALA A O 1 ATOM 2074 C CB . ALA A 1 272 ? 11.088 -23.867 33.807 1.00 22.55 ? 272 ALA A CB 1 ATOM 2075 N N . ALA A 1 273 ? 8.164 -24.814 33.130 1.00 19.90 ? 273 ALA A N 1 ATOM 2076 C CA . ALA A 1 273 ? 6.719 -24.691 33.355 1.00 17.55 ? 273 ALA A CA 1 ATOM 2077 C C . ALA A 1 273 ? 6.019 -26.049 33.560 1.00 17.41 ? 273 ALA A C 1 ATOM 2078 O O . ALA A 1 273 ? 5.054 -26.141 34.318 1.00 16.31 ? 273 ALA A O 1 ATOM 2079 C CB . ALA A 1 273 ? 6.067 -23.912 32.202 1.00 16.73 ? 273 ALA A CB 1 ATOM 2080 N N . PHE A 1 274 ? 6.514 -27.087 32.883 1.00 16.16 ? 274 PHE A N 1 ATOM 2081 C CA . PHE A 1 274 ? 5.890 -28.427 32.893 1.00 16.04 ? 274 PHE A CA 1 ATOM 2082 C C . PHE A 1 274 ? 6.445 -29.314 33.991 1.00 16.82 ? 274 PHE A C 1 ATOM 2083 O O . PHE A 1 274 ? 5.831 -30.329 34.327 1.00 16.01 ? 274 PHE A O 1 ATOM 2084 C CB . PHE A 1 274 ? 6.084 -29.144 31.533 1.00 14.47 ? 274 PHE A CB 1 ATOM 2085 C CG . PHE A 1 274 ? 4.896 -29.936 31.097 1.00 14.66 ? 274 PHE A CG 1 ATOM 2086 C CD1 . PHE A 1 274 ? 3.691 -29.293 30.768 1.00 15.01 ? 274 PHE A CD1 1 ATOM 2087 C CD2 . PHE A 1 274 ? 4.942 -31.325 31.063 1.00 14.78 ? 274 PHE A CD2 1 ATOM 2088 C CE1 . PHE A 1 274 ? 2.564 -30.029 30.382 1.00 13.90 ? 274 PHE A CE1 1 ATOM 2089 C CE2 . PHE A 1 274 ? 3.832 -32.087 30.666 1.00 14.91 ? 274 PHE A CE2 1 ATOM 2090 C CZ . PHE A 1 274 ? 2.636 -31.435 30.323 1.00 16.14 ? 274 PHE A CZ 1 ATOM 2091 N N . GLN A 1 275 ? 7.585 -28.920 34.565 1.00 16.55 ? 275 GLN A N 1 ATOM 2092 C CA . GLN A 1 275 ? 8.284 -29.746 35.579 1.00 17.20 ? 275 GLN A CA 1 ATOM 2093 C C . GLN A 1 275 ? 7.416 -30.208 36.768 1.00 17.34 ? 275 GLN A C 1 ATOM 2094 O O . GLN A 1 275 ? 7.561 -31.359 37.197 1.00 18.25 ? 275 GLN A O 1 ATOM 2095 C CB . GLN A 1 275 ? 9.573 -29.054 36.087 1.00 17.51 ? 275 GLN A CB 1 ATOM 2096 C CG . GLN A 1 275 ? 10.593 -30.029 36.767 1.00 20.17 ? 275 GLN A CG 1 ATOM 2097 C CD . GLN A 1 275 ? 11.063 -31.144 35.829 1.00 21.01 ? 275 GLN A CD 1 ATOM 2098 O OE1 . GLN A 1 275 ? 11.474 -30.880 34.705 1.00 26.14 ? 275 GLN A OE1 1 ATOM 2099 N NE2 . GLN A 1 275 ? 11.004 -32.383 36.290 1.00 20.02 ? 275 GLN A NE2 1 ATOM 2100 N N . PRO A 1 276 ? 6.528 -29.323 37.295 1.00 16.42 ? 276 PRO A N 1 ATOM 2101 C CA . PRO A 1 276 ? 5.647 -29.729 38.381 1.00 16.99 ? 276 PRO A CA 1 ATOM 2102 C C . PRO A 1 276 ? 4.821 -30.945 38.034 1.00 17.60 ? 276 PRO A C 1 ATOM 2103 O O . PRO A 1 276 ? 4.548 -31.740 38.920 1.00 17.90 ? 276 PRO A O 1 ATOM 2104 C CB . PRO A 1 276 ? 4.752 -28.486 38.603 1.00 16.74 ? 276 PRO A CB 1 ATOM 2105 C CG . PRO A 1 276 ? 5.654 -27.337 38.243 1.00 16.69 ? 276 PRO A CG 1 ATOM 2106 C CD . PRO A 1 276 ? 6.401 -27.868 37.022 1.00 16.81 ? 276 PRO A CD 1 ATOM 2107 N N . LEU A 1 277 ? 4.456 -31.104 36.756 1.00 17.80 ? 277 LEU A N 1 ATOM 2108 C CA . LEU A 1 277 ? 3.688 -32.260 36.300 1.00 15.37 ? 277 LEU A CA 1 ATOM 2109 C C . LEU A 1 277 ? 4.594 -33.481 36.136 1.00 16.45 ? 277 LEU A C 1 ATOM 2110 O O . LEU A 1 277 ? 4.253 -34.586 36.608 1.00 16.79 ? 277 LEU A O 1 ATOM 2111 C CB . LEU A 1 277 ? 2.960 -31.975 34.975 1.00 15.85 ? 277 LEU A CB 1 ATOM 2112 C CG . LEU A 1 277 ? 2.108 -33.151 34.402 1.00 16.60 ? 277 LEU A CG 1 ATOM 2113 C CD1 . LEU A 1 277 ? 1.294 -33.860 35.494 1.00 14.32 ? 277 LEU A CD1 1 ATOM 2114 C CD2 . LEU A 1 277 ? 1.148 -32.669 33.263 1.00 16.76 ? 277 LEU A CD2 1 ATOM 2115 N N . LEU A 1 278 ? 5.721 -33.292 35.441 1.00 15.81 ? 278 LEU A N 1 ATOM 2116 C CA . LEU A 1 278 ? 6.728 -34.360 35.291 1.00 17.82 ? 278 LEU A CA 1 ATOM 2117 C C . LEU A 1 278 ? 7.113 -34.952 36.655 1.00 17.74 ? 278 LEU A C 1 ATOM 2118 O O . LEU A 1 278 ? 7.233 -36.170 36.776 1.00 18.53 ? 278 LEU A O 1 ATOM 2119 C CB . LEU A 1 278 ? 7.970 -33.861 34.523 1.00 17.06 ? 278 LEU A CB 1 ATOM 2120 C CG . LEU A 1 278 ? 7.727 -33.236 33.141 1.00 19.18 ? 278 LEU A CG 1 ATOM 2121 C CD1 . LEU A 1 278 ? 9.047 -32.714 32.537 1.00 19.58 ? 278 LEU A CD1 1 ATOM 2122 C CD2 . LEU A 1 278 ? 7.078 -34.242 32.186 1.00 18.51 ? 278 LEU A CD2 1 ATOM 2123 N N . ASP A 1 279 ? 7.244 -34.094 37.677 1.00 18.60 ? 279 ASP A N 1 ATOM 2124 C CA . ASP A 1 279 ? 7.507 -34.553 39.068 1.00 21.55 ? 279 ASP A CA 1 ATOM 2125 C C . ASP A 1 279 ? 6.418 -35.412 39.683 1.00 21.00 ? 279 ASP A C 1 ATOM 2126 O O . ASP A 1 279 ? 6.692 -36.172 40.610 1.00 22.65 ? 279 ASP A O 1 ATOM 2127 C CB . ASP A 1 279 ? 7.777 -33.382 40.028 1.00 20.24 ? 279 ASP A CB 1 ATOM 2128 C CG . ASP A 1 279 ? 9.020 -32.608 39.663 1.00 22.14 ? 279 ASP A CG 1 ATOM 2129 O OD1 . ASP A 1 279 ? 9.919 -33.202 39.031 1.00 21.29 ? 279 ASP A OD1 1 ATOM 2130 O OD2 . ASP A 1 279 ? 9.078 -31.395 39.967 1.00 23.55 ? 279 ASP A OD2 1 ATOM 2131 N N . THR A 1 280 ? 5.192 -35.300 39.196 1.00 18.20 ? 280 THR A N 1 ATOM 2132 C CA . THR A 1 280 ? 4.093 -36.081 39.818 1.00 18.24 ? 280 THR A CA 1 ATOM 2133 C C . THR A 1 280 ? 3.593 -37.234 38.951 1.00 17.48 ? 280 THR A C 1 ATOM 2134 O O . THR A 1 280 ? 2.771 -38.031 39.373 1.00 19.85 ? 280 THR A O 1 ATOM 2135 C CB . THR A 1 280 ? 2.928 -35.174 40.215 1.00 18.38 ? 280 THR A CB 1 ATOM 2136 O OG1 . THR A 1 280 ? 2.597 -34.318 39.107 1.00 18.30 ? 280 THR A OG1 1 ATOM 2137 C CG2 . THR A 1 280 ? 3.342 -34.312 41.384 1.00 17.61 ? 280 THR A CG2 1 ATOM 2138 N N . LEU A 1 281 ? 4.094 -37.317 37.726 1.00 17.80 ? 281 LEU A N 1 ATOM 2139 C CA . LEU A 1 281 ? 3.773 -38.420 36.839 1.00 16.85 ? 281 LEU A CA 1 ATOM 2140 C C . LEU A 1 281 ? 4.354 -39.734 37.362 1.00 18.48 ? 281 LEU A C 1 ATOM 2141 O O . LEU A 1 281 ? 5.426 -39.730 37.959 1.00 19.02 ? 281 LEU A O 1 ATOM 2142 C CB . LEU A 1 281 ? 4.307 -38.130 35.422 1.00 17.01 ? 281 LEU A CB 1 ATOM 2143 C CG . LEU A 1 281 ? 3.475 -37.164 34.542 1.00 16.67 ? 281 LEU A CG 1 ATOM 2144 C CD1 . LEU A 1 281 ? 4.107 -37.007 33.200 1.00 15.74 ? 281 LEU A CD1 1 ATOM 2145 C CD2 . LEU A 1 281 ? 2.015 -37.649 34.347 1.00 16.65 ? 281 LEU A CD2 1 ATOM 2146 N N . PRO A 1 282 ? 3.649 -40.868 37.123 1.00 18.92 ? 282 PRO A N 1 ATOM 2147 C CA . PRO A 1 282 ? 4.194 -42.186 37.459 1.00 19.72 ? 282 PRO A CA 1 ATOM 2148 C C . PRO A 1 282 ? 5.515 -42.319 36.736 1.00 22.11 ? 282 PRO A C 1 ATOM 2149 O O . PRO A 1 282 ? 5.662 -41.806 35.612 1.00 22.44 ? 282 PRO A O 1 ATOM 2150 C CB . PRO A 1 282 ? 3.179 -43.172 36.846 1.00 19.04 ? 282 PRO A CB 1 ATOM 2151 C CG . PRO A 1 282 ? 1.886 -42.379 36.747 1.00 18.74 ? 282 PRO A CG 1 ATOM 2152 C CD . PRO A 1 282 ? 2.291 -40.942 36.546 1.00 17.72 ? 282 PRO A CD 1 ATOM 2153 N N . ALA A 1 283 ? 6.459 -43.009 37.371 1.00 22.69 ? 283 ALA A N 1 ATOM 2154 C CA . ALA A 1 283 ? 7.807 -43.142 36.851 1.00 23.30 ? 283 ALA A CA 1 ATOM 2155 C C . ALA A 1 283 ? 7.804 -43.980 35.581 1.00 21.98 ? 283 ALA A C 1 ATOM 2156 O O . ALA A 1 283 ? 6.943 -44.850 35.395 1.00 21.81 ? 283 ALA A O 1 ATOM 2157 C CB . ALA A 1 283 ? 8.729 -43.764 37.915 1.00 24.49 ? 283 ALA A CB 1 ATOM 2158 N N . GLY A 1 284 ? 8.772 -43.723 34.717 1.00 21.10 ? 284 GLY A N 1 ATOM 2159 C CA . GLY A 1 284 ? 8.858 -44.445 33.458 1.00 23.11 ? 284 GLY A CA 1 ATOM 2160 C C . GLY A 1 284 ? 8.469 -43.607 32.245 1.00 21.67 ? 284 GLY A C 1 ATOM 2161 O O . GLY A 1 284 ? 8.690 -44.030 31.114 1.00 24.73 ? 284 GLY A O 1 ATOM 2162 N N . TYR A 1 285 ? 7.915 -42.413 32.456 1.00 20.91 ? 285 TYR A N 1 ATOM 2163 C CA . TYR A 1 285 ? 7.593 -41.544 31.308 1.00 20.59 ? 285 TYR A CA 1 ATOM 2164 C C . TYR A 1 285 ? 8.882 -41.188 30.598 1.00 20.17 ? 285 TYR A C 1 ATOM 2165 O O . TYR A 1 285 ? 9.956 -41.236 31.205 1.00 21.17 ? 285 TYR A O 1 ATOM 2166 C CB . TYR A 1 285 ? 6.854 -40.282 31.746 1.00 19.43 ? 285 TYR A CB 1 ATOM 2167 C CG . TYR A 1 285 ? 7.656 -39.375 32.639 1.00 19.41 ? 285 TYR A CG 1 ATOM 2168 C CD1 . TYR A 1 285 ? 8.528 -38.414 32.104 1.00 18.30 ? 285 TYR A CD1 1 ATOM 2169 C CD2 . TYR A 1 285 ? 7.550 -39.478 34.026 1.00 19.62 ? 285 TYR A CD2 1 ATOM 2170 C CE1 . TYR A 1 285 ? 9.283 -37.544 32.968 1.00 19.77 ? 285 TYR A CE1 1 ATOM 2171 C CE2 . TYR A 1 285 ? 8.292 -38.625 34.896 1.00 19.86 ? 285 TYR A CE2 1 ATOM 2172 C CZ . TYR A 1 285 ? 9.144 -37.680 34.357 1.00 20.86 ? 285 TYR A CZ 1 ATOM 2173 O OH . TYR A 1 285 ? 9.846 -36.892 35.219 1.00 22.59 ? 285 TYR A OH 1 ATOM 2174 N N . VAL A 1 286 ? 8.794 -40.859 29.317 1.00 18.33 ? 286 VAL A N 1 ATOM 2175 C CA . VAL A 1 286 ? 9.947 -40.341 28.601 1.00 19.29 ? 286 VAL A CA 1 ATOM 2176 C C . VAL A 1 286 ? 9.548 -39.048 27.896 1.00 21.09 ? 286 VAL A C 1 ATOM 2177 O O . VAL A 1 286 ? 8.650 -39.057 27.040 1.00 22.99 ? 286 VAL A O 1 ATOM 2178 C CB . VAL A 1 286 ? 10.498 -41.340 27.526 1.00 19.10 ? 286 VAL A CB 1 ATOM 2179 C CG1 . VAL A 1 286 ? 11.676 -40.700 26.731 1.00 18.43 ? 286 VAL A CG1 1 ATOM 2180 C CG2 . VAL A 1 286 ? 10.940 -42.664 28.142 1.00 19.27 ? 286 VAL A CG2 1 ATOM 2181 N N . VAL A 1 287 ? 10.209 -37.950 28.250 1.00 19.99 ? 287 VAL A N 1 ATOM 2182 C CA . VAL A 1 287 ? 10.052 -36.689 27.548 1.00 22.19 ? 287 VAL A CA 1 ATOM 2183 C C . VAL A 1 287 ? 10.658 -36.777 26.132 1.00 23.86 ? 287 VAL A C 1 ATOM 2184 O O . VAL A 1 287 ? 11.856 -37.043 25.972 1.00 19.88 ? 287 VAL A O 1 ATOM 2185 C CB . VAL A 1 287 ? 10.726 -35.533 28.308 1.00 23.48 ? 287 VAL A CB 1 ATOM 2186 C CG1 . VAL A 1 287 ? 10.528 -34.217 27.547 1.00 23.68 ? 287 VAL A CG1 1 ATOM 2187 C CG2 . VAL A 1 287 ? 10.163 -35.433 29.727 1.00 25.24 ? 287 VAL A CG2 1 ATOM 2188 N N . ASN A 1 288 ? 9.815 -36.579 25.115 1.00 24.61 ? 288 ASN A N 1 ATOM 2189 C CA . ASN A 1 288 ? 10.271 -36.545 23.724 1.00 24.76 ? 288 ASN A CA 1 ATOM 2190 C C . ASN A 1 288 ? 11.117 -35.286 23.465 1.00 23.29 ? 288 ASN A C 1 ATOM 2191 O O . ASN A 1 288 ? 10.939 -34.267 24.151 1.00 22.38 ? 288 ASN A O 1 ATOM 2192 C CB . ASN A 1 288 ? 9.066 -36.549 22.764 1.00 28.19 ? 288 ASN A CB 1 ATOM 2193 C CG . ASN A 1 288 ? 8.011 -37.599 23.113 1.00 32.48 ? 288 ASN A CG 1 ATOM 2194 O OD1 . ASN A 1 288 ? 8.311 -38.694 23.622 1.00 32.17 ? 288 ASN A OD1 1 ATOM 2195 N ND2 . ASN A 1 288 ? 6.752 -37.268 22.812 1.00 31.75 ? 288 ASN A ND2 1 ATOM 2196 N N . PRO A 1 289 ? 12.019 -35.330 22.462 1.00 22.73 ? 289 PRO A N 1 ATOM 2197 C CA . PRO A 1 289 ? 12.665 -34.073 22.058 1.00 22.89 ? 289 PRO A CA 1 ATOM 2198 C C . PRO A 1 289 ? 11.612 -32.998 21.716 1.00 22.28 ? 289 PRO A C 1 ATOM 2199 O O . PRO A 1 289 ? 10.580 -33.306 21.130 1.00 23.04 ? 289 PRO A O 1 ATOM 2200 C CB . PRO A 1 289 ? 13.436 -34.456 20.765 1.00 25.34 ? 289 PRO A CB 1 ATOM 2201 C CG . PRO A 1 289 ? 13.551 -35.946 20.781 1.00 26.22 ? 289 PRO A CG 1 ATOM 2202 C CD . PRO A 1 289 ? 12.415 -36.479 21.611 1.00 25.37 ? 289 PRO A CD 1 ATOM 2203 N N . THR A 1 290 ? 11.865 -31.749 22.079 1.00 22.83 ? 290 THR A N 1 ATOM 2204 C CA . THR A 1 290 ? 10.953 -30.661 21.723 1.00 23.50 ? 290 THR A CA 1 ATOM 2205 C C . THR A 1 290 ? 11.197 -30.261 20.266 1.00 23.37 ? 290 THR A C 1 ATOM 2206 O O . THR A 1 290 ? 12.230 -30.611 19.697 1.00 23.48 ? 290 THR A O 1 ATOM 2207 C CB . THR A 1 290 ? 11.216 -29.418 22.590 1.00 22.91 ? 290 THR A CB 1 ATOM 2208 O OG1 . THR A 1 290 ? 12.608 -29.106 22.518 1.00 25.49 ? 290 THR A OG1 1 ATOM 2209 C CG2 . THR A 1 290 ? 10.807 -29.643 24.060 1.00 21.27 ? 290 THR A CG2 1 ATOM 2210 N N . THR A 1 291 ? 10.252 -29.552 19.653 1.00 21.54 ? 291 THR A N 1 ATOM 2211 C CA . THR A 1 291 ? 10.520 -28.901 18.355 1.00 21.87 ? 291 THR A CA 1 ATOM 2212 C C . THR A 1 291 ? 10.191 -27.428 18.434 1.00 21.30 ? 291 THR A C 1 ATOM 2213 O O . THR A 1 291 ? 9.076 -27.051 18.855 1.00 20.58 ? 291 THR A O 1 ATOM 2214 C CB . THR A 1 291 ? 9.664 -29.487 17.229 1.00 23.29 ? 291 THR A CB 1 ATOM 2215 O OG1 . THR A 1 291 ? 9.616 -30.899 17.371 1.00 25.83 ? 291 THR A OG1 1 ATOM 2216 C CG2 . THR A 1 291 ? 10.215 -29.107 15.845 1.00 23.79 ? 291 THR A CG2 1 ATOM 2217 N N . SER A 1 292 ? 11.141 -26.605 17.998 1.00 20.61 ? 292 SER A N 1 ATOM 2218 C CA . SER A 1 292 ? 10.971 -25.161 17.940 1.00 20.37 ? 292 SER A CA 1 ATOM 2219 C C . SER A 1 292 ? 10.283 -24.739 16.655 1.00 21.16 ? 292 SER A C 1 ATOM 2220 O O . SER A 1 292 ? 10.665 -25.167 15.562 1.00 20.35 ? 292 SER A O 1 ATOM 2221 C CB . SER A 1 292 ? 12.324 -24.458 18.119 1.00 23.04 ? 292 SER A CB 1 ATOM 2222 O OG . SER A 1 292 ? 12.872 -24.829 19.393 1.00 26.01 ? 292 SER A OG 1 ATOM 2223 N N . LEU A 1 293 ? 9.252 -23.906 16.785 1.00 19.44 ? 293 LEU A N 1 ATOM 2224 C CA . LEU A 1 293 ? 8.375 -23.614 15.645 1.00 19.03 ? 293 LEU A CA 1 ATOM 2225 C C . LEU A 1 293 ? 7.952 -22.166 15.670 1.00 19.17 ? 293 LEU A C 1 ATOM 2226 O O . LEU A 1 293 ? 7.819 -21.570 16.753 1.00 19.03 ? 293 LEU A O 1 ATOM 2227 C CB . LEU A 1 293 ? 7.088 -24.469 15.711 1.00 19.59 ? 293 LEU A CB 1 ATOM 2228 C CG . LEU A 1 293 ? 7.195 -26.003 15.704 1.00 20.21 ? 293 LEU A CG 1 ATOM 2229 C CD1 . LEU A 1 293 ? 5.923 -26.639 16.243 1.00 20.38 ? 293 LEU A CD1 1 ATOM 2230 C CD2 . LEU A 1 293 ? 7.497 -26.525 14.309 1.00 17.84 ? 293 LEU A CD2 1 ATOM 2231 N N . ASN A 1 294 ? 7.695 -21.600 14.494 1.00 17.33 ? 294 ASN A N 1 ATOM 2232 C CA . ASN A 1 294 ? 6.894 -20.387 14.456 1.00 17.57 ? 294 ASN A CA 1 ATOM 2233 C C . ASN A 1 294 ? 5.422 -20.746 14.219 1.00 16.95 ? 294 ASN A C 1 ATOM 2234 O O . ASN A 1 294 ? 5.069 -21.945 14.111 1.00 15.73 ? 294 ASN A O 1 ATOM 2235 C CB . ASN A 1 294 ? 7.428 -19.372 13.419 1.00 18.42 ? 294 ASN A CB 1 ATOM 2236 C CG . ASN A 1 294 ? 7.294 -19.868 11.995 1.00 21.04 ? 294 ASN A CG 1 ATOM 2237 O OD1 . ASN A 1 294 ? 6.443 -20.708 11.678 1.00 20.01 ? 294 ASN A OD1 1 ATOM 2238 N ND2 . ASN A 1 294 ? 8.149 -19.352 11.120 1.00 23.52 ? 294 ASN A ND2 1 ATOM 2239 N N . TRP A 1 295 ? 4.569 -19.716 14.164 1.00 15.87 ? 295 TRP A N 1 ATOM 2240 C CA . TRP A 1 295 ? 3.139 -19.913 13.967 1.00 15.70 ? 295 TRP A CA 1 ATOM 2241 C C . TRP A 1 295 ? 2.787 -20.845 12.793 1.00 16.04 ? 295 TRP A C 1 ATOM 2242 O O . TRP A 1 295 ? 2.157 -21.888 12.997 1.00 13.77 ? 295 TRP A O 1 ATOM 2243 C CB . TRP A 1 295 ? 2.407 -18.580 13.758 1.00 14.91 ? 295 TRP A CB 1 ATOM 2244 C CG . TRP A 1 295 ? 0.940 -18.811 13.580 1.00 14.80 ? 295 TRP A CG 1 ATOM 2245 C CD1 . TRP A 1 295 ? 0.212 -18.614 12.448 1.00 14.22 ? 295 TRP A CD1 1 ATOM 2246 C CD2 . TRP A 1 295 ? 0.023 -19.319 14.571 1.00 14.71 ? 295 TRP A CD2 1 ATOM 2247 N NE1 . TRP A 1 295 ? -1.114 -18.951 12.669 1.00 14.27 ? 295 TRP A NE1 1 ATOM 2248 C CE2 . TRP A 1 295 ? -1.253 -19.392 13.962 1.00 14.26 ? 295 TRP A CE2 1 ATOM 2249 C CE3 . TRP A 1 295 ? 0.158 -19.706 15.909 1.00 14.00 ? 295 TRP A CE3 1 ATOM 2250 C CZ2 . TRP A 1 295 ? -2.401 -19.823 14.657 1.00 15.21 ? 295 TRP A CZ2 1 ATOM 2251 C CZ3 . TRP A 1 295 ? -0.988 -20.127 16.614 1.00 16.20 ? 295 TRP A CZ3 1 ATOM 2252 C CH2 . TRP A 1 295 ? -2.258 -20.175 15.986 1.00 13.85 ? 295 TRP A CH2 1 ATOM 2253 N N . ILE A 1 296 ? 3.171 -20.460 11.570 1.00 15.73 ? 296 ILE A N 1 ATOM 2254 C CA . ILE A 1 296 ? 2.719 -21.224 10.395 1.00 16.85 ? 296 ILE A CA 1 ATOM 2255 C C . ILE A 1 296 ? 3.256 -22.664 10.427 1.00 16.67 ? 296 ILE A C 1 ATOM 2256 O O . ILE A 1 296 ? 2.583 -23.628 10.020 1.00 16.17 ? 296 ILE A O 1 ATOM 2257 C CB . ILE A 1 296 ? 2.994 -20.476 9.037 1.00 18.67 ? 296 ILE A CB 1 ATOM 2258 C CG1 . ILE A 1 296 ? 2.130 -21.043 7.906 1.00 18.82 ? 296 ILE A CG1 1 ATOM 2259 C CG2 . ILE A 1 296 ? 4.487 -20.498 8.649 1.00 19.36 ? 296 ILE A CG2 1 ATOM 2260 C CD1 . ILE A 1 296 ? 0.606 -20.991 8.156 1.00 17.72 ? 296 ILE A CD1 1 ATOM 2261 N N . GLU A 1 297 ? 4.465 -22.802 10.953 1.00 15.94 ? 297 GLU A N 1 ATOM 2262 C CA . GLU A 1 297 ? 5.057 -24.109 11.148 1.00 17.28 ? 297 GLU A CA 1 ATOM 2263 C C . GLU A 1 297 ? 4.263 -24.951 12.128 1.00 17.30 ? 297 GLU A C 1 ATOM 2264 O O . GLU A 1 297 ? 4.112 -26.158 11.906 1.00 18.34 ? 297 GLU A O 1 ATOM 2265 C CB . GLU A 1 297 ? 6.505 -23.969 11.612 1.00 19.43 ? 297 GLU A CB 1 ATOM 2266 C CG . GLU A 1 297 ? 7.449 -23.526 10.482 1.00 19.83 ? 297 GLU A CG 1 ATOM 2267 C CD . GLU A 1 297 ? 8.833 -23.123 10.982 1.00 22.75 ? 297 GLU A CD 1 ATOM 2268 O OE1 . GLU A 1 297 ? 9.014 -22.896 12.213 1.00 22.00 ? 297 GLU A OE1 1 ATOM 2269 O OE2 . GLU A 1 297 ? 9.744 -23.009 10.125 1.00 23.78 ? 297 GLU A OE2 1 ATOM 2270 N N . SER A 1 298 ? 3.745 -24.328 13.202 1.00 14.96 ? 298 SER A N 1 ATOM 2271 C CA . SER A 1 298 ? 2.931 -25.074 14.173 1.00 14.36 ? 298 SER A CA 1 ATOM 2272 C C . SER A 1 298 ? 1.628 -25.535 13.517 1.00 13.21 ? 298 SER A C 1 ATOM 2273 O O . SER A 1 298 ? 1.171 -26.649 13.754 1.00 13.88 ? 298 SER A O 1 ATOM 2274 C CB . SER A 1 298 ? 2.639 -24.252 15.447 1.00 13.46 ? 298 SER A CB 1 ATOM 2275 O OG . SER A 1 298 ? 1.706 -23.206 15.189 1.00 13.37 ? 298 SER A OG 1 ATOM 2276 N N . VAL A 1 299 ? 1.043 -24.696 12.668 1.00 12.78 ? 299 VAL A N 1 ATOM 2277 C CA . VAL A 1 299 ? -0.150 -25.119 11.920 1.00 14.55 ? 299 VAL A CA 1 ATOM 2278 C C . VAL A 1 299 ? 0.090 -26.403 11.103 1.00 15.60 ? 299 VAL A C 1 ATOM 2279 O O . VAL A 1 299 ? -0.719 -27.352 11.154 1.00 15.05 ? 299 VAL A O 1 ATOM 2280 C CB . VAL A 1 299 ? -0.722 -24.008 11.030 1.00 13.64 ? 299 VAL A CB 1 ATOM 2281 C CG1 . VAL A 1 299 ? -2.116 -24.439 10.439 1.00 14.06 ? 299 VAL A CG1 1 ATOM 2282 C CG2 . VAL A 1 299 ? -0.887 -22.740 11.831 1.00 13.99 ? 299 VAL A CG2 1 ATOM 2283 N N . LEU A 1 300 ? 1.209 -26.431 10.375 1.00 15.15 ? 300 LEU A N 1 ATOM 2284 C CA . LEU A 1 300 ? 1.589 -27.614 9.612 1.00 15.62 ? 300 LEU A CA 1 ATOM 2285 C C . LEU A 1 300 ? 1.862 -28.790 10.546 1.00 16.72 ? 300 LEU A C 1 ATOM 2286 O O . LEU A 1 300 ? 1.424 -29.935 10.289 1.00 18.03 ? 300 LEU A O 1 ATOM 2287 C CB . LEU A 1 300 ? 2.848 -27.335 8.744 1.00 15.21 ? 300 LEU A CB 1 ATOM 2288 C CG . LEU A 1 300 ? 3.322 -28.486 7.837 1.00 16.36 ? 300 LEU A CG 1 ATOM 2289 C CD1 . LEU A 1 300 ? 2.148 -28.995 6.968 1.00 15.50 ? 300 LEU A CD1 1 ATOM 2290 C CD2 . LEU A 1 300 ? 4.539 -28.036 6.961 1.00 16.40 ? 300 LEU A CD2 1 ATOM 2291 N N . SER A 1 301 ? 2.589 -28.513 11.629 1.00 15.38 ? 301 SER A N 1 ATOM 2292 C CA . SER A 1 301 ? 3.049 -29.583 12.526 1.00 14.82 ? 301 SER A CA 1 ATOM 2293 C C . SER A 1 301 ? 1.932 -30.475 13.079 1.00 15.08 ? 301 SER A C 1 ATOM 2294 O O . SER A 1 301 ? 2.128 -31.665 13.176 1.00 14.73 ? 301 SER A O 1 ATOM 2295 C CB . SER A 1 301 ? 3.836 -29.008 13.694 1.00 14.52 ? 301 SER A CB 1 ATOM 2296 O OG . SER A 1 301 ? 4.411 -30.051 14.430 1.00 13.53 ? 301 SER A OG 1 ATOM 2297 N N . TYR A 1 302 ? 0.779 -29.891 13.432 1.00 15.52 ? 302 TYR A N 1 ATOM 2298 C CA A TYR A 1 302 ? -0.315 -30.672 14.042 0.50 14.65 ? 302 TYR A CA 1 ATOM 2299 C CA B TYR A 1 302 ? -0.352 -30.616 14.045 0.50 14.34 ? 302 TYR A CA 1 ATOM 2300 C C . TYR A 1 302 ? -1.444 -31.018 13.049 1.00 14.28 ? 302 TYR A C 1 ATOM 2301 O O . TYR A 1 302 ? -2.484 -31.539 13.449 1.00 13.69 ? 302 TYR A O 1 ATOM 2302 C CB A TYR A 1 302 ? -0.862 -29.966 15.304 0.50 14.69 ? 302 TYR A CB 1 ATOM 2303 C CB B TYR A 1 302 ? -0.985 -29.762 15.156 0.50 13.86 ? 302 TYR A CB 1 ATOM 2304 C CG A TYR A 1 302 ? -0.152 -30.339 16.610 0.50 15.23 ? 302 TYR A CG 1 ATOM 2305 C CG B TYR A 1 302 ? -0.039 -29.444 16.284 0.50 14.06 ? 302 TYR A CG 1 ATOM 2306 C CD1 A TYR A 1 302 ? -0.105 -31.661 17.055 0.50 15.14 ? 302 TYR A CD1 1 ATOM 2307 C CD1 B TYR A 1 302 ? 0.399 -30.440 17.157 0.50 13.68 ? 302 TYR A CD1 1 ATOM 2308 C CD2 A TYR A 1 302 ? 0.470 -29.370 17.391 0.50 15.43 ? 302 TYR A CD2 1 ATOM 2309 C CD2 B TYR A 1 302 ? 0.441 -28.155 16.468 0.50 14.02 ? 302 TYR A CD2 1 ATOM 2310 C CE1 A TYR A 1 302 ? 0.537 -32.005 18.236 0.50 14.93 ? 302 TYR A CE1 1 ATOM 2311 C CE1 B TYR A 1 302 ? 1.278 -30.154 18.170 0.50 13.64 ? 302 TYR A CE1 1 ATOM 2312 C CE2 A TYR A 1 302 ? 1.126 -29.702 18.570 0.50 15.14 ? 302 TYR A CE2 1 ATOM 2313 C CE2 B TYR A 1 302 ? 1.312 -27.867 17.484 0.50 14.44 ? 302 TYR A CE2 1 ATOM 2314 C CZ A TYR A 1 302 ? 1.149 -31.017 18.996 0.50 15.54 ? 302 TYR A CZ 1 ATOM 2315 C CZ B TYR A 1 302 ? 1.729 -28.868 18.331 0.50 13.74 ? 302 TYR A CZ 1 ATOM 2316 O OH A TYR A 1 302 ? 1.790 -31.344 20.180 0.50 14.40 ? 302 TYR A OH 1 ATOM 2317 O OH B TYR A 1 302 ? 2.597 -28.569 19.343 0.50 14.72 ? 302 TYR A OH 1 ATOM 2318 N N . SER A 1 303 ? -1.212 -30.771 11.749 1.00 13.93 ? 303 SER A N 1 ATOM 2319 C CA A SER A 1 303 ? -2.249 -30.923 10.712 0.30 14.42 ? 303 SER A CA 1 ATOM 2320 C CA B SER A 1 303 ? -2.256 -30.918 10.720 0.70 13.36 ? 303 SER A CA 1 ATOM 2321 C C . SER A 1 303 ? -2.527 -32.356 10.257 1.00 14.83 ? 303 SER A C 1 ATOM 2322 O O . SER A 1 303 ? -3.635 -32.650 9.741 1.00 13.26 ? 303 SER A O 1 ATOM 2323 C CB A SER A 1 303 ? -1.878 -30.110 9.465 0.30 14.66 ? 303 SER A CB 1 ATOM 2324 C CB B SER A 1 303 ? -1.888 -30.088 9.469 0.70 12.39 ? 303 SER A CB 1 ATOM 2325 O OG A SER A 1 303 ? -1.903 -28.726 9.730 0.30 14.68 ? 303 SER A OG 1 ATOM 2326 O OG B SER A 1 303 ? -0.734 -30.621 8.840 0.70 9.40 ? 303 SER A OG 1 ATOM 2327 N N . ASN A 1 304 ? -1.515 -33.221 10.392 1.00 14.79 ? 304 ASN A N 1 ATOM 2328 C CA . ASN A 1 304 ? -1.548 -34.585 9.872 1.00 17.02 ? 304 ASN A CA 1 ATOM 2329 C C . ASN A 1 304 ? -1.545 -34.650 8.339 1.00 17.82 ? 304 ASN A C 1 ATOM 2330 O O . ASN A 1 304 ? -1.946 -35.660 7.774 1.00 18.97 ? 304 ASN A O 1 ATOM 2331 C CB . ASN A 1 304 ? -2.744 -35.373 10.426 1.00 19.12 ? 304 ASN A CB 1 ATOM 2332 C CG . ASN A 1 304 ? -2.585 -35.705 11.893 1.00 23.98 ? 304 ASN A CG 1 ATOM 2333 O OD1 . ASN A 1 304 ? -1.487 -36.042 12.338 1.00 26.43 ? 304 ASN A OD1 1 ATOM 2334 N ND2 . ASN A 1 304 ? -3.676 -35.598 12.661 1.00 25.59 ? 304 ASN A ND2 1 ATOM 2335 N N . PHE A 1 305 ? -1.127 -33.573 7.675 1.00 17.55 ? 305 PHE A N 1 ATOM 2336 C CA . PHE A 1 305 ? -1.028 -33.538 6.201 1.00 18.13 ? 305 PHE A CA 1 ATOM 2337 C C . PHE A 1 305 ? 0.265 -32.875 5.789 1.00 17.76 ? 305 PHE A C 1 ATOM 2338 O O . PHE A 1 305 ? 0.931 -32.222 6.609 1.00 15.58 ? 305 PHE A O 1 ATOM 2339 C CB . PHE A 1 305 ? -2.216 -32.780 5.574 1.00 18.70 ? 305 PHE A CB 1 ATOM 2340 C CG . PHE A 1 305 ? -3.488 -33.518 5.674 1.00 22.08 ? 305 PHE A CG 1 ATOM 2341 C CD1 . PHE A 1 305 ? -3.836 -34.454 4.695 1.00 22.21 ? 305 PHE A CD1 1 ATOM 2342 C CD2 . PHE A 1 305 ? -4.321 -33.345 6.779 1.00 23.87 ? 305 PHE A CD2 1 ATOM 2343 C CE1 . PHE A 1 305 ? -5.006 -35.181 4.799 1.00 24.19 ? 305 PHE A CE1 1 ATOM 2344 C CE2 . PHE A 1 305 ? -5.513 -34.074 6.903 1.00 26.36 ? 305 PHE A CE2 1 ATOM 2345 C CZ . PHE A 1 305 ? -5.856 -35.000 5.916 1.00 28.31 ? 305 PHE A CZ 1 ATOM 2346 N N . ASP A 1 306 ? 0.634 -33.047 4.518 1.00 18.36 ? 306 ASP A N 1 ATOM 2347 C CA . ASP A 1 306 ? 1.870 -32.461 4.054 1.00 19.77 ? 306 ASP A CA 1 ATOM 2348 C C . ASP A 1 306 ? 1.667 -30.992 3.631 1.00 18.48 ? 306 ASP A C 1 ATOM 2349 O O . ASP A 1 306 ? 2.604 -30.345 3.232 1.00 17.14 ? 306 ASP A O 1 ATOM 2350 C CB . ASP A 1 306 ? 2.539 -33.321 2.959 1.00 21.86 ? 306 ASP A CB 1 ATOM 2351 C CG . ASP A 1 306 ? 1.838 -33.226 1.611 1.00 24.09 ? 306 ASP A CG 1 ATOM 2352 O OD1 . ASP A 1 306 ? 0.749 -32.622 1.506 1.00 22.48 ? 306 ASP A OD1 1 ATOM 2353 O OD2 . ASP A 1 306 ? 2.395 -33.761 0.634 1.00 29.99 ? 306 ASP A OD2 1 ATOM 2354 N N . HIS A 1 307 ? 0.440 -30.486 3.714 1.00 17.36 ? 307 HIS A N 1 ATOM 2355 C CA . HIS A 1 307 ? 0.195 -29.043 3.546 1.00 16.69 ? 307 HIS A CA 1 ATOM 2356 C C . HIS A 1 307 ? -1.065 -28.665 4.331 1.00 15.02 ? 307 HIS A C 1 ATOM 2357 O O . HIS A 1 307 ? -1.853 -29.547 4.725 1.00 14.93 ? 307 HIS A O 1 ATOM 2358 C CB . HIS A 1 307 ? 0.047 -28.670 2.059 1.00 15.43 ? 307 HIS A CB 1 ATOM 2359 C CG . HIS A 1 307 ? -1.258 -29.102 1.457 1.00 16.12 ? 307 HIS A CG 1 ATOM 2360 N ND1 . HIS A 1 307 ? -1.492 -30.384 1.011 1.00 18.15 ? 307 HIS A ND1 1 ATOM 2361 C CD2 . HIS A 1 307 ? -2.405 -28.422 1.236 1.00 16.72 ? 307 HIS A CD2 1 ATOM 2362 C CE1 . HIS A 1 307 ? -2.717 -30.473 0.534 1.00 16.61 ? 307 HIS A CE1 1 ATOM 2363 N NE2 . HIS A 1 307 ? -3.292 -29.294 0.658 1.00 16.93 ? 307 HIS A NE2 1 ATOM 2364 N N . VAL A 1 308 ? -1.251 -27.368 4.562 1.00 15.00 ? 308 VAL A N 1 ATOM 2365 C CA . VAL A 1 308 ? -2.418 -26.879 5.302 1.00 16.37 ? 308 VAL A CA 1 ATOM 2366 C C . VAL A 1 308 ? -3.391 -26.030 4.526 1.00 16.51 ? 308 VAL A C 1 ATOM 2367 O O . VAL A 1 308 ? -4.550 -25.905 4.945 1.00 17.07 ? 308 VAL A O 1 ATOM 2368 C CB . VAL A 1 308 ? -2.040 -26.132 6.601 1.00 17.46 ? 308 VAL A CB 1 ATOM 2369 C CG1 . VAL A 1 308 ? -1.189 -27.055 7.516 1.00 17.57 ? 308 VAL A CG1 1 ATOM 2370 C CG2 . VAL A 1 308 ? -1.340 -24.850 6.315 1.00 16.29 ? 308 VAL A CG2 1 ATOM 2371 N N . ASP A 1 309 ? -2.954 -25.435 3.413 1.00 16.33 ? 309 ASP A N 1 ATOM 2372 C CA . ASP A 1 309 ? -3.863 -24.554 2.672 1.00 17.61 ? 309 ASP A CA 1 ATOM 2373 C C . ASP A 1 309 ? -4.881 -25.365 1.859 1.00 16.71 ? 309 ASP A C 1 ATOM 2374 O O . ASP A 1 309 ? -4.711 -25.570 0.653 1.00 17.36 ? 309 ASP A O 1 ATOM 2375 C CB . ASP A 1 309 ? -3.087 -23.554 1.805 1.00 19.88 ? 309 ASP A CB 1 ATOM 2376 C CG . ASP A 1 309 ? -3.977 -22.455 1.218 1.00 21.31 ? 309 ASP A CG 1 ATOM 2377 O OD1 . ASP A 1 309 ? -5.154 -22.307 1.600 1.00 21.93 ? 309 ASP A OD1 1 ATOM 2378 O OD2 . ASP A 1 309 ? -3.497 -21.718 0.349 1.00 23.62 ? 309 ASP A OD2 1 ATOM 2379 N N . PHE A 1 310 ? -5.938 -25.826 2.539 1.00 15.25 ? 310 PHE A N 1 ATOM 2380 C CA . PHE A 1 310 ? -6.999 -26.600 1.904 1.00 16.22 ? 310 PHE A CA 1 ATOM 2381 C C . PHE A 1 310 ? -8.100 -25.718 1.354 1.00 15.32 ? 310 PHE A C 1 ATOM 2382 O O . PHE A 1 310 ? -8.675 -24.884 2.081 1.00 15.78 ? 310 PHE A O 1 ATOM 2383 C CB . PHE A 1 310 ? -7.593 -27.618 2.888 1.00 17.20 ? 310 PHE A CB 1 ATOM 2384 C CG . PHE A 1 310 ? -6.834 -28.918 2.958 1.00 17.63 ? 310 PHE A CG 1 ATOM 2385 C CD1 . PHE A 1 310 ? -5.581 -28.978 3.541 1.00 18.61 ? 310 PHE A CD1 1 ATOM 2386 C CD2 . PHE A 1 310 ? -7.382 -30.085 2.438 1.00 18.29 ? 310 PHE A CD2 1 ATOM 2387 C CE1 . PHE A 1 310 ? -4.877 -30.201 3.608 1.00 20.19 ? 310 PHE A CE1 1 ATOM 2388 C CE2 . PHE A 1 310 ? -6.687 -31.307 2.507 1.00 21.12 ? 310 PHE A CE2 1 ATOM 2389 C CZ . PHE A 1 310 ? -5.436 -31.354 3.110 1.00 18.99 ? 310 PHE A CZ 1 ATOM 2390 N N . ILE A 1 311 ? -8.381 -25.888 0.069 1.00 14.79 ? 311 ILE A N 1 ATOM 2391 C CA . ILE A 1 311 ? -9.548 -25.258 -0.571 1.00 16.54 ? 311 ILE A CA 1 ATOM 2392 C C . ILE A 1 311 ? -10.479 -26.329 -1.182 1.00 18.25 ? 311 ILE A C 1 ATOM 2393 O O . ILE A 1 311 ? -11.414 -26.013 -1.912 1.00 20.05 ? 311 ILE A O 1 ATOM 2394 C CB . ILE A 1 311 ? -9.118 -24.228 -1.646 1.00 17.22 ? 311 ILE A CB 1 ATOM 2395 C CG1 . ILE A 1 311 ? -8.241 -24.892 -2.722 1.00 16.61 ? 311 ILE A CG1 1 ATOM 2396 C CG2 . ILE A 1 311 ? -8.378 -23.025 -0.984 1.00 15.23 ? 311 ILE A CG2 1 ATOM 2397 C CD1 . ILE A 1 311 ? -8.060 -24.015 -4.014 1.00 17.74 ? 311 ILE A CD1 1 ATOM 2398 N N . THR A 1 312 ? -10.181 -27.588 -0.864 1.00 18.03 ? 312 THR A N 1 ATOM 2399 C CA . THR A 1 312 ? -10.938 -28.785 -1.227 1.00 19.94 ? 312 THR A CA 1 ATOM 2400 C C . THR A 1 312 ? -11.145 -29.606 0.063 1.00 17.65 ? 312 THR A C 1 ATOM 2401 O O . THR A 1 312 ? -10.480 -29.337 1.059 1.00 16.01 ? 312 THR A O 1 ATOM 2402 C CB . THR A 1 312 ? -10.115 -29.696 -2.175 1.00 21.67 ? 312 THR A CB 1 ATOM 2403 O OG1 . THR A 1 312 ? -8.806 -29.861 -1.624 1.00 25.87 ? 312 THR A OG1 1 ATOM 2404 C CG2 . THR A 1 312 ? -10.003 -29.092 -3.554 1.00 24.14 ? 312 THR A CG2 1 ATOM 2405 N N . PRO A 1 313 ? -12.052 -30.610 0.045 1.00 17.17 ? 313 PRO A N 1 ATOM 2406 C CA . PRO A 1 313 ? -12.274 -31.479 1.221 1.00 16.00 ? 313 PRO A CA 1 ATOM 2407 C C . PRO A 1 313 ? -11.024 -32.294 1.569 1.00 16.28 ? 313 PRO A C 1 ATOM 2408 O O . PRO A 1 313 ? -10.245 -32.568 0.681 1.00 14.77 ? 313 PRO A O 1 ATOM 2409 C CB . PRO A 1 313 ? -13.372 -32.447 0.743 1.00 16.18 ? 313 PRO A CB 1 ATOM 2410 C CG . PRO A 1 313 ? -14.039 -31.777 -0.428 1.00 15.68 ? 313 PRO A CG 1 ATOM 2411 C CD . PRO A 1 313 ? -12.939 -30.969 -1.087 1.00 16.86 ? 313 PRO A CD 1 ATOM 2412 N N . GLN A 1 314 ? -10.847 -32.713 2.827 1.00 15.72 ? 314 GLN A N 1 ATOM 2413 C CA . GLN A 1 314 ? -9.819 -33.713 3.103 1.00 17.41 ? 314 GLN A CA 1 ATOM 2414 C C . GLN A 1 314 ? -10.368 -35.110 2.814 1.00 18.35 ? 314 GLN A C 1 ATOM 2415 O O . GLN A 1 314 ? -11.574 -35.251 2.535 1.00 17.29 ? 314 GLN A O 1 ATOM 2416 C CB . GLN A 1 314 ? -9.164 -33.578 4.492 1.00 19.69 ? 314 GLN A CB 1 ATOM 2417 C CG . GLN A 1 314 ? -10.034 -33.226 5.677 1.00 19.83 ? 314 GLN A CG 1 ATOM 2418 C CD . GLN A 1 314 ? -9.210 -33.133 6.972 1.00 19.45 ? 314 GLN A CD 1 ATOM 2419 O OE1 . GLN A 1 314 ? -8.839 -32.029 7.452 1.00 17.62 ? 314 GLN A OE1 1 ATOM 2420 N NE2 . GLN A 1 314 ? -8.909 -34.292 7.532 1.00 18.18 ? 314 GLN A NE2 1 ATOM 2421 N N . PRO A 1 315 ? -9.489 -36.137 2.811 1.00 17.16 ? 315 PRO A N 1 ATOM 2422 C CA . PRO A 1 315 ? -9.981 -37.496 2.558 1.00 16.41 ? 315 PRO A CA 1 ATOM 2423 C C . PRO A 1 315 ? -11.080 -37.865 3.541 1.00 16.78 ? 315 PRO A C 1 ATOM 2424 O O . PRO A 1 315 ? -11.051 -37.439 4.702 1.00 17.40 ? 315 PRO A O 1 ATOM 2425 C CB . PRO A 1 315 ? -8.733 -38.382 2.762 1.00 17.73 ? 315 PRO A CB 1 ATOM 2426 C CG . PRO A 1 315 ? -7.536 -37.425 2.438 1.00 17.27 ? 315 PRO A CG 1 ATOM 2427 C CD . PRO A 1 315 ? -8.012 -36.063 2.906 1.00 17.99 ? 315 PRO A CD 1 ATOM 2428 N N . VAL A 1 316 ? -12.028 -38.677 3.089 1.00 15.24 ? 316 VAL A N 1 ATOM 2429 C CA . VAL A 1 316 ? -13.185 -39.031 3.902 1.00 14.59 ? 316 VAL A CA 1 ATOM 2430 C C . VAL A 1 316 ? -12.788 -40.136 4.836 1.00 15.44 ? 316 VAL A C 1 ATOM 2431 O O . VAL A 1 316 ? -11.763 -40.800 4.624 1.00 13.07 ? 316 VAL A O 1 ATOM 2432 C CB . VAL A 1 316 ? -14.387 -39.497 3.033 1.00 16.11 ? 316 VAL A CB 1 ATOM 2433 C CG1 . VAL A 1 316 ? -14.874 -38.348 2.111 1.00 13.67 ? 316 VAL A CG1 1 ATOM 2434 C CG2 . VAL A 1 316 ? -14.021 -40.756 2.205 1.00 14.86 ? 316 VAL A CG2 1 ATOM 2435 N N . GLU A 1 317 ? -13.602 -40.324 5.877 1.00 14.47 ? 317 GLU A N 1 ATOM 2436 C CA . GLU A 1 317 ? -13.381 -41.376 6.850 1.00 15.25 ? 317 GLU A CA 1 ATOM 2437 C C . GLU A 1 317 ? -14.710 -42.040 7.152 1.00 15.35 ? 317 GLU A C 1 ATOM 2438 O O . GLU A 1 317 ? -15.777 -41.537 6.769 1.00 15.33 ? 317 GLU A O 1 ATOM 2439 C CB . GLU A 1 317 ? -12.748 -40.810 8.144 1.00 14.81 ? 317 GLU A CB 1 ATOM 2440 C CG . GLU A 1 317 ? -11.411 -40.091 7.896 1.00 15.91 ? 317 GLU A CG 1 ATOM 2441 C CD . GLU A 1 317 ? -10.732 -39.565 9.181 1.00 17.43 ? 317 GLU A CD 1 ATOM 2442 O OE1 . GLU A 1 317 ? -11.097 -39.949 10.314 1.00 17.86 ? 317 GLU A OE1 1 ATOM 2443 O OE2 . GLU A 1 317 ? -9.840 -38.727 9.044 1.00 20.48 ? 317 GLU A OE2 1 ATOM 2444 N N . ASN A 1 318 ? -14.640 -43.155 7.871 1.00 15.04 ? 318 ASN A N 1 ATOM 2445 C CA . ASN A 1 318 ? -15.808 -43.995 8.100 1.00 14.74 ? 318 ASN A CA 1 ATOM 2446 C C . ASN A 1 318 ? -15.870 -44.371 9.590 1.00 13.50 ? 318 ASN A C 1 ATOM 2447 O O . ASN A 1 318 ? -15.114 -45.241 10.052 1.00 11.53 ? 318 ASN A O 1 ATOM 2448 C CB . ASN A 1 318 ? -15.693 -45.247 7.209 1.00 15.18 ? 318 ASN A CB 1 ATOM 2449 C CG . ASN A 1 318 ? -16.849 -46.202 7.383 1.00 16.44 ? 318 ASN A CG 1 ATOM 2450 O OD1 . ASN A 1 318 ? -17.968 -45.800 7.704 1.00 16.83 ? 318 ASN A OD1 1 ATOM 2451 N ND2 . ASN A 1 318 ? -16.580 -47.493 7.184 1.00 19.08 ? 318 ASN A ND2 1 ATOM 2452 N N . PHE A 1 319 ? -16.752 -43.727 10.355 1.00 12.80 ? 319 PHE A N 1 ATOM 2453 C CA . PHE A 1 319 ? -16.525 -43.743 11.794 1.00 12.91 ? 319 PHE A CA 1 ATOM 2454 C C . PHE A 1 319 ? -17.726 -43.375 12.647 1.00 14.07 ? 319 PHE A C 1 ATOM 2455 O O . PHE A 1 319 ? -18.778 -42.941 12.146 1.00 14.04 ? 319 PHE A O 1 ATOM 2456 C CB . PHE A 1 319 ? -15.356 -42.771 12.128 1.00 13.39 ? 319 PHE A CB 1 ATOM 2457 C CG . PHE A 1 319 ? -15.724 -41.291 11.949 1.00 13.40 ? 319 PHE A CG 1 ATOM 2458 C CD1 . PHE A 1 319 ? -15.611 -40.672 10.706 1.00 12.71 ? 319 PHE A CD1 1 ATOM 2459 C CD2 . PHE A 1 319 ? -16.180 -40.541 13.029 1.00 12.80 ? 319 PHE A CD2 1 ATOM 2460 C CE1 . PHE A 1 319 ? -15.951 -39.317 10.551 1.00 13.86 ? 319 PHE A CE1 1 ATOM 2461 C CE2 . PHE A 1 319 ? -16.519 -39.180 12.886 1.00 13.24 ? 319 PHE A CE2 1 ATOM 2462 C CZ . PHE A 1 319 ? -16.410 -38.574 11.668 1.00 13.19 ? 319 PHE A CZ 1 ATOM 2463 N N . TYR A 1 320 ? -17.540 -43.560 13.951 1.00 12.88 ? 320 TYR A N 1 ATOM 2464 C CA . TYR A 1 320 ? -18.460 -43.106 14.954 1.00 12.82 ? 320 TYR A CA 1 ATOM 2465 C C . TYR A 1 320 ? -17.636 -42.382 16.016 1.00 12.81 ? 320 TYR A C 1 ATOM 2466 O O . TYR A 1 320 ? -16.462 -42.725 16.252 1.00 13.07 ? 320 TYR A O 1 ATOM 2467 C CB . TYR A 1 320 ? -19.200 -44.279 15.591 1.00 13.38 ? 320 TYR A CB 1 ATOM 2468 C CG . TYR A 1 320 ? -20.215 -43.846 16.633 1.00 13.37 ? 320 TYR A CG 1 ATOM 2469 C CD1 . TYR A 1 320 ? -21.227 -42.918 16.322 1.00 13.23 ? 320 TYR A CD1 1 ATOM 2470 C CD2 . TYR A 1 320 ? -20.179 -44.365 17.914 1.00 13.38 ? 320 TYR A CD2 1 ATOM 2471 C CE1 . TYR A 1 320 ? -22.167 -42.529 17.262 1.00 12.26 ? 320 TYR A CE1 1 ATOM 2472 C CE2 . TYR A 1 320 ? -21.110 -43.988 18.864 1.00 12.70 ? 320 TYR A CE2 1 ATOM 2473 C CZ . TYR A 1 320 ? -22.099 -43.068 18.539 1.00 13.13 ? 320 TYR A CZ 1 ATOM 2474 O OH . TYR A 1 320 ? -23.008 -42.695 19.510 1.00 11.57 ? 320 TYR A OH 1 ATOM 2475 N N . ALA A 1 321 ? -18.241 -41.380 16.645 1.00 11.25 ? 321 ALA A N 1 ATOM 2476 C CA . ALA A 1 321 ? -17.541 -40.570 17.635 1.00 10.83 ? 321 ALA A CA 1 ATOM 2477 C C . ALA A 1 321 ? -18.520 -40.131 18.743 1.00 11.50 ? 321 ALA A C 1 ATOM 2478 O O . ALA A 1 321 ? -19.750 -40.051 18.526 1.00 12.10 ? 321 ALA A O 1 ATOM 2479 C CB . ALA A 1 321 ? -16.901 -39.346 16.953 1.00 8.76 ? 321 ALA A CB 1 ATOM 2480 N N . LYS A 1 322 ? -17.968 -39.834 19.917 1.00 11.36 ? 322 LYS A N 1 ATOM 2481 C CA . LYS A 1 322 ? -18.744 -39.383 21.055 1.00 11.23 ? 322 LYS A CA 1 ATOM 2482 C C . LYS A 1 322 ? -17.902 -38.371 21.798 1.00 11.26 ? 322 LYS A C 1 ATOM 2483 O O . LYS A 1 322 ? -16.703 -38.274 21.551 1.00 10.55 ? 322 LYS A O 1 ATOM 2484 C CB . LYS A 1 322 ? -19.100 -40.553 21.981 1.00 11.23 ? 322 LYS A CB 1 ATOM 2485 C CG . LYS A 1 322 ? -20.115 -41.542 21.409 1.00 10.97 ? 322 LYS A CG 1 ATOM 2486 C CD . LYS A 1 322 ? -20.637 -42.565 22.489 1.00 10.88 ? 322 LYS A CD 1 ATOM 2487 C CE . LYS A 1 322 ? -21.828 -42.037 23.326 1.00 10.62 ? 322 LYS A CE 1 ATOM 2488 N NZ . LYS A 1 322 ? -23.094 -42.116 22.495 1.00 10.47 ? 322 LYS A NZ 1 ATOM 2489 N N . SER A 1 323 ? -18.510 -37.659 22.742 1.00 12.09 ? 323 SER A N 1 ATOM 2490 C CA . SER A 1 323 ? -17.773 -36.681 23.529 1.00 13.09 ? 323 SER A CA 1 ATOM 2491 C C . SER A 1 323 ? -18.280 -36.604 24.965 1.00 12.95 ? 323 SER A C 1 ATOM 2492 O O . SER A 1 323 ? -19.339 -37.124 25.287 1.00 11.35 ? 323 SER A O 1 ATOM 2493 C CB . SER A 1 323 ? -17.843 -35.276 22.877 1.00 13.71 ? 323 SER A CB 1 ATOM 2494 O OG . SER A 1 323 ? -19.124 -34.664 23.092 1.00 15.14 ? 323 SER A OG 1 ATOM 2495 N N . LEU A 1 324 ? -17.491 -35.926 25.801 1.00 13.10 ? 324 LEU A N 1 ATOM 2496 C CA . LEU A 1 324 ? -17.852 -35.537 27.162 1.00 12.65 ? 324 LEU A CA 1 ATOM 2497 C C . LEU A 1 324 ? -17.120 -34.267 27.495 1.00 13.00 ? 324 LEU A C 1 ATOM 2498 O O . LEU A 1 324 ? -15.958 -34.081 27.082 1.00 12.84 ? 324 LEU A O 1 ATOM 2499 C CB . LEU A 1 324 ? -17.446 -36.609 28.182 1.00 12.24 ? 324 LEU A CB 1 ATOM 2500 C CG . LEU A 1 324 ? -18.353 -37.848 28.261 1.00 13.06 ? 324 LEU A CG 1 ATOM 2501 C CD1 . LEU A 1 324 ? -17.756 -38.901 29.218 1.00 12.23 ? 324 LEU A CD1 1 ATOM 2502 C CD2 . LEU A 1 324 ? -19.798 -37.454 28.667 1.00 12.40 ? 324 LEU A CD2 1 ATOM 2503 N N . THR A 1 325 ? -17.797 -33.397 28.246 1.00 12.73 ? 325 THR A N 1 ATOM 2504 C CA . THR A 1 325 ? -17.139 -32.285 28.893 1.00 12.79 ? 325 THR A CA 1 ATOM 2505 C C . THR A 1 325 ? -17.377 -32.531 30.406 1.00 12.81 ? 325 THR A C 1 ATOM 2506 O O . THR A 1 325 ? -18.478 -32.840 30.807 1.00 13.23 ? 325 THR A O 1 ATOM 2507 C CB . THR A 1 325 ? -17.678 -30.907 28.388 1.00 13.50 ? 325 THR A CB 1 ATOM 2508 O OG1 . THR A 1 325 ? -19.082 -30.758 28.711 1.00 13.25 ? 325 THR A OG1 1 ATOM 2509 C CG2 . THR A 1 325 ? -17.508 -30.768 26.837 1.00 12.64 ? 325 THR A CG2 1 ATOM 2510 N N . LEU A 1 326 ? -16.341 -32.424 31.234 1.00 12.67 ? 326 LEU A N 1 ATOM 2511 C CA . LEU A 1 326 ? -16.502 -32.745 32.664 1.00 12.44 ? 326 LEU A CA 1 ATOM 2512 C C . LEU A 1 326 ? -15.943 -31.670 33.544 1.00 13.24 ? 326 LEU A C 1 ATOM 2513 O O . LEU A 1 326 ? -14.873 -31.128 33.244 1.00 11.46 ? 326 LEU A O 1 ATOM 2514 C CB . LEU A 1 326 ? -15.774 -34.042 33.024 1.00 11.76 ? 326 LEU A CB 1 ATOM 2515 C CG . LEU A 1 326 ? -15.913 -35.272 32.118 1.00 12.10 ? 326 LEU A CG 1 ATOM 2516 C CD1 . LEU A 1 326 ? -14.855 -36.320 32.573 1.00 12.28 ? 326 LEU A CD1 1 ATOM 2517 C CD2 . LEU A 1 326 ? -17.349 -35.846 32.156 1.00 11.09 ? 326 LEU A CD2 1 ATOM 2518 N N . LYS A 1 327 ? -16.646 -31.391 34.654 1.00 13.67 ? 327 LYS A N 1 ATOM 2519 C CA . LYS A 1 327 ? -16.068 -30.545 35.695 1.00 15.50 ? 327 LYS A CA 1 ATOM 2520 C C . LYS A 1 327 ? -14.796 -31.181 36.238 1.00 14.42 ? 327 LYS A C 1 ATOM 2521 O O . LYS A 1 327 ? -13.816 -30.493 36.488 1.00 16.11 ? 327 LYS A O 1 ATOM 2522 C CB . LYS A 1 327 ? -17.060 -30.306 36.847 1.00 15.23 ? 327 LYS A CB 1 ATOM 2523 C CG . LYS A 1 327 ? -18.298 -29.579 36.391 1.00 17.85 ? 327 LYS A CG 1 ATOM 2524 C CD . LYS A 1 327 ? -19.137 -29.057 37.570 1.00 19.44 ? 327 LYS A CD 1 ATOM 2525 C CE . LYS A 1 327 ? -20.309 -28.282 37.026 1.00 20.62 ? 327 LYS A CE 1 ATOM 2526 N NZ . LYS A 1 327 ? -21.460 -28.277 38.003 1.00 22.39 ? 327 LYS A NZ 1 ATOM 2527 N N . SER A 1 328 ? -14.831 -32.490 36.426 1.00 12.90 ? 328 SER A N 1 ATOM 2528 C CA . SER A 1 328 ? -13.703 -33.234 36.984 1.00 13.68 ? 328 SER A CA 1 ATOM 2529 C C . SER A 1 328 ? -13.826 -34.665 36.586 1.00 13.45 ? 328 SER A C 1 ATOM 2530 O O . SER A 1 328 ? -14.943 -35.200 36.538 1.00 13.58 ? 328 SER A O 1 ATOM 2531 C CB . SER A 1 328 ? -13.730 -33.212 38.518 1.00 14.18 ? 328 SER A CB 1 ATOM 2532 O OG . SER A 1 328 ? -12.636 -33.984 39.028 1.00 14.88 ? 328 SER A OG 1 ATOM 2533 N N . ILE A 1 329 ? -12.703 -35.338 36.380 1.00 13.46 ? 329 ILE A N 1 ATOM 2534 C CA . ILE A 1 329 ? -12.814 -36.789 36.138 1.00 14.96 ? 329 ILE A CA 1 ATOM 2535 C C . ILE A 1 329 ? -12.576 -37.616 37.434 1.00 15.84 ? 329 ILE A C 1 ATOM 2536 O O . ILE A 1 329 ? -12.729 -38.844 37.449 1.00 16.23 ? 329 ILE A O 1 ATOM 2537 C CB . ILE A 1 329 ? -11.884 -37.261 34.977 1.00 14.88 ? 329 ILE A CB 1 ATOM 2538 C CG1 . ILE A 1 329 ? -12.427 -38.566 34.351 1.00 16.26 ? 329 ILE A CG1 1 ATOM 2539 C CG2 . ILE A 1 329 ? -10.440 -37.368 35.465 1.00 13.53 ? 329 ILE A CG2 1 ATOM 2540 C CD1 . ILE A 1 329 ? -11.683 -39.045 33.086 1.00 18.28 ? 329 ILE A CD1 1 ATOM 2541 N N . LYS A 1 330 ? -12.180 -36.939 38.506 1.00 16.76 ? 330 LYS A N 1 ATOM 2542 C CA . LYS A 1 330 ? -11.827 -37.628 39.775 1.00 19.28 ? 330 LYS A CA 1 ATOM 2543 C C . LYS A 1 330 ? -12.952 -38.528 40.325 1.00 18.62 ? 330 LYS A C 1 ATOM 2544 O O . LYS A 1 330 ? -14.145 -38.255 40.149 1.00 20.41 ? 330 LYS A O 1 ATOM 2545 C CB . LYS A 1 330 ? -11.354 -36.623 40.843 1.00 16.32 ? 330 LYS A CB 1 ATOM 2546 C CG . LYS A 1 330 ? -10.039 -35.947 40.489 1.00 15.48 ? 330 LYS A CG 1 ATOM 2547 C CD . LYS A 1 330 ? -9.686 -34.868 41.510 1.00 17.52 ? 330 LYS A CD 1 ATOM 2548 C CE . LYS A 1 330 ? -8.356 -34.225 41.158 1.00 16.61 ? 330 LYS A CE 1 ATOM 2549 N NZ . LYS A 1 330 ? -7.955 -33.199 42.154 1.00 15.68 ? 330 LYS A NZ 1 ATOM 2550 N N . GLY A 1 331 ? -12.559 -39.614 40.970 1.00 19.97 ? 331 GLY A N 1 ATOM 2551 C CA . GLY A 1 331 ? -13.504 -40.436 41.726 1.00 20.27 ? 331 GLY A CA 1 ATOM 2552 C C . GLY A 1 331 ? -13.808 -41.729 41.002 1.00 21.66 ? 331 GLY A C 1 ATOM 2553 O O . GLY A 1 331 ? -12.936 -42.346 40.378 1.00 18.23 ? 331 GLY A O 1 ATOM 2554 N N . ASP A 1 332 ? -15.061 -42.139 41.064 1.00 23.15 ? 332 ASP A N 1 ATOM 2555 C CA . ASP A 1 332 ? -15.449 -43.344 40.364 1.00 24.95 ? 332 ASP A CA 1 ATOM 2556 C C . ASP A 1 332 ? -15.383 -43.196 38.845 1.00 24.29 ? 332 ASP A C 1 ATOM 2557 O O . ASP A 1 332 ? -15.184 -44.194 38.154 1.00 26.53 ? 332 ASP A O 1 ATOM 2558 C CB . ASP A 1 332 ? -16.820 -43.812 40.825 1.00 26.73 ? 332 ASP A CB 1 ATOM 2559 C CG . ASP A 1 332 ? -16.764 -44.495 42.179 1.00 30.98 ? 332 ASP A CG 1 ATOM 2560 O OD1 . ASP A 1 332 ? -15.668 -44.954 42.575 1.00 30.96 ? 332 ASP A OD1 1 ATOM 2561 O OD2 . ASP A 1 332 ? -17.810 -44.565 42.849 1.00 35.61 ? 332 ASP A OD2 1 ATOM 2562 N N . ALA A 1 333 ? -15.514 -41.963 38.347 1.00 22.49 ? 333 ALA A N 1 ATOM 2563 C CA . ALA A 1 333 ? -15.453 -41.682 36.902 1.00 20.80 ? 333 ALA A CA 1 ATOM 2564 C C . ALA A 1 333 ? -14.133 -42.158 36.287 1.00 18.14 ? 333 ALA A C 1 ATOM 2565 O O . ALA A 1 333 ? -14.121 -42.932 35.323 1.00 17.85 ? 333 ALA A O 1 ATOM 2566 C CB . ALA A 1 333 ? -15.686 -40.190 36.617 1.00 19.43 ? 333 ALA A CB 1 ATOM 2567 N N . VAL A 1 334 ? -13.021 -41.732 36.866 1.00 18.11 ? 334 VAL A N 1 ATOM 2568 C CA . VAL A 1 334 ? -11.733 -42.139 36.331 1.00 18.33 ? 334 VAL A CA 1 ATOM 2569 C C . VAL A 1 334 ? -11.472 -43.633 36.585 1.00 18.73 ? 334 VAL A C 1 ATOM 2570 O O . VAL A 1 334 ? -10.887 -44.328 35.742 1.00 18.26 ? 334 VAL A O 1 ATOM 2571 C CB . VAL A 1 334 ? -10.554 -41.256 36.823 1.00 17.82 ? 334 VAL A CB 1 ATOM 2572 C CG1 . VAL A 1 334 ? -10.369 -41.343 38.393 1.00 17.75 ? 334 VAL A CG1 1 ATOM 2573 C CG2 . VAL A 1 334 ? -9.273 -41.623 36.058 1.00 16.70 ? 334 VAL A CG2 1 ATOM 2574 N N . LYS A 1 335 ? -11.928 -44.126 37.730 1.00 20.11 ? 335 LYS A N 1 ATOM 2575 C CA . LYS A 1 335 ? -11.821 -45.549 38.026 1.00 19.71 ? 335 LYS A CA 1 ATOM 2576 C C . LYS A 1 335 ? -12.530 -46.355 36.947 1.00 17.64 ? 335 LYS A C 1 ATOM 2577 O O . LYS A 1 335 ? -11.960 -47.296 36.417 1.00 17.58 ? 335 LYS A O 1 ATOM 2578 C CB . LYS A 1 335 ? -12.389 -45.874 39.427 1.00 19.29 ? 335 LYS A CB 1 ATOM 2579 C CG . LYS A 1 335 ? -12.033 -47.313 39.916 1.00 21.32 ? 335 LYS A CG 1 ATOM 2580 C CD . LYS A 1 335 ? -12.831 -47.691 41.194 0.50 21.16 ? 335 LYS A CD 1 ATOM 2581 C CE . LYS A 1 335 ? -12.862 -46.525 42.213 0.50 21.42 ? 335 LYS A CE 1 ATOM 2582 N NZ . LYS A 1 335 ? -13.576 -46.825 43.494 0.50 21.64 ? 335 LYS A NZ 1 ATOM 2583 N N . ASN A 1 336 ? -13.768 -45.969 36.619 1.00 17.72 ? 336 ASN A N 1 ATOM 2584 C CA . ASN A 1 336 ? -14.567 -46.690 35.626 1.00 16.20 ? 336 ASN A CA 1 ATOM 2585 C C . ASN A 1 336 ? -13.937 -46.492 34.257 1.00 16.52 ? 336 ASN A C 1 ATOM 2586 O O . ASN A 1 336 ? -13.870 -47.423 33.473 1.00 16.25 ? 336 ASN A O 1 ATOM 2587 C CB . ASN A 1 336 ? -16.020 -46.178 35.597 1.00 16.41 ? 336 ASN A CB 1 ATOM 2588 C CG . ASN A 1 336 ? -16.757 -46.428 36.895 1.00 17.33 ? 336 ASN A CG 1 ATOM 2589 O OD1 . ASN A 1 336 ? -16.299 -47.215 37.721 1.00 18.85 ? 336 ASN A OD1 1 ATOM 2590 N ND2 . ASN A 1 336 ? -17.902 -45.759 37.090 1.00 16.51 ? 336 ASN A ND2 1 ATOM 2591 N N . PHE A 1 337 ? -13.466 -45.280 33.982 1.00 15.97 ? 337 PHE A N 1 ATOM 2592 C CA . PHE A 1 337 ? -12.835 -44.981 32.693 1.00 15.94 ? 337 PHE A CA 1 ATOM 2593 C C . PHE A 1 337 ? -11.641 -45.911 32.434 1.00 16.01 ? 337 PHE A C 1 ATOM 2594 O O . PHE A 1 337 ? -11.528 -46.515 31.373 1.00 16.13 ? 337 PHE A O 1 ATOM 2595 C CB . PHE A 1 337 ? -12.393 -43.508 32.632 1.00 15.22 ? 337 PHE A CB 1 ATOM 2596 C CG . PHE A 1 337 ? -11.676 -43.140 31.357 1.00 15.39 ? 337 PHE A CG 1 ATOM 2597 C CD1 . PHE A 1 337 ? -10.298 -43.313 31.235 1.00 15.44 ? 337 PHE A CD1 1 ATOM 2598 C CD2 . PHE A 1 337 ? -12.374 -42.613 30.291 1.00 15.77 ? 337 PHE A CD2 1 ATOM 2599 C CE1 . PHE A 1 337 ? -9.617 -42.967 30.062 1.00 15.01 ? 337 PHE A CE1 1 ATOM 2600 C CE2 . PHE A 1 337 ? -11.701 -42.267 29.108 1.00 15.85 ? 337 PHE A CE2 1 ATOM 2601 C CZ . PHE A 1 337 ? -10.327 -42.442 29.002 1.00 15.64 ? 337 PHE A CZ 1 ATOM 2602 N N . VAL A 1 338 ? -10.748 -46.002 33.418 1.00 17.39 ? 338 VAL A N 1 ATOM 2603 C CA . VAL A 1 338 ? -9.537 -46.823 33.332 1.00 18.18 ? 338 VAL A CA 1 ATOM 2604 C C . VAL A 1 338 ? -9.829 -48.343 33.302 1.00 19.56 ? 338 VAL A C 1 ATOM 2605 O O . VAL A 1 338 ? -9.130 -49.080 32.595 1.00 18.46 ? 338 VAL A O 1 ATOM 2606 C CB . VAL A 1 338 ? -8.532 -46.422 34.442 1.00 19.87 ? 338 VAL A CB 1 ATOM 2607 C CG1 . VAL A 1 338 ? -7.352 -47.391 34.515 1.00 16.85 ? 338 VAL A CG1 1 ATOM 2608 C CG2 . VAL A 1 338 ? -8.014 -44.963 34.179 1.00 18.94 ? 338 VAL A CG2 1 ATOM 2609 N N . ASP A 1 339 ? -10.851 -48.792 34.049 1.00 17.77 ? 339 ASP A N 1 ATOM 2610 C CA . ASP A 1 339 ? -11.314 -50.196 33.982 1.00 18.86 ? 339 ASP A CA 1 ATOM 2611 C C . ASP A 1 339 ? -11.653 -50.592 32.528 1.00 20.36 ? 339 ASP A C 1 ATOM 2612 O O . ASP A 1 339 ? -11.141 -51.592 32.004 1.00 18.03 ? 339 ASP A O 1 ATOM 2613 C CB . ASP A 1 339 ? -12.523 -50.418 34.908 1.00 17.48 ? 339 ASP A CB 1 ATOM 2614 C CG . ASP A 1 339 ? -12.119 -50.638 36.385 1.00 20.03 ? 339 ASP A CG 1 ATOM 2615 O OD1 . ASP A 1 339 ? -10.935 -50.886 36.695 1.00 18.28 ? 339 ASP A OD1 1 ATOM 2616 O OD2 . ASP A 1 339 ? -13.007 -50.569 37.246 1.00 21.36 ? 339 ASP A OD2 1 ATOM 2617 N N . TYR A 1 340 ? -12.484 -49.763 31.877 1.00 19.21 ? 340 TYR A N 1 ATOM 2618 C CA . TYR A 1 340 ? -12.902 -49.971 30.492 1.00 17.91 ? 340 TYR A CA 1 ATOM 2619 C C . TYR A 1 340 ? -11.721 -49.859 29.537 1.00 17.35 ? 340 TYR A C 1 ATOM 2620 O O . TYR A 1 340 ? -11.563 -50.664 28.636 1.00 16.71 ? 340 TYR A O 1 ATOM 2621 C CB . TYR A 1 340 ? -13.959 -48.908 30.143 1.00 18.57 ? 340 TYR A CB 1 ATOM 2622 C CG . TYR A 1 340 ? -14.865 -49.255 28.979 1.00 16.71 ? 340 TYR A CG 1 ATOM 2623 C CD1 . TYR A 1 340 ? -14.514 -48.933 27.669 1.00 17.94 ? 340 TYR A CD1 1 ATOM 2624 C CD2 . TYR A 1 340 ? -16.080 -49.903 29.198 1.00 16.59 ? 340 TYR A CD2 1 ATOM 2625 C CE1 . TYR A 1 340 ? -15.368 -49.253 26.592 1.00 17.11 ? 340 TYR A CE1 1 ATOM 2626 C CE2 . TYR A 1 340 ? -16.942 -50.204 28.153 1.00 17.38 ? 340 TYR A CE2 1 ATOM 2627 C CZ . TYR A 1 340 ? -16.577 -49.875 26.851 1.00 17.75 ? 340 TYR A CZ 1 ATOM 2628 O OH . TYR A 1 340 ? -17.426 -50.196 25.819 1.00 19.30 ? 340 TYR A OH 1 ATOM 2629 N N . TYR A 1 341 ? -10.885 -48.847 29.748 1.00 17.30 ? 341 TYR A N 1 ATOM 2630 C CA . TYR A 1 341 ? -9.664 -48.639 28.957 1.00 17.06 ? 341 TYR A CA 1 ATOM 2631 C C . TYR A 1 341 ? -8.911 -49.970 28.811 1.00 19.35 ? 341 TYR A C 1 ATOM 2632 O O . TYR A 1 341 ? -8.594 -50.402 27.683 1.00 18.55 ? 341 TYR A O 1 ATOM 2633 C CB . TYR A 1 341 ? -8.785 -47.642 29.709 1.00 13.97 ? 341 TYR A CB 1 ATOM 2634 C CG . TYR A 1 341 ? -7.617 -47.027 28.994 1.00 13.80 ? 341 TYR A CG 1 ATOM 2635 C CD1 . TYR A 1 341 ? -7.188 -47.464 27.719 1.00 12.53 ? 341 TYR A CD1 1 ATOM 2636 C CD2 . TYR A 1 341 ? -6.913 -45.981 29.607 1.00 12.24 ? 341 TYR A CD2 1 ATOM 2637 C CE1 . TYR A 1 341 ? -6.084 -46.862 27.083 1.00 12.92 ? 341 TYR A CE1 1 ATOM 2638 C CE2 . TYR A 1 341 ? -5.820 -45.395 28.987 1.00 13.06 ? 341 TYR A CE2 1 ATOM 2639 C CZ . TYR A 1 341 ? -5.405 -45.826 27.736 1.00 12.61 ? 341 TYR A CZ 1 ATOM 2640 O OH . TYR A 1 341 ? -4.343 -45.169 27.147 1.00 12.78 ? 341 TYR A OH 1 ATOM 2641 N N . PHE A 1 342 ? -8.631 -50.603 29.956 1.00 18.46 ? 342 PHE A N 1 ATOM 2642 C CA . PHE A 1 342 ? -7.780 -51.808 29.998 1.00 20.42 ? 342 PHE A CA 1 ATOM 2643 C C . PHE A 1 342 ? -8.516 -53.118 29.716 1.00 18.43 ? 342 PHE A C 1 ATOM 2644 O O . PHE A 1 342 ? -7.975 -53.967 29.019 1.00 15.87 ? 342 PHE A O 1 ATOM 2645 C CB . PHE A 1 342 ? -6.944 -51.888 31.298 1.00 19.34 ? 342 PHE A CB 1 ATOM 2646 C CG . PHE A 1 342 ? -5.765 -50.956 31.300 1.00 20.21 ? 342 PHE A CG 1 ATOM 2647 C CD1 . PHE A 1 342 ? -5.926 -49.608 31.651 1.00 20.93 ? 342 PHE A CD1 1 ATOM 2648 C CD2 . PHE A 1 342 ? -4.506 -51.400 30.910 1.00 20.69 ? 342 PHE A CD2 1 ATOM 2649 C CE1 . PHE A 1 342 ? -4.845 -48.720 31.619 1.00 21.16 ? 342 PHE A CE1 1 ATOM 2650 C CE2 . PHE A 1 342 ? -3.405 -50.512 30.877 1.00 21.35 ? 342 PHE A CE2 1 ATOM 2651 C CZ . PHE A 1 342 ? -3.578 -49.174 31.242 1.00 20.09 ? 342 PHE A CZ 1 ATOM 2652 N N . ASP A 1 343 ? -9.730 -53.270 30.245 1.00 17.70 ? 343 ASP A N 1 ATOM 2653 C CA . ASP A 1 343 ? -10.490 -54.516 30.073 1.00 20.22 ? 343 ASP A CA 1 ATOM 2654 C C . ASP A 1 343 ? -11.276 -54.611 28.749 1.00 20.54 ? 343 ASP A C 1 ATOM 2655 O O . ASP A 1 343 ? -11.534 -55.721 28.265 1.00 19.06 ? 343 ASP A O 1 ATOM 2656 C CB . ASP A 1 343 ? -11.447 -54.742 31.246 1.00 19.92 ? 343 ASP A CB 1 ATOM 2657 C CG . ASP A 1 343 ? -10.729 -54.702 32.603 1.00 22.53 ? 343 ASP A CG 1 ATOM 2658 O OD1 . ASP A 1 343 ? -9.492 -54.893 32.643 1.00 22.85 ? 343 ASP A OD1 1 ATOM 2659 O OD2 . ASP A 1 343 ? -11.403 -54.459 33.618 1.00 21.36 ? 343 ASP A OD2 1 ATOM 2660 N N . VAL A 1 344 ? -11.655 -53.459 28.177 1.00 19.89 ? 344 VAL A N 1 ATOM 2661 C CA . VAL A 1 344 ? -12.378 -53.430 26.877 1.00 18.66 ? 344 VAL A CA 1 ATOM 2662 C C . VAL A 1 344 ? -11.552 -52.778 25.751 1.00 19.66 ? 344 VAL A C 1 ATOM 2663 O O . VAL A 1 344 ? -11.099 -53.457 24.813 1.00 19.74 ? 344 VAL A O 1 ATOM 2664 C CB . VAL A 1 344 ? -13.784 -52.770 27.010 1.00 18.13 ? 344 VAL A CB 1 ATOM 2665 C CG1 . VAL A 1 344 ? -14.534 -52.842 25.678 1.00 17.26 ? 344 VAL A CG1 1 ATOM 2666 C CG2 . VAL A 1 344 ? -14.628 -53.472 28.134 1.00 17.96 ? 344 VAL A CG2 1 ATOM 2667 N N . SER A 1 345 ? -11.332 -51.472 25.860 1.00 17.62 ? 345 SER A N 1 ATOM 2668 C CA . SER A 1 345 ? -10.725 -50.705 24.769 1.00 17.50 ? 345 SER A CA 1 ATOM 2669 C C . SER A 1 345 ? -9.436 -51.281 24.205 1.00 16.36 ? 345 SER A C 1 ATOM 2670 O O . SER A 1 345 ? -9.299 -51.396 22.980 1.00 15.21 ? 345 SER A O 1 ATOM 2671 C CB . SER A 1 345 ? -10.550 -49.221 25.150 1.00 16.76 ? 345 SER A CB 1 ATOM 2672 O OG . SER A 1 345 ? -11.715 -48.758 25.798 1.00 17.92 ? 345 SER A OG 1 ATOM 2673 N N . ASN A 1 346 ? -8.489 -51.615 25.081 1.00 16.20 ? 346 ASN A N 1 ATOM 2674 C CA . ASN A 1 346 ? -7.176 -52.127 24.633 1.00 18.67 ? 346 ASN A CA 1 ATOM 2675 C C . ASN A 1 346 ? -7.247 -53.522 23.970 1.00 17.49 ? 346 ASN A C 1 ATOM 2676 O O . ASN A 1 346 ? -6.284 -53.977 23.339 1.00 16.81 ? 346 ASN A O 1 ATOM 2677 C CB . ASN A 1 346 ? -6.110 -52.073 25.768 1.00 18.53 ? 346 ASN A CB 1 ATOM 2678 C CG . ASN A 1 346 ? -5.681 -50.630 26.123 1.00 21.51 ? 346 ASN A CG 1 ATOM 2679 O OD1 . ASN A 1 346 ? -6.124 -49.642 25.510 1.00 20.57 ? 346 ASN A OD1 1 ATOM 2680 N ND2 . ASN A 1 346 ? -4.826 -50.507 27.149 1.00 23.66 ? 346 ASN A ND2 1 ATOM 2681 N N . LYS A 1 347 ? -8.408 -54.159 24.072 1.00 19.05 ? 347 LYS A N 1 ATOM 2682 C CA . LYS A 1 347 ? -8.668 -55.459 23.423 1.00 22.03 ? 347 LYS A CA 1 ATOM 2683 C C . LYS A 1 347 ? -9.481 -55.288 22.127 1.00 22.84 ? 347 LYS A C 1 ATOM 2684 O O . LYS A 1 347 ? -9.752 -56.264 21.404 1.00 20.15 ? 347 LYS A O 1 ATOM 2685 C CB . LYS A 1 347 ? -9.393 -56.409 24.386 1.00 21.75 ? 347 LYS A CB 1 ATOM 2686 C CG . LYS A 1 347 ? -8.530 -56.854 25.571 1.00 26.19 ? 347 LYS A CG 1 ATOM 2687 C CD . LYS A 1 347 ? -9.323 -57.755 26.525 1.00 29.30 ? 347 LYS A CD 1 ATOM 2688 C CE . LYS A 1 347 ? -8.802 -57.700 27.973 1.00 34.44 ? 347 LYS A CE 1 ATOM 2689 N NZ . LYS A 1 347 ? -9.904 -57.977 28.992 1.00 32.06 ? 347 LYS A NZ 1 ATOM 2690 N N . VAL A 1 348 ? -9.886 -54.050 21.842 1.00 20.96 ? 348 VAL A N 1 ATOM 2691 C CA . VAL A 1 348 ? -10.546 -53.757 20.571 1.00 20.07 ? 348 VAL A CA 1 ATOM 2692 C C . VAL A 1 348 ? -9.460 -53.556 19.524 1.00 18.14 ? 348 VAL A C 1 ATOM 2693 O O . VAL A 1 348 ? -8.764 -52.534 19.514 1.00 18.37 ? 348 VAL A O 1 ATOM 2694 C CB . VAL A 1 348 ? -11.488 -52.533 20.636 1.00 18.79 ? 348 VAL A CB 1 ATOM 2695 C CG1 . VAL A 1 348 ? -12.075 -52.254 19.244 1.00 21.00 ? 348 VAL A CG1 1 ATOM 2696 C CG2 . VAL A 1 348 ? -12.631 -52.789 21.600 1.00 17.69 ? 348 VAL A CG2 1 ATOM 2697 N N . LYS A 1 349 ? -9.326 -54.528 18.631 1.00 20.34 ? 349 LYS A N 1 ATOM 2698 C CA . LYS A 1 349 ? -8.219 -54.522 17.675 1.00 22.03 ? 349 LYS A CA 1 ATOM 2699 C C . LYS A 1 349 ? -8.672 -54.543 16.227 1.00 22.04 ? 349 LYS A C 1 ATOM 2700 O O . LYS A 1 349 ? -7.849 -54.420 15.310 1.00 25.20 ? 349 LYS A O 1 ATOM 2701 C CB . LYS A 1 349 ? -7.278 -55.717 17.935 1.00 25.30 ? 349 LYS A CB 1 ATOM 2702 C CG . LYS A 1 349 ? -6.792 -55.846 19.395 1.00 30.53 ? 349 LYS A CG 1 ATOM 2703 C CD . LYS A 1 349 ? -5.791 -54.724 19.818 1.00 31.65 ? 349 LYS A CD 1 ATOM 2704 C CE . LYS A 1 349 ? -4.438 -54.838 19.083 1.00 38.68 ? 349 LYS A CE 1 ATOM 2705 N NZ . LYS A 1 349 ? -3.435 -53.779 19.484 1.00 40.19 ? 349 LYS A NZ 1 ATOM 2706 N N . ASP A 1 350 ? -9.964 -54.725 16.003 1.00 22.37 ? 350 ASP A N 1 ATOM 2707 C CA . ASP A 1 350 ? -10.463 -54.863 14.641 1.00 22.77 ? 350 ASP A CA 1 ATOM 2708 C C . ASP A 1 350 ? -10.588 -53.532 13.889 1.00 23.50 ? 350 ASP A C 1 ATOM 2709 O O . ASP A 1 350 ? -10.762 -53.531 12.653 1.00 20.06 ? 350 ASP A O 1 ATOM 2710 C CB . ASP A 1 350 ? -11.777 -55.656 14.591 1.00 24.78 ? 350 ASP A CB 1 ATOM 2711 C CG . ASP A 1 350 ? -12.910 -54.960 15.292 1.00 29.66 ? 350 ASP A CG 1 ATOM 2712 O OD1 . ASP A 1 350 ? -12.704 -54.358 16.373 1.00 31.94 ? 350 ASP A OD1 1 ATOM 2713 O OD2 . ASP A 1 350 ? -14.039 -55.030 14.765 1.00 37.41 ? 350 ASP A OD2 1 ATOM 2714 N N . ARG A 1 351 ? -10.468 -52.405 14.601 1.00 17.33 ? 351 ARG A N 1 ATOM 2715 C CA . ARG A 1 351 ? -10.407 -51.121 13.899 1.00 17.44 ? 351 ARG A CA 1 ATOM 2716 C C . ARG A 1 351 ? -9.575 -50.085 14.694 1.00 16.46 ? 351 ARG A C 1 ATOM 2717 O O . ARG A 1 351 ? -9.246 -50.326 15.848 1.00 17.14 ? 351 ARG A O 1 ATOM 2718 C CB . ARG A 1 351 ? -11.831 -50.611 13.596 1.00 14.29 ? 351 ARG A CB 1 ATOM 2719 C CG . ARG A 1 351 ? -12.542 -50.038 14.809 1.00 13.03 ? 351 ARG A CG 1 ATOM 2720 C CD . ARG A 1 351 ? -13.030 -51.122 15.745 1.00 12.18 ? 351 ARG A CD 1 ATOM 2721 N NE . ARG A 1 351 ? -14.146 -50.625 16.532 1.00 12.24 ? 351 ARG A NE 1 ATOM 2722 C CZ . ARG A 1 351 ? -14.994 -51.386 17.207 1.00 13.02 ? 351 ARG A CZ 1 ATOM 2723 N NH1 . ARG A 1 351 ? -15.968 -50.805 17.881 1.00 11.19 ? 351 ARG A NH1 1 ATOM 2724 N NH2 . ARG A 1 351 ? -14.876 -52.736 17.189 1.00 12.55 ? 351 ARG A NH2 1 ATOM 2725 N N . PHE A 1 352 ? -9.236 -48.964 14.064 1.00 15.35 ? 352 PHE A N 1 ATOM 2726 C CA . PHE A 1 352 ? -8.543 -47.868 14.751 1.00 16.72 ? 352 PHE A CA 1 ATOM 2727 C C . PHE A 1 352 ? -9.499 -47.123 15.710 1.00 17.32 ? 352 PHE A C 1 ATOM 2728 O O . PHE A 1 352 ? -10.675 -46.883 15.383 1.00 18.05 ? 352 PHE A O 1 ATOM 2729 C CB . PHE A 1 352 ? -7.984 -46.901 13.718 1.00 16.38 ? 352 PHE A CB 1 ATOM 2730 C CG . PHE A 1 352 ? -7.294 -45.711 14.302 1.00 16.26 ? 352 PHE A CG 1 ATOM 2731 C CD1 . PHE A 1 352 ? -6.154 -45.859 15.076 1.00 16.61 ? 352 PHE A CD1 1 ATOM 2732 C CD2 . PHE A 1 352 ? -7.792 -44.418 14.072 1.00 17.40 ? 352 PHE A CD2 1 ATOM 2733 C CE1 . PHE A 1 352 ? -5.514 -44.748 15.628 1.00 17.68 ? 352 PHE A CE1 1 ATOM 2734 C CE2 . PHE A 1 352 ? -7.157 -43.283 14.612 1.00 16.73 ? 352 PHE A CE2 1 ATOM 2735 C CZ . PHE A 1 352 ? -6.013 -43.451 15.388 1.00 17.10 ? 352 PHE A CZ 1 ATOM 2736 N N . TRP A 1 353 ? -9.013 -46.793 16.899 1.00 15.80 ? 353 TRP A N 1 ATOM 2737 C CA . TRP A 1 353 ? -9.772 -45.937 17.804 1.00 15.97 ? 353 TRP A CA 1 ATOM 2738 C C . TRP A 1 353 ? -8.786 -45.055 18.544 1.00 17.02 ? 353 TRP A C 1 ATOM 2739 O O . TRP A 1 353 ? -7.613 -45.421 18.675 1.00 16.81 ? 353 TRP A O 1 ATOM 2740 C CB . TRP A 1 353 ? -10.665 -46.727 18.788 1.00 14.59 ? 353 TRP A CB 1 ATOM 2741 C CG . TRP A 1 353 ? -9.919 -47.656 19.740 1.00 15.79 ? 353 TRP A CG 1 ATOM 2742 C CD1 . TRP A 1 353 ? -9.774 -49.029 19.615 1.00 16.14 ? 353 TRP A CD1 1 ATOM 2743 C CD2 . TRP A 1 353 ? -9.235 -47.298 20.959 1.00 15.67 ? 353 TRP A CD2 1 ATOM 2744 N NE1 . TRP A 1 353 ? -9.035 -49.526 20.664 1.00 16.01 ? 353 TRP A NE1 1 ATOM 2745 C CE2 . TRP A 1 353 ? -8.679 -48.496 21.498 1.00 16.25 ? 353 TRP A CE2 1 ATOM 2746 C CE3 . TRP A 1 353 ? -9.021 -46.084 21.638 1.00 16.05 ? 353 TRP A CE3 1 ATOM 2747 C CZ2 . TRP A 1 353 ? -7.943 -48.517 22.708 1.00 15.64 ? 353 TRP A CZ2 1 ATOM 2748 C CZ3 . TRP A 1 353 ? -8.272 -46.096 22.824 1.00 16.26 ? 353 TRP A CZ3 1 ATOM 2749 C CH2 . TRP A 1 353 ? -7.728 -47.309 23.340 1.00 16.02 ? 353 TRP A CH2 1 ATOM 2750 N N . PHE A 1 354 ? -9.273 -43.905 19.024 1.00 14.58 ? 354 PHE A N 1 ATOM 2751 C CA . PHE A 1 354 ? -8.538 -43.076 19.963 1.00 13.72 ? 354 PHE A CA 1 ATOM 2752 C C . PHE A 1 354 ? -9.465 -42.366 20.970 1.00 13.43 ? 354 PHE A C 1 ATOM 2753 O O . PHE A 1 354 ? -10.684 -42.269 20.759 1.00 13.14 ? 354 PHE A O 1 ATOM 2754 C CB . PHE A 1 354 ? -7.615 -42.093 19.231 1.00 12.33 ? 354 PHE A CB 1 ATOM 2755 C CG . PHE A 1 354 ? -8.339 -40.980 18.514 1.00 14.33 ? 354 PHE A CG 1 ATOM 2756 C CD1 . PHE A 1 354 ? -8.845 -39.892 19.221 1.00 13.94 ? 354 PHE A CD1 1 ATOM 2757 C CD2 . PHE A 1 354 ? -8.479 -41.007 17.113 1.00 15.02 ? 354 PHE A CD2 1 ATOM 2758 C CE1 . PHE A 1 354 ? -9.500 -38.837 18.549 1.00 14.99 ? 354 PHE A CE1 1 ATOM 2759 C CE2 . PHE A 1 354 ? -9.118 -39.971 16.430 1.00 15.51 ? 354 PHE A CE2 1 ATOM 2760 C CZ . PHE A 1 354 ? -9.636 -38.878 17.155 1.00 16.54 ? 354 PHE A CZ 1 ATOM 2761 N N . TYR A 1 355 ? -8.882 -41.906 22.076 1.00 13.36 ? 355 TYR A N 1 ATOM 2762 C CA . TYR A 1 355 ? -9.513 -40.858 22.893 1.00 13.62 ? 355 TYR A CA 1 ATOM 2763 C C . TYR A 1 355 ? -8.513 -39.698 22.982 1.00 13.88 ? 355 TYR A C 1 ATOM 2764 O O . TYR A 1 355 ? -7.308 -39.887 22.833 1.00 15.17 ? 355 TYR A O 1 ATOM 2765 C CB . TYR A 1 355 ? -9.882 -41.356 24.299 1.00 12.75 ? 355 TYR A CB 1 ATOM 2766 C CG . TYR A 1 355 ? -8.666 -41.685 25.142 1.00 13.98 ? 355 TYR A CG 1 ATOM 2767 C CD1 . TYR A 1 355 ? -7.972 -40.682 25.812 1.00 13.88 ? 355 TYR A CD1 1 ATOM 2768 C CD2 . TYR A 1 355 ? -8.200 -43.012 25.256 1.00 13.89 ? 355 TYR A CD2 1 ATOM 2769 C CE1 . TYR A 1 355 ? -6.863 -40.975 26.580 1.00 14.95 ? 355 TYR A CE1 1 ATOM 2770 C CE2 . TYR A 1 355 ? -7.089 -43.323 26.024 1.00 14.12 ? 355 TYR A CE2 1 ATOM 2771 C CZ . TYR A 1 355 ? -6.425 -42.293 26.681 1.00 15.26 ? 355 TYR A CZ 1 ATOM 2772 O OH . TYR A 1 355 ? -5.314 -42.551 27.435 1.00 16.16 ? 355 TYR A OH 1 ATOM 2773 N N . GLN A 1 356 ? -9.026 -38.499 23.219 1.00 14.23 ? 356 GLN A N 1 ATOM 2774 C CA . GLN A 1 356 ? -8.214 -37.337 23.572 1.00 13.23 ? 356 GLN A CA 1 ATOM 2775 C C . GLN A 1 356 ? -8.830 -36.721 24.798 1.00 13.45 ? 356 GLN A C 1 ATOM 2776 O O . GLN A 1 356 ? -10.044 -36.474 24.830 1.00 15.36 ? 356 GLN A O 1 ATOM 2777 C CB . GLN A 1 356 ? -8.163 -36.315 22.431 1.00 12.54 ? 356 GLN A CB 1 ATOM 2778 C CG . GLN A 1 356 ? -7.551 -36.891 21.178 1.00 13.32 ? 356 GLN A CG 1 ATOM 2779 C CD . GLN A 1 356 ? -7.688 -36.021 19.963 1.00 14.43 ? 356 GLN A CD 1 ATOM 2780 O OE1 . GLN A 1 356 ? -6.787 -35.962 19.114 1.00 15.86 ? 356 GLN A OE1 1 ATOM 2781 N NE2 . GLN A 1 356 ? -8.817 -35.351 19.851 1.00 16.07 ? 356 GLN A NE2 1 ATOM 2782 N N . LEU A 1 357 ? -7.997 -36.499 25.816 1.00 12.84 ? 357 LEU A N 1 ATOM 2783 C CA . LEU A 1 357 ? -8.389 -35.763 27.001 1.00 12.45 ? 357 LEU A CA 1 ATOM 2784 C C . LEU A 1 357 ? -7.726 -34.381 26.952 1.00 11.77 ? 357 LEU A C 1 ATOM 2785 O O . LEU A 1 357 ? -6.552 -34.219 27.357 1.00 10.11 ? 357 LEU A O 1 ATOM 2786 C CB . LEU A 1 357 ? -8.002 -36.522 28.265 1.00 13.11 ? 357 LEU A CB 1 ATOM 2787 C CG . LEU A 1 357 ? -8.323 -38.031 28.405 1.00 14.87 ? 357 LEU A CG 1 ATOM 2788 C CD1 . LEU A 1 357 ? -7.907 -38.576 29.791 1.00 15.45 ? 357 LEU A CD1 1 ATOM 2789 C CD2 . LEU A 1 357 ? -9.768 -38.387 28.164 1.00 14.08 ? 357 LEU A CD2 1 ATOM 2790 N N . ASP A 1 358 ? -8.502 -33.418 26.437 1.00 10.68 ? 358 ASP A N 1 ATOM 2791 C CA A ASP A 1 358 ? -8.024 -32.049 26.256 0.50 11.19 ? 358 ASP A CA 1 ATOM 2792 C CA B ASP A 1 358 ? -8.072 -32.027 26.225 0.50 10.87 ? 358 ASP A CA 1 ATOM 2793 C C . ASP A 1 358 ? -8.173 -31.209 27.518 1.00 10.93 ? 358 ASP A C 1 ATOM 2794 O O . ASP A 1 358 ? -9.222 -31.194 28.142 1.00 9.87 ? 358 ASP A O 1 ATOM 2795 C CB A ASP A 1 358 ? -8.725 -31.374 25.074 0.50 10.85 ? 358 ASP A CB 1 ATOM 2796 C CB B ASP A 1 358 ? -8.960 -31.351 25.166 0.50 9.98 ? 358 ASP A CB 1 ATOM 2797 C CG A ASP A 1 358 ? -8.175 -31.851 23.748 0.50 12.04 ? 358 ASP A CG 1 ATOM 2798 C CG B ASP A 1 358 ? -8.664 -31.818 23.755 0.50 10.58 ? 358 ASP A CG 1 ATOM 2799 O OD1 A ASP A 1 358 ? -8.539 -32.973 23.345 0.50 12.15 ? 358 ASP A OD1 1 ATOM 2800 O OD1 B ASP A 1 358 ? -9.619 -31.919 22.962 0.50 9.87 ? 358 ASP A OD1 1 ATOM 2801 O OD2 A ASP A 1 358 ? -7.341 -31.137 23.136 0.50 12.13 ? 358 ASP A OD2 1 ATOM 2802 O OD2 B ASP A 1 358 ? -7.478 -32.076 23.429 0.50 11.46 ? 358 ASP A OD2 1 ATOM 2803 N N . VAL A 1 359 ? -7.095 -30.512 27.875 1.00 11.38 ? 359 VAL A N 1 ATOM 2804 C CA . VAL A 1 359 ? -7.106 -29.588 28.998 1.00 11.05 ? 359 VAL A CA 1 ATOM 2805 C C . VAL A 1 359 ? -7.790 -28.277 28.570 1.00 11.30 ? 359 VAL A C 1 ATOM 2806 O O . VAL A 1 359 ? -7.165 -27.346 28.028 1.00 13.04 ? 359 VAL A O 1 ATOM 2807 C CB . VAL A 1 359 ? -5.684 -29.425 29.575 1.00 11.62 ? 359 VAL A CB 1 ATOM 2808 C CG1 . VAL A 1 359 ? -5.624 -28.333 30.626 1.00 10.95 ? 359 VAL A CG1 1 ATOM 2809 C CG2 . VAL A 1 359 ? -5.207 -30.779 30.167 1.00 12.43 ? 359 VAL A CG2 1 ATOM 2810 N N . HIS A 1 360 ? -9.083 -28.217 28.848 1.00 10.76 ? 360 HIS A N 1 ATOM 2811 C CA . HIS A 1 360 ? -10.015 -27.204 28.324 1.00 11.83 ? 360 HIS A CA 1 ATOM 2812 C C . HIS A 1 360 ? -10.157 -26.080 29.340 1.00 12.55 ? 360 HIS A C 1 ATOM 2813 O O . HIS A 1 360 ? -9.999 -24.915 29.012 1.00 13.42 ? 360 HIS A O 1 ATOM 2814 C CB . HIS A 1 360 ? -11.355 -27.935 28.037 1.00 12.31 ? 360 HIS A CB 1 ATOM 2815 C CG . HIS A 1 360 ? -12.514 -27.060 27.654 1.00 12.43 ? 360 HIS A CG 1 ATOM 2816 N ND1 . HIS A 1 360 ? -13.379 -26.516 28.586 1.00 11.96 ? 360 HIS A ND1 1 ATOM 2817 C CD2 . HIS A 1 360 ? -13.019 -26.733 26.443 1.00 12.55 ? 360 HIS A CD2 1 ATOM 2818 C CE1 . HIS A 1 360 ? -14.330 -25.837 27.967 1.00 11.78 ? 360 HIS A CE1 1 ATOM 2819 N NE2 . HIS A 1 360 ? -14.150 -25.972 26.666 1.00 13.72 ? 360 HIS A NE2 1 ATOM 2820 N N . GLY A 1 361 ? -10.418 -26.436 30.595 1.00 13.33 ? 361 GLY A N 1 ATOM 2821 C CA . GLY A 1 361 ? -10.552 -25.457 31.652 1.00 13.26 ? 361 GLY A CA 1 ATOM 2822 C C . GLY A 1 361 ? -9.327 -25.415 32.548 1.00 15.09 ? 361 GLY A C 1 ATOM 2823 O O . GLY A 1 361 ? -8.209 -25.761 32.115 1.00 14.03 ? 361 GLY A O 1 ATOM 2824 N N . GLY A 1 362 ? -9.530 -24.996 33.801 1.00 14.63 ? 362 GLY A N 1 ATOM 2825 C CA . GLY A 1 362 ? -8.423 -24.854 34.727 1.00 15.02 ? 362 GLY A CA 1 ATOM 2826 C C . GLY A 1 362 ? -8.154 -23.386 35.000 1.00 15.58 ? 362 GLY A C 1 ATOM 2827 O O . GLY A 1 362 ? -8.523 -22.512 34.204 1.00 15.56 ? 362 GLY A O 1 ATOM 2828 N N . LYS A 1 363 ? -7.489 -23.120 36.119 1.00 17.64 ? 363 LYS A N 1 ATOM 2829 C CA . LYS A 1 363 ? -7.276 -21.756 36.611 1.00 19.79 ? 363 LYS A CA 1 ATOM 2830 C C . LYS A 1 363 ? -6.732 -20.776 35.547 1.00 17.79 ? 363 LYS A C 1 ATOM 2831 O O . LYS A 1 363 ? -7.236 -19.652 35.412 1.00 17.17 ? 363 LYS A O 1 ATOM 2832 C CB . LYS A 1 363 ? -6.342 -21.775 37.833 1.00 22.67 ? 363 LYS A CB 1 ATOM 2833 C CG . LYS A 1 363 ? -6.329 -20.477 38.610 1.00 28.17 ? 363 LYS A CG 1 ATOM 2834 C CD . LYS A 1 363 ? -4.913 -20.004 38.888 1.00 35.08 ? 363 LYS A CD 1 ATOM 2835 C CE . LYS A 1 363 ? -4.503 -20.231 40.325 1.00 40.63 ? 363 LYS A CE 1 ATOM 2836 N NZ . LYS A 1 363 ? -3.298 -19.412 40.649 1.00 41.35 ? 363 LYS A NZ 1 ATOM 2837 N N . ASN A 1 364 ? -5.696 -21.178 34.817 1.00 15.26 ? 364 ASN A N 1 ATOM 2838 C CA . ASN A 1 364 ? -5.069 -20.249 33.868 1.00 15.32 ? 364 ASN A CA 1 ATOM 2839 C C . ASN A 1 364 ? -5.506 -20.441 32.406 1.00 14.54 ? 364 ASN A C 1 ATOM 2840 O O . ASN A 1 364 ? -4.906 -19.873 31.467 1.00 13.16 ? 364 ASN A O 1 ATOM 2841 C CB . ASN A 1 364 ? -3.545 -20.286 34.039 1.00 16.76 ? 364 ASN A CB 1 ATOM 2842 C CG . ASN A 1 364 ? -3.128 -20.024 35.493 1.00 18.99 ? 364 ASN A CG 1 ATOM 2843 O OD1 . ASN A 1 364 ? -3.428 -18.974 36.029 1.00 19.11 ? 364 ASN A OD1 1 ATOM 2844 N ND2 . ASN A 1 364 ? -2.495 -21.001 36.133 1.00 19.06 ? 364 ASN A ND2 1 ATOM 2845 N N . SER A 1 365 ? -6.561 -21.232 32.203 1.00 13.76 ? 365 SER A N 1 ATOM 2846 C CA . SER A 1 365 ? -7.044 -21.454 30.850 1.00 13.18 ? 365 SER A CA 1 ATOM 2847 C C . SER A 1 365 ? -7.797 -20.223 30.373 1.00 14.02 ? 365 SER A C 1 ATOM 2848 O O . SER A 1 365 ? -8.774 -19.784 31.009 1.00 13.34 ? 365 SER A O 1 ATOM 2849 C CB . SER A 1 365 ? -7.923 -22.698 30.746 1.00 12.22 ? 365 SER A CB 1 ATOM 2850 O OG . SER A 1 365 ? -8.508 -22.771 29.443 1.00 11.15 ? 365 SER A OG 1 ATOM 2851 N N . GLN A 1 366 ? -7.362 -19.668 29.245 1.00 13.64 ? 366 GLN A N 1 ATOM 2852 C CA . GLN A 1 366 ? -8.084 -18.543 28.641 1.00 15.07 ? 366 GLN A CA 1 ATOM 2853 C C . GLN A 1 366 ? -9.561 -18.877 28.252 1.00 14.73 ? 366 GLN A C 1 ATOM 2854 O O . GLN A 1 366 ? -10.431 -18.000 28.232 1.00 15.06 ? 366 GLN A O 1 ATOM 2855 C CB . GLN A 1 366 ? -7.283 -18.027 27.438 1.00 15.80 ? 366 GLN A CB 1 ATOM 2856 C CG . GLN A 1 366 ? -7.612 -16.633 26.983 1.00 17.92 ? 366 GLN A CG 1 ATOM 2857 C CD . GLN A 1 366 ? -7.491 -15.526 28.039 1.00 17.34 ? 366 GLN A CD 1 ATOM 2858 O OE1 . GLN A 1 366 ? -8.199 -14.547 27.928 1.00 22.73 ? 366 GLN A OE1 1 ATOM 2859 N NE2 . GLN A 1 366 ? -6.615 -15.662 29.034 1.00 17.34 ? 366 GLN A NE2 1 ATOM 2860 N N . VAL A 1 367 ? -9.845 -20.141 27.965 1.00 13.13 ? 367 VAL A N 1 ATOM 2861 C CA . VAL A 1 367 ? -11.211 -20.543 27.622 1.00 14.77 ? 367 VAL A CA 1 ATOM 2862 C C . VAL A 1 367 ? -12.199 -20.184 28.757 1.00 16.09 ? 367 VAL A C 1 ATOM 2863 O O . VAL A 1 367 ? -13.350 -19.785 28.495 1.00 15.30 ? 367 VAL A O 1 ATOM 2864 C CB . VAL A 1 367 ? -11.317 -22.090 27.355 1.00 14.26 ? 367 VAL A CB 1 ATOM 2865 C CG1 . VAL A 1 367 ? -12.810 -22.528 27.238 1.00 13.60 ? 367 VAL A CG1 1 ATOM 2866 C CG2 . VAL A 1 367 ? -10.501 -22.484 26.131 1.00 13.48 ? 367 VAL A CG2 1 ATOM 2867 N N . THR A 1 368 ? -11.712 -20.292 29.998 1.00 16.28 ? 368 THR A N 1 ATOM 2868 C CA . THR A 1 368 ? -12.510 -20.090 31.235 1.00 18.87 ? 368 THR A CA 1 ATOM 2869 C C . THR A 1 368 ? -12.664 -18.631 31.642 1.00 20.82 ? 368 THR A C 1 ATOM 2870 O O . THR A 1 368 ? -13.384 -18.340 32.585 1.00 26.05 ? 368 THR A O 1 ATOM 2871 C CB . THR A 1 368 ? -11.864 -20.800 32.460 1.00 17.65 ? 368 THR A CB 1 ATOM 2872 O OG1 . THR A 1 368 ? -10.653 -20.110 32.863 1.00 19.09 ? 368 THR A OG1 1 ATOM 2873 C CG2 . THR A 1 368 ? -11.543 -22.207 32.151 1.00 14.89 ? 368 THR A CG2 1 ATOM 2874 N N . LYS A 1 369 ? -11.958 -17.720 30.978 1.00 20.29 ? 369 LYS A N 1 ATOM 2875 C CA . LYS A 1 369 ? -12.132 -16.293 31.239 1.00 21.84 ? 369 LYS A CA 1 ATOM 2876 C C . LYS A 1 369 ? -13.443 -15.728 30.658 1.00 25.70 ? 369 LYS A C 1 ATOM 2877 O O . LYS A 1 369 ? -13.809 -14.599 30.954 1.00 28.22 ? 369 LYS A O 1 ATOM 2878 C CB . LYS A 1 369 ? -10.924 -15.487 30.749 1.00 23.52 ? 369 LYS A CB 1 ATOM 2879 C CG . LYS A 1 369 ? -9.542 -16.003 31.262 1.00 24.54 ? 369 LYS A CG 1 ATOM 2880 C CD . LYS A 1 369 ? -9.474 -16.036 32.790 1.00 24.55 ? 369 LYS A CD 1 ATOM 2881 C CE . LYS A 1 369 ? -8.131 -16.521 33.285 1.00 25.34 ? 369 LYS A CE 1 ATOM 2882 N NZ . LYS A 1 369 ? -8.240 -16.790 34.718 1.00 31.19 ? 369 LYS A NZ 1 ATOM 2883 N N . VAL A 1 370 ? -14.137 -16.503 29.817 1.00 24.19 ? 370 VAL A N 1 ATOM 2884 C CA . VAL A 1 370 ? -15.504 -16.185 29.452 1.00 20.00 ? 370 VAL A CA 1 ATOM 2885 C C . VAL A 1 370 ? -16.403 -17.066 30.322 1.00 20.58 ? 370 VAL A C 1 ATOM 2886 O O . VAL A 1 370 ? -16.092 -18.240 30.555 1.00 18.96 ? 370 VAL A O 1 ATOM 2887 C CB . VAL A 1 370 ? -15.750 -16.409 27.948 1.00 22.41 ? 370 VAL A CB 1 ATOM 2888 C CG1 . VAL A 1 370 ? -17.191 -16.067 27.549 1.00 18.43 ? 370 VAL A CG1 1 ATOM 2889 C CG2 . VAL A 1 370 ? -14.757 -15.577 27.107 1.00 20.08 ? 370 VAL A CG2 1 ATOM 2890 N N . THR A 1 371 ? -17.497 -16.521 30.850 1.00 17.75 ? 371 THR A N 1 ATOM 2891 C CA . THR A 1 371 ? -18.405 -17.384 31.631 1.00 16.89 ? 371 THR A CA 1 ATOM 2892 C C . THR A 1 371 ? -19.484 -18.010 30.746 1.00 15.16 ? 371 THR A C 1 ATOM 2893 O O . THR A 1 371 ? -19.711 -17.572 29.625 1.00 13.15 ? 371 THR A O 1 ATOM 2894 C CB . THR A 1 371 ? -19.136 -16.600 32.715 1.00 18.07 ? 371 THR A CB 1 ATOM 2895 O OG1 . THR A 1 371 ? -20.077 -15.722 32.088 1.00 18.61 ? 371 THR A OG1 1 ATOM 2896 C CG2 . THR A 1 371 ? -18.144 -15.766 33.592 1.00 19.97 ? 371 THR A CG2 1 ATOM 2897 N N . ASN A 1 372 ? -20.192 -18.990 31.279 1.00 15.02 ? 372 ASN A N 1 ATOM 2898 C CA . ASN A 1 372 ? -21.329 -19.557 30.568 1.00 16.43 ? 372 ASN A CA 1 ATOM 2899 C C . ASN A 1 372 ? -22.445 -18.578 30.186 1.00 17.32 ? 372 ASN A C 1 ATOM 2900 O O . ASN A 1 372 ? -23.143 -18.817 29.206 1.00 18.51 ? 372 ASN A O 1 ATOM 2901 C CB . ASN A 1 372 ? -21.916 -20.712 31.371 1.00 16.43 ? 372 ASN A CB 1 ATOM 2902 C CG . ASN A 1 372 ? -21.155 -22.008 31.157 1.00 17.97 ? 372 ASN A CG 1 ATOM 2903 O OD1 . ASN A 1 372 ? -20.450 -22.178 30.137 1.00 16.98 ? 372 ASN A OD1 1 ATOM 2904 N ND2 . ASN A 1 372 ? -21.298 -22.945 32.109 1.00 16.55 ? 372 ASN A ND2 1 ATOM 2905 N N . ALA A 1 373 ? -22.629 -17.511 30.967 1.00 15.67 ? 373 ALA A N 1 ATOM 2906 C CA . ALA A 1 373 ? -23.685 -16.528 30.705 1.00 17.67 ? 373 ALA A CA 1 ATOM 2907 C C . ALA A 1 373 ? -23.347 -15.652 29.513 1.00 17.67 ? 373 ALA A C 1 ATOM 2908 O O . ALA A 1 373 ? -24.240 -15.083 28.905 1.00 20.09 ? 373 ALA A O 1 ATOM 2909 C CB . ALA A 1 373 ? -23.924 -15.606 31.978 1.00 17.60 ? 373 ALA A CB 1 ATOM 2910 N N . GLU A 1 374 ? -22.057 -15.529 29.198 1.00 16.26 ? 374 GLU A N 1 ATOM 2911 C CA . GLU A 1 374 ? -21.585 -14.529 28.233 1.00 17.25 ? 374 GLU A CA 1 ATOM 2912 C C . GLU A 1 374 ? -21.714 -14.855 26.729 1.00 15.26 ? 374 GLU A C 1 ATOM 2913 O O . GLU A 1 374 ? -21.736 -13.945 25.908 1.00 13.90 ? 374 GLU A O 1 ATOM 2914 C CB . GLU A 1 374 ? -20.151 -14.085 28.571 1.00 18.50 ? 374 GLU A CB 1 ATOM 2915 C CG . GLU A 1 374 ? -20.067 -13.365 29.930 1.00 21.20 ? 374 GLU A CG 1 ATOM 2916 C CD . GLU A 1 374 ? -18.689 -12.789 30.185 1.00 24.05 ? 374 GLU A CD 1 ATOM 2917 O OE1 . GLU A 1 374 ? -17.697 -13.540 30.200 1.00 23.84 ? 374 GLU A OE1 1 ATOM 2918 O OE2 . GLU A 1 374 ? -18.593 -11.564 30.349 1.00 32.55 ? 374 GLU A OE2 1 ATOM 2919 N N . THR A 1 375 ? -21.774 -16.145 26.392 1.00 14.31 ? 375 THR A N 1 ATOM 2920 C CA . THR A 1 375 ? -21.998 -16.609 25.021 1.00 12.65 ? 375 THR A CA 1 ATOM 2921 C C . THR A 1 375 ? -22.823 -17.887 25.139 1.00 12.99 ? 375 THR A C 1 ATOM 2922 O O . THR A 1 375 ? -22.992 -18.428 26.246 1.00 12.98 ? 375 THR A O 1 ATOM 2923 C CB . THR A 1 375 ? -20.662 -16.926 24.251 1.00 11.76 ? 375 THR A CB 1 ATOM 2924 O OG1 . THR A 1 375 ? -20.089 -18.150 24.729 1.00 11.86 ? 375 THR A OG1 1 ATOM 2925 C CG2 . THR A 1 375 ? -19.634 -15.809 24.385 1.00 11.45 ? 375 THR A CG2 1 ATOM 2926 N N . ALA A 1 376 ? -23.359 -18.360 24.022 1.00 12.16 ? 376 ALA A N 1 ATOM 2927 C CA . ALA A 1 376 ? -24.112 -19.620 24.003 1.00 11.80 ? 376 ALA A CA 1 ATOM 2928 C C . ALA A 1 376 ? -23.281 -20.817 24.485 1.00 11.06 ? 376 ALA A C 1 ATOM 2929 O O . ALA A 1 376 ? -23.842 -21.780 25.014 1.00 10.34 ? 376 ALA A O 1 ATOM 2930 C CB . ALA A 1 376 ? -24.630 -19.900 22.572 1.00 11.80 ? 376 ALA A CB 1 ATOM 2931 N N . TYR A 1 377 ? -21.957 -20.766 24.267 1.00 11.37 ? 377 TYR A N 1 ATOM 2932 C CA . TYR A 1 377 ? -21.055 -21.880 24.626 1.00 11.12 ? 377 TYR A CA 1 ATOM 2933 C C . TYR A 1 377 ? -21.240 -22.231 26.121 1.00 11.14 ? 377 TYR A C 1 ATOM 2934 O O . TYR A 1 377 ? -21.062 -21.353 26.977 1.00 11.42 ? 377 TYR A O 1 ATOM 2935 C CB . TYR A 1 377 ? -19.605 -21.517 24.313 1.00 10.62 ? 377 TYR A CB 1 ATOM 2936 C CG . TYR A 1 377 ? -18.637 -22.687 24.425 1.00 10.82 ? 377 TYR A CG 1 ATOM 2937 C CD1 . TYR A 1 377 ? -18.483 -23.594 23.372 1.00 10.03 ? 377 TYR A CD1 1 ATOM 2938 C CD2 . TYR A 1 377 ? -17.888 -22.893 25.602 1.00 10.70 ? 377 TYR A CD2 1 ATOM 2939 C CE1 . TYR A 1 377 ? -17.588 -24.667 23.466 1.00 10.78 ? 377 TYR A CE1 1 ATOM 2940 C CE2 . TYR A 1 377 ? -17.002 -23.955 25.715 1.00 10.45 ? 377 TYR A CE2 1 ATOM 2941 C CZ . TYR A 1 377 ? -16.851 -24.846 24.645 1.00 10.72 ? 377 TYR A CZ 1 ATOM 2942 O OH . TYR A 1 377 ? -15.968 -25.908 24.744 1.00 10.40 ? 377 TYR A OH 1 ATOM 2943 N N . PRO A 1 378 ? -21.627 -23.494 26.431 1.00 11.01 ? 378 PRO A N 1 ATOM 2944 C CA . PRO A 1 378 ? -22.048 -23.859 27.808 1.00 11.33 ? 378 PRO A CA 1 ATOM 2945 C C . PRO A 1 378 ? -21.030 -24.633 28.619 1.00 11.84 ? 378 PRO A C 1 ATOM 2946 O O . PRO A 1 378 ? -21.375 -25.143 29.699 1.00 12.74 ? 378 PRO A O 1 ATOM 2947 C CB . PRO A 1 378 ? -23.202 -24.837 27.554 1.00 11.38 ? 378 PRO A CB 1 ATOM 2948 C CG . PRO A 1 378 ? -22.782 -25.539 26.226 1.00 10.58 ? 378 PRO A CG 1 ATOM 2949 C CD . PRO A 1 378 ? -21.854 -24.606 25.486 1.00 10.59 ? 378 PRO A CD 1 ATOM 2950 N N . HIS A 1 379 ? -19.808 -24.762 28.116 1.00 10.84 ? 379 HIS A N 1 ATOM 2951 C CA . HIS A 1 379 ? -18.849 -25.657 28.767 1.00 10.98 ? 379 HIS A CA 1 ATOM 2952 C C . HIS A 1 379 ? -17.760 -24.910 29.546 1.00 11.00 ? 379 HIS A C 1 ATOM 2953 O O . HIS A 1 379 ? -16.692 -25.473 29.815 1.00 9.73 ? 379 HIS A O 1 ATOM 2954 C CB . HIS A 1 379 ? -18.184 -26.571 27.734 1.00 10.88 ? 379 HIS A CB 1 ATOM 2955 C CG . HIS A 1 379 ? -19.144 -27.297 26.856 1.00 11.32 ? 379 HIS A CG 1 ATOM 2956 N ND1 . HIS A 1 379 ? -20.044 -28.227 27.339 1.00 11.43 ? 379 HIS A ND1 1 ATOM 2957 C CD2 . HIS A 1 379 ? -19.325 -27.253 25.513 1.00 11.44 ? 379 HIS A CD2 1 ATOM 2958 C CE1 . HIS A 1 379 ? -20.744 -28.724 26.331 1.00 11.77 ? 379 HIS A CE1 1 ATOM 2959 N NE2 . HIS A 1 379 ? -20.321 -28.154 25.208 1.00 12.57 ? 379 HIS A NE2 1 ATOM 2960 N N . ARG A 1 380 ? -18.006 -23.638 29.872 1.00 11.28 ? 380 ARG A N 1 ATOM 2961 C CA . ARG A 1 380 ? -16.938 -22.813 30.502 1.00 12.04 ? 380 ARG A CA 1 ATOM 2962 C C . ARG A 1 380 ? -16.540 -23.315 31.903 1.00 12.55 ? 380 ARG A C 1 ATOM 2963 O O . ARG A 1 380 ? -15.487 -22.933 32.426 1.00 13.06 ? 380 ARG A O 1 ATOM 2964 C CB . ARG A 1 380 ? -17.361 -21.330 30.582 1.00 10.96 ? 380 ARG A CB 1 ATOM 2965 C CG . ARG A 1 380 ? -17.743 -20.694 29.234 1.00 10.96 ? 380 ARG A CG 1 ATOM 2966 C CD . ARG A 1 380 ? -16.577 -20.573 28.206 1.00 10.53 ? 380 ARG A CD 1 ATOM 2967 N NE . ARG A 1 380 ? -17.060 -19.880 27.016 1.00 10.44 ? 380 ARG A NE 1 ATOM 2968 C CZ . ARG A 1 380 ? -16.318 -19.376 26.017 1.00 11.50 ? 380 ARG A CZ 1 ATOM 2969 N NH1 . ARG A 1 380 ? -14.976 -19.413 26.039 1.00 10.61 ? 380 ARG A NH1 1 ATOM 2970 N NH2 . ARG A 1 380 ? -16.943 -18.803 24.980 1.00 10.01 ? 380 ARG A NH2 1 ATOM 2971 N N . ASP A 1 381 ? -17.412 -24.132 32.518 1.00 13.40 ? 381 ASP A N 1 ATOM 2972 C CA . ASP A 1 381 ? -17.185 -24.641 33.871 1.00 14.29 ? 381 ASP A CA 1 ATOM 2973 C C . ASP A 1 381 ? -16.690 -26.074 33.799 1.00 14.46 ? 381 ASP A C 1 ATOM 2974 O O . ASP A 1 381 ? -16.813 -26.832 34.767 1.00 14.03 ? 381 ASP A O 1 ATOM 2975 C CB . ASP A 1 381 ? -18.481 -24.568 34.710 1.00 14.45 ? 381 ASP A CB 1 ATOM 2976 C CG . ASP A 1 381 ? -19.654 -25.303 34.056 1.00 15.97 ? 381 ASP A CG 1 ATOM 2977 O OD1 . ASP A 1 381 ? -19.574 -25.678 32.845 1.00 16.85 ? 381 ASP A OD1 1 ATOM 2978 O OD2 . ASP A 1 381 ? -20.675 -25.525 34.748 1.00 16.21 ? 381 ASP A OD2 1 ATOM 2979 N N . LYS A 1 382 ? -16.197 -26.466 32.626 1.00 14.25 ? 382 LYS A N 1 ATOM 2980 C CA . LYS A 1 382 ? -15.680 -27.842 32.412 1.00 14.52 ? 382 LYS A CA 1 ATOM 2981 C C . LYS A 1 382 ? -14.183 -27.827 32.193 1.00 13.69 ? 382 LYS A C 1 ATOM 2982 O O . LYS A 1 382 ? -13.685 -27.116 31.314 1.00 14.49 ? 382 LYS A O 1 ATOM 2983 C CB . LYS A 1 382 ? -16.356 -28.543 31.221 1.00 14.57 ? 382 LYS A CB 1 ATOM 2984 C CG . LYS A 1 382 ? -17.910 -28.463 31.200 1.00 16.09 ? 382 LYS A CG 1 ATOM 2985 C CD . LYS A 1 382 ? -18.545 -29.006 32.520 1.00 15.59 ? 382 LYS A CD 1 ATOM 2986 C CE . LYS A 1 382 ? -20.025 -29.375 32.376 1.00 14.36 ? 382 LYS A CE 1 ATOM 2987 N NZ . LYS A 1 382 ? -20.883 -28.180 32.189 1.00 14.85 ? 382 LYS A NZ 1 ATOM 2988 N N . LEU A 1 383 ? -13.475 -28.628 32.982 1.00 13.28 ? 383 LEU A N 1 ATOM 2989 C CA . LEU A 1 383 ? -12.040 -28.732 32.906 1.00 13.20 ? 383 LEU A CA 1 ATOM 2990 C C . LEU A 1 383 ? -11.613 -29.591 31.720 1.00 13.41 ? 383 LEU A C 1 ATOM 2991 O O . LEU A 1 383 ? -10.664 -29.232 30.988 1.00 13.09 ? 383 LEU A O 1 ATOM 2992 C CB . LEU A 1 383 ? -11.453 -29.307 34.235 1.00 14.57 ? 383 LEU A CB 1 ATOM 2993 C CG . LEU A 1 383 ? -9.921 -29.269 34.295 1.00 14.72 ? 383 LEU A CG 1 ATOM 2994 C CD1 . LEU A 1 383 ? -9.405 -28.922 35.689 1.00 17.19 ? 383 LEU A CD1 1 ATOM 2995 C CD2 . LEU A 1 383 ? -9.289 -30.571 33.805 1.00 15.66 ? 383 LEU A CD2 1 ATOM 2996 N N . TRP A 1 384 ? -12.282 -30.735 31.556 1.00 12.37 ? 384 TRP A N 1 ATOM 2997 C CA . TRP A 1 384 ? -11.947 -31.691 30.494 1.00 12.74 ? 384 TRP A CA 1 ATOM 2998 C C . TRP A 1 384 ? -12.898 -31.603 29.296 1.00 12.32 ? 384 TRP A C 1 ATOM 2999 O O . TRP A 1 384 ? -14.117 -31.584 29.462 1.00 13.74 ? 384 TRP A O 1 ATOM 3000 C CB . TRP A 1 384 ? -12.082 -33.127 31.034 1.00 12.96 ? 384 TRP A CB 1 ATOM 3001 C CG . TRP A 1 384 ? -11.039 -33.517 32.062 1.00 14.42 ? 384 TRP A CG 1 ATOM 3002 C CD1 . TRP A 1 384 ? -11.243 -33.753 33.405 1.00 14.63 ? 384 TRP A CD1 1 ATOM 3003 C CD2 . TRP A 1 384 ? -9.649 -33.752 31.822 1.00 14.96 ? 384 TRP A CD2 1 ATOM 3004 N NE1 . TRP A 1 384 ? -10.061 -34.112 34.014 1.00 15.06 ? 384 TRP A NE1 1 ATOM 3005 C CE2 . TRP A 1 384 ? -9.063 -34.122 33.067 1.00 15.56 ? 384 TRP A CE2 1 ATOM 3006 C CE3 . TRP A 1 384 ? -8.832 -33.667 30.684 1.00 14.74 ? 384 TRP A CE3 1 ATOM 3007 C CZ2 . TRP A 1 384 ? -7.698 -34.407 33.200 1.00 15.48 ? 384 TRP A CZ2 1 ATOM 3008 C CZ3 . TRP A 1 384 ? -7.468 -33.964 30.817 1.00 15.87 ? 384 TRP A CZ3 1 ATOM 3009 C CH2 . TRP A 1 384 ? -6.917 -34.321 32.070 1.00 16.33 ? 384 TRP A CH2 1 ATOM 3010 N N . LEU A 1 385 ? -12.336 -31.602 28.101 1.00 12.22 ? 385 LEU A N 1 ATOM 3011 C CA . LEU A 1 385 ? -13.071 -31.839 26.859 1.00 12.07 ? 385 LEU A CA 1 ATOM 3012 C C . LEU A 1 385 ? -12.533 -33.184 26.313 1.00 11.77 ? 385 LEU A C 1 ATOM 3013 O O . LEU A 1 385 ? -11.328 -33.345 26.117 1.00 11.85 ? 385 LEU A O 1 ATOM 3014 C CB . LEU A 1 385 ? -12.832 -30.706 25.839 1.00 11.95 ? 385 LEU A CB 1 ATOM 3015 C CG . LEU A 1 385 ? -13.121 -31.021 24.353 1.00 12.34 ? 385 LEU A CG 1 ATOM 3016 C CD1 . LEU A 1 385 ? -14.574 -31.363 24.105 1.00 11.80 ? 385 LEU A CD1 1 ATOM 3017 C CD2 . LEU A 1 385 ? -12.737 -29.891 23.451 1.00 11.96 ? 385 LEU A CD2 1 ATOM 3018 N N . ILE A 1 386 ? -13.426 -34.135 26.071 1.00 10.93 ? 386 ILE A N 1 ATOM 3019 C CA . ILE A 1 386 ? -12.994 -35.496 25.786 1.00 10.81 ? 386 ILE A CA 1 ATOM 3020 C C . ILE A 1 386 ? -13.603 -35.943 24.481 1.00 10.26 ? 386 ILE A C 1 ATOM 3021 O O . ILE A 1 386 ? -14.818 -35.828 24.290 1.00 10.41 ? 386 ILE A O 1 ATOM 3022 C CB . ILE A 1 386 ? -13.405 -36.472 26.932 1.00 10.57 ? 386 ILE A CB 1 ATOM 3023 C CG1 . ILE A 1 386 ? -12.768 -36.025 28.264 1.00 10.69 ? 386 ILE A CG1 1 ATOM 3024 C CG2 . ILE A 1 386 ? -13.057 -37.938 26.584 1.00 9.11 ? 386 ILE A CG2 1 ATOM 3025 C CD1 . ILE A 1 386 ? -13.278 -36.827 29.508 1.00 10.63 ? 386 ILE A CD1 1 ATOM 3026 N N . GLN A 1 387 ? -12.751 -36.439 23.592 1.00 10.81 ? 387 GLN A N 1 ATOM 3027 C CA . GLN A 1 387 ? -13.187 -37.035 22.342 1.00 10.49 ? 387 GLN A CA 1 ATOM 3028 C C . GLN A 1 387 ? -12.917 -38.543 22.331 1.00 11.78 ? 387 GLN A C 1 ATOM 3029 O O . GLN A 1 387 ? -11.826 -38.995 22.734 1.00 12.22 ? 387 GLN A O 1 ATOM 3030 C CB . GLN A 1 387 ? -12.517 -36.356 21.131 1.00 11.07 ? 387 GLN A CB 1 ATOM 3031 C CG . GLN A 1 387 ? -13.033 -36.959 19.795 1.00 10.91 ? 387 GLN A CG 1 ATOM 3032 C CD . GLN A 1 387 ? -12.624 -36.196 18.552 1.00 12.26 ? 387 GLN A CD 1 ATOM 3033 O OE1 . GLN A 1 387 ? -13.293 -36.296 17.514 1.00 12.59 ? 387 GLN A OE1 1 ATOM 3034 N NE2 . GLN A 1 387 ? -11.492 -35.460 18.625 1.00 11.70 ? 387 GLN A NE2 1 ATOM 3035 N N . PHE A 1 388 ? -13.929 -39.294 21.874 1.00 11.95 ? 388 PHE A N 1 ATOM 3036 C CA . PHE A 1 388 ? -13.896 -40.731 21.651 1.00 12.55 ? 388 PHE A CA 1 ATOM 3037 C C . PHE A 1 388 ? -14.176 -40.932 20.168 1.00 12.87 ? 388 PHE A C 1 ATOM 3038 O O . PHE A 1 388 ? -15.149 -40.385 19.647 1.00 14.14 ? 388 PHE A O 1 ATOM 3039 C CB . PHE A 1 388 ? -15.038 -41.422 22.416 1.00 13.44 ? 388 PHE A CB 1 ATOM 3040 C CG . PHE A 1 388 ? -14.952 -41.320 23.919 1.00 13.40 ? 388 PHE A CG 1 ATOM 3041 C CD1 . PHE A 1 388 ? -14.170 -42.221 24.658 1.00 14.74 ? 388 PHE A CD1 1 ATOM 3042 C CD2 . PHE A 1 388 ? -15.686 -40.363 24.590 1.00 13.58 ? 388 PHE A CD2 1 ATOM 3043 C CE1 . PHE A 1 388 ? -14.109 -42.141 26.051 1.00 15.31 ? 388 PHE A CE1 1 ATOM 3044 C CE2 . PHE A 1 388 ? -15.644 -40.266 25.981 1.00 15.39 ? 388 PHE A CE2 1 ATOM 3045 C CZ . PHE A 1 388 ? -14.852 -41.161 26.720 1.00 14.81 ? 388 PHE A CZ 1 ATOM 3046 N N . TYR A 1 389 ? -13.342 -41.711 19.489 1.00 12.87 ? 389 TYR A N 1 ATOM 3047 C CA . TYR A 1 389 ? -13.385 -41.828 18.002 1.00 13.34 ? 389 TYR A CA 1 ATOM 3048 C C . TYR A 1 389 ? -13.124 -43.290 17.620 1.00 13.45 ? 389 TYR A C 1 ATOM 3049 O O . TYR A 1 389 ? -12.183 -43.886 18.128 1.00 13.50 ? 389 TYR A O 1 ATOM 3050 C CB . TYR A 1 389 ? -12.293 -40.975 17.390 1.00 11.85 ? 389 TYR A CB 1 ATOM 3051 C CG . TYR A 1 389 ? -12.496 -40.493 15.959 1.00 13.09 ? 389 TYR A CG 1 ATOM 3052 C CD1 . TYR A 1 389 ? -13.124 -39.276 15.702 1.00 13.51 ? 389 TYR A CD1 1 ATOM 3053 C CD2 . TYR A 1 389 ? -11.999 -41.216 14.861 1.00 14.04 ? 389 TYR A CD2 1 ATOM 3054 C CE1 . TYR A 1 389 ? -13.279 -38.793 14.414 1.00 14.07 ? 389 TYR A CE1 1 ATOM 3055 C CE2 . TYR A 1 389 ? -12.146 -40.720 13.548 1.00 13.45 ? 389 TYR A CE2 1 ATOM 3056 C CZ . TYR A 1 389 ? -12.791 -39.504 13.352 1.00 14.22 ? 389 TYR A CZ 1 ATOM 3057 O OH . TYR A 1 389 ? -12.970 -38.986 12.089 1.00 15.93 ? 389 TYR A OH 1 ATOM 3058 N N . ASP A 1 390 ? -13.952 -43.825 16.729 1.00 12.96 ? 390 ASP A N 1 ATOM 3059 C CA . ASP A 1 390 ? -14.000 -45.239 16.388 1.00 13.50 ? 390 ASP A CA 1 ATOM 3060 C C . ASP A 1 390 ? -14.061 -45.375 14.856 1.00 13.47 ? 390 ASP A C 1 ATOM 3061 O O . ASP A 1 390 ? -15.111 -45.187 14.242 1.00 12.75 ? 390 ASP A O 1 ATOM 3062 C CB . ASP A 1 390 ? -15.244 -45.827 17.032 1.00 13.83 ? 390 ASP A CB 1 ATOM 3063 C CG . ASP A 1 390 ? -15.321 -47.334 16.925 1.00 15.99 ? 390 ASP A CG 1 ATOM 3064 O OD1 . ASP A 1 390 ? -14.373 -47.951 16.361 1.00 15.23 ? 390 ASP A OD1 1 ATOM 3065 O OD2 . ASP A 1 390 ? -16.364 -47.887 17.392 1.00 14.59 ? 390 ASP A OD2 1 ATOM 3066 N N . ARG A 1 391 ? -12.928 -45.689 14.246 1.00 12.56 ? 391 ARG A N 1 ATOM 3067 C CA . ARG A 1 391 ? -12.824 -45.611 12.792 1.00 14.50 ? 391 ARG A CA 1 ATOM 3068 C C . ARG A 1 391 ? -12.491 -46.935 12.045 1.00 14.91 ? 391 ARG A C 1 ATOM 3069 O O . ARG A 1 391 ? -11.455 -47.541 12.270 1.00 13.99 ? 391 ARG A O 1 ATOM 3070 C CB . ARG A 1 391 ? -11.809 -44.532 12.393 1.00 13.43 ? 391 ARG A CB 1 ATOM 3071 C CG . ARG A 1 391 ? -11.599 -44.463 10.891 1.00 15.44 ? 391 ARG A CG 1 ATOM 3072 C CD . ARG A 1 391 ? -10.756 -43.292 10.458 1.00 18.47 ? 391 ARG A CD 1 ATOM 3073 N NE . ARG A 1 391 ? -9.314 -43.465 10.653 1.00 20.89 ? 391 ARG A NE 1 ATOM 3074 C CZ . ARG A 1 391 ? -8.486 -42.480 11.066 1.00 25.80 ? 391 ARG A CZ 1 ATOM 3075 N NH1 . ARG A 1 391 ? -8.947 -41.246 11.412 1.00 22.17 ? 391 ARG A NH1 1 ATOM 3076 N NH2 . ARG A 1 391 ? -7.182 -42.724 11.171 1.00 21.97 ? 391 ARG A NH2 1 ATOM 3077 N N . TYR A 1 392 ? -13.373 -47.315 11.121 1.00 15.49 ? 392 TYR A N 1 ATOM 3078 C CA . TYR A 1 392 ? -13.154 -48.420 10.200 1.00 15.42 ? 392 TYR A CA 1 ATOM 3079 C C . TYR A 1 392 ? -12.594 -47.917 8.862 1.00 17.45 ? 392 TYR A C 1 ATOM 3080 O O . TYR A 1 392 ? -12.600 -46.698 8.573 1.00 16.96 ? 392 TYR A O 1 ATOM 3081 C CB . TYR A 1 392 ? -14.462 -49.165 9.975 1.00 15.94 ? 392 TYR A CB 1 ATOM 3082 C CG . TYR A 1 392 ? -14.870 -50.056 11.131 1.00 15.89 ? 392 TYR A CG 1 ATOM 3083 C CD1 . TYR A 1 392 ? -15.439 -49.513 12.288 1.00 15.32 ? 392 TYR A CD1 1 ATOM 3084 C CD2 . TYR A 1 392 ? -14.676 -51.453 11.070 1.00 16.76 ? 392 TYR A CD2 1 ATOM 3085 C CE1 . TYR A 1 392 ? -15.824 -50.316 13.349 1.00 15.78 ? 392 TYR A CE1 1 ATOM 3086 C CE2 . TYR A 1 392 ? -15.045 -52.276 12.124 1.00 16.01 ? 392 TYR A CE2 1 ATOM 3087 C CZ . TYR A 1 392 ? -15.611 -51.709 13.259 1.00 16.66 ? 392 TYR A CZ 1 ATOM 3088 O OH . TYR A 1 392 ? -15.996 -52.509 14.291 1.00 17.46 ? 392 TYR A OH 1 ATOM 3089 N N . ASP A 1 393 ? -12.075 -48.844 8.061 1.00 15.58 ? 393 ASP A N 1 ATOM 3090 C CA . ASP A 1 393 ? -11.568 -48.495 6.734 1.00 17.52 ? 393 ASP A CA 1 ATOM 3091 C C . ASP A 1 393 ? -12.741 -48.081 5.845 1.00 16.87 ? 393 ASP A C 1 ATOM 3092 O O . ASP A 1 393 ? -13.883 -48.488 6.072 1.00 15.91 ? 393 ASP A O 1 ATOM 3093 C CB . ASP A 1 393 ? -10.833 -49.685 6.108 1.00 17.59 ? 393 ASP A CB 1 ATOM 3094 C CG . ASP A 1 393 ? -9.574 -50.031 6.839 0.50 19.36 ? 393 ASP A CG 1 ATOM 3095 O OD1 . ASP A 1 393 ? -8.928 -49.108 7.385 0.50 18.44 ? 393 ASP A OD1 1 ATOM 3096 O OD2 . ASP A 1 393 ? -9.234 -51.237 6.866 0.50 21.27 ? 393 ASP A OD2 1 ATOM 3097 N N . ASN A 1 394 ? -12.451 -47.291 4.823 1.00 16.97 ? 394 ASN A N 1 ATOM 3098 C CA . ASN A 1 394 ? -13.504 -46.810 3.936 1.00 19.13 ? 394 ASN A CA 1 ATOM 3099 C C . ASN A 1 394 ? -14.139 -47.890 3.067 1.00 20.28 ? 394 ASN A C 1 ATOM 3100 O O . ASN A 1 394 ? -15.249 -47.710 2.605 1.00 19.07 ? 394 ASN A O 1 ATOM 3101 C CB . ASN A 1 394 ? -13.013 -45.623 3.093 1.00 17.96 ? 394 ASN A CB 1 ATOM 3102 C CG . ASN A 1 394 ? -12.750 -44.385 3.952 1.00 18.03 ? 394 ASN A CG 1 ATOM 3103 O OD1 . ASN A 1 394 ? -13.256 -44.283 5.082 1.00 14.05 ? 394 ASN A OD1 1 ATOM 3104 N ND2 . ASN A 1 394 ? -11.941 -43.455 3.430 1.00 17.12 ? 394 ASN A ND2 1 ATOM 3105 N N . ASN A 1 395 ? -13.441 -49.003 2.860 1.00 25.21 ? 395 ASN A N 1 ATOM 3106 C CA . ASN A 1 395 ? -14.041 -50.159 2.176 1.00 27.80 ? 395 ASN A CA 1 ATOM 3107 C C . ASN A 1 395 ? -14.727 -51.165 3.114 1.00 29.10 ? 395 ASN A C 1 ATOM 3108 O O . ASN A 1 395 ? -14.984 -52.304 2.704 1.00 28.05 ? 395 ASN A O 1 ATOM 3109 C CB . ASN A 1 395 ? -13.029 -50.858 1.241 1.00 30.22 ? 395 ASN A CB 1 ATOM 3110 C CG . ASN A 1 395 ? -11.810 -51.422 1.979 1.00 38.90 ? 395 ASN A CG 1 ATOM 3111 O OD1 . ASN A 1 395 ? -11.845 -51.655 3.188 1.00 39.78 ? 395 ASN A OD1 1 ATOM 3112 N ND2 . ASN A 1 395 ? -10.717 -51.644 1.237 1.00 43.78 ? 395 ASN A ND2 1 ATOM 3113 N N . GLN A 1 396 ? -15.016 -50.759 4.357 1.00 24.56 ? 396 GLN A N 1 ATOM 3114 C CA . GLN A 1 396 ? -15.779 -51.603 5.286 1.00 23.13 ? 396 GLN A CA 1 ATOM 3115 C C . GLN A 1 396 ? -17.052 -50.905 5.708 1.00 23.02 ? 396 GLN A C 1 ATOM 3116 O O . GLN A 1 396 ? -17.126 -49.673 5.721 1.00 24.12 ? 396 GLN A O 1 ATOM 3117 C CB . GLN A 1 396 ? -14.995 -51.891 6.581 1.00 26.87 ? 396 GLN A CB 1 ATOM 3118 C CG . GLN A 1 396 ? -13.679 -52.620 6.432 1.00 28.34 ? 396 GLN A CG 1 ATOM 3119 C CD . GLN A 1 396 ? -12.921 -52.768 7.754 1.00 30.39 ? 396 GLN A CD 1 ATOM 3120 O OE1 . GLN A 1 396 ? -12.502 -51.772 8.380 1.00 29.43 ? 396 GLN A OE1 1 ATOM 3121 N NE2 . GLN A 1 396 ? -12.715 -54.013 8.170 1.00 25.92 ? 396 GLN A NE2 1 ATOM 3122 N N . THR A 1 397 ? -18.035 -51.699 6.094 1.00 20.88 ? 397 THR A N 1 ATOM 3123 C CA . THR A 1 397 ? -19.265 -51.212 6.690 1.00 21.43 ? 397 THR A CA 1 ATOM 3124 C C . THR A 1 397 ? -19.039 -51.040 8.167 1.00 22.42 ? 397 THR A C 1 ATOM 3125 O O . THR A 1 397 ? -18.503 -51.938 8.804 1.00 22.07 ? 397 THR A O 1 ATOM 3126 C CB . THR A 1 397 ? -20.406 -52.231 6.466 1.00 20.80 ? 397 THR A CB 1 ATOM 3127 O OG1 . THR A 1 397 ? -20.596 -52.378 5.060 1.00 24.71 ? 397 THR A OG1 1 ATOM 3128 C CG2 . THR A 1 397 ? -21.727 -51.762 7.073 1.00 22.81 ? 397 THR A CG2 1 ATOM 3129 N N . TYR A 1 398 ? -19.441 -49.891 8.727 1.00 21.04 ? 398 TYR A N 1 ATOM 3130 C CA . TYR A 1 398 ? -19.413 -49.758 10.170 1.00 19.01 ? 398 TYR A CA 1 ATOM 3131 C C . TYR A 1 398 ? -20.457 -50.712 10.747 1.00 19.21 ? 398 TYR A C 1 ATOM 3132 O O . TYR A 1 398 ? -21.633 -50.546 10.466 1.00 17.45 ? 398 TYR A O 1 ATOM 3133 C CB . TYR A 1 398 ? -19.714 -48.321 10.613 1.00 18.09 ? 398 TYR A CB 1 ATOM 3134 C CG . TYR A 1 398 ? -19.484 -48.136 12.091 1.00 16.20 ? 398 TYR A CG 1 ATOM 3135 C CD1 . TYR A 1 398 ? -20.471 -48.446 13.016 1.00 13.82 ? 398 TYR A CD1 1 ATOM 3136 C CD2 . TYR A 1 398 ? -18.249 -47.659 12.569 1.00 14.67 ? 398 TYR A CD2 1 ATOM 3137 C CE1 . TYR A 1 398 ? -20.239 -48.278 14.381 1.00 13.09 ? 398 TYR A CE1 1 ATOM 3138 C CE2 . TYR A 1 398 ? -18.018 -47.496 13.923 1.00 12.77 ? 398 TYR A CE2 1 ATOM 3139 C CZ . TYR A 1 398 ? -19.003 -47.815 14.823 1.00 12.10 ? 398 TYR A CZ 1 ATOM 3140 O OH . TYR A 1 398 ? -18.752 -47.677 16.181 1.00 11.77 ? 398 TYR A OH 1 ATOM 3141 N N . PRO A 1 399 ? -20.033 -51.696 11.577 1.00 21.63 ? 399 PRO A N 1 ATOM 3142 C CA . PRO A 1 399 ? -20.987 -52.664 12.123 1.00 20.62 ? 399 PRO A CA 1 ATOM 3143 C C . PRO A 1 399 ? -21.986 -52.104 13.121 1.00 22.60 ? 399 PRO A C 1 ATOM 3144 O O . PRO A 1 399 ? -21.631 -51.330 14.012 1.00 21.04 ? 399 PRO A O 1 ATOM 3145 C CB . PRO A 1 399 ? -20.079 -53.730 12.789 1.00 21.09 ? 399 PRO A CB 1 ATOM 3146 C CG . PRO A 1 399 ? -18.778 -53.605 12.099 1.00 21.30 ? 399 PRO A CG 1 ATOM 3147 C CD . PRO A 1 399 ? -18.644 -52.110 11.859 1.00 20.87 ? 399 PRO A CD 1 ATOM 3148 N N . GLU A 1 400 ? -23.234 -52.543 12.980 1.00 23.52 ? 400 GLU A N 1 ATOM 3149 C CA . GLU A 1 400 ? -24.318 -52.154 13.877 1.00 25.43 ? 400 GLU A CA 1 ATOM 3150 C C . GLU A 1 400 ? -24.014 -52.453 15.350 1.00 24.63 ? 400 GLU A C 1 ATOM 3151 O O . GLU A 1 400 ? -24.494 -51.762 16.244 1.00 25.51 ? 400 GLU A O 1 ATOM 3152 C CB . GLU A 1 400 ? -25.655 -52.801 13.417 1.00 27.84 ? 400 GLU A CB 1 ATOM 3153 C CG . GLU A 1 400 ? -26.051 -54.192 14.032 1.00 29.96 ? 400 GLU A CG 1 ATOM 3154 C CD . GLU A 1 400 ? -25.790 -55.438 13.161 0.50 29.96 ? 400 GLU A CD 1 ATOM 3155 O OE1 . GLU A 1 400 ? -25.012 -55.409 12.173 0.50 26.83 ? 400 GLU A OE1 1 ATOM 3156 O OE2 . GLU A 1 400 ? -26.384 -56.484 13.507 0.50 32.61 ? 400 GLU A OE2 1 ATOM 3157 N N . THR A 1 401 ? -23.200 -53.473 15.608 1.00 28.07 ? 401 THR A N 1 ATOM 3158 C CA . THR A 1 401 ? -22.833 -53.808 17.001 1.00 27.01 ? 401 THR A CA 1 ATOM 3159 C C . THR A 1 401 ? -21.692 -52.959 17.587 1.00 25.75 ? 401 THR A C 1 ATOM 3160 O O . THR A 1 401 ? -21.564 -52.862 18.818 1.00 22.90 ? 401 THR A O 1 ATOM 3161 C CB . THR A 1 401 ? -22.510 -55.305 17.172 1.00 30.02 ? 401 THR A CB 1 ATOM 3162 O OG1 . THR A 1 401 ? -21.638 -55.756 16.112 1.00 31.93 ? 401 THR A OG1 1 ATOM 3163 C CG2 . THR A 1 401 ? -23.809 -56.111 17.159 1.00 33.17 ? 401 THR A CG2 1 ATOM 3164 N N . SER A 1 402 ? -20.907 -52.309 16.721 1.00 23.78 ? 402 SER A N 1 ATOM 3165 C CA . SER A 1 402 ? -19.732 -51.516 17.172 1.00 20.83 ? 402 SER A CA 1 ATOM 3166 C C . SER A 1 402 ? -20.056 -50.286 18.055 1.00 18.82 ? 402 SER A C 1 ATOM 3167 O O . SER A 1 402 ? -19.226 -49.867 18.885 1.00 16.49 ? 402 SER A O 1 ATOM 3168 C CB . SER A 1 402 ? -18.837 -51.151 15.986 1.00 20.46 ? 402 SER A CB 1 ATOM 3169 O OG . SER A 1 402 ? -18.337 -52.349 15.396 1.00 22.58 ? 402 SER A OG 1 ATOM 3170 N N . PHE A 1 403 ? -21.258 -49.730 17.913 1.00 20.44 ? 403 PHE A N 1 ATOM 3171 C CA . PHE A 1 403 ? -21.637 -48.516 18.660 1.00 20.46 ? 403 PHE A CA 1 ATOM 3172 C C . PHE A 1 403 ? -21.465 -48.716 20.170 1.00 22.20 ? 403 PHE A C 1 ATOM 3173 O O . PHE A 1 403 ? -21.056 -47.802 20.887 1.00 19.07 ? 403 PHE A O 1 ATOM 3174 C CB . PHE A 1 403 ? -23.084 -48.086 18.380 1.00 21.12 ? 403 PHE A CB 1 ATOM 3175 C CG . PHE A 1 403 ? -23.343 -47.705 16.938 1.00 19.93 ? 403 PHE A CG 1 ATOM 3176 C CD1 . PHE A 1 403 ? -22.800 -46.555 16.407 1.00 17.26 ? 403 PHE A CD1 1 ATOM 3177 C CD2 . PHE A 1 403 ? -24.125 -48.520 16.123 1.00 20.40 ? 403 PHE A CD2 1 ATOM 3178 C CE1 . PHE A 1 403 ? -23.011 -46.212 15.092 1.00 20.31 ? 403 PHE A CE1 1 ATOM 3179 C CE2 . PHE A 1 403 ? -24.372 -48.179 14.780 1.00 23.39 ? 403 PHE A CE2 1 ATOM 3180 C CZ . PHE A 1 403 ? -23.799 -47.017 14.256 1.00 21.04 ? 403 PHE A CZ 1 ATOM 3181 N N . LYS A 1 404 ? -21.750 -49.926 20.636 1.00 22.61 ? 404 LYS A N 1 ATOM 3182 C CA . LYS A 1 404 ? -21.710 -50.203 22.072 1.00 24.36 ? 404 LYS A CA 1 ATOM 3183 C C . LYS A 1 404 ? -20.305 -49.970 22.684 1.00 21.32 ? 404 LYS A C 1 ATOM 3184 O O . LYS A 1 404 ? -20.205 -49.687 23.863 1.00 19.69 ? 404 LYS A O 1 ATOM 3185 C CB . LYS A 1 404 ? -22.293 -51.588 22.402 1.00 26.53 ? 404 LYS A CB 1 ATOM 3186 C CG . LYS A 1 404 ? -21.489 -52.770 21.918 1.00 30.96 ? 404 LYS A CG 1 ATOM 3187 C CD . LYS A 1 404 ? -22.213 -54.102 22.238 1.00 36.00 ? 404 LYS A CD 1 ATOM 3188 C CE . LYS A 1 404 ? -21.219 -55.267 22.441 1.00 38.96 ? 404 LYS A CE 1 ATOM 3189 N NZ . LYS A 1 404 ? -20.364 -55.556 21.236 1.00 37.06 ? 404 LYS A NZ 1 ATOM 3190 N N . PHE A 1 405 ? -19.255 -50.056 21.861 1.00 18.27 ? 405 PHE A N 1 ATOM 3191 C CA . PHE A 1 405 ? -17.885 -49.782 22.293 1.00 16.36 ? 405 PHE A CA 1 ATOM 3192 C C . PHE A 1 405 ? -17.759 -48.345 22.849 1.00 16.53 ? 405 PHE A C 1 ATOM 3193 O O . PHE A 1 405 ? -17.494 -48.173 24.061 1.00 15.63 ? 405 PHE A O 1 ATOM 3194 C CB . PHE A 1 405 ? -16.875 -50.056 21.152 1.00 15.49 ? 405 PHE A CB 1 ATOM 3195 C CG . PHE A 1 405 ? -15.472 -49.551 21.433 1.00 16.80 ? 405 PHE A CG 1 ATOM 3196 C CD1 . PHE A 1 405 ? -14.856 -49.774 22.675 1.00 17.15 ? 405 PHE A CD1 1 ATOM 3197 C CD2 . PHE A 1 405 ? -14.753 -48.880 20.445 1.00 14.78 ? 405 PHE A CD2 1 ATOM 3198 C CE1 . PHE A 1 405 ? -13.554 -49.262 22.938 1.00 17.37 ? 405 PHE A CE1 1 ATOM 3199 C CE2 . PHE A 1 405 ? -13.478 -48.410 20.696 1.00 16.42 ? 405 PHE A CE2 1 ATOM 3200 C CZ . PHE A 1 405 ? -12.874 -48.595 21.947 1.00 14.66 ? 405 PHE A CZ 1 ATOM 3201 N N . LEU A 1 406 ? -17.971 -47.315 22.011 1.00 13.39 ? 406 LEU A N 1 ATOM 3202 C CA . LEU A 1 406 ? -17.898 -45.945 22.557 1.00 13.24 ? 406 LEU A CA 1 ATOM 3203 C C . LEU A 1 406 ? -19.027 -45.667 23.557 1.00 13.09 ? 406 LEU A C 1 ATOM 3204 O O . LEU A 1 406 ? -18.800 -45.000 24.561 1.00 13.89 ? 406 LEU A O 1 ATOM 3205 C CB . LEU A 1 406 ? -17.818 -44.869 21.468 1.00 12.91 ? 406 LEU A CB 1 ATOM 3206 C CG . LEU A 1 406 ? -16.589 -44.911 20.526 1.00 12.79 ? 406 LEU A CG 1 ATOM 3207 C CD1 . LEU A 1 406 ? -16.469 -43.616 19.734 1.00 12.19 ? 406 LEU A CD1 1 ATOM 3208 C CD2 . LEU A 1 406 ? -15.301 -45.184 21.271 1.00 12.91 ? 406 LEU A CD2 1 ATOM 3209 N N . ASP A 1 407 ? -20.226 -46.193 23.314 1.00 12.46 ? 407 ASP A N 1 ATOM 3210 C CA . ASP A 1 407 ? -21.333 -45.986 24.250 1.00 14.94 ? 407 ASP A CA 1 ATOM 3211 C C . ASP A 1 407 ? -20.950 -46.450 25.659 1.00 16.86 ? 407 ASP A C 1 ATOM 3212 O O . ASP A 1 407 ? -21.244 -45.771 26.652 1.00 18.29 ? 407 ASP A O 1 ATOM 3213 C CB . ASP A 1 407 ? -22.588 -46.766 23.805 1.00 14.65 ? 407 ASP A CB 1 ATOM 3214 C CG . ASP A 1 407 ? -23.326 -46.109 22.635 1.00 15.76 ? 407 ASP A CG 1 ATOM 3215 O OD1 . ASP A 1 407 ? -22.968 -44.972 22.209 1.00 12.89 ? 407 ASP A OD1 1 ATOM 3216 O OD2 . ASP A 1 407 ? -24.310 -46.739 22.168 1.00 15.18 ? 407 ASP A OD2 1 ATOM 3217 N N . GLY A 1 408 ? -20.300 -47.616 25.741 1.00 16.16 ? 408 GLY A N 1 ATOM 3218 C CA . GLY A 1 408 ? -19.917 -48.176 27.034 1.00 17.54 ? 408 GLY A CA 1 ATOM 3219 C C . GLY A 1 408 ? -18.834 -47.358 27.721 1.00 16.68 ? 408 GLY A C 1 ATOM 3220 O O . GLY A 1 408 ? -18.856 -47.186 28.935 1.00 18.76 ? 408 GLY A O 1 ATOM 3221 N N . TRP A 1 409 ? -17.887 -46.830 26.952 1.00 15.32 ? 409 TRP A N 1 ATOM 3222 C CA . TRP A 1 409 ? -16.831 -46.024 27.559 1.00 15.37 ? 409 TRP A CA 1 ATOM 3223 C C . TRP A 1 409 ? -17.412 -44.747 28.155 1.00 15.19 ? 409 TRP A C 1 ATOM 3224 O O . TRP A 1 409 ? -17.047 -44.360 29.254 1.00 15.28 ? 409 TRP A O 1 ATOM 3225 C CB . TRP A 1 409 ? -15.731 -45.688 26.549 1.00 14.08 ? 409 TRP A CB 1 ATOM 3226 C CG . TRP A 1 409 ? -14.337 -45.646 27.136 1.00 12.43 ? 409 TRP A CG 1 ATOM 3227 C CD1 . TRP A 1 409 ? -13.980 -45.532 28.473 1.00 12.81 ? 409 TRP A CD1 1 ATOM 3228 C CD2 . TRP A 1 409 ? -13.122 -45.687 26.406 1.00 12.02 ? 409 TRP A CD2 1 ATOM 3229 N NE1 . TRP A 1 409 ? -12.612 -45.521 28.595 1.00 12.25 ? 409 TRP A NE1 1 ATOM 3230 C CE2 . TRP A 1 409 ? -12.063 -45.610 27.340 1.00 12.30 ? 409 TRP A CE2 1 ATOM 3231 C CE3 . TRP A 1 409 ? -12.816 -45.805 25.039 1.00 11.80 ? 409 TRP A CE3 1 ATOM 3232 C CZ2 . TRP A 1 409 ? -10.736 -45.651 26.952 1.00 11.96 ? 409 TRP A CZ2 1 ATOM 3233 C CZ3 . TRP A 1 409 ? -11.508 -45.813 24.659 1.00 11.13 ? 409 TRP A CZ3 1 ATOM 3234 C CH2 . TRP A 1 409 ? -10.477 -45.745 25.612 1.00 11.75 ? 409 TRP A CH2 1 ATOM 3235 N N . VAL A 1 410 ? -18.323 -44.101 27.418 1.00 16.11 ? 410 VAL A N 1 ATOM 3236 C CA . VAL A 1 410 ? -18.933 -42.856 27.859 1.00 15.24 ? 410 VAL A CA 1 ATOM 3237 C C . VAL A 1 410 ? -19.820 -43.143 29.080 1.00 16.58 ? 410 VAL A C 1 ATOM 3238 O O . VAL A 1 410 ? -19.828 -42.387 30.050 1.00 15.98 ? 410 VAL A O 1 ATOM 3239 C CB . VAL A 1 410 ? -19.761 -42.204 26.710 1.00 15.64 ? 410 VAL A CB 1 ATOM 3240 C CG1 . VAL A 1 410 ? -20.780 -41.197 27.258 1.00 15.51 ? 410 VAL A CG1 1 ATOM 3241 C CG2 . VAL A 1 410 ? -18.830 -41.540 25.675 1.00 14.59 ? 410 VAL A CG2 1 ATOM 3242 N N . ASN A 1 411 ? -20.555 -44.254 29.021 1.00 18.77 ? 411 ASN A N 1 ATOM 3243 C CA . ASN A 1 411 ? -21.412 -44.668 30.128 1.00 19.64 ? 411 ASN A CA 1 ATOM 3244 C C . ASN A 1 411 ? -20.566 -44.953 31.375 1.00 18.47 ? 411 ASN A C 1 ATOM 3245 O O . ASN A 1 411 ? -20.975 -44.638 32.502 1.00 16.18 ? 411 ASN A O 1 ATOM 3246 C CB . ASN A 1 411 ? -22.247 -45.897 29.737 1.00 21.65 ? 411 ASN A CB 1 ATOM 3247 C CG . ASN A 1 411 ? -22.850 -46.602 30.948 1.00 29.62 ? 411 ASN A CG 1 ATOM 3248 O OD1 . ASN A 1 411 ? -23.860 -46.154 31.503 1.00 30.92 ? 411 ASN A OD1 1 ATOM 3249 N ND2 . ASN A 1 411 ? -22.222 -47.715 31.371 1.00 33.63 ? 411 ASN A ND2 1 ATOM 3250 N N . SER A 1 412 ? -19.375 -45.520 31.160 1.00 19.10 ? 412 SER A N 1 ATOM 3251 C CA . SER A 1 412 ? -18.458 -45.777 32.280 1.00 19.06 ? 412 SER A CA 1 ATOM 3252 C C . SER A 1 412 ? -18.213 -44.505 33.095 1.00 19.41 ? 412 SER A C 1 ATOM 3253 O O . SER A 1 412 ? -18.119 -44.582 34.317 1.00 19.93 ? 412 SER A O 1 ATOM 3254 C CB . SER A 1 412 ? -17.138 -46.427 31.826 1.00 16.33 ? 412 SER A CB 1 ATOM 3255 O OG . SER A 1 412 ? -16.164 -45.457 31.481 1.00 18.05 ? 412 SER A OG 1 ATOM 3256 N N . VAL A 1 413 ? -18.138 -43.340 32.429 1.00 17.74 ? 413 VAL A N 1 ATOM 3257 C CA . VAL A 1 413 ? -17.920 -42.071 33.130 1.00 15.67 ? 413 VAL A CA 1 ATOM 3258 C C . VAL A 1 413 ? -19.227 -41.488 33.674 1.00 16.83 ? 413 VAL A C 1 ATOM 3259 O O . VAL A 1 413 ? -19.285 -41.069 34.836 1.00 16.61 ? 413 VAL A O 1 ATOM 3260 C CB . VAL A 1 413 ? -17.169 -41.012 32.239 1.00 15.96 ? 413 VAL A CB 1 ATOM 3261 C CG1 . VAL A 1 413 ? -17.100 -39.637 32.918 1.00 14.79 ? 413 VAL A CG1 1 ATOM 3262 C CG2 . VAL A 1 413 ? -15.782 -41.474 31.898 1.00 15.68 ? 413 VAL A CG2 1 ATOM 3263 N N . THR A 1 414 ? -20.285 -41.482 32.859 1.00 17.83 ? 414 THR A N 1 ATOM 3264 C CA . THR A 1 414 ? -21.515 -40.755 33.226 1.00 18.02 ? 414 THR A CA 1 ATOM 3265 C C . THR A 1 414 ? -22.280 -41.409 34.359 1.00 21.53 ? 414 THR A C 1 ATOM 3266 O O . THR A 1 414 ? -22.905 -40.704 35.185 1.00 21.00 ? 414 THR A O 1 ATOM 3267 C CB . THR A 1 414 ? -22.470 -40.464 32.026 1.00 16.62 ? 414 THR A CB 1 ATOM 3268 O OG1 . THR A 1 414 ? -22.921 -41.680 31.420 1.00 18.36 ? 414 THR A OG1 1 ATOM 3269 C CG2 . THR A 1 414 ? -21.775 -39.590 30.967 1.00 17.11 ? 414 THR A CG2 1 ATOM 3270 N N . LYS A 1 415 ? -22.230 -42.744 34.409 1.00 21.33 ? 415 LYS A N 1 ATOM 3271 C CA . LYS A 1 415 ? -22.883 -43.442 35.495 1.00 22.81 ? 415 LYS A CA 1 ATOM 3272 C C . LYS A 1 415 ? -22.284 -42.989 36.838 1.00 23.01 ? 415 LYS A C 1 ATOM 3273 O O . LYS A 1 415 ? -22.961 -43.061 37.851 1.00 22.98 ? 415 LYS A O 1 ATOM 3274 C CB . LYS A 1 415 ? -22.825 -44.967 35.316 1.00 23.15 ? 415 LYS A CB 1 ATOM 3275 C CG . LYS A 1 415 ? -21.470 -45.622 35.631 1.00 23.25 ? 415 LYS A CG 1 ATOM 3276 C CD . LYS A 1 415 ? -21.530 -47.116 35.364 1.00 24.04 ? 415 LYS A CD 1 ATOM 3277 C CE . LYS A 1 415 ? -20.313 -47.802 35.977 1.00 29.07 ? 415 LYS A CE 1 ATOM 3278 N NZ . LYS A 1 415 ? -20.107 -49.216 35.508 1.00 29.58 ? 415 LYS A NZ 1 ATOM 3279 N N . ALA A 1 416 ? -21.048 -42.465 36.831 1.00 20.97 ? 416 ALA A N 1 ATOM 3280 C CA . ALA A 1 416 ? -20.384 -42.069 38.091 1.00 21.08 ? 416 ALA A CA 1 ATOM 3281 C C . ALA A 1 416 ? -20.629 -40.618 38.506 1.00 21.36 ? 416 ALA A C 1 ATOM 3282 O O . ALA A 1 416 ? -20.120 -40.162 39.538 1.00 21.83 ? 416 ALA A O 1 ATOM 3283 C CB . ALA A 1 416 ? -18.915 -42.338 38.021 1.00 19.91 ? 416 ALA A CB 1 ATOM 3284 N N . LEU A 1 417 ? -21.403 -39.884 37.715 1.00 20.37 ? 417 LEU A N 1 ATOM 3285 C CA . LEU A 1 417 ? -21.507 -38.429 37.934 1.00 19.41 ? 417 LEU A CA 1 ATOM 3286 C C . LEU A 1 417 ? -22.935 -37.922 38.012 1.00 19.12 ? 417 LEU A C 1 ATOM 3287 O O . LEU A 1 417 ? -23.816 -38.457 37.337 1.00 21.11 ? 417 LEU A O 1 ATOM 3288 C CB . LEU A 1 417 ? -20.771 -37.669 36.808 1.00 17.25 ? 417 LEU A CB 1 ATOM 3289 C CG . LEU A 1 417 ? -19.246 -37.796 36.688 1.00 17.21 ? 417 LEU A CG 1 ATOM 3290 C CD1 . LEU A 1 417 ? -18.766 -37.123 35.370 1.00 14.60 ? 417 LEU A CD1 1 ATOM 3291 C CD2 . LEU A 1 417 ? -18.526 -37.215 37.926 1.00 15.77 ? 417 LEU A CD2 1 ATOM 3292 N N . PRO A 1 418 ? -23.173 -36.866 38.803 1.00 19.97 ? 418 PRO A N 1 ATOM 3293 C CA . PRO A 1 418 ? -24.508 -36.275 38.670 1.00 22.27 ? 418 PRO A CA 1 ATOM 3294 C C . PRO A 1 418 ? -24.599 -35.646 37.273 1.00 24.88 ? 418 PRO A C 1 ATOM 3295 O O . PRO A 1 418 ? -23.572 -35.225 36.735 1.00 22.20 ? 418 PRO A O 1 ATOM 3296 C CB . PRO A 1 418 ? -24.541 -35.190 39.746 1.00 21.07 ? 418 PRO A CB 1 ATOM 3297 C CG . PRO A 1 418 ? -23.132 -34.877 40.050 1.00 21.99 ? 418 PRO A CG 1 ATOM 3298 C CD . PRO A 1 418 ? -22.281 -36.088 39.680 1.00 19.65 ? 418 PRO A CD 1 ATOM 3299 N N . LYS A 1 419 ? -25.805 -35.587 36.707 1.00 26.93 ? 419 LYS A N 1 ATOM 3300 C CA A LYS A 1 419 ? -25.996 -35.077 35.352 0.50 26.84 ? 419 LYS A CA 1 ATOM 3301 C CA B LYS A 1 419 ? -26.010 -35.069 35.355 0.50 26.69 ? 419 LYS A CA 1 ATOM 3302 C C . LYS A 1 419 ? -25.515 -33.637 35.202 1.00 27.68 ? 419 LYS A C 1 ATOM 3303 O O . LYS A 1 419 ? -25.061 -33.233 34.136 1.00 29.46 ? 419 LYS A O 1 ATOM 3304 C CB A LYS A 1 419 ? -27.455 -35.237 34.910 0.50 29.24 ? 419 LYS A CB 1 ATOM 3305 C CB B LYS A 1 419 ? -27.481 -35.174 34.951 0.50 28.62 ? 419 LYS A CB 1 ATOM 3306 C CG A LYS A 1 419 ? -27.888 -36.712 34.747 0.50 29.82 ? 419 LYS A CG 1 ATOM 3307 C CG B LYS A 1 419 ? -27.892 -36.551 34.394 0.50 29.39 ? 419 LYS A CG 1 ATOM 3308 C CD A LYS A 1 419 ? -29.143 -36.872 33.885 0.50 31.76 ? 419 LYS A CD 1 ATOM 3309 C CD B LYS A 1 419 ? -27.881 -37.637 35.458 0.50 30.26 ? 419 LYS A CD 1 ATOM 3310 C CE A LYS A 1 419 ? -30.413 -36.553 34.664 0.50 33.83 ? 419 LYS A CE 1 ATOM 3311 C CE B LYS A 1 419 ? -28.159 -39.013 34.869 0.50 31.65 ? 419 LYS A CE 1 ATOM 3312 N NZ A LYS A 1 419 ? -30.664 -37.552 35.749 0.50 35.79 ? 419 LYS A NZ 1 ATOM 3313 N NZ B LYS A 1 419 ? -29.552 -39.131 34.358 0.50 31.22 ? 419 LYS A NZ 1 ATOM 3314 N N . SER A 1 420 ? -25.582 -32.868 36.279 1.00 25.47 ? 420 SER A N 1 ATOM 3315 C CA . SER A 1 420 ? -25.160 -31.486 36.227 1.00 23.85 ? 420 SER A CA 1 ATOM 3316 C C . SER A 1 420 ? -23.638 -31.336 36.024 1.00 22.84 ? 420 SER A C 1 ATOM 3317 O O . SER A 1 420 ? -23.164 -30.254 35.727 1.00 23.81 ? 420 SER A O 1 ATOM 3318 C CB . SER A 1 420 ? -25.572 -30.789 37.524 1.00 22.93 ? 420 SER A CB 1 ATOM 3319 O OG . SER A 1 420 ? -24.639 -31.115 38.542 1.00 22.97 ? 420 SER A OG 1 ATOM 3320 N N . ASP A 1 421 ? -22.873 -32.407 36.232 1.00 22.68 ? 421 ASP A N 1 ATOM 3321 C CA . ASP A 1 421 ? -21.405 -32.313 36.176 1.00 21.34 ? 421 ASP A CA 1 ATOM 3322 C C . ASP A 1 421 ? -20.811 -32.503 34.775 1.00 18.84 ? 421 ASP A C 1 ATOM 3323 O O . ASP A 1 421 ? -19.606 -32.342 34.575 1.00 18.52 ? 421 ASP A O 1 ATOM 3324 C CB . ASP A 1 421 ? -20.767 -33.317 37.126 1.00 20.26 ? 421 ASP A CB 1 ATOM 3325 C CG . ASP A 1 421 ? -20.452 -32.721 38.491 0.50 19.77 ? 421 ASP A CG 1 ATOM 3326 O OD1 . ASP A 1 421 ? -20.985 -31.640 38.825 0.50 18.50 ? 421 ASP A OD1 1 ATOM 3327 O OD2 . ASP A 1 421 ? -19.657 -33.339 39.230 0.50 19.48 ? 421 ASP A OD2 1 ATOM 3328 N N . TRP A 1 422 ? -21.647 -32.866 33.815 1.00 16.45 ? 422 TRP A N 1 ATOM 3329 C CA . TRP A 1 422 ? -21.109 -33.243 32.515 1.00 15.38 ? 422 TRP A CA 1 ATOM 3330 C C . TRP A 1 422 ? -22.012 -32.786 31.391 1.00 15.63 ? 422 TRP A C 1 ATOM 3331 O O . TRP A 1 422 ? -23.232 -32.662 31.573 1.00 14.06 ? 422 TRP A O 1 ATOM 3332 C CB . TRP A 1 422 ? -20.818 -34.744 32.437 1.00 15.01 ? 422 TRP A CB 1 ATOM 3333 C CG . TRP A 1 422 ? -22.027 -35.656 32.494 1.00 16.53 ? 422 TRP A CG 1 ATOM 3334 C CD1 . TRP A 1 422 ? -22.572 -36.252 33.624 1.00 16.35 ? 422 TRP A CD1 1 ATOM 3335 C CD2 . TRP A 1 422 ? -22.833 -36.097 31.381 1.00 15.32 ? 422 TRP A CD2 1 ATOM 3336 N NE1 . TRP A 1 422 ? -23.651 -37.029 33.264 1.00 16.61 ? 422 TRP A NE1 1 ATOM 3337 C CE2 . TRP A 1 422 ? -23.839 -36.946 31.903 1.00 16.12 ? 422 TRP A CE2 1 ATOM 3338 C CE3 . TRP A 1 422 ? -22.804 -35.849 29.996 1.00 15.69 ? 422 TRP A CE3 1 ATOM 3339 C CZ2 . TRP A 1 422 ? -24.815 -37.546 31.089 1.00 15.27 ? 422 TRP A CZ2 1 ATOM 3340 C CZ3 . TRP A 1 422 ? -23.768 -36.445 29.180 1.00 15.78 ? 422 TRP A CZ3 1 ATOM 3341 C CH2 . TRP A 1 422 ? -24.774 -37.281 29.736 1.00 16.38 ? 422 TRP A CH2 1 ATOM 3342 N N . GLY A 1 423 ? -21.389 -32.537 30.233 1.00 14.97 ? 423 GLY A N 1 ATOM 3343 C CA . GLY A 1 423 ? -22.124 -32.254 29.014 1.00 14.26 ? 423 GLY A CA 1 ATOM 3344 C C . GLY A 1 423 ? -21.491 -32.967 27.847 1.00 13.34 ? 423 GLY A C 1 ATOM 3345 O O . GLY A 1 423 ? -20.618 -33.794 28.031 1.00 11.76 ? 423 GLY A O 1 ATOM 3346 N N . MET A 1 424 ? -21.941 -32.627 26.644 1.00 12.63 ? 424 MET A N 1 ATOM 3347 C CA . MET A 1 424 ? -21.360 -33.148 25.411 1.00 12.39 ? 424 MET A CA 1 ATOM 3348 C C . MET A 1 424 ? -21.146 -31.989 24.454 1.00 11.28 ? 424 MET A C 1 ATOM 3349 O O . MET A 1 424 ? -21.855 -31.005 24.508 1.00 11.47 ? 424 MET A O 1 ATOM 3350 C CB . MET A 1 424 ? -22.279 -34.224 24.787 1.00 12.27 ? 424 MET A CB 1 ATOM 3351 C CG . MET A 1 424 ? -22.307 -35.500 25.630 1.00 12.44 ? 424 MET A CG 1 ATOM 3352 S SD . MET A 1 424 ? -23.264 -36.831 24.915 1.00 12.49 ? 424 MET A SD 1 ATOM 3353 C CE . MET A 1 424 ? -22.547 -38.219 25.775 1.00 13.73 ? 424 MET A CE 1 ATOM 3354 N N . TYR A 1 425 ? -20.177 -32.133 23.559 1.00 11.72 ? 425 TYR A N 1 ATOM 3355 C CA . TYR A 1 425 ? -19.742 -31.033 22.661 1.00 11.10 ? 425 TYR A CA 1 ATOM 3356 C C . TYR A 1 425 ? -20.228 -31.283 21.235 1.00 11.24 ? 425 TYR A C 1 ATOM 3357 O O . TYR A 1 425 ? -19.785 -32.241 20.583 1.00 12.28 ? 425 TYR A O 1 ATOM 3358 C CB . TYR A 1 425 ? -18.217 -30.967 22.743 1.00 10.88 ? 425 TYR A CB 1 ATOM 3359 C CG . TYR A 1 425 ? -17.446 -29.973 21.882 1.00 11.43 ? 425 TYR A CG 1 ATOM 3360 C CD1 . TYR A 1 425 ? -17.757 -28.613 21.868 1.00 11.73 ? 425 TYR A CD1 1 ATOM 3361 C CD2 . TYR A 1 425 ? -16.331 -30.393 21.166 1.00 11.14 ? 425 TYR A CD2 1 ATOM 3362 C CE1 . TYR A 1 425 ? -16.986 -27.710 21.097 1.00 11.84 ? 425 TYR A CE1 1 ATOM 3363 C CE2 . TYR A 1 425 ? -15.555 -29.513 20.422 1.00 11.09 ? 425 TYR A CE2 1 ATOM 3364 C CZ . TYR A 1 425 ? -15.888 -28.162 20.396 1.00 11.79 ? 425 TYR A CZ 1 ATOM 3365 O OH . TYR A 1 425 ? -15.128 -27.274 19.627 1.00 12.19 ? 425 TYR A OH 1 ATOM 3366 N N . ILE A 1 426 ? -21.154 -30.440 20.747 1.00 10.65 ? 426 ILE A N 1 ATOM 3367 C CA . ILE A 1 426 ? -21.757 -30.650 19.419 1.00 9.52 ? 426 ILE A CA 1 ATOM 3368 C C . ILE A 1 426 ? -20.739 -30.489 18.251 1.00 9.80 ? 426 ILE A C 1 ATOM 3369 O O . ILE A 1 426 ? -21.049 -30.863 17.124 1.00 10.01 ? 426 ILE A O 1 ATOM 3370 C CB . ILE A 1 426 ? -22.987 -29.715 19.207 1.00 9.47 ? 426 ILE A CB 1 ATOM 3371 C CG1 . ILE A 1 426 ? -23.873 -30.219 18.026 1.00 9.58 ? 426 ILE A CG1 1 ATOM 3372 C CG2 . ILE A 1 426 ? -22.520 -28.262 19.048 1.00 8.45 ? 426 ILE A CG2 1 ATOM 3373 C CD1 . ILE A 1 426 ? -25.132 -29.374 17.789 1.00 9.18 ? 426 ILE A CD1 1 ATOM 3374 N N . ASN A 1 427 ? -19.539 -29.928 18.483 1.00 9.83 ? 427 ASN A N 1 ATOM 3375 C CA . ASN A 1 427 ? -18.495 -30.036 17.406 1.00 10.06 ? 427 ASN A CA 1 ATOM 3376 C C . ASN A 1 427 ? -17.940 -31.474 17.255 1.00 10.25 ? 427 ASN A C 1 ATOM 3377 O O . ASN A 1 427 ? -17.310 -31.809 16.243 1.00 9.55 ? 427 ASN A O 1 ATOM 3378 C CB . ASN A 1 427 ? -17.365 -29.017 17.550 1.00 9.40 ? 427 ASN A CB 1 ATOM 3379 C CG . ASN A 1 427 ? -17.656 -27.711 16.804 1.00 9.82 ? 427 ASN A CG 1 ATOM 3380 O OD1 . ASN A 1 427 ? -18.553 -27.644 15.931 1.00 10.19 ? 427 ASN A OD1 1 ATOM 3381 N ND2 . ASN A 1 427 ? -16.923 -26.661 17.159 1.00 9.21 ? 427 ASN A ND2 1 ATOM 3382 N N . TYR A 1 428 ? -18.235 -32.322 18.239 1.00 10.21 ? 428 TYR A N 1 ATOM 3383 C CA . TYR A 1 428 ? -18.055 -33.757 18.076 1.00 11.30 ? 428 TYR A CA 1 ATOM 3384 C C . TYR A 1 428 ? -19.439 -34.408 18.019 1.00 12.62 ? 428 TYR A C 1 ATOM 3385 O O . TYR A 1 428 ? -19.809 -35.214 18.890 1.00 12.32 ? 428 TYR A O 1 ATOM 3386 C CB . TYR A 1 428 ? -17.211 -34.329 19.212 1.00 11.46 ? 428 TYR A CB 1 ATOM 3387 C CG . TYR A 1 428 ? -15.835 -33.729 19.364 1.00 12.29 ? 428 TYR A CG 1 ATOM 3388 C CD1 . TYR A 1 428 ? -15.155 -33.214 18.250 1.00 13.16 ? 428 TYR A CD1 1 ATOM 3389 C CD2 . TYR A 1 428 ? -15.174 -33.730 20.612 1.00 13.25 ? 428 TYR A CD2 1 ATOM 3390 C CE1 . TYR A 1 428 ? -13.888 -32.681 18.355 1.00 14.96 ? 428 TYR A CE1 1 ATOM 3391 C CE2 . TYR A 1 428 ? -13.880 -33.171 20.732 1.00 15.95 ? 428 TYR A CE2 1 ATOM 3392 C CZ . TYR A 1 428 ? -13.252 -32.657 19.578 1.00 16.51 ? 428 TYR A CZ 1 ATOM 3393 O OH . TYR A 1 428 ? -11.986 -32.120 19.604 1.00 21.12 ? 428 TYR A OH 1 ATOM 3394 N N . ALA A 1 429 ? -20.227 -33.995 17.014 1.00 13.14 ? 429 ALA A N 1 ATOM 3395 C CA . ALA A 1 429 ? -21.665 -34.321 16.958 1.00 11.97 ? 429 ALA A CA 1 ATOM 3396 C C . ALA A 1 429 ? -21.935 -35.839 16.968 1.00 12.08 ? 429 ALA A C 1 ATOM 3397 O O . ALA A 1 429 ? -21.358 -36.612 16.175 1.00 10.54 ? 429 ALA A O 1 ATOM 3398 C CB . ALA A 1 429 ? -22.311 -33.695 15.725 1.00 12.14 ? 429 ALA A CB 1 ATOM 3399 N N . ASP A 1 430 ? -22.856 -36.242 17.835 1.00 11.45 ? 430 ASP A N 1 ATOM 3400 C CA . ASP A 1 430 ? -23.137 -37.656 18.013 1.00 11.58 ? 430 ASP A CA 1 ATOM 3401 C C . ASP A 1 430 ? -24.613 -37.822 17.722 1.00 11.05 ? 430 ASP A C 1 ATOM 3402 O O . ASP A 1 430 ? -25.452 -37.477 18.562 1.00 10.58 ? 430 ASP A O 1 ATOM 3403 C CB . ASP A 1 430 ? -22.762 -38.067 19.454 1.00 12.14 ? 430 ASP A CB 1 ATOM 3404 C CG . ASP A 1 430 ? -23.257 -39.451 19.832 1.00 11.58 ? 430 ASP A CG 1 ATOM 3405 O OD1 . ASP A 1 430 ? -23.854 -40.152 18.986 1.00 11.25 ? 430 ASP A OD1 1 ATOM 3406 O OD2 . ASP A 1 430 ? -23.000 -39.826 20.980 1.00 12.92 ? 430 ASP A OD2 1 ATOM 3407 N N . PRO A 1 431 ? -24.946 -38.330 16.520 1.00 11.41 ? 431 PRO A N 1 ATOM 3408 C CA . PRO A 1 431 ? -26.369 -38.303 16.110 1.00 11.95 ? 431 PRO A CA 1 ATOM 3409 C C . PRO A 1 431 ? -27.242 -39.329 16.803 1.00 13.55 ? 431 PRO A C 1 ATOM 3410 O O . PRO A 1 431 ? -28.469 -39.309 16.604 1.00 14.60 ? 431 PRO A O 1 ATOM 3411 C CB . PRO A 1 431 ? -26.317 -38.600 14.618 1.00 11.86 ? 431 PRO A CB 1 ATOM 3412 C CG . PRO A 1 431 ? -25.054 -39.473 14.463 1.00 11.35 ? 431 PRO A CG 1 ATOM 3413 C CD . PRO A 1 431 ? -24.071 -38.900 15.479 1.00 10.48 ? 431 PRO A CD 1 ATOM 3414 N N . ARG A 1 432 ? -26.654 -40.214 17.611 1.00 13.75 ? 432 ARG A N 1 ATOM 3415 C CA . ARG A 1 432 ? -27.475 -41.286 18.234 1.00 16.25 ? 432 ARG A CA 1 ATOM 3416 C C . ARG A 1 432 ? -28.115 -40.852 19.560 1.00 16.33 ? 432 ARG A C 1 ATOM 3417 O O . ARG A 1 432 ? -27.999 -41.531 20.581 1.00 16.61 ? 432 ARG A O 1 ATOM 3418 C CB . ARG A 1 432 ? -26.669 -42.585 18.369 1.00 16.44 ? 432 ARG A CB 1 ATOM 3419 C CG . ARG A 1 432 ? -26.443 -43.239 17.001 1.00 18.12 ? 432 ARG A CG 1 ATOM 3420 C CD . ARG A 1 432 ? -25.422 -44.393 17.064 1.00 19.65 ? 432 ARG A CD 1 ATOM 3421 N NE . ARG A 1 432 ? -25.905 -45.569 17.794 1.00 18.58 ? 432 ARG A NE 1 ATOM 3422 C CZ . ARG A 1 432 ? -25.606 -45.878 19.063 1.00 23.55 ? 432 ARG A CZ 1 ATOM 3423 N NH1 . ARG A 1 432 ? -24.817 -45.101 19.825 1.00 19.35 ? 432 ARG A NH1 1 ATOM 3424 N NH2 . ARG A 1 432 ? -26.100 -47.002 19.590 1.00 23.28 ? 432 ARG A NH2 1 ATOM 3425 N N . MET A 1 433 ? -28.751 -39.681 19.527 1.00 16.31 ? 433 MET A N 1 ATOM 3426 C CA . MET A 1 433 ? -29.509 -39.135 20.649 1.00 17.71 ? 433 MET A CA 1 ATOM 3427 C C . MET A 1 433 ? -30.723 -38.371 20.071 1.00 19.23 ? 433 MET A C 1 ATOM 3428 O O . MET A 1 433 ? -30.602 -37.707 19.030 1.00 17.89 ? 433 MET A O 1 ATOM 3429 C CB . MET A 1 433 ? -28.643 -38.180 21.475 1.00 16.64 ? 433 MET A CB 1 ATOM 3430 C CG . MET A 1 433 ? -27.426 -38.818 22.216 1.00 17.82 ? 433 MET A CG 1 ATOM 3431 S SD . MET A 1 433 ? -26.388 -37.586 23.104 0.98 17.99 ? 433 MET A SD 1 ATOM 3432 C CE . MET A 1 433 ? -25.729 -36.606 21.764 1.00 19.06 ? 433 MET A CE 1 ATOM 3433 N N . ASP A 1 434 ? -31.886 -38.463 20.723 1.00 18.60 ? 434 ASP A N 1 ATOM 3434 C CA . ASP A 1 434 ? -33.049 -37.766 20.224 1.00 19.65 ? 434 ASP A CA 1 ATOM 3435 C C . ASP A 1 434 ? -32.859 -36.260 20.442 1.00 19.46 ? 434 ASP A C 1 ATOM 3436 O O . ASP A 1 434 ? -31.959 -35.859 21.183 1.00 19.46 ? 434 ASP A O 1 ATOM 3437 C CB . ASP A 1 434 ? -34.358 -38.310 20.825 1.00 22.33 ? 434 ASP A CB 1 ATOM 3438 C CG . ASP A 1 434 ? -34.540 -37.984 22.316 1.00 26.58 ? 434 ASP A CG 1 ATOM 3439 O OD1 . ASP A 1 434 ? -34.083 -36.942 22.823 1.00 25.50 ? 434 ASP A OD1 1 ATOM 3440 O OD2 . ASP A 1 434 ? -35.217 -38.784 22.993 1.00 35.64 ? 434 ASP A OD2 1 ATOM 3441 N N . ARG A 1 435 ? -33.699 -35.446 19.795 1.00 17.58 ? 435 ARG A N 1 ATOM 3442 C CA . ARG A 1 435 ? -33.577 -33.978 19.806 1.00 16.45 ? 435 ARG A CA 1 ATOM 3443 C C . ARG A 1 435 ? -33.538 -33.350 21.207 1.00 17.49 ? 435 ARG A C 1 ATOM 3444 O O . ARG A 1 435 ? -32.738 -32.441 21.479 1.00 17.86 ? 435 ARG A O 1 ATOM 3445 C CB . ARG A 1 435 ? -34.731 -33.360 18.982 1.00 15.22 ? 435 ARG A CB 1 ATOM 3446 C CG . ARG A 1 435 ? -34.532 -31.887 18.666 1.00 16.42 ? 435 ARG A CG 1 ATOM 3447 C CD . ARG A 1 435 ? -35.570 -31.354 17.675 1.00 15.96 ? 435 ARG A CD 1 ATOM 3448 N NE . ARG A 1 435 ? -35.328 -29.946 17.356 1.00 13.82 ? 435 ARG A NE 1 ATOM 3449 C CZ . ARG A 1 435 ? -36.074 -29.237 16.510 1.00 14.17 ? 435 ARG A CZ 1 ATOM 3450 N NH1 . ARG A 1 435 ? -37.128 -29.792 15.904 1.00 12.36 ? 435 ARG A NH1 1 ATOM 3451 N NH2 . ARG A 1 435 ? -35.771 -27.970 16.277 1.00 12.35 ? 435 ARG A NH2 1 ATOM 3452 N N . ASP A 1 436 ? -34.406 -33.822 22.101 1.00 17.95 ? 436 ASP A N 1 ATOM 3453 C CA . ASP A 1 436 ? -34.453 -33.257 23.450 1.00 18.94 ? 436 ASP A CA 1 ATOM 3454 C C . ASP A 1 436 ? -33.229 -33.609 24.284 1.00 16.85 ? 436 ASP A C 1 ATOM 3455 O O . ASP A 1 436 ? -32.675 -32.751 24.973 1.00 18.83 ? 436 ASP A O 1 ATOM 3456 C CB . ASP A 1 436 ? -35.724 -33.696 24.197 1.00 20.46 ? 436 ASP A CB 1 ATOM 3457 C CG . ASP A 1 436 ? -36.993 -33.264 23.498 1.00 22.64 ? 436 ASP A CG 1 ATOM 3458 O OD1 . ASP A 1 436 ? -37.073 -32.137 22.965 1.00 23.18 ? 436 ASP A OD1 1 ATOM 3459 O OD2 . ASP A 1 436 ? -37.920 -34.086 23.462 1.00 30.71 ? 436 ASP A OD2 1 ATOM 3460 N N . TYR A 1 437 ? -32.831 -34.872 24.260 1.00 17.46 ? 437 TYR A N 1 ATOM 3461 C CA . TYR A 1 437 ? -31.697 -35.310 25.052 1.00 16.57 ? 437 TYR A CA 1 ATOM 3462 C C . TYR A 1 437 ? -30.415 -34.649 24.537 1.00 15.43 ? 437 TYR A C 1 ATOM 3463 O O . TYR A 1 437 ? -29.627 -34.127 25.320 1.00 15.78 ? 437 TYR A O 1 ATOM 3464 C CB . TYR A 1 437 ? -31.579 -36.839 25.031 1.00 17.89 ? 437 TYR A CB 1 ATOM 3465 C CG . TYR A 1 437 ? -30.480 -37.375 25.919 1.00 19.98 ? 437 TYR A CG 1 ATOM 3466 C CD1 . TYR A 1 437 ? -30.684 -37.571 27.289 1.00 21.39 ? 437 TYR A CD1 1 ATOM 3467 C CD2 . TYR A 1 437 ? -29.227 -37.699 25.395 1.00 23.54 ? 437 TYR A CD2 1 ATOM 3468 C CE1 . TYR A 1 437 ? -29.663 -38.077 28.105 1.00 21.99 ? 437 TYR A CE1 1 ATOM 3469 C CE2 . TYR A 1 437 ? -28.195 -38.214 26.217 1.00 23.40 ? 437 TYR A CE2 1 ATOM 3470 C CZ . TYR A 1 437 ? -28.424 -38.397 27.562 1.00 21.99 ? 437 TYR A CZ 1 ATOM 3471 O OH . TYR A 1 437 ? -27.397 -38.891 28.362 1.00 22.68 ? 437 TYR A OH 1 ATOM 3472 N N . ALA A 1 438 ? -30.218 -34.676 23.219 1.00 14.61 ? 438 ALA A N 1 ATOM 3473 C CA . ALA A 1 438 ? -28.992 -34.130 22.609 1.00 13.50 ? 438 ALA A CA 1 ATOM 3474 C C . ALA A 1 438 ? -28.837 -32.665 22.982 1.00 13.05 ? 438 ALA A C 1 ATOM 3475 O O . ALA A 1 438 ? -27.775 -32.247 23.425 1.00 13.40 ? 438 ALA A O 1 ATOM 3476 C CB . ALA A 1 438 ? -29.034 -34.283 21.099 1.00 11.68 ? 438 ALA A CB 1 ATOM 3477 N N . THR A 1 439 ? -29.911 -31.885 22.838 1.00 13.06 ? 439 THR A N 1 ATOM 3478 C CA . THR A 1 439 ? -29.785 -30.455 23.081 1.00 12.93 ? 439 THR A CA 1 ATOM 3479 C C . THR A 1 439 ? -29.604 -30.215 24.561 1.00 13.45 ? 439 THR A C 1 ATOM 3480 O O . THR A 1 439 ? -28.956 -29.256 24.958 1.00 12.96 ? 439 THR A O 1 ATOM 3481 C CB . THR A 1 439 ? -30.940 -29.634 22.457 1.00 13.98 ? 439 THR A CB 1 ATOM 3482 O OG1 . THR A 1 439 ? -32.209 -30.109 22.954 1.00 14.77 ? 439 THR A OG1 1 ATOM 3483 C CG2 . THR A 1 439 ? -30.900 -29.742 20.906 1.00 12.29 ? 439 THR A CG2 1 ATOM 3484 N N . LYS A 1 440 ? -30.130 -31.120 25.390 1.00 15.21 ? 440 LYS A N 1 ATOM 3485 C CA . LYS A 1 440 ? -29.923 -30.984 26.829 1.00 15.66 ? 440 LYS A CA 1 ATOM 3486 C C . LYS A 1 440 ? -28.439 -31.137 27.184 1.00 14.45 ? 440 LYS A C 1 ATOM 3487 O O . LYS A 1 440 ? -27.932 -30.379 27.976 1.00 13.49 ? 440 LYS A O 1 ATOM 3488 C CB . LYS A 1 440 ? -30.771 -31.991 27.621 1.00 18.77 ? 440 LYS A CB 1 ATOM 3489 C CG . LYS A 1 440 ? -30.980 -31.617 29.107 1.00 25.39 ? 440 LYS A CG 1 ATOM 3490 C CD . LYS A 1 440 ? -31.494 -32.825 29.926 1.00 30.84 ? 440 LYS A CD 1 ATOM 3491 C CE . LYS A 1 440 ? -30.349 -33.814 30.202 1.00 37.35 ? 440 LYS A CE 1 ATOM 3492 N NZ . LYS A 1 440 ? -30.667 -35.224 29.811 1.00 38.86 ? 440 LYS A NZ 1 ATOM 3493 N N . VAL A 1 441 ? -27.744 -32.118 26.607 1.00 14.36 ? 441 VAL A N 1 ATOM 3494 C CA . VAL A 1 441 ? -26.337 -32.314 26.976 1.00 13.18 ? 441 VAL A CA 1 ATOM 3495 C C . VAL A 1 441 ? -25.403 -31.377 26.214 1.00 13.23 ? 441 VAL A C 1 ATOM 3496 O O . VAL A 1 441 ? -24.338 -31.017 26.739 1.00 12.99 ? 441 VAL A O 1 ATOM 3497 C CB . VAL A 1 441 ? -25.873 -33.807 26.867 1.00 13.70 ? 441 VAL A CB 1 ATOM 3498 C CG1 . VAL A 1 441 ? -26.648 -34.679 27.845 1.00 12.92 ? 441 VAL A CG1 1 ATOM 3499 C CG2 . VAL A 1 441 ? -26.009 -34.358 25.408 1.00 11.88 ? 441 VAL A CG2 1 ATOM 3500 N N . TYR A 1 442 ? -25.788 -30.970 24.990 1.00 12.93 ? 442 TYR A N 1 ATOM 3501 C CA . TYR A 1 442 ? -24.930 -30.074 24.200 1.00 12.28 ? 442 TYR A CA 1 ATOM 3502 C C . TYR A 1 442 ? -24.921 -28.633 24.730 1.00 13.21 ? 442 TYR A C 1 ATOM 3503 O O . TYR A 1 442 ? -23.942 -27.895 24.519 1.00 12.68 ? 442 TYR A O 1 ATOM 3504 C CB . TYR A 1 442 ? -25.348 -30.020 22.713 1.00 11.99 ? 442 TYR A CB 1 ATOM 3505 C CG . TYR A 1 442 ? -25.075 -31.243 21.822 1.00 12.04 ? 442 TYR A CG 1 ATOM 3506 C CD1 . TYR A 1 442 ? -24.002 -32.108 22.026 1.00 10.87 ? 442 TYR A CD1 1 ATOM 3507 C CD2 . TYR A 1 442 ? -25.903 -31.478 20.724 1.00 12.80 ? 442 TYR A CD2 1 ATOM 3508 C CE1 . TYR A 1 442 ? -23.789 -33.218 21.151 1.00 11.78 ? 442 TYR A CE1 1 ATOM 3509 C CE2 . TYR A 1 442 ? -25.733 -32.556 19.894 1.00 12.26 ? 442 TYR A CE2 1 ATOM 3510 C CZ . TYR A 1 442 ? -24.678 -33.413 20.087 1.00 12.43 ? 442 TYR A CZ 1 ATOM 3511 O OH . TYR A 1 442 ? -24.560 -34.417 19.171 1.00 12.03 ? 442 TYR A OH 1 ATOM 3512 N N . TYR A 1 443 ? -26.018 -28.212 25.380 1.00 12.94 ? 443 TYR A N 1 ATOM 3513 C CA . TYR A 1 443 ? -26.175 -26.807 25.720 1.00 12.48 ? 443 TYR A CA 1 ATOM 3514 C C . TYR A 1 443 ? -26.362 -26.467 27.213 1.00 13.12 ? 443 TYR A C 1 ATOM 3515 O O . TYR A 1 443 ? -26.407 -25.310 27.540 1.00 12.24 ? 443 TYR A O 1 ATOM 3516 C CB . TYR A 1 443 ? -27.274 -26.167 24.869 1.00 11.69 ? 443 TYR A CB 1 ATOM 3517 C CG . TYR A 1 443 ? -26.979 -26.206 23.384 1.00 10.97 ? 443 TYR A CG 1 ATOM 3518 C CD1 . TYR A 1 443 ? -25.842 -25.565 22.855 1.00 10.78 ? 443 TYR A CD1 1 ATOM 3519 C CD2 . TYR A 1 443 ? -27.810 -26.919 22.508 1.00 10.21 ? 443 TYR A CD2 1 ATOM 3520 C CE1 . TYR A 1 443 ? -25.553 -25.627 21.466 1.00 10.36 ? 443 TYR A CE1 1 ATOM 3521 C CE2 . TYR A 1 443 ? -27.519 -26.986 21.142 1.00 10.21 ? 443 TYR A CE2 1 ATOM 3522 C CZ . TYR A 1 443 ? -26.400 -26.337 20.636 1.00 9.86 ? 443 TYR A CZ 1 ATOM 3523 O OH . TYR A 1 443 ? -26.150 -26.388 19.291 1.00 10.28 ? 443 TYR A OH 1 ATOM 3524 N N . GLY A 1 444 ? -26.464 -27.471 28.088 1.00 14.31 ? 444 GLY A N 1 ATOM 3525 C CA . GLY A 1 444 ? -26.352 -27.262 29.545 1.00 14.92 ? 444 GLY A CA 1 ATOM 3526 C C . GLY A 1 444 ? -27.239 -26.143 30.063 1.00 16.00 ? 444 GLY A C 1 ATOM 3527 O O . GLY A 1 444 ? -28.442 -26.096 29.743 1.00 17.20 ? 444 GLY A O 1 ATOM 3528 N N . GLU A 1 445 ? -26.642 -25.217 30.810 1.00 15.73 ? 445 GLU A N 1 ATOM 3529 C CA . GLU A 1 445 ? -27.412 -24.138 31.469 1.00 17.57 ? 445 GLU A CA 1 ATOM 3530 C C . GLU A 1 445 ? -27.952 -23.094 30.475 1.00 17.97 ? 445 GLU A C 1 ATOM 3531 O O . GLU A 1 445 ? -28.764 -22.250 30.842 1.00 17.74 ? 445 GLU A O 1 ATOM 3532 C CB . GLU A 1 445 ? -26.589 -23.465 32.593 1.00 18.70 ? 445 GLU A CB 1 ATOM 3533 C CG . GLU A 1 445 ? -25.309 -22.728 32.121 1.00 20.21 ? 445 GLU A CG 1 ATOM 3534 C CD . GLU A 1 445 ? -24.565 -21.993 33.241 1.00 21.57 ? 445 GLU A CD 1 ATOM 3535 O OE1 . GLU A 1 445 ? -23.588 -22.539 33.802 1.00 22.77 ? 445 GLU A OE1 1 ATOM 3536 O OE2 . GLU A 1 445 ? -24.933 -20.845 33.543 1.00 24.73 ? 445 GLU A OE2 1 ATOM 3537 N N . ASN A 1 446 ? -27.504 -23.154 29.214 1.00 17.94 ? 446 ASN A N 1 ATOM 3538 C CA . ASN A 1 446 ? -27.914 -22.157 28.216 1.00 15.88 ? 446 ASN A CA 1 ATOM 3539 C C . ASN A 1 446 ? -29.078 -22.589 27.318 1.00 16.12 ? 446 ASN A C 1 ATOM 3540 O O . ASN A 1 446 ? -29.565 -21.804 26.499 1.00 16.73 ? 446 ASN A O 1 ATOM 3541 C CB . ASN A 1 446 ? -26.712 -21.754 27.360 1.00 15.78 ? 446 ASN A CB 1 ATOM 3542 C CG . ASN A 1 446 ? -25.731 -20.869 28.113 1.00 17.15 ? 446 ASN A CG 1 ATOM 3543 O OD1 . ASN A 1 446 ? -26.120 -20.148 29.045 1.00 16.86 ? 446 ASN A OD1 1 ATOM 3544 N ND2 . ASN A 1 446 ? -24.454 -20.901 27.707 1.00 15.40 ? 446 ASN A ND2 1 ATOM 3545 N N . LEU A 1 447 ? -29.505 -23.838 27.442 1.00 15.05 ? 447 LEU A N 1 ATOM 3546 C CA . LEU A 1 447 ? -30.570 -24.373 26.588 1.00 15.36 ? 447 LEU A CA 1 ATOM 3547 C C . LEU A 1 447 ? -31.888 -23.577 26.629 1.00 17.58 ? 447 LEU A C 1 ATOM 3548 O O . LEU A 1 447 ? -32.470 -23.286 25.575 1.00 18.07 ? 447 LEU A O 1 ATOM 3549 C CB . LEU A 1 447 ? -30.840 -25.847 26.903 1.00 13.68 ? 447 LEU A CB 1 ATOM 3550 C CG . LEU A 1 447 ? -31.962 -26.498 26.070 1.00 14.18 ? 447 LEU A CG 1 ATOM 3551 C CD1 . LEU A 1 447 ? -31.689 -26.431 24.566 1.00 12.07 ? 447 LEU A CD1 1 ATOM 3552 C CD2 . LEU A 1 447 ? -32.221 -27.925 26.476 1.00 13.40 ? 447 LEU A CD2 1 ATOM 3553 N N . ALA A 1 448 ? -32.366 -23.247 27.830 1.00 16.45 ? 448 ALA A N 1 ATOM 3554 C CA . ALA A 1 448 ? -33.646 -22.526 27.949 1.00 16.81 ? 448 ALA A CA 1 ATOM 3555 C C . ALA A 1 448 ? -33.601 -21.176 27.224 1.00 15.65 ? 448 ALA A C 1 ATOM 3556 O O . ALA A 1 448 ? -34.528 -20.833 26.506 1.00 16.17 ? 448 ALA A O 1 ATOM 3557 C CB . ALA A 1 448 ? -34.066 -22.341 29.443 1.00 15.60 ? 448 ALA A CB 1 ATOM 3558 N N . ARG A 1 449 ? -32.537 -20.414 27.409 1.00 15.40 ? 449 ARG A N 1 ATOM 3559 C CA . ARG A 1 449 ? -32.365 -19.171 26.653 1.00 16.79 ? 449 ARG A CA 1 ATOM 3560 C C . ARG A 1 449 ? -32.288 -19.413 25.122 1.00 17.42 ? 449 ARG A C 1 ATOM 3561 O O . ARG A 1 449 ? -32.879 -18.650 24.329 1.00 18.28 ? 449 ARG A O 1 ATOM 3562 C CB . ARG A 1 449 ? -31.129 -18.414 27.145 1.00 18.76 ? 449 ARG A CB 1 ATOM 3563 C CG . ARG A 1 449 ? -30.946 -17.051 26.518 1.00 19.53 ? 449 ARG A CG 1 ATOM 3564 C CD . ARG A 1 449 ? -29.828 -16.238 27.171 1.00 21.00 ? 449 ARG A CD 1 ATOM 3565 N NE . ARG A 1 449 ? -29.459 -15.113 26.295 1.00 24.51 ? 449 ARG A NE 1 ATOM 3566 C CZ . ARG A 1 449 ? -28.587 -14.153 26.595 1.00 23.14 ? 449 ARG A CZ 1 ATOM 3567 N NH1 . ARG A 1 449 ? -27.972 -14.155 27.768 1.00 23.15 ? 449 ARG A NH1 1 ATOM 3568 N NH2 . ARG A 1 449 ? -28.342 -13.179 25.720 1.00 25.69 ? 449 ARG A NH2 1 ATOM 3569 N N . LEU A 1 450 ? -31.609 -20.492 24.723 1.00 15.34 ? 450 LEU A N 1 ATOM 3570 C CA . LEU A 1 450 ? -31.462 -20.839 23.302 1.00 15.13 ? 450 LEU A CA 1 ATOM 3571 C C . LEU A 1 450 ? -32.814 -21.186 22.665 1.00 15.26 ? 450 LEU A C 1 ATOM 3572 O O . LEU A 1 450 ? -33.067 -20.828 21.509 1.00 14.01 ? 450 LEU A O 1 ATOM 3573 C CB . LEU A 1 450 ? -30.453 -21.994 23.130 1.00 14.18 ? 450 LEU A CB 1 ATOM 3574 C CG . LEU A 1 450 ? -28.979 -21.563 23.323 1.00 14.47 ? 450 LEU A CG 1 ATOM 3575 C CD1 . LEU A 1 450 ? -28.065 -22.770 23.373 1.00 14.83 ? 450 LEU A CD1 1 ATOM 3576 C CD2 . LEU A 1 450 ? -28.509 -20.605 22.216 1.00 14.40 ? 450 LEU A CD2 1 ATOM 3577 N N . GLN A 1 451 ? -33.679 -21.864 23.436 1.00 15.20 ? 451 GLN A N 1 ATOM 3578 C CA . GLN A 1 451 ? -35.041 -22.247 22.984 1.00 17.07 ? 451 GLN A CA 1 ATOM 3579 C C . GLN A 1 451 ? -35.939 -21.029 22.720 1.00 17.73 ? 451 GLN A C 1 ATOM 3580 O O . GLN A 1 451 ? -36.697 -20.999 21.730 1.00 17.73 ? 451 GLN A O 1 ATOM 3581 C CB . GLN A 1 451 ? -35.722 -23.190 23.996 1.00 16.92 ? 451 GLN A CB 1 ATOM 3582 C CG . GLN A 1 451 ? -35.121 -24.589 24.040 1.00 17.63 ? 451 GLN A CG 1 ATOM 3583 C CD . GLN A 1 451 ? -35.731 -25.496 25.109 1.00 17.85 ? 451 GLN A CD 1 ATOM 3584 O OE1 . GLN A 1 451 ? -35.687 -26.724 24.990 1.00 19.79 ? 451 GLN A OE1 1 ATOM 3585 N NE2 . GLN A 1 451 ? -36.253 -24.905 26.162 1.00 18.12 ? 451 GLN A NE2 1 ATOM 3586 N N . LYS A 1 452 ? -35.840 -20.030 23.595 1.00 17.14 ? 452 LYS A N 1 ATOM 3587 C CA A LYS A 1 452 ? -36.519 -18.751 23.398 0.50 17.35 ? 452 LYS A CA 1 ATOM 3588 C CA B LYS A 1 452 ? -36.550 -18.774 23.359 0.50 18.44 ? 452 LYS A CA 1 ATOM 3589 C C . LYS A 1 452 ? -35.977 -18.042 22.140 1.00 17.39 ? 452 LYS A C 1 ATOM 3590 O O . LYS A 1 452 ? -36.740 -17.598 21.269 1.00 17.20 ? 452 LYS A O 1 ATOM 3591 C CB A LYS A 1 452 ? -36.349 -17.865 24.643 0.50 17.25 ? 452 LYS A CB 1 ATOM 3592 C CB B LYS A 1 452 ? -36.564 -17.874 24.601 0.50 20.22 ? 452 LYS A CB 1 ATOM 3593 C CG A LYS A 1 452 ? -36.937 -18.476 25.932 0.50 18.67 ? 452 LYS A CG 1 ATOM 3594 C CG B LYS A 1 452 ? -37.846 -18.032 25.448 0.50 23.72 ? 452 LYS A CG 1 ATOM 3595 C CD A LYS A 1 452 ? -37.348 -17.397 26.949 0.50 18.84 ? 452 LYS A CD 1 ATOM 3596 C CD B LYS A 1 452 ? -37.829 -19.337 26.220 0.50 25.38 ? 452 LYS A CD 1 ATOM 3597 C CE A LYS A 1 452 ? -37.648 -17.996 28.312 0.50 19.96 ? 452 LYS A CE 1 ATOM 3598 C CE B LYS A 1 452 ? -39.192 -19.684 26.839 0.50 29.71 ? 452 LYS A CE 1 ATOM 3599 N NZ A LYS A 1 452 ? -37.940 -16.936 29.342 0.50 21.21 ? 452 LYS A NZ 1 ATOM 3600 N NZ B LYS A 1 452 ? -39.906 -18.484 27.381 0.50 28.66 ? 452 LYS A NZ 1 ATOM 3601 N N . LEU A 1 453 ? -34.653 -17.938 22.051 1.00 14.28 ? 453 LEU A N 1 ATOM 3602 C CA . LEU A 1 453 ? -34.016 -17.291 20.891 1.00 14.01 ? 453 LEU A CA 1 ATOM 3603 C C . LEU A 1 453 ? -34.368 -18.012 19.567 1.00 13.24 ? 453 LEU A C 1 ATOM 3604 O O . LEU A 1 453 ? -34.499 -17.385 18.517 1.00 15.68 ? 453 LEU A O 1 ATOM 3605 C CB . LEU A 1 453 ? -32.497 -17.260 21.087 1.00 13.90 ? 453 LEU A CB 1 ATOM 3606 C CG . LEU A 1 453 ? -31.709 -16.344 20.186 1.00 15.43 ? 453 LEU A CG 1 ATOM 3607 C CD1 . LEU A 1 453 ? -31.997 -14.868 20.569 1.00 15.21 ? 453 LEU A CD1 1 ATOM 3608 C CD2 . LEU A 1 453 ? -30.235 -16.670 20.389 1.00 17.01 ? 453 LEU A CD2 1 ATOM 3609 N N . LYS A 1 454 ? -34.537 -19.323 19.633 1.00 12.57 ? 454 LYS A N 1 ATOM 3610 C CA . LYS A 1 454 ? -34.960 -20.122 18.494 1.00 13.42 ? 454 LYS A CA 1 ATOM 3611 C C . LYS A 1 454 ? -36.378 -19.756 18.051 1.00 14.79 ? 454 LYS A C 1 ATOM 3612 O O . LYS A 1 454 ? -36.644 -19.634 16.846 1.00 15.08 ? 454 LYS A O 1 ATOM 3613 C CB . LYS A 1 454 ? -34.891 -21.621 18.849 1.00 12.94 ? 454 LYS A CB 1 ATOM 3614 C CG . LYS A 1 454 ? -35.149 -22.585 17.701 1.00 13.34 ? 454 LYS A CG 1 ATOM 3615 C CD . LYS A 1 454 ? -33.981 -22.634 16.684 1.00 14.23 ? 454 LYS A CD 1 ATOM 3616 C CE . LYS A 1 454 ? -34.337 -23.560 15.549 1.00 15.04 ? 454 LYS A CE 1 ATOM 3617 N NZ . LYS A 1 454 ? -33.212 -23.777 14.592 1.00 17.51 ? 454 LYS A NZ 1 ATOM 3618 N N . ALA A 1 455 ? -37.286 -19.601 19.023 1.00 15.40 ? 455 ALA A N 1 ATOM 3619 C CA . ALA A 1 455 ? -38.674 -19.214 18.748 1.00 16.16 ? 455 ALA A CA 1 ATOM 3620 C C . ALA A 1 455 ? -38.659 -17.820 18.103 1.00 18.02 ? 455 ALA A C 1 ATOM 3621 O O . ALA A 1 455 ? -39.436 -17.554 17.193 1.00 18.82 ? 455 ALA A O 1 ATOM 3622 C CB . ALA A 1 455 ? -39.544 -19.222 20.060 1.00 14.79 ? 455 ALA A CB 1 ATOM 3623 N N . LYS A 1 456 ? -37.758 -16.949 18.556 1.00 17.53 ? 456 LYS A N 1 ATOM 3624 C CA . LYS A 1 456 ? -37.639 -15.618 17.961 1.00 16.46 ? 456 LYS A CA 1 ATOM 3625 C C . LYS A 1 456 ? -37.100 -15.599 16.516 1.00 17.76 ? 456 LYS A C 1 ATOM 3626 O O . LYS A 1 456 ? -37.645 -14.891 15.661 1.00 15.49 ? 456 LYS A O 1 ATOM 3627 C CB . LYS A 1 456 ? -36.777 -14.706 18.817 1.00 15.75 ? 456 LYS A CB 1 ATOM 3628 C CG . LYS A 1 456 ? -36.636 -13.266 18.223 1.00 15.16 ? 456 LYS A CG 1 ATOM 3629 C CD . LYS A 1 456 ? -36.008 -12.275 19.196 1.00 14.30 ? 456 LYS A CD 1 ATOM 3630 C CE . LYS A 1 456 ? -35.815 -10.938 18.517 1.00 13.74 ? 456 LYS A CE 1 ATOM 3631 N NZ . LYS A 1 456 ? -34.979 -10.083 19.433 1.00 13.19 ? 456 LYS A NZ 1 ATOM 3632 N N . PHE A 1 457 ? -36.017 -16.337 16.258 1.00 16.81 ? 457 PHE A N 1 ATOM 3633 C CA . PHE A 1 457 ? -35.329 -16.245 14.960 1.00 16.49 ? 457 PHE A CA 1 ATOM 3634 C C . PHE A 1 457 ? -35.664 -17.313 13.945 1.00 16.20 ? 457 PHE A C 1 ATOM 3635 O O . PHE A 1 457 ? -35.621 -17.044 12.753 1.00 16.78 ? 457 PHE A O 1 ATOM 3636 C CB . PHE A 1 457 ? -33.802 -16.102 15.140 1.00 15.31 ? 457 PHE A CB 1 ATOM 3637 C CG . PHE A 1 457 ? -33.413 -14.728 15.586 1.00 15.93 ? 457 PHE A CG 1 ATOM 3638 C CD1 . PHE A 1 457 ? -33.464 -13.659 14.687 1.00 14.82 ? 457 PHE A CD1 1 ATOM 3639 C CD2 . PHE A 1 457 ? -33.101 -14.477 16.927 1.00 14.83 ? 457 PHE A CD2 1 ATOM 3640 C CE1 . PHE A 1 457 ? -33.152 -12.350 15.106 1.00 15.66 ? 457 PHE A CE1 1 ATOM 3641 C CE2 . PHE A 1 457 ? -32.785 -13.183 17.362 1.00 14.88 ? 457 PHE A CE2 1 ATOM 3642 C CZ . PHE A 1 457 ? -32.813 -12.114 16.468 1.00 14.95 ? 457 PHE A CZ 1 ATOM 3643 N N . ASP A 1 458 ? -35.957 -18.526 14.409 1.00 17.49 ? 458 ASP A N 1 ATOM 3644 C CA . ASP A 1 458 ? -36.361 -19.603 13.499 1.00 18.14 ? 458 ASP A CA 1 ATOM 3645 C C . ASP A 1 458 ? -37.616 -20.328 13.996 1.00 17.76 ? 458 ASP A C 1 ATOM 3646 O O . ASP A 1 458 ? -37.582 -21.534 14.217 1.00 17.48 ? 458 ASP A O 1 ATOM 3647 C CB . ASP A 1 458 ? -35.199 -20.581 13.236 1.00 17.82 ? 458 ASP A CB 1 ATOM 3648 C CG . ASP A 1 458 ? -35.484 -21.543 12.074 1.00 18.67 ? 458 ASP A CG 1 ATOM 3649 O OD1 . ASP A 1 458 ? -36.405 -21.262 11.262 1.00 18.69 ? 458 ASP A OD1 1 ATOM 3650 O OD2 . ASP A 1 458 ? -34.773 -22.575 11.976 1.00 17.76 ? 458 ASP A OD2 1 ATOM 3651 N N . PRO A 1 459 ? -38.744 -19.598 14.143 1.00 19.24 ? 459 PRO A N 1 ATOM 3652 C CA . PRO A 1 459 ? -39.946 -20.238 14.707 1.00 20.29 ? 459 PRO A CA 1 ATOM 3653 C C . PRO A 1 459 ? -40.550 -21.334 13.816 1.00 20.20 ? 459 PRO A C 1 ATOM 3654 O O . PRO A 1 459 ? -41.196 -22.255 14.334 1.00 20.59 ? 459 PRO A O 1 ATOM 3655 C CB . PRO A 1 459 ? -40.917 -19.057 14.900 1.00 20.26 ? 459 PRO A CB 1 ATOM 3656 C CG . PRO A 1 459 ? -40.471 -18.052 13.861 1.00 19.12 ? 459 PRO A CG 1 ATOM 3657 C CD . PRO A 1 459 ? -38.973 -18.162 13.886 1.00 19.14 ? 459 PRO A CD 1 ATOM 3658 N N . THR A 1 460 ? -40.303 -21.296 12.508 1.00 18.28 ? 460 THR A N 1 ATOM 3659 C CA . THR A 1 460 ? -40.818 -22.379 11.673 1.00 18.48 ? 460 THR A CA 1 ATOM 3660 C C . THR A 1 460 ? -39.820 -23.533 11.514 1.00 18.00 ? 460 THR A C 1 ATOM 3661 O O . THR A 1 460 ? -40.044 -24.449 10.721 1.00 16.02 ? 460 THR A O 1 ATOM 3662 C CB . THR A 1 460 ? -41.288 -21.900 10.301 1.00 19.14 ? 460 THR A CB 1 ATOM 3663 O OG1 . THR A 1 460 ? -40.148 -21.545 9.510 1.00 22.19 ? 460 THR A OG1 1 ATOM 3664 C CG2 . THR A 1 460 ? -42.271 -20.693 10.430 1.00 19.36 ? 460 THR A CG2 1 ATOM 3665 N N . ASP A 1 461 ? -38.717 -23.495 12.260 1.00 18.09 ? 461 ASP A N 1 ATOM 3666 C CA . ASP A 1 461 ? -37.719 -24.572 12.159 1.00 16.44 ? 461 ASP A CA 1 ATOM 3667 C C . ASP A 1 461 ? -37.257 -24.746 10.687 1.00 14.57 ? 461 ASP A C 1 ATOM 3668 O O . ASP A 1 461 ? -37.086 -25.871 10.195 1.00 13.52 ? 461 ASP A O 1 ATOM 3669 C CB . ASP A 1 461 ? -38.332 -25.872 12.689 1.00 18.90 ? 461 ASP A CB 1 ATOM 3670 C CG . ASP A 1 461 ? -37.390 -26.650 13.613 1.00 21.05 ? 461 ASP A CG 1 ATOM 3671 O OD1 . ASP A 1 461 ? -36.230 -26.239 13.829 1.00 21.37 ? 461 ASP A OD1 1 ATOM 3672 O OD2 . ASP A 1 461 ? -37.828 -27.708 14.099 1.00 23.42 ? 461 ASP A OD2 1 ATOM 3673 N N . ARG A 1 462 ? -37.085 -23.622 9.992 1.00 12.63 ? 462 ARG A N 1 ATOM 3674 C CA A ARG A 1 462 ? -36.664 -23.605 8.589 0.50 13.02 ? 462 ARG A CA 1 ATOM 3675 C CA B ARG A 1 462 ? -36.682 -23.643 8.588 0.50 12.99 ? 462 ARG A CA 1 ATOM 3676 C C . ARG A 1 462 ? -35.285 -24.258 8.421 1.00 13.14 ? 462 ARG A C 1 ATOM 3677 O O . ARG A 1 462 ? -34.994 -24.894 7.395 1.00 14.43 ? 462 ARG A O 1 ATOM 3678 C CB A ARG A 1 462 ? -36.631 -22.156 8.078 0.50 12.67 ? 462 ARG A CB 1 ATOM 3679 C CB B ARG A 1 462 ? -36.736 -22.232 7.990 0.50 12.59 ? 462 ARG A CB 1 ATOM 3680 C CG A ARG A 1 462 ? -36.039 -21.961 6.677 0.50 11.85 ? 462 ARG A CG 1 ATOM 3681 C CG B ARG A 1 462 ? -36.301 -22.140 6.524 0.50 11.69 ? 462 ARG A CG 1 ATOM 3682 C CD A ARG A 1 462 ? -36.936 -22.561 5.620 0.50 11.59 ? 462 ARG A CD 1 ATOM 3683 C CD B ARG A 1 462 ? -36.957 -20.953 5.837 0.50 11.55 ? 462 ARG A CD 1 ATOM 3684 N NE A ARG A 1 462 ? -38.282 -21.991 5.649 0.50 11.78 ? 462 ARG A NE 1 ATOM 3685 N NE B ARG A 1 462 ? -38.408 -21.118 5.721 0.50 11.14 ? 462 ARG A NE 1 ATOM 3686 C CZ A ARG A 1 462 ? -39.388 -22.704 5.460 0.50 11.74 ? 462 ARG A CZ 1 ATOM 3687 C CZ B ARG A 1 462 ? -39.306 -20.325 6.299 0.50 10.72 ? 462 ARG A CZ 1 ATOM 3688 N NH1 A ARG A 1 462 ? -39.280 -24.000 5.239 0.50 11.53 ? 462 ARG A NH1 1 ATOM 3689 N NH1 B ARG A 1 462 ? -38.911 -19.279 7.026 0.50 10.36 ? 462 ARG A NH1 1 ATOM 3690 N NH2 A ARG A 1 462 ? -40.593 -22.136 5.490 0.50 11.28 ? 462 ARG A NH2 1 ATOM 3691 N NH2 B ARG A 1 462 ? -40.603 -20.570 6.137 0.50 10.18 ? 462 ARG A NH2 1 ATOM 3692 N N . PHE A 1 463 ? -34.441 -24.085 9.427 1.00 12.63 ? 463 PHE A N 1 ATOM 3693 C CA . PHE A 1 463 ? -33.090 -24.629 9.402 1.00 14.06 ? 463 PHE A CA 1 ATOM 3694 C C . PHE A 1 463 ? -32.976 -25.964 10.139 1.00 13.05 ? 463 PHE A C 1 ATOM 3695 O O . PHE A 1 463 ? -31.886 -26.356 10.540 1.00 13.48 ? 463 PHE A O 1 ATOM 3696 C CB . PHE A 1 463 ? -32.097 -23.618 9.974 1.00 13.06 ? 463 PHE A CB 1 ATOM 3697 C CG . PHE A 1 463 ? -32.062 -22.307 9.226 1.00 14.34 ? 463 PHE A CG 1 ATOM 3698 C CD1 . PHE A 1 463 ? -31.632 -22.254 7.895 1.00 13.91 ? 463 PHE A CD1 1 ATOM 3699 C CD2 . PHE A 1 463 ? -32.397 -21.116 9.873 1.00 14.00 ? 463 PHE A CD2 1 ATOM 3700 C CE1 . PHE A 1 463 ? -31.579 -21.032 7.204 1.00 13.84 ? 463 PHE A CE1 1 ATOM 3701 C CE2 . PHE A 1 463 ? -32.331 -19.882 9.192 1.00 14.58 ? 463 PHE A CE2 1 ATOM 3702 C CZ . PHE A 1 463 ? -31.934 -19.846 7.850 1.00 14.00 ? 463 PHE A CZ 1 ATOM 3703 N N . TYR A 1 464 ? -34.100 -26.667 10.289 1.00 12.96 ? 464 TYR A N 1 ATOM 3704 C CA . TYR A 1 464 ? -34.158 -27.923 11.048 1.00 11.86 ? 464 TYR A CA 1 ATOM 3705 C C . TYR A 1 464 ? -33.059 -28.937 10.760 1.00 12.88 ? 464 TYR A C 1 ATOM 3706 O O . TYR A 1 464 ? -32.676 -29.178 9.594 1.00 11.23 ? 464 TYR A O 1 ATOM 3707 C CB . TYR A 1 464 ? -35.469 -28.632 10.760 1.00 12.31 ? 464 TYR A CB 1 ATOM 3708 C CG . TYR A 1 464 ? -35.560 -30.031 11.344 1.00 12.91 ? 464 TYR A CG 1 ATOM 3709 C CD1 . TYR A 1 464 ? -35.888 -30.232 12.694 1.00 13.14 ? 464 TYR A CD1 1 ATOM 3710 C CD2 . TYR A 1 464 ? -35.316 -31.149 10.549 1.00 13.42 ? 464 TYR A CD2 1 ATOM 3711 C CE1 . TYR A 1 464 ? -35.990 -31.536 13.235 1.00 14.05 ? 464 TYR A CE1 1 ATOM 3712 C CE2 . TYR A 1 464 ? -35.401 -32.452 11.076 1.00 13.49 ? 464 TYR A CE2 1 ATOM 3713 C CZ . TYR A 1 464 ? -35.735 -32.639 12.407 1.00 14.25 ? 464 TYR A CZ 1 ATOM 3714 O OH . TYR A 1 464 ? -35.806 -33.919 12.905 1.00 14.57 ? 464 TYR A OH 1 ATOM 3715 N N . TYR A 1 465 ? -32.596 -29.559 11.841 1.00 12.00 ? 465 TYR A N 1 ATOM 3716 C CA . TYR A 1 465 ? -31.891 -30.816 11.756 1.00 11.97 ? 465 TYR A CA 1 ATOM 3717 C C . TYR A 1 465 ? -32.157 -31.552 13.067 1.00 12.51 ? 465 TYR A C 1 ATOM 3718 O O . TYR A 1 465 ? -32.610 -30.935 14.041 1.00 13.05 ? 465 TYR A O 1 ATOM 3719 C CB . TYR A 1 465 ? -30.388 -30.602 11.470 1.00 10.75 ? 465 TYR A CB 1 ATOM 3720 C CG . TYR A 1 465 ? -29.549 -29.880 12.539 1.00 10.73 ? 465 TYR A CG 1 ATOM 3721 C CD1 . TYR A 1 465 ? -29.526 -28.476 12.623 1.00 10.50 ? 465 TYR A CD1 1 ATOM 3722 C CD2 . TYR A 1 465 ? -28.726 -30.597 13.422 1.00 9.78 ? 465 TYR A CD2 1 ATOM 3723 C CE1 . TYR A 1 465 ? -28.731 -27.812 13.597 1.00 9.13 ? 465 TYR A CE1 1 ATOM 3724 C CE2 . TYR A 1 465 ? -27.919 -29.939 14.387 1.00 9.16 ? 465 TYR A CE2 1 ATOM 3725 C CZ . TYR A 1 465 ? -27.907 -28.547 14.456 1.00 9.32 ? 465 TYR A CZ 1 ATOM 3726 O OH . TYR A 1 465 ? -27.093 -27.873 15.407 1.00 8.83 ? 465 TYR A OH 1 ATOM 3727 N N . PRO A 1 466 ? -31.859 -32.858 13.115 1.00 12.46 ? 466 PRO A N 1 ATOM 3728 C CA . PRO A 1 466 ? -32.407 -33.598 14.256 1.00 12.99 ? 466 PRO A CA 1 ATOM 3729 C C . PRO A 1 466 ? -31.845 -33.238 15.642 1.00 13.49 ? 466 PRO A C 1 ATOM 3730 O O . PRO A 1 466 ? -32.396 -33.704 16.655 1.00 14.34 ? 466 PRO A O 1 ATOM 3731 C CB . PRO A 1 466 ? -32.103 -35.075 13.905 1.00 12.42 ? 466 PRO A CB 1 ATOM 3732 C CG . PRO A 1 466 ? -32.064 -35.090 12.414 1.00 13.61 ? 466 PRO A CG 1 ATOM 3733 C CD . PRO A 1 466 ? -31.347 -33.770 12.071 1.00 12.69 ? 466 PRO A CD 1 ATOM 3734 N N . GLN A 1 467 ? -30.781 -32.436 15.720 1.00 12.12 ? 467 GLN A N 1 ATOM 3735 C CA . GLN A 1 467 ? -30.335 -31.990 17.041 1.00 11.35 ? 467 GLN A CA 1 ATOM 3736 C C . GLN A 1 467 ? -30.278 -30.471 17.136 1.00 11.42 ? 467 GLN A C 1 ATOM 3737 O O . GLN A 1 467 ? -29.522 -29.916 17.942 1.00 10.71 ? 467 GLN A O 1 ATOM 3738 C CB . GLN A 1 467 ? -29.028 -32.679 17.508 1.00 11.82 ? 467 GLN A CB 1 ATOM 3739 C CG . GLN A 1 467 ? -29.155 -34.220 17.571 1.00 11.56 ? 467 GLN A CG 1 ATOM 3740 C CD . GLN A 1 467 ? -27.862 -34.974 17.899 1.00 12.28 ? 467 GLN A CD 1 ATOM 3741 O OE1 . GLN A 1 467 ? -26.753 -34.487 17.685 1.00 11.00 ? 467 GLN A OE1 1 ATOM 3742 N NE2 . GLN A 1 467 ? -28.022 -36.211 18.408 1.00 12.67 ? 467 GLN A NE2 1 ATOM 3743 N N . ALA A 1 468 ? -31.093 -29.805 16.313 1.00 10.91 ? 468 ALA A N 1 ATOM 3744 C CA . ALA A 1 468 ? -31.377 -28.381 16.481 1.00 11.16 ? 468 ALA A CA 1 ATOM 3745 C C . ALA A 1 468 ? -32.096 -28.191 17.807 1.00 11.74 ? 468 ALA A C 1 ATOM 3746 O O . ALA A 1 468 ? -32.870 -29.059 18.231 1.00 11.94 ? 468 ALA A O 1 ATOM 3747 C CB . ALA A 1 468 ? -32.280 -27.848 15.316 1.00 10.21 ? 468 ALA A CB 1 ATOM 3748 N N . VAL A 1 469 ? -31.855 -27.051 18.441 1.00 12.62 ? 469 VAL A N 1 ATOM 3749 C CA . VAL A 1 469 ? -32.625 -26.602 19.589 1.00 14.36 ? 469 VAL A CA 1 ATOM 3750 C C . VAL A 1 469 ? -34.117 -26.449 19.183 1.00 14.96 ? 469 VAL A C 1 ATOM 3751 O O . VAL A 1 469 ? -34.411 -25.957 18.099 1.00 14.08 ? 469 VAL A O 1 ATOM 3752 C CB . VAL A 1 469 ? -32.017 -25.260 20.086 1.00 16.32 ? 469 VAL A CB 1 ATOM 3753 C CG1 . VAL A 1 469 ? -32.926 -24.542 21.030 1.00 16.83 ? 469 VAL A CG1 1 ATOM 3754 C CG2 . VAL A 1 469 ? -30.632 -25.504 20.764 1.00 16.03 ? 469 VAL A CG2 1 ATOM 3755 N N . ARG A 1 470 ? -35.055 -26.882 20.028 1.00 16.14 ? 470 ARG A N 1 ATOM 3756 C CA . ARG A 1 470 ? -36.487 -26.626 19.747 1.00 17.00 ? 470 ARG A CA 1 ATOM 3757 C C . ARG A 1 470 ? -36.863 -25.155 19.957 1.00 16.52 ? 470 ARG A C 1 ATOM 3758 O O . ARG A 1 470 ? -36.427 -24.555 20.932 1.00 16.11 ? 470 ARG A O 1 ATOM 3759 C CB . ARG A 1 470 ? -37.413 -27.483 20.620 1.00 18.12 ? 470 ARG A CB 1 ATOM 3760 C CG . ARG A 1 470 ? -37.365 -28.955 20.364 1.00 19.41 ? 470 ARG A CG 1 ATOM 3761 C CD . ARG A 1 470 ? -38.522 -29.705 21.095 1.00 19.83 ? 470 ARG A CD 1 ATOM 3762 N NE . ARG A 1 470 ? -38.374 -31.146 20.905 1.00 18.09 ? 470 ARG A NE 1 ATOM 3763 C CZ . ARG A 1 470 ? -38.750 -31.792 19.805 1.00 20.16 ? 470 ARG A CZ 1 ATOM 3764 N NH1 . ARG A 1 470 ? -39.304 -31.129 18.792 1.00 19.19 ? 470 ARG A NH1 1 ATOM 3765 N NH2 . ARG A 1 470 ? -38.575 -33.105 19.713 1.00 18.45 ? 470 ARG A NH2 1 ATOM 3766 N N . PRO A 1 471 ? -37.660 -24.575 19.029 1.00 17.17 ? 471 PRO A N 1 ATOM 3767 C CA . PRO A 1 471 ? -38.272 -23.271 19.263 1.00 19.47 ? 471 PRO A CA 1 ATOM 3768 C C . PRO A 1 471 ? -39.338 -23.388 20.365 1.00 20.66 ? 471 PRO A C 1 ATOM 3769 O O . PRO A 1 471 ? -40.317 -24.117 20.203 1.00 20.81 ? 471 PRO A O 1 ATOM 3770 C CB . PRO A 1 471 ? -38.949 -22.945 17.924 1.00 17.58 ? 471 PRO A CB 1 ATOM 3771 C CG . PRO A 1 471 ? -39.154 -24.251 17.275 1.00 18.72 ? 471 PRO A CG 1 ATOM 3772 C CD . PRO A 1 471 ? -38.028 -25.132 17.717 1.00 17.14 ? 471 PRO A CD 1 ATOM 3773 N N . VAL A 1 472 ? -39.121 -22.698 21.478 1.00 22.33 ? 472 VAL A N 1 ATOM 3774 C CA . VAL A 1 472 ? -40.099 -22.665 22.576 1.00 25.19 ? 472 VAL A CA 1 ATOM 3775 C C . VAL A 1 472 ? -40.348 -21.213 22.984 1.00 27.20 ? 472 VAL A C 1 ATOM 3776 O O . VAL A 1 472 ? -39.487 -20.584 23.603 1.00 25.18 ? 472 VAL A O 1 ATOM 3777 C CB . VAL A 1 472 ? -39.623 -23.480 23.805 1.00 24.95 ? 472 VAL A CB 1 ATOM 3778 C CG1 . VAL A 1 472 ? -40.753 -23.599 24.828 1.00 24.91 ? 472 VAL A CG1 1 ATOM 3779 C CG2 . VAL A 1 472 ? -39.156 -24.858 23.383 1.00 23.62 ? 472 VAL A CG2 1 ATOM 3780 N N . LYS A 1 473 ? -41.512 -20.677 22.607 1.00 33.07 ? 473 LYS A N 1 ATOM 3781 C CA . LYS A 1 473 ? -41.929 -19.332 23.025 1.00 40.82 ? 473 LYS A CA 1 ATOM 3782 C C . LYS A 1 473 ? -41.818 -19.182 24.545 1.00 44.50 ? 473 LYS A C 1 ATOM 3783 O O . LYS A 1 473 ? -42.203 -20.064 25.320 1.00 43.09 ? 473 LYS A O 1 ATOM 3784 C CB . LYS A 1 473 ? -43.372 -19.056 22.597 1.00 46.20 ? 473 LYS A CB 1 ATOM 3785 C CG . LYS A 1 473 ? -43.560 -18.796 21.118 1.00 56.67 ? 473 LYS A CG 1 ATOM 3786 C CD . LYS A 1 473 ? -45.005 -18.400 20.822 1.00 67.34 ? 473 LYS A CD 1 ATOM 3787 C CE . LYS A 1 473 ? -45.164 -17.831 19.416 1.00 75.57 ? 473 LYS A CE 1 ATOM 3788 N NZ . LYS A 1 473 ? -46.498 -17.179 19.248 1.00 75.88 ? 473 LYS A NZ 1 ATOM 3789 O OXT . LYS A 1 473 ? -41.312 -18.179 25.040 1.00 49.27 ? 473 LYS A OXT 1 HETATM 3790 P PA . FAD B 2 . ? -20.317 -28.622 8.441 1.00 9.18 ? 501 FAD A PA 1 HETATM 3791 O O1A . FAD B 2 . ? -20.262 -27.946 7.097 1.00 9.44 ? 501 FAD A O1A 1 HETATM 3792 O O2A . FAD B 2 . ? -20.633 -30.095 8.399 1.00 8.50 ? 501 FAD A O2A 1 HETATM 3793 O O5B . FAD B 2 . ? -21.415 -27.883 9.348 1.00 9.51 ? 501 FAD A O5B 1 HETATM 3794 C C5B . FAD B 2 . ? -21.477 -28.158 10.743 1.00 8.98 ? 501 FAD A C5B 1 HETATM 3795 C C4B . FAD B 2 . ? -22.759 -27.525 11.311 1.00 9.00 ? 501 FAD A C4B 1 HETATM 3796 O O4B . FAD B 2 . ? -22.688 -26.104 11.186 1.00 8.24 ? 501 FAD A O4B 1 HETATM 3797 C C3B . FAD B 2 . ? -24.020 -27.962 10.568 1.00 9.12 ? 501 FAD A C3B 1 HETATM 3798 O O3B . FAD B 2 . ? -25.128 -27.896 11.469 1.00 11.12 ? 501 FAD A O3B 1 HETATM 3799 C C2B . FAD B 2 . ? -24.168 -26.845 9.540 1.00 9.41 ? 501 FAD A C2B 1 HETATM 3800 O O2B . FAD B 2 . ? -25.452 -26.667 8.990 1.00 8.87 ? 501 FAD A O2B 1 HETATM 3801 C C1B . FAD B 2 . ? -23.732 -25.646 10.370 1.00 9.05 ? 501 FAD A C1B 1 HETATM 3802 N N9A . FAD B 2 . ? -23.226 -24.587 9.502 1.00 9.38 ? 501 FAD A N9A 1 HETATM 3803 C C8A . FAD B 2 . ? -22.301 -24.692 8.468 1.00 9.97 ? 501 FAD A C8A 1 HETATM 3804 N N7A . FAD B 2 . ? -22.142 -23.446 7.946 1.00 10.42 ? 501 FAD A N7A 1 HETATM 3805 C C5A . FAD B 2 . ? -22.909 -22.582 8.630 1.00 9.47 ? 501 FAD A C5A 1 HETATM 3806 C C6A . FAD B 2 . ? -23.113 -21.205 8.497 1.00 10.31 ? 501 FAD A C6A 1 HETATM 3807 N N6A . FAD B 2 . ? -22.457 -20.494 7.553 1.00 9.02 ? 501 FAD A N6A 1 HETATM 3808 N N1A . FAD B 2 . ? -23.978 -20.590 9.386 1.00 9.14 ? 501 FAD A N1A 1 HETATM 3809 C C2A . FAD B 2 . ? -24.657 -21.329 10.349 1.00 9.90 ? 501 FAD A C2A 1 HETATM 3810 N N3A . FAD B 2 . ? -24.489 -22.695 10.458 1.00 9.60 ? 501 FAD A N3A 1 HETATM 3811 C C4A . FAD B 2 . ? -23.610 -23.296 9.607 1.00 9.58 ? 501 FAD A C4A 1 HETATM 3812 N N1 . FAD B 2 . ? -13.172 -29.623 16.563 1.00 15.10 ? 501 FAD A N1 1 HETATM 3813 C C2 . FAD B 2 . ? -12.484 -28.852 17.507 1.00 16.31 ? 501 FAD A C2 1 HETATM 3814 O O2 . FAD B 2 . ? -13.080 -28.124 18.310 1.00 12.78 ? 501 FAD A O2 1 HETATM 3815 N N3 . FAD B 2 . ? -11.093 -28.888 17.464 1.00 16.29 ? 501 FAD A N3 1 HETATM 3816 C C4 . FAD B 2 . ? -10.340 -29.531 16.500 1.00 16.18 ? 501 FAD A C4 1 HETATM 3817 O O4 . FAD B 2 . ? -9.094 -29.416 16.467 1.00 16.32 ? 501 FAD A O4 1 HETATM 3818 C C4X . FAD B 2 . ? -11.116 -30.385 15.548 1.00 14.93 ? 501 FAD A C4X 1 HETATM 3819 N N5 . FAD B 2 . ? -10.488 -31.058 14.599 1.00 15.77 ? 501 FAD A N5 1 HETATM 3820 C C5X . FAD B 2 . ? -11.176 -31.767 13.642 1.00 13.64 ? 501 FAD A C5X 1 HETATM 3821 C C6 . FAD B 2 . ? -10.490 -32.406 12.577 1.00 13.59 ? 501 FAD A C6 1 HETATM 3822 C C7 . FAD B 2 . ? -11.179 -33.004 11.539 1.00 11.50 ? 501 FAD A C7 1 HETATM 3823 C C7M . FAD B 2 . ? -10.423 -33.710 10.394 1.00 11.85 ? 501 FAD A C7M 1 HETATM 3824 C C8 . FAD B 2 . ? -12.586 -32.862 11.481 1.00 11.94 ? 501 FAD A C8 1 HETATM 3825 C C8M . FAD B 2 . ? -13.385 -33.478 10.350 1.00 10.63 ? 501 FAD A C8M 1 HETATM 3826 C C9 . FAD B 2 . ? -13.276 -32.301 12.545 1.00 12.62 ? 501 FAD A C9 1 HETATM 3827 C C9A . FAD B 2 . ? -12.590 -31.721 13.631 1.00 13.63 ? 501 FAD A C9A 1 HETATM 3828 N N10 . FAD B 2 . ? -13.259 -31.015 14.660 1.00 14.02 ? 501 FAD A N10 1 HETATM 3829 C C10 . FAD B 2 . ? -12.548 -30.410 15.685 1.00 14.89 ? 501 FAD A C10 1 HETATM 3830 C "C1'" . FAD B 2 . ? -14.758 -30.977 14.665 1.00 13.44 ? 501 FAD A "C1'" 1 HETATM 3831 C "C2'" . FAD B 2 . ? -15.262 -29.696 14.015 1.00 12.43 ? 501 FAD A "C2'" 1 HETATM 3832 O "O2'" . FAD B 2 . ? -15.057 -28.606 14.905 1.00 13.88 ? 501 FAD A "O2'" 1 HETATM 3833 C "C3'" . FAD B 2 . ? -16.745 -29.806 13.741 1.00 11.71 ? 501 FAD A "C3'" 1 HETATM 3834 O "O3'" . FAD B 2 . ? -17.017 -30.975 12.998 1.00 11.43 ? 501 FAD A "O3'" 1 HETATM 3835 C "C4'" . FAD B 2 . ? -17.228 -28.549 12.998 1.00 11.75 ? 501 FAD A "C4'" 1 HETATM 3836 O "O4'" . FAD B 2 . ? -18.584 -28.357 13.261 1.00 10.13 ? 501 FAD A "O4'" 1 HETATM 3837 C "C5'" . FAD B 2 . ? -16.962 -28.642 11.493 1.00 10.36 ? 501 FAD A "C5'" 1 HETATM 3838 O "O5'" . FAD B 2 . ? -17.393 -27.466 10.866 1.00 11.29 ? 501 FAD A "O5'" 1 HETATM 3839 P P . FAD B 2 . ? -17.723 -27.508 9.276 1.00 10.43 ? 501 FAD A P 1 HETATM 3840 O O1P . FAD B 2 . ? -18.067 -26.136 8.779 1.00 10.64 ? 501 FAD A O1P 1 HETATM 3841 O O2P . FAD B 2 . ? -16.549 -28.145 8.530 1.00 9.59 ? 501 FAD A O2P 1 HETATM 3842 O O3P . FAD B 2 . ? -18.954 -28.530 9.292 1.00 9.17 ? 501 FAD A O3P 1 HETATM 3843 C C1 . NAG C 3 . ? 1.894 -51.259 37.318 0.50 32.70 ? 502 NAG A C1 1 HETATM 3844 C C2 . NAG C 3 . ? 2.147 -52.387 38.307 0.50 32.53 ? 502 NAG A C2 1 HETATM 3845 C C3 . NAG C 3 . ? 2.893 -51.814 39.491 0.50 32.78 ? 502 NAG A C3 1 HETATM 3846 C C4 . NAG C 3 . ? 4.171 -51.161 38.995 0.50 33.58 ? 502 NAG A C4 1 HETATM 3847 C C5 . NAG C 3 . ? 3.955 -50.257 37.772 0.50 33.17 ? 502 NAG A C5 1 HETATM 3848 C C6 . NAG C 3 . ? 5.294 -49.984 37.113 0.50 32.19 ? 502 NAG A C6 1 HETATM 3849 C C7 . NAG C 3 . ? 0.292 -52.728 39.859 0.50 30.94 ? 502 NAG A C7 1 HETATM 3850 C C8 . NAG C 3 . ? -0.952 -53.508 40.175 0.50 30.22 ? 502 NAG A C8 1 HETATM 3851 N N2 . NAG C 3 . ? 0.926 -53.049 38.734 0.50 32.89 ? 502 NAG A N2 1 HETATM 3852 O O3 . NAG C 3 . ? 3.212 -52.826 40.422 0.50 33.11 ? 502 NAG A O3 1 HETATM 3853 O O4 . NAG C 3 . ? 4.685 -50.422 40.080 0.50 32.86 ? 502 NAG A O4 1 HETATM 3854 O O5 . NAG C 3 . ? 3.130 -50.856 36.790 0.50 32.50 ? 502 NAG A O5 1 HETATM 3855 O O6 . NAG C 3 . ? 6.231 -50.857 37.695 0.50 33.68 ? 502 NAG A O6 1 HETATM 3856 O O7 . NAG C 3 . ? 0.682 -51.843 40.616 0.50 32.44 ? 502 NAG A O7 1 HETATM 3857 ZN ZN . ZN D 4 . ? -5.514 -20.687 0.376 0.50 32.45 ? 601 ZN A ZN 1 HETATM 3858 ZN ZN . ZN E 4 . ? 0.000 -31.567 0.000 0.50 23.94 ? 602 ZN A ZN 1 HETATM 3859 ZN ZN . ZN F 4 . ? -4.192 -35.139 43.246 0.50 18.88 ? 603 ZN A ZN 1 HETATM 3860 C C1 . ABL G 5 . ? -10.370 -33.916 16.056 1.00 42.43 ? 604 ABL A C1 1 HETATM 3861 O O1 . ABL G 5 . ? -11.140 -33.106 16.622 1.00 45.61 ? 604 ABL A O1 1 HETATM 3862 C C2 . ABL G 5 . ? -8.917 -34.098 16.541 1.00 42.65 ? 604 ABL A C2 1 HETATM 3863 O O2 . ABL G 5 . ? -8.460 -32.831 17.012 1.00 39.75 ? 604 ABL A O2 1 HETATM 3864 C C3 . ABL G 5 . ? -7.966 -34.651 15.450 1.00 38.30 ? 604 ABL A C3 1 HETATM 3865 O O3 . ABL G 5 . ? -6.754 -35.071 16.125 1.00 38.64 ? 604 ABL A O3 1 HETATM 3866 C C4 . ABL G 5 . ? -8.596 -35.868 14.801 1.00 40.88 ? 604 ABL A C4 1 HETATM 3867 O O4 . ABL G 5 . ? -7.723 -36.454 13.802 1.00 43.18 ? 604 ABL A O4 1 HETATM 3868 C C5 . ABL G 5 . ? -9.931 -35.441 14.098 1.00 40.31 ? 604 ABL A C5 1 HETATM 3869 N N5 . ABL G 5 . ? -10.807 -34.663 15.014 1.00 39.74 ? 604 ABL A N5 1 HETATM 3870 C C6 . ABL G 5 . ? -10.776 -36.656 13.635 1.00 39.00 ? 604 ABL A C6 1 HETATM 3871 O O6 . ABL G 5 . ? -11.635 -36.363 12.517 1.00 35.72 ? 604 ABL A O6 1 HETATM 3872 C C1A . ABL G 5 . ? -6.917 -37.616 14.151 1.00 45.15 ? 604 ABL A C1A 1 HETATM 3873 C C2A . ABL G 5 . ? -6.574 -38.436 12.882 1.00 46.58 ? 604 ABL A C2A 1 HETATM 3874 O O2A . ABL G 5 . ? -7.798 -38.845 12.260 1.00 51.76 ? 604 ABL A O2A 1 HETATM 3875 C C3A . ABL G 5 . ? -5.702 -39.636 13.274 1.00 48.71 ? 604 ABL A C3A 1 HETATM 3876 O O3A . ABL G 5 . ? -5.340 -40.413 12.133 1.00 50.06 ? 604 ABL A O3A 1 HETATM 3877 C C4A . ABL G 5 . ? -4.452 -39.119 14.057 1.00 46.14 ? 604 ABL A C4A 1 HETATM 3878 O O4A . ABL G 5 . ? -3.587 -40.178 14.441 1.00 48.59 ? 604 ABL A O4A 1 HETATM 3879 C C5A . ABL G 5 . ? -4.903 -38.336 15.296 1.00 44.99 ? 604 ABL A C5A 1 HETATM 3880 O O5A . ABL G 5 . ? -5.743 -37.241 14.856 1.00 45.16 ? 604 ABL A O5A 1 HETATM 3881 C C6A . ABL G 5 . ? -3.724 -37.837 16.140 1.00 40.74 ? 604 ABL A C6A 1 HETATM 3882 O O6A . ABL G 5 . ? -2.790 -37.087 15.432 1.00 36.37 ? 604 ABL A O6A 1 HETATM 3883 C C1 . ABL H 5 . ? -21.987 -28.311 -11.069 0.50 21.76 ? 605 ABL A C1 1 HETATM 3884 O O1 . ABL H 5 . ? -22.339 -29.426 -10.618 0.50 19.31 ? 605 ABL A O1 1 HETATM 3885 C C2 . ABL H 5 . ? -21.439 -28.155 -12.489 0.50 22.23 ? 605 ABL A C2 1 HETATM 3886 O O2 . ABL H 5 . ? -20.844 -29.402 -12.838 0.50 23.90 ? 605 ABL A O2 1 HETATM 3887 C C3 . ABL H 5 . ? -20.340 -27.081 -12.535 0.50 22.79 ? 605 ABL A C3 1 HETATM 3888 O O3 . ABL H 5 . ? -19.959 -26.893 -13.910 0.50 24.11 ? 605 ABL A O3 1 HETATM 3889 C C4 . ABL H 5 . ? -20.859 -25.782 -11.986 0.50 21.59 ? 605 ABL A C4 1 HETATM 3890 O O4 . ABL H 5 . ? -19.830 -24.775 -12.022 0.50 24.03 ? 605 ABL A O4 1 HETATM 3891 C C5 . ABL H 5 . ? -21.125 -26.061 -10.482 0.50 20.25 ? 605 ABL A C5 1 HETATM 3892 N N5 . ABL H 5 . ? -22.061 -27.188 -10.320 0.50 20.01 ? 605 ABL A N5 1 HETATM 3893 C C6 . ABL H 5 . ? -21.793 -24.829 -9.829 0.50 18.31 ? 605 ABL A C6 1 HETATM 3894 O O6 . ABL H 5 . ? -22.667 -24.193 -10.743 0.50 16.40 ? 605 ABL A O6 1 HETATM 3895 C C1A . ABL H 5 . ? -19.953 -23.584 -12.838 0.50 27.42 ? 605 ABL A C1A 1 HETATM 3896 C C2A . ABL H 5 . ? -18.715 -22.696 -12.608 0.50 28.90 ? 605 ABL A C2A 1 HETATM 3897 O O2A . ABL H 5 . ? -18.610 -22.328 -11.229 0.50 28.96 ? 605 ABL A O2A 1 HETATM 3898 C C3A . ABL H 5 . ? -18.794 -21.440 -13.465 0.50 29.69 ? 605 ABL A C3A 1 HETATM 3899 O O3A . ABL H 5 . ? -17.545 -20.782 -13.362 0.50 30.26 ? 605 ABL A O3A 1 HETATM 3900 C C4A . ABL H 5 . ? -19.148 -21.800 -14.942 0.50 29.86 ? 605 ABL A C4A 1 HETATM 3901 O O4A . ABL H 5 . ? -19.433 -20.617 -15.674 0.50 30.60 ? 605 ABL A O4A 1 HETATM 3902 C C5A . ABL H 5 . ? -20.359 -22.738 -15.000 0.50 29.63 ? 605 ABL A C5A 1 HETATM 3903 O O5A . ABL H 5 . ? -20.035 -23.893 -14.211 0.50 29.53 ? 605 ABL A O5A 1 HETATM 3904 C C6A . ABL H 5 . ? -20.814 -23.112 -16.417 0.50 30.59 ? 605 ABL A C6A 1 HETATM 3905 O O6A . ABL H 5 . ? -19.829 -23.693 -17.231 0.50 30.97 ? 605 ABL A O6A 1 HETATM 3906 C C A TRS I 6 . ? -15.236 -15.883 -4.562 0.50 18.30 ? 606 TRS A C 1 HETATM 3907 C C B TRS I 6 . ? -15.557 -15.178 -4.489 0.50 27.70 ? 606 TRS A C 1 HETATM 3908 C C1 A TRS I 6 . ? -16.502 -15.069 -4.472 0.50 18.50 ? 606 TRS A C1 1 HETATM 3909 C C1 B TRS I 6 . ? -15.824 -13.943 -3.650 0.50 28.57 ? 606 TRS A C1 1 HETATM 3910 C C2 A TRS I 6 . ? -14.766 -15.729 -3.123 0.50 18.04 ? 606 TRS A C2 1 HETATM 3911 C C2 B TRS I 6 . ? -16.388 -16.258 -3.810 0.50 30.39 ? 606 TRS A C2 1 HETATM 3912 C C3 A TRS I 6 . ? -14.246 -15.575 -5.680 0.50 20.91 ? 606 TRS A C3 1 HETATM 3913 C C3 B TRS I 6 . ? -14.070 -15.431 -4.690 0.50 31.14 ? 606 TRS A C3 1 HETATM 3914 N N A TRS I 6 . ? -15.662 -17.275 -4.759 0.50 20.11 ? 606 TRS A N 1 HETATM 3915 N N B TRS I 6 . ? -16.178 -14.942 -5.789 0.50 29.98 ? 606 TRS A N 1 HETATM 3916 O O1 A TRS I 6 . ? -17.262 -15.615 -3.401 0.50 19.75 ? 606 TRS A O1 1 HETATM 3917 O O1 B TRS I 6 . ? -14.688 -13.123 -3.802 0.50 26.14 ? 606 TRS A O1 1 HETATM 3918 O O2 A TRS I 6 . ? -14.292 -16.958 -2.611 0.50 16.83 ? 606 TRS A O2 1 HETATM 3919 O O2 B TRS I 6 . ? -16.305 -17.473 -4.541 0.50 29.00 ? 606 TRS A O2 1 HETATM 3920 O O3 A TRS I 6 . ? -13.497 -16.738 -5.998 0.50 22.92 ? 606 TRS A O3 1 HETATM 3921 O O3 B TRS I 6 . ? -13.700 -15.340 -6.051 0.50 34.89 ? 606 TRS A O3 1 HETATM 3922 S S . SO4 J 7 . ? -26.513 -46.016 10.077 0.50 36.69 ? 607 SO4 A S 1 HETATM 3923 O O1 . SO4 J 7 . ? -25.121 -46.139 9.641 0.50 30.88 ? 607 SO4 A O1 1 HETATM 3924 O O2 . SO4 J 7 . ? -27.155 -44.932 9.315 0.50 32.91 ? 607 SO4 A O2 1 HETATM 3925 O O3 . SO4 J 7 . ? -27.194 -47.298 9.823 0.50 31.50 ? 607 SO4 A O3 1 HETATM 3926 O O4 . SO4 J 7 . ? -26.586 -45.688 11.507 0.50 29.19 ? 607 SO4 A O4 1 HETATM 3927 CL CL . CL K 8 . ? -18.644 -29.853 -12.475 0.50 25.82 ? 608 CL A CL 1 HETATM 3928 CL CL . CL L 8 . ? -43.763 -22.586 21.664 0.50 34.03 ? 609 CL A CL 1 HETATM 3929 CL CL . CL M 8 . ? -37.044 -34.072 15.757 0.50 25.52 ? 610 CL A CL 1 HETATM 3930 CL CL . CL N 8 . ? -38.449 -33.067 15.869 0.50 27.40 ? 611 CL A CL 1 HETATM 3931 O O . HOH O 9 . ? -17.194 -53.681 22.868 0.50 25.13 ? 612 HOH A O 1 HETATM 3932 O O . HOH O 9 . ? -16.510 -25.865 -10.464 1.00 31.32 ? 613 HOH A O 1 HETATM 3933 O O . HOH O 9 . ? -33.993 -7.534 13.086 1.00 34.48 ? 614 HOH A O 1 HETATM 3934 O O . HOH O 9 . ? 1.562 -46.114 19.476 0.50 21.43 ? 615 HOH A O 1 HETATM 3935 O O . HOH O 9 . ? 0.000 -13.555 0.000 0.50 33.60 ? 616 HOH A O 1 HETATM 3936 O O . HOH O 9 . ? -15.954 -37.948 -4.961 0.50 11.66 ? 617 HOH A O 1 HETATM 3937 O O . HOH O 9 . ? -36.400 -27.832 -13.537 0.50 10.38 ? 618 HOH A O 1 HETATM 3938 O O . HOH O 9 . ? -38.411 -20.780 -14.206 1.00 25.09 ? 619 HOH A O 1 HETATM 3939 O O . HOH O 9 . ? -30.278 -33.889 -13.334 1.00 33.30 ? 620 HOH A O 1 HETATM 3940 O O . HOH O 9 . ? -6.658 -11.353 19.859 1.00 35.83 ? 621 HOH A O 1 HETATM 3941 O O . HOH O 9 . ? -4.624 -21.977 -2.774 0.50 9.67 ? 622 HOH A O 1 HETATM 3942 O O . HOH O 9 . ? -6.943 -45.256 10.565 1.00 33.30 ? 623 HOH A O 1 HETATM 3943 O O . HOH O 9 . ? -35.612 -28.741 27.538 1.00 33.04 ? 624 HOH A O 1 HETATM 3944 O O . HOH O 9 . ? -19.506 -41.441 41.851 1.00 37.07 ? 625 HOH A O 1 HETATM 3945 O O . HOH O 9 . ? -29.555 -41.801 25.439 1.00 41.97 ? 626 HOH A O 1 HETATM 3946 O O . HOH O 9 . ? -1.077 -36.139 17.030 1.00 30.83 ? 627 HOH A O 1 HETATM 3947 O O . HOH O 9 . ? 2.237 -38.086 42.193 1.00 24.30 ? 630 HOH A O 1 HETATM 3948 O O . HOH O 9 . ? -26.992 -50.900 15.898 1.00 28.78 ? 631 HOH A O 1 HETATM 3949 O O . HOH O 9 . ? -11.976 -20.677 36.255 1.00 43.66 ? 632 HOH A O 1 HETATM 3950 O O . HOH O 9 . ? -19.496 -11.125 -3.494 1.00 36.99 ? 633 HOH A O 1 HETATM 3951 O O . HOH O 9 . ? -8.744 -46.835 9.901 1.00 32.17 ? 634 HOH A O 1 HETATM 3952 O O . HOH O 9 . ? 3.685 -47.833 34.625 1.00 37.11 ? 635 HOH A O 1 HETATM 3953 O O . HOH O 9 . ? 7.522 -17.971 29.922 1.00 46.33 ? 636 HOH A O 1 HETATM 3954 O O . HOH O 9 . ? -33.670 -8.908 14.915 1.00 36.09 ? 637 HOH A O 1 HETATM 3955 O O . HOH O 9 . ? -15.639 -20.948 -7.451 0.50 10.87 ? 638 HOH A O 1 HETATM 3956 O O . HOH O 9 . ? 4.243 -24.193 36.251 1.00 24.99 ? 639 HOH A O 1 HETATM 3957 O O . HOH O 9 . ? -13.217 -28.857 -8.237 1.00 41.05 ? 640 HOH A O 1 HETATM 3958 O O . HOH O 9 . ? -21.386 -9.566 -5.851 1.00 50.43 ? 641 HOH A O 1 HETATM 3959 O O . HOH O 9 . ? -10.746 -42.951 41.549 1.00 30.11 ? 642 HOH A O 1 HETATM 3960 O O . HOH O 9 . ? -5.776 -21.323 -1.593 0.50 9.18 ? 643 HOH A O 1 HETATM 3961 O O . HOH O 9 . ? -36.918 -12.587 13.956 1.00 37.34 ? 644 HOH A O 1 HETATM 3962 O O . HOH O 9 . ? -40.384 -29.141 4.941 0.50 23.63 ? 645 HOH A O 1 HETATM 3963 O O . HOH O 9 . ? -23.511 -48.447 28.055 0.50 14.48 ? 646 HOH A O 1 HETATM 3964 O O . HOH O 9 . ? -13.878 -24.147 -7.593 0.50 11.49 ? 647 HOH A O 1 HETATM 3965 O O . HOH O 9 . ? -33.941 -30.149 28.951 1.00 42.38 ? 648 HOH A O 1 HETATM 3966 O O . HOH O 9 . ? -20.050 -43.841 41.463 1.00 45.10 ? 649 HOH A O 1 HETATM 3967 O O . HOH O 9 . ? -39.619 -29.379 11.759 0.50 10.91 ? 650 HOH A O 1 HETATM 3968 O O . HOH O 9 . ? -39.874 -21.019 -11.494 1.00 37.66 ? 651 HOH A O 1 HETATM 3969 O O . HOH O 9 . ? -7.544 -6.274 3.193 0.50 16.05 ? 652 HOH A O 1 HETATM 3970 O O . HOH O 9 . ? -27.738 -42.837 27.066 1.00 41.82 ? 653 HOH A O 1 HETATM 3971 O O . HOH O 9 . ? -40.060 -27.675 15.508 1.00 27.81 ? 654 HOH A O 1 HETATM 3972 O O . HOH O 9 . ? 5.679 -20.228 33.593 1.00 43.50 ? 655 HOH A O 1 HETATM 3973 O O . HOH O 9 . ? -27.250 -49.387 18.107 1.00 44.26 ? 656 HOH A O 1 HETATM 3974 O O . HOH O 9 . ? 13.466 -39.212 23.884 1.00 37.85 ? 657 HOH A O 1 HETATM 3975 O O . HOH O 9 . ? -31.243 -32.037 -8.923 1.00 35.23 ? 658 HOH A O 1 HETATM 3976 O O . HOH O 9 . ? -16.588 -10.590 21.411 1.00 25.72 ? 659 HOH A O 1 HETATM 3977 O O . HOH O 9 . ? -37.483 -13.054 11.749 1.00 44.60 ? 660 HOH A O 1 HETATM 3978 O O . HOH O 9 . ? -28.433 -26.878 33.212 1.00 44.41 ? 661 HOH A O 1 HETATM 3979 O O . HOH O 9 . ? -2.690 -50.400 17.530 1.00 29.42 ? 662 HOH A O 1 HETATM 3980 O O . HOH O 9 . ? -8.345 -29.484 -7.092 0.50 25.51 ? 663 HOH A O 1 HETATM 3981 O O . HOH O 9 . ? -27.673 -33.356 38.328 1.00 41.68 ? 664 HOH A O 1 HETATM 3982 O O . HOH O 9 . ? -27.903 -36.533 38.788 1.00 41.79 ? 665 HOH A O 1 HETATM 3983 O O . HOH O 9 . ? -34.449 -35.594 27.129 1.00 37.25 ? 666 HOH A O 1 HETATM 3984 O O . HOH O 9 . ? -15.800 -22.842 -7.841 0.50 12.51 ? 667 HOH A O 1 HETATM 3985 O O . HOH O 9 . ? -13.122 -55.843 23.737 1.00 46.18 ? 668 HOH A O 1 HETATM 3986 O O . HOH O 9 . ? -5.551 -41.830 8.432 1.00 45.84 ? 669 HOH A O 1 HETATM 3987 O O . HOH O 9 . ? -36.995 -31.522 -7.201 0.50 17.05 ? 670 HOH A O 1 HETATM 3988 O O . HOH O 9 . ? -17.296 -33.825 36.402 1.00 32.64 ? 671 HOH A O 1 HETATM 3989 O O . HOH O 9 . ? -33.596 -39.867 27.695 1.00 57.80 ? 672 HOH A O 1 HETATM 3990 O O . HOH O 9 . ? -17.397 -39.706 -4.905 0.50 21.50 ? 673 HOH A O 1 HETATM 3991 O O . HOH O 9 . ? -33.837 -39.738 25.053 1.00 44.51 ? 674 HOH A O 1 HETATM 3992 O O . HOH O 9 . ? -1.793 -5.517 11.435 1.00 33.37 ? 675 HOH A O 1 HETATM 3993 O O . HOH O 9 . ? -6.559 -31.733 17.159 0.50 5.43 ? 676 HOH A O 1 HETATM 3994 O O . HOH O 9 . ? -38.537 -19.342 5.983 0.50 5.83 ? 677 HOH A O 1 HETATM 3995 O O . HOH O 9 . ? -39.310 -23.736 4.699 0.50 4.40 ? 678 HOH A O 1 HETATM 3996 O O . HOH O 9 . ? -10.368 -33.553 21.059 0.50 8.01 ? 679 HOH A O 1 HETATM 3997 O O . HOH O 9 . ? -40.073 -17.172 7.693 0.50 9.38 ? 680 HOH A O 1 HETATM 3998 O O . HOH O 9 . ? -41.386 -15.967 6.768 0.50 21.32 ? 681 HOH A O 1 HETATM 3999 O O . HOH O 9 . ? -22.883 -29.131 -11.766 0.50 18.41 ? 682 HOH A O 1 HETATM 4000 O O . HOH O 9 . ? -37.005 -31.631 -13.476 0.50 5.34 ? 683 HOH A O 1 HETATM 4001 O O . HOH O 9 . ? -30.643 -3.841 14.295 0.50 16.29 ? 684 HOH A O 1 HETATM 4002 O O . HOH O 9 . ? 14.468 -29.179 24.493 1.00 31.94 ? 685 HOH A O 1 HETATM 4003 O O . HOH O 9 . ? -21.794 -21.369 35.132 1.00 29.47 ? 686 HOH A O 1 HETATM 4004 O O . HOH O 9 . ? -16.745 -31.702 40.389 1.00 37.71 ? 687 HOH A O 1 HETATM 4005 O O . HOH O 9 . ? -14.017 -30.102 41.070 1.00 38.07 ? 688 HOH A O 1 HETATM 4006 O O . HOH O 9 . ? -5.158 -25.417 12.003 1.00 43.57 ? 689 HOH A O 1 HETATM 4007 O O . HOH O 9 . ? -24.787 -41.504 -7.366 1.00 44.23 ? 690 HOH A O 1 HETATM 4008 O O . HOH O 9 . ? -2.602 -25.758 -1.011 1.00 45.33 ? 691 HOH A O 1 HETATM 4009 O O . HOH O 9 . ? -6.969 -39.627 9.394 1.00 42.68 ? 692 HOH A O 1 HETATM 4010 O O . HOH O 9 . ? -25.367 -44.283 29.743 1.00 38.95 ? 693 HOH A O 1 HETATM 4011 O O . HOH O 9 . ? -30.350 -41.481 9.765 1.00 52.00 ? 694 HOH A O 1 HETATM 4012 O O . HOH O 9 . ? -36.926 -38.414 6.594 1.00 50.51 ? 695 HOH A O 1 HETATM 4013 O O . HOH O 9 . ? -17.870 -33.519 39.095 0.50 22.24 ? 696 HOH A O 1 HETATM 4014 O O . HOH O 9 . ? -10.349 -39.810 41.965 1.00 34.43 ? 697 HOH A O 1 HETATM 4015 O O . HOH O 9 . ? -10.208 -10.988 21.538 1.00 47.53 ? 698 HOH A O 1 HETATM 4016 O O . HOH O 9 . ? -19.725 -3.303 16.961 0.50 20.76 ? 699 HOH A O 1 HETATM 4017 O O . HOH O 9 . ? -45.215 -15.366 3.004 0.50 20.97 ? 700 HOH A O 1 HETATM 4018 O O . HOH O 9 . ? -4.129 -19.022 0.449 0.50 9.87 ? 701 HOH A O 1 HETATM 4019 O O . HOH O 9 . ? -22.305 -30.823 38.756 0.50 16.38 ? 702 HOH A O 1 HETATM 4020 O O . HOH O 9 . ? -28.231 -36.062 31.414 0.50 25.28 ? 703 HOH A O 1 HETATM 4021 O O . HOH O 9 . ? 0.000 -24.902 0.000 0.50 42.02 ? 704 HOH A O 1 HETATM 4022 O O . HOH O 9 . ? -32.226 -14.468 24.508 0.50 16.92 ? 705 HOH A O 1 HETATM 4023 O O . HOH O 9 . ? -42.263 -22.503 3.920 0.50 17.38 ? 706 HOH A O 1 HETATM 4024 O O . HOH O 9 . ? -13.595 -20.366 -4.923 0.50 10.11 ? 707 HOH A O 1 HETATM 4025 O O . HOH O 9 . ? -8.124 -58.361 21.662 1.00 38.69 ? 708 HOH A O 1 HETATM 4026 O O . HOH O 9 . ? 2.719 -36.325 19.221 1.00 42.42 ? 709 HOH A O 1 HETATM 4027 O O . HOH O 9 . ? -18.106 -13.433 -3.248 0.50 16.93 ? 710 HOH A O 1 HETATM 4028 O O . HOH O 9 . ? -24.274 -54.327 11.232 0.50 10.31 ? 711 HOH A O 1 HETATM 4029 O O . HOH O 9 . ? -17.769 -35.638 40.798 1.00 42.36 ? 712 HOH A O 1 HETATM 4030 O O . HOH O 9 . ? -29.765 -1.754 17.822 1.00 48.36 ? 713 HOH A O 1 HETATM 4031 O O . HOH O 9 . ? -15.577 -55.295 22.834 0.50 22.10 ? 714 HOH A O 1 HETATM 4032 O O . HOH O 9 . ? 16.285 -30.203 32.742 1.00 51.32 ? 715 HOH A O 1 HETATM 4033 O O . HOH O 9 . ? -21.006 -32.598 39.338 0.50 19.78 ? 716 HOH A O 1 HETATM 4034 O O . HOH O 9 . ? 1.482 -54.359 35.673 1.00 51.54 ? 717 HOH A O 1 HETATM 4035 O O . HOH O 9 . ? -11.589 -23.945 -6.237 1.00 40.15 ? 718 HOH A O 1 HETATM 4036 O O . HOH O 9 . ? -26.956 -38.245 10.862 1.00 10.50 ? 719 HOH A O 1 HETATM 4037 O O . HOH O 9 . ? -30.889 -38.425 13.430 1.00 28.17 ? 720 HOH A O 1 HETATM 4038 O O . HOH O 9 . ? 10.772 -20.190 16.452 0.50 21.92 ? 721 HOH A O 1 HETATM 4039 O O . HOH O 9 . ? -0.861 -54.379 38.624 0.50 30.99 ? 722 HOH A O 1 HETATM 4040 O O . HOH O 9 . ? -4.153 -6.867 18.094 0.50 13.91 ? 723 HOH A O 1 HETATM 4041 O O . HOH O 9 . ? -4.330 -5.017 17.022 0.50 16.14 ? 724 HOH A O 1 HETATM 4042 O O . HOH O 9 . ? -13.195 -40.186 -1.794 1.00 39.59 ? 725 HOH A O 1 HETATM 4043 O O . HOH O 9 . ? -14.457 -18.905 36.510 1.00 43.48 ? 726 HOH A O 1 HETATM 4044 O O . HOH O 9 . ? 4.674 -46.376 24.802 0.50 22.60 ? 727 HOH A O 1 HETATM 4045 O O . HOH O 9 . ? 1.913 -50.309 22.758 0.50 28.32 ? 728 HOH A O 1 HETATM 4046 O O . HOH O 9 . ? -4.213 -8.396 19.913 0.50 23.08 ? 729 HOH A O 1 HETATM 4047 O O . HOH O 9 . ? -3.470 -4.547 15.360 0.50 15.25 ? 730 HOH A O 1 HETATM 4048 O O . HOH O 9 . ? -2.388 -36.180 21.184 0.50 2.00 ? 731 HOH A O 1 HETATM 4049 O O . HOH O 9 . ? -32.906 -40.201 6.485 1.00 32.32 ? 732 HOH A O 1 HETATM 4050 O O . HOH O 9 . ? -13.531 -37.773 -2.919 1.00 52.32 ? 733 HOH A O 1 HETATM 4051 O O . HOH O 9 . ? -8.782 -4.931 3.349 0.50 5.73 ? 734 HOH A O 1 HETATM 4052 O O . HOH O 9 . ? -23.952 -46.909 10.546 0.50 4.68 ? 735 HOH A O 1 HETATM 4053 O O . HOH O 9 . ? -16.694 -53.447 19.184 0.50 18.28 ? 736 HOH A O 1 HETATM 4054 O O . HOH O 9 . ? -18.060 -53.801 20.112 0.50 13.83 ? 737 HOH A O 1 HETATM 4055 O O . HOH O 9 . ? 10.581 -21.460 18.446 1.00 33.81 ? 738 HOH A O 1 HETATM 4056 O O . HOH O 9 . ? -8.747 -53.405 1.826 1.00 53.96 ? 739 HOH A O 1 HETATM 4057 O O . HOH O 9 . ? -24.422 -38.229 -9.164 0.50 6.91 ? 740 HOH A O 1 HETATM 4058 O O . HOH O 9 . ? 6.164 -14.786 20.205 1.00 34.89 ? 741 HOH A O 1 HETATM 4059 O O . HOH O 9 . ? -2.699 -17.598 10.733 1.00 12.29 ? 742 HOH A O 1 HETATM 4060 O O . HOH O 9 . ? -33.284 -17.225 11.372 1.00 14.76 ? 743 HOH A O 1 HETATM 4061 O O . HOH O 9 . ? -9.064 -16.813 -0.554 1.00 16.95 ? 744 HOH A O 1 HETATM 4062 O O . HOH O 9 . ? -22.167 -12.990 23.385 1.00 17.91 ? 745 HOH A O 1 HETATM 4063 O O . HOH O 9 . ? -3.682 -53.602 34.805 1.00 27.30 ? 746 HOH A O 1 HETATM 4064 O O . HOH O 9 . ? -5.139 -18.577 12.220 1.00 9.04 ? 747 HOH A O 1 HETATM 4065 O O . HOH O 9 . ? -31.986 -36.564 17.041 1.00 22.26 ? 748 HOH A O 1 HETATM 4066 O O . HOH O 9 . ? -36.535 -15.368 10.750 1.00 16.03 ? 749 HOH A O 1 HETATM 4067 O O . HOH O 9 . ? -20.990 -35.440 21.343 1.00 10.76 ? 750 HOH A O 1 HETATM 4068 O O . HOH O 9 . ? -19.846 -22.215 -2.313 1.00 14.82 ? 751 HOH A O 1 HETATM 4069 O O . HOH O 9 . ? -2.730 -27.761 12.987 1.00 13.66 ? 752 HOH A O 1 HETATM 4070 O O . HOH O 9 . ? -17.613 -23.961 -9.117 1.00 26.88 ? 753 HOH A O 1 HETATM 4071 O O . HOH O 9 . ? -6.270 -23.346 19.311 1.00 13.16 ? 754 HOH A O 1 HETATM 4072 O O . HOH O 9 . ? -19.626 -20.126 33.881 1.00 23.18 ? 755 HOH A O 1 HETATM 4073 O O . HOH O 9 . ? -7.232 -35.258 9.895 1.00 14.14 ? 756 HOH A O 1 HETATM 4074 O O . HOH O 9 . ? -24.296 -37.868 0.563 1.00 13.08 ? 757 HOH A O 1 HETATM 4075 O O . HOH O 9 . ? -21.575 -38.021 22.531 1.00 7.53 ? 758 HOH A O 1 HETATM 4076 O O . HOH O 9 . ? -28.067 -27.577 17.879 1.00 7.54 ? 759 HOH A O 1 HETATM 4077 O O . HOH O 9 . ? -30.592 -20.586 29.799 1.00 15.17 ? 760 HOH A O 1 HETATM 4078 O O . HOH O 9 . ? -36.885 -35.115 21.136 1.00 18.29 ? 761 HOH A O 1 HETATM 4079 O O . HOH O 9 . ? 9.964 -25.553 37.344 1.00 28.05 ? 762 HOH A O 1 HETATM 4080 O O . HOH O 9 . ? -30.774 -33.487 2.742 1.00 6.68 ? 763 HOH A O 1 HETATM 4081 O O . HOH O 9 . ? -17.814 -33.279 -14.485 1.00 27.14 ? 764 HOH A O 1 HETATM 4082 O O . HOH O 9 . ? -19.863 -18.919 27.238 1.00 10.68 ? 765 HOH A O 1 HETATM 4083 O O . HOH O 9 . ? 2.658 -44.669 26.500 1.00 19.37 ? 766 HOH A O 1 HETATM 4084 O O . HOH O 9 . ? -27.602 -28.692 10.339 1.00 9.90 ? 767 HOH A O 1 HETATM 4085 O O . HOH O 9 . ? -29.351 -14.612 -5.950 1.00 13.11 ? 768 HOH A O 1 HETATM 4086 O O . HOH O 9 . ? 12.769 -38.216 29.900 1.00 24.56 ? 769 HOH A O 1 HETATM 4087 O O . HOH O 9 . ? -20.134 -36.117 7.550 1.00 9.29 ? 770 HOH A O 1 HETATM 4088 O O . HOH O 9 . ? -10.322 -48.330 2.239 1.00 34.64 ? 771 HOH A O 1 HETATM 4089 O O . HOH O 9 . ? -4.775 -26.933 26.722 1.00 9.27 ? 772 HOH A O 1 HETATM 4090 O O . HOH O 9 . ? -26.143 -23.386 -12.321 1.00 13.06 ? 773 HOH A O 1 HETATM 4091 O O . HOH O 9 . ? -29.681 -27.104 9.163 1.00 8.94 ? 774 HOH A O 1 HETATM 4092 O O . HOH O 9 . ? -11.664 -6.140 8.408 1.00 25.15 ? 775 HOH A O 1 HETATM 4093 O O . HOH O 9 . ? -21.781 -28.117 22.787 1.00 7.98 ? 776 HOH A O 1 HETATM 4094 O O . HOH O 9 . ? -29.542 -34.182 -4.987 1.00 15.44 ? 777 HOH A O 1 HETATM 4095 O O . HOH O 9 . ? -19.715 -46.207 39.338 1.00 29.12 ? 778 HOH A O 1 HETATM 4096 O O . HOH O 9 . ? -16.815 -29.386 -1.793 1.00 9.94 ? 779 HOH A O 1 HETATM 4097 O O . HOH O 9 . ? -18.353 -28.884 2.181 1.00 8.37 ? 780 HOH A O 1 HETATM 4098 O O . HOH O 9 . ? -23.816 -25.576 31.119 1.00 13.86 ? 781 HOH A O 1 HETATM 4099 O O . HOH O 9 . ? 4.184 -14.043 9.744 1.00 31.54 ? 782 HOH A O 1 HETATM 4100 O O . HOH O 9 . ? 0.719 -44.193 19.312 0.50 13.65 ? 783 HOH A O 1 HETATM 4101 O O . HOH O 9 . ? 13.310 -29.019 34.827 1.00 40.93 ? 784 HOH A O 1 HETATM 4102 O O . HOH O 9 . ? -34.357 -28.123 22.542 1.00 17.60 ? 785 HOH A O 1 HETATM 4103 O O . HOH O 9 . ? -0.658 -38.168 22.682 1.00 29.23 ? 786 HOH A O 1 HETATM 4104 O O . HOH O 9 . ? -38.697 -19.888 10.839 1.00 15.66 ? 787 HOH A O 1 HETATM 4105 O O . HOH O 9 . ? -0.327 -18.221 33.737 1.00 17.63 ? 788 HOH A O 1 HETATM 4106 O O . HOH O 9 . ? -18.919 -7.335 19.204 1.00 13.03 ? 789 HOH A O 1 HETATM 4107 O O . HOH O 9 . ? -14.102 -34.651 3.372 1.00 13.85 ? 790 HOH A O 1 HETATM 4108 O O . HOH O 9 . ? -5.482 -25.726 32.728 1.00 13.37 ? 791 HOH A O 1 HETATM 4109 O O . HOH O 9 . ? -0.639 -42.893 21.258 1.00 15.82 ? 792 HOH A O 1 HETATM 4110 O O . HOH O 9 . ? -20.119 -47.510 7.182 1.00 14.75 ? 793 HOH A O 1 HETATM 4111 O O . HOH O 9 . ? -32.232 -40.123 22.965 1.00 27.70 ? 794 HOH A O 1 HETATM 4112 O O . HOH O 9 . ? -17.363 -54.395 5.999 1.00 34.95 ? 795 HOH A O 1 HETATM 4113 O O . HOH O 9 . ? -21.168 -25.567 21.642 1.00 9.15 ? 796 HOH A O 1 HETATM 4114 O O . HOH O 9 . ? -27.278 -40.979 12.053 1.00 15.37 ? 797 HOH A O 1 HETATM 4115 O O . HOH O 9 . ? -41.043 -28.171 11.013 0.50 9.33 ? 798 HOH A O 1 HETATM 4116 O O . HOH O 9 . ? -24.165 -11.065 22.990 1.00 15.55 ? 799 HOH A O 1 HETATM 4117 O O . HOH O 9 . ? -33.705 -6.498 8.720 1.00 28.83 ? 800 HOH A O 1 HETATM 4118 O O . HOH O 9 . ? -18.246 -47.411 19.259 1.00 15.72 ? 801 HOH A O 1 HETATM 4119 O O . HOH O 9 . ? -27.053 -38.053 -5.239 1.00 12.35 ? 802 HOH A O 1 HETATM 4120 O O . HOH O 9 . ? -8.010 -7.938 16.688 1.00 20.62 ? 803 HOH A O 1 HETATM 4121 O O . HOH O 9 . ? -34.416 -25.074 12.716 1.00 27.02 ? 804 HOH A O 1 HETATM 4122 O O . HOH O 9 . ? -11.045 -25.440 39.869 1.00 33.20 ? 805 HOH A O 1 HETATM 4123 O O . HOH O 9 . ? -10.054 -31.453 41.857 1.00 23.34 ? 806 HOH A O 1 HETATM 4124 O O . HOH O 9 . ? -30.980 -25.132 13.062 1.00 13.10 ? 807 HOH A O 1 HETATM 4125 O O . HOH O 9 . ? -4.574 -25.597 17.039 1.00 9.72 ? 808 HOH A O 1 HETATM 4126 O O . HOH O 9 . ? -21.038 -11.710 -1.262 1.00 15.18 ? 809 HOH A O 1 HETATM 4127 O O . HOH O 9 . ? 10.677 -39.790 23.187 1.00 39.26 ? 810 HOH A O 1 HETATM 4128 O O . HOH O 9 . ? 3.907 -41.462 33.432 1.00 17.96 ? 811 HOH A O 1 HETATM 4129 O O . HOH O 9 . ? -9.498 -48.687 37.276 1.00 22.16 ? 812 HOH A O 1 HETATM 4130 O O . HOH O 9 . ? -18.997 -32.959 2.880 1.00 8.15 ? 813 HOH A O 1 HETATM 4131 O O . HOH O 9 . ? -17.863 -31.484 -0.207 1.00 9.76 ? 814 HOH A O 1 HETATM 4132 O O . HOH O 9 . ? -20.620 -39.405 16.172 1.00 9.13 ? 815 HOH A O 1 HETATM 4133 O O . HOH O 9 . ? -36.778 -30.174 3.015 1.00 9.28 ? 816 HOH A O 1 HETATM 4134 O O . HOH O 9 . ? -24.353 -10.240 -2.102 1.00 16.13 ? 817 HOH A O 1 HETATM 4135 O O . HOH O 9 . ? -16.921 -41.050 42.721 1.00 36.83 ? 818 HOH A O 1 HETATM 4136 O O . HOH O 9 . ? -28.167 -34.855 -14.039 1.00 25.25 ? 819 HOH A O 1 HETATM 4137 O O . HOH O 9 . ? -11.914 -44.347 7.375 1.00 12.60 ? 820 HOH A O 1 HETATM 4138 O O . HOH O 9 . ? -33.618 -36.225 -1.881 1.00 13.94 ? 821 HOH A O 1 HETATM 4139 O O . HOH O 9 . ? -11.513 -17.148 25.923 1.00 12.80 ? 822 HOH A O 1 HETATM 4140 O O . HOH O 9 . ? -4.284 -23.580 34.958 1.00 20.69 ? 823 HOH A O 1 HETATM 4141 O O . HOH O 9 . ? 3.843 -33.769 20.491 1.00 21.41 ? 824 HOH A O 1 HETATM 4142 O O . HOH O 9 . ? 0.330 -22.615 4.648 1.00 21.14 ? 825 HOH A O 1 HETATM 4143 O O . HOH O 9 . ? -35.885 -10.181 14.188 1.00 26.92 ? 826 HOH A O 1 HETATM 4144 O O . HOH O 9 . ? -13.019 -32.280 4.459 1.00 17.14 ? 827 HOH A O 1 HETATM 4145 O O . HOH O 9 . ? -4.813 -51.846 17.683 1.00 33.00 ? 828 HOH A O 1 HETATM 4146 O O . HOH O 9 . ? -9.189 -37.104 11.062 1.00 20.16 ? 829 HOH A O 1 HETATM 4147 O O . HOH O 9 . ? -13.519 -27.659 36.569 1.00 22.72 ? 830 HOH A O 1 HETATM 4148 O O . HOH O 9 . ? -38.957 -31.514 10.377 0.50 14.38 ? 831 HOH A O 1 HETATM 4149 O O . HOH O 9 . ? -25.866 -34.279 31.714 1.00 22.61 ? 832 HOH A O 1 HETATM 4150 O O . HOH O 9 . ? -12.722 -23.932 -2.644 1.00 17.34 ? 833 HOH A O 1 HETATM 4151 O O . HOH O 9 . ? -21.995 -50.532 25.622 0.50 23.17 ? 834 HOH A O 1 HETATM 4152 O O . HOH O 9 . ? -5.146 -21.945 15.481 1.00 11.02 ? 835 HOH A O 1 HETATM 4153 O O . HOH O 9 . ? 4.603 -20.443 31.067 1.00 17.26 ? 836 HOH A O 1 HETATM 4154 O O . HOH O 9 . ? 14.560 -31.494 23.449 1.00 34.27 ? 837 HOH A O 1 HETATM 4155 O O . HOH O 9 . ? -33.544 -15.919 24.747 0.50 4.35 ? 838 HOH A O 1 HETATM 4156 O O . HOH O 9 . ? -35.285 -37.349 25.470 1.00 37.80 ? 839 HOH A O 1 HETATM 4157 O O . HOH O 9 . ? -10.202 -46.313 4.561 1.00 24.24 ? 840 HOH A O 1 HETATM 4158 O O . HOH O 9 . ? 0.171 -32.969 39.393 1.00 12.76 ? 841 HOH A O 1 HETATM 4159 O O . HOH O 9 . ? -10.709 -51.762 10.528 1.00 23.76 ? 842 HOH A O 1 HETATM 4160 O O . HOH O 9 . ? 0.484 -15.003 21.200 1.00 15.84 ? 843 HOH A O 1 HETATM 4161 O O . HOH O 9 . ? -28.074 -29.945 -7.062 1.00 22.30 ? 844 HOH A O 1 HETATM 4162 O O . HOH O 9 . ? -1.365 -39.039 41.125 1.00 16.46 ? 845 HOH A O 1 HETATM 4163 O O . HOH O 9 . ? -29.723 -32.341 -7.071 1.00 25.15 ? 846 HOH A O 1 HETATM 4164 O O . HOH O 9 . ? 1.027 -13.039 19.387 1.00 20.50 ? 847 HOH A O 1 HETATM 4165 O O . HOH O 9 . ? -10.876 -33.501 22.904 0.50 7.79 ? 848 HOH A O 1 HETATM 4166 O O . HOH O 9 . ? -26.214 -45.266 23.247 1.00 32.35 ? 849 HOH A O 1 HETATM 4167 O O . HOH O 9 . ? -24.880 -38.881 34.981 1.00 23.45 ? 850 HOH A O 1 HETATM 4168 O O . HOH O 9 . ? -24.934 -40.445 24.236 1.00 22.54 ? 851 HOH A O 1 HETATM 4169 O O . HOH O 9 . ? -18.965 -12.682 0.386 1.00 20.69 ? 852 HOH A O 1 HETATM 4170 O O . HOH O 9 . ? -15.897 -23.222 36.886 1.00 37.92 ? 853 HOH A O 1 HETATM 4171 O O . HOH O 9 . ? -23.860 -49.894 29.747 0.50 13.73 ? 854 HOH A O 1 HETATM 4172 O O . HOH O 9 . ? 9.030 -21.148 32.228 1.00 25.91 ? 855 HOH A O 1 HETATM 4173 O O . HOH O 9 . ? -4.855 -26.999 23.887 1.00 13.49 ? 856 HOH A O 1 HETATM 4174 O O . HOH O 9 . ? -27.473 -42.458 6.099 1.00 33.87 ? 857 HOH A O 1 HETATM 4175 O O . HOH O 9 . ? -15.645 -34.535 -1.697 1.00 17.83 ? 858 HOH A O 1 HETATM 4176 O O . HOH O 9 . ? -37.409 -32.328 -0.281 1.00 16.87 ? 859 HOH A O 1 HETATM 4177 O O . HOH O 9 . ? -14.922 -36.291 -5.372 0.50 15.49 ? 860 HOH A O 1 HETATM 4178 O O . HOH O 9 . ? -46.244 -27.360 1.724 1.00 52.76 ? 861 HOH A O 1 HETATM 4179 O O . HOH O 9 . ? -20.042 -38.422 -4.265 1.00 14.36 ? 862 HOH A O 1 HETATM 4180 O O . HOH O 9 . ? -21.083 -40.348 13.507 1.00 14.16 ? 863 HOH A O 1 HETATM 4181 O O . HOH O 9 . ? -9.209 -22.424 19.664 1.00 26.89 ? 864 HOH A O 1 HETATM 4182 O O . HOH O 9 . ? -24.893 -30.522 31.495 1.00 21.22 ? 865 HOH A O 1 HETATM 4183 O O . HOH O 9 . ? -16.154 -14.550 23.570 1.00 15.99 ? 866 HOH A O 1 HETATM 4184 O O . HOH O 9 . ? -15.497 -36.083 39.792 1.00 31.99 ? 867 HOH A O 1 HETATM 4185 O O . HOH O 9 . ? -25.732 -42.703 13.329 1.00 14.95 ? 868 HOH A O 1 HETATM 4186 O O . HOH O 9 . ? -7.891 -30.146 18.880 1.00 33.56 ? 869 HOH A O 1 HETATM 4187 O O . HOH O 9 . ? -23.888 -39.488 -1.523 1.00 12.02 ? 870 HOH A O 1 HETATM 4188 O O . HOH O 9 . ? -5.661 -17.252 31.018 1.00 27.53 ? 871 HOH A O 1 HETATM 4189 O O . HOH O 9 . ? 4.623 -42.037 21.686 1.00 41.80 ? 872 HOH A O 1 HETATM 4190 O O . HOH O 9 . ? 8.931 -32.643 24.610 1.00 19.41 ? 873 HOH A O 1 HETATM 4191 O O . HOH O 9 . ? -27.818 -12.315 -6.782 1.00 18.25 ? 874 HOH A O 1 HETATM 4192 O O . HOH O 9 . ? -6.000 -13.926 23.988 1.00 22.85 ? 875 HOH A O 1 HETATM 4193 O O . HOH O 9 . ? -8.163 -36.836 44.278 1.00 23.73 ? 876 HOH A O 1 HETATM 4194 O O . HOH O 9 . ? -20.630 -21.664 -7.666 1.00 15.32 ? 877 HOH A O 1 HETATM 4195 O O . HOH O 9 . ? -26.126 -10.772 25.113 1.00 33.54 ? 878 HOH A O 1 HETATM 4196 O O . HOH O 9 . ? -32.537 -8.869 17.996 1.00 27.67 ? 879 HOH A O 1 HETATM 4197 O O . HOH O 9 . ? -36.862 -22.211 26.900 1.00 33.63 ? 880 HOH A O 1 HETATM 4198 O O . HOH O 9 . ? -12.479 -25.625 34.739 1.00 24.95 ? 881 HOH A O 1 HETATM 4199 O O . HOH O 9 . ? -11.203 -56.925 18.371 1.00 26.91 ? 882 HOH A O 1 HETATM 4200 O O . HOH O 9 . ? -0.689 -34.335 41.721 1.00 16.60 ? 883 HOH A O 1 HETATM 4201 O O . HOH O 9 . ? -29.263 -29.937 -10.977 1.00 38.81 ? 884 HOH A O 1 HETATM 4202 O O . HOH O 9 . ? -31.120 -24.459 30.170 1.00 21.49 ? 885 HOH A O 1 HETATM 4203 O O . HOH O 9 . ? -5.549 -37.163 9.102 1.00 39.71 ? 886 HOH A O 1 HETATM 4204 O O . HOH O 9 . ? -20.645 -13.787 2.013 1.00 12.64 ? 887 HOH A O 1 HETATM 4205 O O . HOH O 9 . ? -9.225 -37.117 6.806 1.00 14.86 ? 888 HOH A O 1 HETATM 4206 O O . HOH O 9 . ? -39.975 -28.506 18.024 1.00 26.89 ? 889 HOH A O 1 HETATM 4207 O O . HOH O 9 . ? -29.636 -14.222 23.585 1.00 28.13 ? 890 HOH A O 1 HETATM 4208 O O . HOH O 9 . ? -5.110 -32.341 13.146 1.00 20.61 ? 891 HOH A O 1 HETATM 4209 O O . HOH O 9 . ? -28.407 -21.970 -11.634 1.00 21.28 ? 892 HOH A O 1 HETATM 4210 O O . HOH O 9 . ? 10.603 -41.634 35.533 1.00 34.39 ? 893 HOH A O 1 HETATM 4211 O O . HOH O 9 . ? 7.833 -38.114 38.370 1.00 25.40 ? 894 HOH A O 1 HETATM 4212 O O . HOH O 9 . ? -23.923 -42.183 28.872 1.00 20.72 ? 895 HOH A O 1 HETATM 4213 O O . HOH O 9 . ? -23.051 -25.422 33.758 1.00 22.79 ? 896 HOH A O 1 HETATM 4214 O O . HOH O 9 . ? -16.521 -30.665 2.037 1.00 7.96 ? 897 HOH A O 1 HETATM 4215 O O . HOH O 9 . ? 14.205 -25.501 31.919 1.00 30.62 ? 898 HOH A O 1 HETATM 4216 O O . HOH O 9 . ? -17.820 -13.038 25.162 1.00 17.37 ? 899 HOH A O 1 HETATM 4217 O O . HOH O 9 . ? -37.043 -9.638 21.612 1.00 33.89 ? 900 HOH A O 1 HETATM 4218 O O . HOH O 9 . ? -26.334 -39.082 -7.494 1.00 32.04 ? 901 HOH A O 1 HETATM 4219 O O . HOH O 9 . ? -31.997 -5.925 12.862 1.00 29.48 ? 902 HOH A O 1 HETATM 4220 O O . HOH O 9 . ? -24.963 -48.981 22.555 1.00 26.05 ? 903 HOH A O 1 HETATM 4221 O O . HOH O 9 . ? 13.371 -27.381 20.122 1.00 26.23 ? 904 HOH A O 1 HETATM 4222 O O . HOH O 9 . ? -16.301 -32.586 3.938 1.00 12.97 ? 905 HOH A O 1 HETATM 4223 O O . HOH O 9 . ? 6.313 -46.834 25.073 0.50 10.40 ? 906 HOH A O 1 HETATM 4224 O O . HOH O 9 . ? 0.810 -34.396 15.262 0.50 22.29 ? 907 HOH A O 1 HETATM 4225 O O . HOH O 9 . ? -20.453 -7.687 6.037 1.00 29.28 ? 908 HOH A O 1 HETATM 4226 O O . HOH O 9 . ? 2.574 -32.376 8.554 1.00 38.21 ? 909 HOH A O 1 HETATM 4227 O O . HOH O 9 . ? -25.606 -40.424 27.115 1.00 23.77 ? 910 HOH A O 1 HETATM 4228 O O . HOH O 9 . ? -8.218 -13.443 18.528 1.00 18.55 ? 911 HOH A O 1 HETATM 4229 O O . HOH O 9 . ? -4.128 -23.857 13.832 1.00 25.35 ? 912 HOH A O 1 HETATM 4230 O O . HOH O 9 . ? 0.966 -18.757 36.233 1.00 26.12 ? 913 HOH A O 1 HETATM 4231 O O . HOH O 9 . ? -2.675 -51.803 38.133 1.00 36.23 ? 914 HOH A O 1 HETATM 4232 O O . HOH O 9 . ? -20.518 -20.620 -10.409 1.00 31.62 ? 915 HOH A O 1 HETATM 4233 O O . HOH O 9 . ? -16.128 -34.664 1.232 1.00 15.60 ? 916 HOH A O 1 HETATM 4234 O O . HOH O 9 . ? 4.296 -45.266 34.106 1.00 35.56 ? 917 HOH A O 1 HETATM 4235 O O . HOH O 9 . ? -16.006 -5.321 12.003 1.00 39.21 ? 918 HOH A O 1 HETATM 4236 O O . HOH O 9 . ? 7.275 -30.389 41.844 1.00 40.28 ? 919 HOH A O 1 HETATM 4237 O O . HOH O 9 . ? -4.217 -53.365 28.361 1.00 31.71 ? 920 HOH A O 1 HETATM 4238 O O . HOH O 9 . ? -32.596 -7.157 20.045 1.00 35.12 ? 921 HOH A O 1 HETATM 4239 O O . HOH O 9 . ? 5.357 -39.761 41.034 1.00 39.01 ? 922 HOH A O 1 HETATM 4240 O O . HOH O 9 . ? -11.123 -14.603 25.425 1.00 39.50 ? 923 HOH A O 1 HETATM 4241 O O . HOH O 9 . ? -0.024 -25.085 3.128 1.00 23.23 ? 924 HOH A O 1 HETATM 4242 O O . HOH O 9 . ? -24.126 -51.284 18.882 1.00 33.84 ? 925 HOH A O 1 HETATM 4243 O O . HOH O 9 . ? -24.559 -1.863 11.539 1.00 43.18 ? 926 HOH A O 1 HETATM 4244 O O . HOH O 9 . ? 8.193 -32.383 19.960 1.00 42.75 ? 927 HOH A O 1 HETATM 4245 O O . HOH O 9 . ? -22.416 -9.760 2.289 1.00 27.43 ? 928 HOH A O 1 HETATM 4246 O O . HOH O 9 . ? -22.029 -18.117 33.986 1.00 36.42 ? 929 HOH A O 1 HETATM 4247 O O . HOH O 9 . ? -28.375 -5.465 20.646 1.00 26.47 ? 930 HOH A O 1 HETATM 4248 O O . HOH O 9 . ? -3.691 -52.980 22.649 1.00 22.49 ? 931 HOH A O 1 HETATM 4249 O O . HOH O 9 . ? -25.883 -19.000 31.544 1.00 33.94 ? 932 HOH A O 1 HETATM 4250 O O . HOH O 9 . ? -25.137 -42.772 32.676 1.00 34.49 ? 933 HOH A O 1 HETATM 4251 O O . HOH O 9 . ? 5.044 -13.079 12.147 1.00 35.48 ? 934 HOH A O 1 HETATM 4252 O O . HOH O 9 . ? 13.383 -27.748 16.925 1.00 31.49 ? 935 HOH A O 1 HETATM 4253 O O . HOH O 9 . ? -41.140 -26.344 19.767 1.00 33.92 ? 936 HOH A O 1 HETATM 4254 O O . HOH O 9 . ? 13.091 -30.657 28.037 1.00 31.80 ? 937 HOH A O 1 HETATM 4255 O O . HOH O 9 . ? -5.693 -29.680 -0.483 1.00 29.14 ? 938 HOH A O 1 HETATM 4256 O O . HOH O 9 . ? -39.906 -24.190 7.880 1.00 19.11 ? 939 HOH A O 1 HETATM 4257 O O . HOH O 9 . ? -13.429 -34.195 -3.212 1.00 34.59 ? 940 HOH A O 1 HETATM 4258 O O . HOH O 9 . ? -13.819 -53.810 33.705 1.00 26.10 ? 941 HOH A O 1 HETATM 4259 O O . HOH O 9 . ? -22.263 -9.053 -0.878 1.00 37.77 ? 942 HOH A O 1 HETATM 4260 O O . HOH O 9 . ? 5.744 -46.742 36.824 1.00 41.82 ? 943 HOH A O 1 HETATM 4261 O O . HOH O 9 . ? -9.648 -48.987 10.857 1.00 38.58 ? 944 HOH A O 1 HETATM 4262 O O . HOH O 9 . ? -39.100 -16.386 22.043 1.00 25.30 ? 945 HOH A O 1 HETATM 4263 O O . HOH O 9 . ? 14.518 -19.512 27.313 1.00 26.33 ? 946 HOH A O 1 HETATM 4264 O O . HOH O 9 . ? -6.696 -27.815 -1.298 1.00 14.51 ? 947 HOH A O 1 HETATM 4265 O O . HOH O 9 . ? 9.750 -35.422 19.695 1.00 38.84 ? 948 HOH A O 1 HETATM 4266 O O . HOH O 9 . ? -0.506 -35.155 3.120 1.00 24.30 ? 949 HOH A O 1 HETATM 4267 O O . HOH O 9 . ? -38.409 -26.766 26.833 1.00 37.96 ? 950 HOH A O 1 HETATM 4268 O O . HOH O 9 . ? -15.814 -13.378 32.025 1.00 31.05 ? 951 HOH A O 1 HETATM 4269 O O . HOH O 9 . ? -23.254 -43.689 26.311 1.00 31.28 ? 952 HOH A O 1 HETATM 4270 O O . HOH O 9 . ? -9.960 -13.560 20.705 1.00 30.51 ? 953 HOH A O 1 HETATM 4271 O O . HOH O 9 . ? -12.066 -22.183 -4.634 1.00 34.42 ? 954 HOH A O 1 HETATM 4272 O O . HOH O 9 . ? -35.052 -25.859 28.732 1.00 27.75 ? 955 HOH A O 1 HETATM 4273 O O . HOH O 9 . ? -13.912 -34.479 42.040 1.00 33.24 ? 956 HOH A O 1 HETATM 4274 O O . HOH O 9 . ? -33.925 -12.409 22.669 1.00 20.13 ? 957 HOH A O 1 HETATM 4275 O O . HOH O 9 . ? -3.539 0.388 15.762 1.00 29.61 ? 958 HOH A O 1 HETATM 4276 O O . HOH O 9 . ? 2.656 -9.979 12.996 1.00 34.17 ? 959 HOH A O 1 HETATM 4277 O O . HOH O 9 . ? 0.447 -40.271 21.475 1.00 31.15 ? 960 HOH A O 1 HETATM 4278 O O . HOH O 9 . ? -28.961 -19.113 -13.273 1.00 36.39 ? 961 HOH A O 1 HETATM 4279 O O . HOH O 9 . ? -12.370 -12.448 26.288 1.00 52.09 ? 962 HOH A O 1 HETATM 4280 O O . HOH O 9 . ? -19.861 -48.974 30.597 1.00 26.15 ? 963 HOH A O 1 HETATM 4281 O O . HOH O 9 . ? -29.948 -4.416 18.261 1.00 36.12 ? 964 HOH A O 1 HETATM 4282 O O . HOH O 9 . ? -27.672 -46.735 15.981 1.00 42.38 ? 965 HOH A O 1 HETATM 4283 O O . HOH O 9 . ? -15.576 -49.667 33.618 1.00 23.65 ? 966 HOH A O 1 HETATM 4284 O O . HOH O 9 . ? -45.059 -21.902 -3.653 1.00 31.08 ? 967 HOH A O 1 HETATM 4285 O O . HOH O 9 . ? -16.144 -26.369 37.407 1.00 26.38 ? 968 HOH A O 1 HETATM 4286 O O . HOH O 9 . ? -18.809 -55.094 15.966 1.00 37.00 ? 969 HOH A O 1 HETATM 4287 O O . HOH O 9 . ? -10.265 -52.815 39.212 1.00 34.25 ? 970 HOH A O 1 HETATM 4288 O O . HOH O 9 . ? -15.445 -34.724 -8.044 1.00 30.91 ? 971 HOH A O 1 HETATM 4289 O O . HOH O 9 . ? 6.063 -35.712 20.601 1.00 32.49 ? 972 HOH A O 1 HETATM 4290 O O . HOH O 9 . ? 1.189 -30.488 39.479 1.00 22.64 ? 973 HOH A O 1 HETATM 4291 O O . HOH O 9 . ? -35.510 -7.597 18.130 1.00 33.47 ? 974 HOH A O 1 HETATM 4292 O O . HOH O 9 . ? -1.510 -51.453 42.588 1.00 36.81 ? 975 HOH A O 1 HETATM 4293 O O . HOH O 9 . ? 10.026 -16.710 14.170 1.00 46.36 ? 976 HOH A O 1 HETATM 4294 O O . HOH O 9 . ? 5.286 -30.395 3.986 1.00 35.44 ? 977 HOH A O 1 HETATM 4295 O O . HOH O 9 . ? -16.831 -39.772 39.714 1.00 26.66 ? 978 HOH A O 1 HETATM 4296 O O . HOH O 9 . ? -18.663 -52.863 25.346 1.00 37.73 ? 979 HOH A O 1 HETATM 4297 O O . HOH O 9 . ? -44.817 -29.093 0.283 1.00 45.73 ? 980 HOH A O 1 HETATM 4298 O O . HOH O 9 . ? -39.865 -22.925 -9.000 1.00 32.97 ? 981 HOH A O 1 HETATM 4299 O O . HOH O 9 . ? 11.987 -34.832 34.618 1.00 24.97 ? 982 HOH A O 1 HETATM 4300 O O . HOH O 9 . ? 9.268 -45.019 26.065 1.00 41.13 ? 983 HOH A O 1 HETATM 4301 O O . HOH O 9 . ? 11.201 -22.229 13.339 1.00 45.74 ? 984 HOH A O 1 HETATM 4302 O O . HOH O 9 . ? -21.240 -39.702 -2.199 1.00 19.17 ? 985 HOH A O 1 HETATM 4303 O O . HOH O 9 . ? -1.630 -20.642 38.869 0.50 16.88 ? 986 HOH A O 1 HETATM 4304 O O . HOH O 9 . ? -9.383 -4.596 17.936 1.00 27.12 ? 987 HOH A O 1 HETATM 4305 O O . HOH O 9 . ? -19.097 -38.072 41.272 1.00 43.60 ? 988 HOH A O 1 HETATM 4306 O O . HOH O 9 . ? -3.961 -43.039 11.850 1.00 48.56 ? 989 HOH A O 1 HETATM 4307 O O . HOH O 9 . ? -1.373 -6.097 17.124 0.50 13.92 ? 990 HOH A O 1 HETATM 4308 O O . HOH O 9 . ? -15.354 -53.802 36.198 1.00 41.22 ? 991 HOH A O 1 HETATM 4309 O O . HOH O 9 . ? -36.932 -17.161 3.272 1.00 29.62 ? 992 HOH A O 1 HETATM 4310 O O . HOH O 9 . ? -10.579 -3.112 6.567 1.00 34.86 ? 993 HOH A O 1 HETATM 4311 O O . HOH O 9 . ? 3.456 -15.196 27.328 1.00 33.98 ? 994 HOH A O 1 HETATM 4312 O O . HOH O 9 . ? -13.257 -33.074 -8.285 1.00 33.71 ? 995 HOH A O 1 HETATM 4313 O O . HOH O 9 . ? -11.207 -26.198 -5.200 1.00 36.66 ? 996 HOH A O 1 HETATM 4314 O O . HOH O 9 . ? -44.113 -21.826 25.579 0.50 23.32 ? 997 HOH A O 1 HETATM 4315 O O . HOH O 9 . ? 0.621 -7.842 13.380 1.00 37.40 ? 998 HOH A O 1 HETATM 4316 O O . HOH O 9 . ? -11.917 -3.063 12.124 1.00 22.07 ? 999 HOH A O 1 HETATM 4317 O O . HOH O 9 . ? -2.487 -16.992 37.681 1.00 35.34 ? 1000 HOH A O 1 HETATM 4318 O O . HOH O 9 . ? 1.994 -12.279 1.369 1.00 38.78 ? 1001 HOH A O 1 HETATM 4319 O O . HOH O 9 . ? -26.146 -14.480 -9.764 1.00 24.79 ? 1002 HOH A O 1 HETATM 4320 O O . HOH O 9 . ? 6.436 -28.190 10.614 1.00 46.11 ? 1003 HOH A O 1 HETATM 4321 O O . HOH O 9 . ? 14.798 -31.325 20.695 1.00 44.37 ? 1004 HOH A O 1 HETATM 4322 O O . HOH O 9 . ? 13.460 -28.467 26.909 1.00 35.99 ? 1005 HOH A O 1 HETATM 4323 O O . HOH O 9 . ? -33.967 -13.985 -5.171 1.00 25.92 ? 1006 HOH A O 1 HETATM 4324 O O . HOH O 9 . ? 9.271 -42.160 23.829 1.00 31.17 ? 1007 HOH A O 1 HETATM 4325 O O . HOH O 9 . ? -32.780 -19.219 30.961 1.00 40.18 ? 1008 HOH A O 1 HETATM 4326 O O . HOH O 9 . ? -21.725 -42.342 -4.360 0.50 11.32 ? 1009 HOH A O 1 HETATM 4327 O O . HOH O 9 . ? 2.611 -41.688 23.119 1.00 33.09 ? 1010 HOH A O 1 HETATM 4328 O O . HOH O 9 . ? 6.946 -30.362 13.581 1.00 30.73 ? 1011 HOH A O 1 HETATM 4329 O O . HOH O 9 . ? -2.369 -52.642 25.315 1.00 47.03 ? 1012 HOH A O 1 HETATM 4330 O O . HOH O 9 . ? 5.725 -17.025 22.381 1.00 34.32 ? 1013 HOH A O 1 HETATM 4331 O O . HOH O 9 . ? -17.915 -8.522 21.134 1.00 27.80 ? 1014 HOH A O 1 HETATM 4332 O O . HOH O 9 . ? -10.825 -24.753 37.017 1.00 41.42 ? 1015 HOH A O 1 HETATM 4333 O O . HOH O 9 . ? -14.067 -23.517 34.657 1.00 23.50 ? 1016 HOH A O 1 HETATM 4334 O O . HOH O 9 . ? -21.347 -37.108 43.496 1.00 40.72 ? 1017 HOH A O 1 HETATM 4335 O O . HOH O 9 . ? -35.681 -21.080 -13.772 1.00 20.22 ? 1018 HOH A O 1 HETATM 4336 O O . HOH O 9 . ? -41.477 -28.748 -2.308 1.00 41.64 ? 1019 HOH A O 1 HETATM 4337 O O . HOH O 9 . ? -32.098 -39.551 9.286 1.00 33.69 ? 1020 HOH A O 1 HETATM 4338 O O . HOH O 9 . ? -34.441 -30.745 25.991 1.00 26.82 ? 1021 HOH A O 1 HETATM 4339 O O . HOH O 9 . ? -0.753 -11.528 21.445 1.00 47.83 ? 1022 HOH A O 1 HETATM 4340 O O . HOH O 9 . ? 11.107 -18.519 11.599 1.00 43.07 ? 1023 HOH A O 1 HETATM 4341 O O . HOH O 9 . ? 1.428 -33.145 11.056 1.00 38.87 ? 1024 HOH A O 1 HETATM 4342 O O . HOH O 9 . ? -21.420 -7.160 13.226 1.00 28.84 ? 1025 HOH A O 1 HETATM 4343 O O . HOH O 9 . ? -18.767 -4.493 19.192 1.00 50.28 ? 1026 HOH A O 1 HETATM 4344 O O . HOH O 9 . ? -9.025 -20.612 -4.797 1.00 44.64 ? 1027 HOH A O 1 HETATM 4345 O O . HOH O 9 . ? -36.350 -17.378 -7.386 1.00 41.65 ? 1028 HOH A O 1 HETATM 4346 O O . HOH O 9 . ? -19.677 -26.108 39.454 1.00 47.14 ? 1029 HOH A O 1 HETATM 4347 O O . HOH O 9 . ? -18.802 -8.168 3.538 1.00 45.98 ? 1030 HOH A O 1 HETATM 4348 O O . HOH O 9 . ? -25.606 -47.220 33.458 0.50 25.20 ? 1031 HOH A O 1 HETATM 4349 O O . HOH O 9 . ? -25.373 -39.361 -11.736 0.50 24.23 ? 1032 HOH A O 1 HETATM 4350 O O . HOH O 9 . ? 4.279 -13.824 3.623 1.00 32.16 ? 1033 HOH A O 1 HETATM 4351 O O . HOH O 9 . ? -36.890 -35.172 -1.221 1.00 31.29 ? 1034 HOH A O 1 HETATM 4352 O O . HOH O 9 . ? -14.995 -51.758 32.125 1.00 27.66 ? 1035 HOH A O 1 HETATM 4353 O O . HOH O 9 . ? -1.099 -49.418 28.486 1.00 27.57 ? 1036 HOH A O 1 HETATM 4354 O O . HOH O 9 . ? 4.820 -33.135 12.590 1.00 51.71 ? 1037 HOH A O 1 HETATM 4355 O O . HOH O 9 . ? -19.583 -52.064 34.156 1.00 39.12 ? 1038 HOH A O 1 HETATM 4356 O O . HOH O 9 . ? -1.248 -13.529 31.064 1.00 44.36 ? 1039 HOH A O 1 HETATM 4357 O O . HOH O 9 . ? -3.476 -22.375 42.239 1.00 21.52 ? 1040 HOH A O 1 HETATM 4358 O O . HOH O 9 . ? 11.695 -40.941 33.473 1.00 42.39 ? 1041 HOH A O 1 HETATM 4359 O O . HOH O 9 . ? -38.382 -29.244 28.300 1.00 45.14 ? 1042 HOH A O 1 HETATM 4360 O O . HOH O 9 . ? -20.921 -51.933 26.340 0.50 19.83 ? 1043 HOH A O 1 HETATM 4361 O O . HOH O 9 . ? -18.040 -5.854 14.005 1.00 44.74 ? 1044 HOH A O 1 HETATM 4362 O O . HOH O 9 . ? -12.270 -30.837 -6.838 1.00 44.12 ? 1045 HOH A O 1 HETATM 4363 O O . HOH O 9 . ? -24.046 -27.040 36.104 1.00 49.51 ? 1046 HOH A O 1 HETATM 4364 O O . HOH O 9 . ? -31.124 -22.865 32.600 1.00 54.12 ? 1047 HOH A O 1 HETATM 4365 O O . HOH O 9 . ? -11.537 -16.907 -4.166 1.00 46.90 ? 1048 HOH A O 1 HETATM 4366 O O . HOH O 9 . ? -22.213 -55.130 9.594 1.00 42.55 ? 1049 HOH A O 1 HETATM 4367 O O . HOH O 9 . ? -7.130 -41.877 40.174 1.00 38.07 ? 1050 HOH A O 1 HETATM 4368 O O . HOH O 9 . ? -25.915 -42.684 22.260 1.00 38.33 ? 1051 HOH A O 1 HETATM 4369 O O . HOH O 9 . ? -28.678 -10.637 24.926 1.00 46.19 ? 1052 HOH A O 1 HETATM 4370 O O . HOH O 9 . ? -9.299 -43.626 6.565 1.00 29.52 ? 1053 HOH A O 1 HETATM 4371 O O . HOH O 9 . ? 11.881 -14.942 15.215 1.00 46.33 ? 1054 HOH A O 1 HETATM 4372 O O . HOH O 9 . ? 1.955 -46.740 39.087 0.50 20.01 ? 1055 HOH A O 1 HETATM 4373 O O . HOH O 9 . ? 11.625 -20.877 9.496 1.00 43.61 ? 1056 HOH A O 1 HETATM 4374 O O . HOH O 9 . ? -28.379 -18.855 29.676 1.00 28.14 ? 1057 HOH A O 1 HETATM 4375 O O . HOH O 9 . ? -17.313 -6.960 5.330 1.00 35.86 ? 1058 HOH A O 1 HETATM 4376 O O . HOH O 9 . ? -35.244 -14.482 22.670 1.00 22.30 ? 1059 HOH A O 1 HETATM 4377 O O . HOH O 9 . ? -36.928 -36.684 3.921 1.00 38.59 ? 1060 HOH A O 1 HETATM 4378 O O . HOH O 9 . ? -30.378 -7.873 21.591 1.00 35.60 ? 1061 HOH A O 1 HETATM 4379 O O . HOH O 9 . ? -35.612 -14.551 -7.714 1.00 43.70 ? 1062 HOH A O 1 HETATM 4380 O O . HOH O 9 . ? -31.062 -4.824 10.576 1.00 42.04 ? 1063 HOH A O 1 HETATM 4381 O O . HOH O 9 . ? -1.100 -22.098 -0.949 1.00 30.93 ? 1064 HOH A O 1 HETATM 4382 O O . HOH O 9 . ? -15.618 -50.029 36.684 1.00 36.52 ? 1065 HOH A O 1 HETATM 4383 O O . HOH O 9 . ? -22.873 -48.484 8.991 1.00 28.60 ? 1066 HOH A O 1 HETATM 4384 O O . HOH O 9 . ? -22.622 -4.644 14.355 1.00 27.84 ? 1067 HOH A O 1 HETATM 4385 O O . HOH O 9 . ? 5.701 -36.730 43.278 1.00 29.73 ? 1068 HOH A O 1 HETATM 4386 O O . HOH O 9 . ? 7.247 -22.107 6.625 1.00 30.23 ? 1069 HOH A O 1 HETATM 4387 O O . HOH O 9 . ? -5.846 -2.110 6.622 1.00 39.59 ? 1070 HOH A O 1 HETATM 4388 O O . HOH O 9 . ? -15.158 -6.174 4.697 1.00 43.63 ? 1071 HOH A O 1 HETATM 4389 O O . HOH O 9 . ? -33.746 -19.168 -15.088 1.00 45.24 ? 1072 HOH A O 1 HETATM 4390 O O . HOH O 9 . ? -19.638 -40.919 -0.152 1.00 32.93 ? 1073 HOH A O 1 HETATM 4391 O O . HOH O 9 . ? -5.367 -16.772 35.365 1.00 25.75 ? 1074 HOH A O 1 HETATM 4392 O O . HOH O 9 . ? -8.904 -23.889 39.201 1.00 41.14 ? 1075 HOH A O 1 HETATM 4393 O O . HOH O 9 . ? -24.446 -35.100 -15.949 1.00 46.47 ? 1076 HOH A O 1 HETATM 4394 O O . HOH O 9 . ? -10.800 -6.811 18.974 1.00 39.22 ? 1077 HOH A O 1 HETATM 4395 O O . HOH O 9 . ? -29.959 -8.383 24.157 1.00 45.64 ? 1078 HOH A O 1 HETATM 4396 O O . HOH O 9 . ? -0.577 -6.785 9.376 1.00 43.24 ? 1079 HOH A O 1 HETATM 4397 O O . HOH O 9 . ? -10.989 -55.155 10.555 1.00 24.62 ? 1080 HOH A O 1 HETATM 4398 O O . HOH O 9 . ? -35.806 -16.935 -4.731 1.00 29.42 ? 1081 HOH A O 1 HETATM 4399 O O . HOH O 9 . ? -6.981 -51.234 13.415 1.00 42.99 ? 1082 HOH A O 1 HETATM 4400 O O . HOH O 9 . ? -13.244 -57.020 26.218 1.00 42.00 ? 1083 HOH A O 1 HETATM 4401 O O . HOH O 9 . ? -4.888 -52.974 38.967 1.00 45.34 ? 1084 HOH A O 1 HETATM 4402 O O . HOH O 9 . ? 14.545 -35.121 29.781 1.00 39.60 ? 1085 HOH A O 1 HETATM 4403 O O . HOH O 9 . ? -15.552 -19.307 33.528 1.00 32.29 ? 1086 HOH A O 1 HETATM 4404 O O . HOH O 9 . ? -18.485 -48.948 33.338 1.00 34.76 ? 1087 HOH A O 1 HETATM 4405 O O . HOH O 9 . ? 5.688 -43.981 39.986 1.00 34.12 ? 1088 HOH A O 1 HETATM 4406 O O . HOH O 9 . ? -37.202 -33.355 4.561 1.00 42.30 ? 1089 HOH A O 1 HETATM 4407 O O . HOH O 9 . ? -12.669 -32.436 -11.045 1.00 42.55 ? 1090 HOH A O 1 HETATM 4408 O O . HOH O 9 . ? -5.745 -54.764 33.782 1.00 38.65 ? 1091 HOH A O 1 HETATM 4409 O O . HOH O 9 . ? -37.362 -23.938 29.983 1.00 46.50 ? 1092 HOH A O 1 HETATM 4410 O O . HOH O 9 . ? 10.828 -12.219 12.240 1.00 50.28 ? 1093 HOH A O 1 HETATM 4411 O O . HOH O 9 . ? 16.398 -33.586 22.587 1.00 44.81 ? 1094 HOH A O 1 HETATM 4412 O O . HOH O 9 . ? -3.910 -39.057 10.448 1.00 42.52 ? 1095 HOH A O 1 HETATM 4413 O O . HOH O 9 . ? -13.812 -12.957 23.618 1.00 38.79 ? 1096 HOH A O 1 HETATM 4414 O O . HOH O 9 . ? -5.585 -53.308 15.190 1.00 37.97 ? 1097 HOH A O 1 HETATM 4415 O O . HOH O 9 . ? -25.341 -11.849 27.709 1.00 52.88 ? 1098 HOH A O 1 HETATM 4416 O O . HOH O 9 . ? 4.376 -19.163 5.286 1.00 35.61 ? 1099 HOH A O 1 HETATM 4417 O O . HOH O 9 . ? 9.091 -23.671 7.552 1.00 22.85 ? 1100 HOH A O 1 HETATM 4418 O O . HOH O 9 . ? -21.044 -57.227 13.491 1.00 34.26 ? 1101 HOH A O 1 HETATM 4419 O O . HOH O 9 . ? -36.108 -29.831 23.949 1.00 35.44 ? 1102 HOH A O 1 HETATM 4420 O O . HOH O 9 . ? 11.763 -45.439 30.328 1.00 50.25 ? 1103 HOH A O 1 HETATM 4421 O O . HOH O 9 . ? -9.271 -41.367 5.137 1.00 29.63 ? 1104 HOH A O 1 HETATM 4422 O O . HOH O 9 . ? -17.114 -41.381 -0.978 1.00 25.36 ? 1105 HOH A O 1 HETATM 4423 O O . HOH O 9 . ? -6.708 -50.861 39.937 1.00 50.41 ? 1106 HOH A O 1 HETATM 4424 O O . HOH O 9 . ? 7.879 -19.734 8.173 1.00 30.50 ? 1107 HOH A O 1 HETATM 4425 O O . HOH O 9 . ? -33.139 -26.241 30.418 1.00 35.81 ? 1108 HOH A O 1 HETATM 4426 O O . HOH O 9 . ? 16.164 -24.350 23.004 1.00 42.01 ? 1109 HOH A O 1 HETATM 4427 O O . HOH O 9 . ? 4.852 -21.715 5.170 1.00 42.66 ? 1110 HOH A O 1 HETATM 4428 O O . HOH O 9 . ? -21.802 -11.313 26.617 1.00 35.17 ? 1111 HOH A O 1 HETATM 4429 O O . HOH O 9 . ? -20.744 -24.355 37.086 1.00 29.93 ? 1112 HOH A O 1 HETATM 4430 O O . HOH O 9 . ? -35.832 -38.061 8.990 1.00 38.07 ? 1113 HOH A O 1 HETATM 4431 O O . HOH O 9 . ? 11.795 -14.052 18.284 1.00 42.26 ? 1114 HOH A O 1 HETATM 4432 O O . HOH O 9 . ? -4.790 -47.606 42.207 0.50 19.01 ? 1115 HOH A O 1 HETATM 4433 O O . HOH O 9 . ? -19.554 -12.283 23.009 1.00 16.27 ? 1116 HOH A O 1 HETATM 4434 O O . HOH O 9 . ? -40.466 -30.507 -8.912 1.00 34.88 ? 1117 HOH A O 1 HETATM 4435 O O . HOH O 9 . ? -22.418 -43.584 -0.294 1.00 27.49 ? 1118 HOH A O 1 HETATM 4436 O O . HOH O 9 . ? 5.643 -30.852 9.740 1.00 36.66 ? 1119 HOH A O 1 HETATM 4437 O O . HOH O 9 . ? -4.982 -29.798 23.056 1.00 32.88 ? 1120 HOH A O 1 HETATM 4438 O O . HOH O 9 . ? -0.903 -12.317 24.011 1.00 46.66 ? 1121 HOH A O 1 HETATM 4439 O O . HOH O 9 . ? -18.499 -4.200 10.493 1.00 38.61 ? 1122 HOH A O 1 HETATM 4440 O O . HOH O 9 . ? -45.430 -19.326 -4.718 1.00 29.23 ? 1123 HOH A O 1 HETATM 4441 O O . HOH O 9 . ? -23.136 -52.633 9.438 1.00 40.76 ? 1124 HOH A O 1 HETATM 4442 O O . HOH O 9 . ? -1.852 -20.730 -3.219 1.00 23.18 ? 1125 HOH A O 1 HETATM 4443 O O . HOH O 9 . ? -3.962 -16.172 32.953 1.00 39.34 ? 1126 HOH A O 1 HETATM 4444 O O . HOH O 9 . ? -32.729 -8.499 23.786 1.00 38.76 ? 1127 HOH A O 1 HETATM 4445 O O . HOH O 9 . ? 2.420 -29.565 41.645 1.00 19.42 ? 1128 HOH A O 1 HETATM 4446 O O . HOH O 9 . ? -38.769 -28.599 24.936 1.00 33.89 ? 1129 HOH A O 1 HETATM 4447 O O . HOH O 9 . ? -18.160 -54.531 27.211 1.00 32.56 ? 1130 HOH A O 1 HETATM 4448 O O . HOH O 9 . ? -22.380 -40.417 -13.211 0.50 23.86 ? 1131 HOH A O 1 HETATM 4449 O O . HOH O 9 . ? 9.279 -16.899 25.580 1.00 37.11 ? 1132 HOH A O 1 HETATM 4450 O O . HOH O 9 . ? -29.124 -20.287 33.573 1.00 35.79 ? 1133 HOH A O 1 HETATM 4451 O O . HOH O 9 . ? -7.205 -2.245 18.367 1.00 49.43 ? 1134 HOH A O 1 HETATM 4452 O O . HOH O 9 . ? -38.908 -36.806 5.531 1.00 45.72 ? 1135 HOH A O 1 HETATM 4453 O O . HOH O 9 . ? -5.456 -49.405 14.517 1.00 33.16 ? 1136 HOH A O 1 HETATM 4454 O O . HOH O 9 . ? -34.261 -24.893 33.046 1.00 49.25 ? 1137 HOH A O 1 HETATM 4455 O O . HOH O 9 . ? 16.473 -36.306 24.142 1.00 47.30 ? 1138 HOH A O 1 HETATM 4456 O O . HOH O 9 . ? 5.442 -17.011 7.108 1.00 43.61 ? 1139 HOH A O 1 HETATM 4457 O O . HOH O 9 . ? 15.934 -32.676 33.630 1.00 37.88 ? 1140 HOH A O 1 HETATM 4458 O O . HOH O 9 . ? 12.395 -31.870 39.555 1.00 43.80 ? 1141 HOH A O 1 HETATM 4459 O O . HOH O 9 . ? -22.694 -30.764 13.055 1.00 9.16 ? 1142 HOH A O 1 HETATM 4460 O O . HOH O 9 . ? -10.900 -23.027 2.121 1.00 10.91 ? 1143 HOH A O 1 HETATM 4461 O O . HOH O 9 . ? -22.018 -31.987 7.166 1.00 11.54 ? 1144 HOH A O 1 HETATM 4462 O O . HOH O 9 . ? -28.298 -22.902 9.957 1.00 10.27 ? 1145 HOH A O 1 HETATM 4463 O O . HOH O 9 . ? -19.020 -32.753 14.394 1.00 10.47 ? 1146 HOH A O 1 HETATM 4464 O O . HOH O 9 . ? -20.438 -33.932 5.816 1.00 11.17 ? 1147 HOH A O 1 HETATM 4465 O O . HOH O 9 . ? -24.573 -28.940 13.935 1.00 13.46 ? 1148 HOH A O 1 HETATM 4466 O O . HOH O 9 . ? -20.334 -30.456 14.310 1.00 12.52 ? 1149 HOH A O 1 HETATM 4467 O O . HOH O 9 . ? -13.245 -24.372 1.219 1.00 12.02 ? 1150 HOH A O 1 HETATM 4468 O O . HOH O 9 . ? -27.780 -25.043 8.656 1.00 9.45 ? 1151 HOH A O 1 HETATM 4469 O O . HOH O 9 . ? -9.916 -16.738 20.489 1.00 9.33 ? 1152 HOH A O 1 HETATM 4470 O O . HOH O 9 . ? -29.145 -37.248 11.728 1.00 13.49 ? 1153 HOH A O 1 HETATM 4471 O O . HOH O 9 . ? -32.175 -7.758 4.455 1.00 15.76 ? 1154 HOH A O 1 HETATM 4472 O O . HOH O 9 . ? -6.361 -48.207 18.208 1.00 17.35 ? 1155 HOH A O 1 HETATM 4473 O O . HOH O 9 . ? -6.001 -46.447 20.525 1.00 17.04 ? 1156 HOH A O 1 HETATM 4474 O O . HOH O 9 . ? -1.081 -24.113 15.679 1.00 16.77 ? 1157 HOH A O 1 HETATM 4475 O O . HOH O 9 . ? -2.751 -26.158 15.206 1.00 12.47 ? 1158 HOH A O 1 HETATM 4476 O O . HOH O 9 . ? -30.506 -12.035 -3.014 1.00 14.80 ? 1159 HOH A O 1 HETATM 4477 O O . HOH O 9 . ? 4.197 -17.706 11.062 1.00 12.95 ? 1160 HOH A O 1 HETATM 4478 O O . HOH O 9 . ? -7.240 -50.780 17.815 1.00 21.46 ? 1161 HOH A O 1 HETATM 4479 O O . HOH O 9 . ? -29.490 -28.606 29.405 1.00 18.07 ? 1162 HOH A O 1 HETATM 4480 O O . HOH O 9 . ? -8.097 -16.329 18.683 1.00 11.51 ? 1163 HOH A O 1 HETATM 4481 O O . HOH O 9 . ? -24.071 -29.405 29.049 1.00 17.12 ? 1164 HOH A O 1 HETATM 4482 O O . HOH O 9 . ? -34.724 -31.980 -6.586 1.00 13.50 ? 1165 HOH A O 1 HETATM 4483 O O . HOH O 9 . ? -8.373 -14.530 0.773 1.00 15.90 ? 1166 HOH A O 1 HETATM 4484 O O . HOH O 9 . ? -11.285 -39.404 -0.241 1.00 26.60 ? 1167 HOH A O 1 HETATM 4485 O O . HOH O 9 . ? -29.964 -37.256 15.421 1.00 15.24 ? 1168 HOH A O 1 HETATM 4486 O O . HOH O 9 . ? -25.130 -12.246 -6.202 1.00 18.11 ? 1169 HOH A O 1 HETATM 4487 O O . HOH O 9 . ? -21.683 -28.492 29.550 1.00 16.89 ? 1170 HOH A O 1 HETATM 4488 O O . HOH O 9 . ? -39.911 -16.953 -1.068 1.00 31.42 ? 1171 HOH A O 1 HETATM 4489 O O . HOH O 9 . ? -26.625 -42.889 -0.061 1.00 18.80 ? 1172 HOH A O 1 HETATM 4490 O O . HOH O 9 . ? -38.779 -16.899 10.038 1.00 19.13 ? 1173 HOH A O 1 HETATM 4491 O O . HOH O 9 . ? 5.488 -16.357 12.946 1.00 21.24 ? 1174 HOH A O 1 HETATM 4492 O O . HOH O 9 . ? -23.433 -12.649 -8.412 1.00 20.10 ? 1175 HOH A O 1 HETATM 4493 O O . HOH O 9 . ? -3.066 -23.142 17.390 1.00 14.35 ? 1176 HOH A O 1 HETATM 4494 O O . HOH O 9 . ? -37.764 -14.931 2.154 1.00 15.74 ? 1177 HOH A O 1 HETATM 4495 O O . HOH O 9 . ? -26.301 -9.233 -0.460 1.00 27.10 ? 1178 HOH A O 1 HETATM 4496 O O . HOH O 9 . ? -29.157 -8.832 -0.923 1.00 27.64 ? 1179 HOH A O 1 HETATM 4497 O O . HOH O 9 . ? -7.736 -27.129 -5.818 1.00 21.29 ? 1180 HOH A O 1 HETATM 4498 O O . HOH O 9 . ? -6.057 -27.664 -3.933 1.00 25.21 ? 1181 HOH A O 1 HETATM 4499 O O . HOH O 9 . ? -6.142 -33.184 10.717 1.00 22.87 ? 1182 HOH A O 1 HETATM 4500 O O . HOH O 9 . ? -41.544 -13.751 1.271 1.00 17.46 ? 1183 HOH A O 1 HETATM 4501 O O . HOH O 9 . ? -34.657 -38.966 5.253 1.00 20.55 ? 1184 HOH A O 1 HETATM 4502 O O . HOH O 9 . ? -42.745 -17.207 -0.920 1.00 30.03 ? 1185 HOH A O 1 HETATM 4503 O O . HOH O 9 . ? -44.058 -17.512 -3.706 1.00 24.10 ? 1186 HOH A O 1 HETATM 4504 O O . HOH O 9 . ? -21.957 -25.408 -10.344 0.50 30.61 ? 1187 HOH A O 1 HETATM 4505 O O . HOH O 9 . ? 3.016 -38.169 22.762 1.00 40.38 ? 1188 HOH A O 1 HETATM 4506 O O . HOH O 9 . ? -24.920 -39.314 -3.989 1.00 17.30 ? 1189 HOH A O 1 HETATM 4507 O O . HOH O 9 . ? -4.088 -48.053 17.059 1.00 26.24 ? 1190 HOH A O 1 HETATM 4508 O O . HOH O 9 . ? -36.301 -34.314 -4.122 1.00 20.85 ? 1191 HOH A O 1 HETATM 4509 O O . HOH O 9 . ? -24.544 -9.895 -4.845 1.00 23.32 ? 1192 HOH A O 1 HETATM 4510 O O . HOH O 9 . ? 4.556 -12.966 7.635 1.00 27.29 ? 1193 HOH A O 1 HETATM 4511 O O . HOH O 9 . ? -7.255 -11.079 1.806 1.00 21.43 ? 1194 HOH A O 1 HETATM 4512 O O . HOH O 9 . ? -28.612 -5.281 11.046 1.00 24.57 ? 1195 HOH A O 1 HETATM 4513 O O . HOH O 9 . ? -38.306 -32.977 -8.956 1.00 28.79 ? 1196 HOH A O 1 HETATM 4514 O O . HOH O 9 . ? 4.397 -24.378 7.164 1.00 35.70 ? 1197 HOH A O 1 HETATM 4515 O O . HOH O 9 . ? -27.468 -44.784 13.765 1.00 20.94 ? 1198 HOH A O 1 HETATM 4516 O O . HOH O 9 . ? -23.379 -29.093 33.383 1.00 20.58 ? 1199 HOH A O 1 HETATM 4517 O O . HOH O 9 . ? -29.984 -43.651 13.618 1.00 28.37 ? 1200 HOH A O 1 HETATM 4518 O O . HOH O 9 . ? 4.744 -30.973 41.604 1.00 21.83 ? 1201 HOH A O 1 HETATM 4519 O O . HOH O 9 . ? -11.396 -27.099 44.303 1.00 30.97 ? 1202 HOH A O 1 HETATM 4520 O O . HOH O 9 . ? 13.607 -32.783 25.557 1.00 35.11 ? 1203 HOH A O 1 HETATM 4521 O O . HOH O 9 . ? 13.512 -26.651 34.196 1.00 37.50 ? 1204 HOH A O 1 HETATM 4522 O O . HOH O 9 . ? -12.335 -36.042 -0.244 1.00 35.04 ? 1205 HOH A O 1 HETATM 4523 O O . HOH O 9 . ? -19.619 -9.399 23.235 1.00 27.84 ? 1206 HOH A O 1 HETATM 4524 O O . HOH O 9 . ? -29.692 -40.930 13.176 1.00 32.80 ? 1207 HOH A O 1 HETATM 4525 O O . HOH O 9 . ? -39.437 -16.715 -4.017 1.00 27.44 ? 1208 HOH A O 1 HETATM 4526 O O . HOH O 9 . ? -6.242 -12.977 0.209 1.00 27.08 ? 1209 HOH A O 1 HETATM 4527 O O . HOH O 9 . ? -9.865 -24.704 44.046 1.00 31.50 ? 1210 HOH A O 1 HETATM 4528 O O . HOH O 9 . ? -38.572 -29.376 -6.452 1.00 23.05 ? 1211 HOH A O 1 HETATM 4529 O O . HOH O 9 . ? -12.513 -32.347 42.250 1.00 27.36 ? 1212 HOH A O 1 HETATM 4530 O O . HOH O 9 . ? -22.543 -39.337 -5.490 1.00 28.44 ? 1213 HOH A O 1 HETATM 4531 O O . HOH O 9 . ? -22.609 -9.160 23.648 1.00 25.70 ? 1214 HOH A O 1 HETATM 4532 O O . HOH O 9 . ? -39.979 -13.304 4.218 1.00 30.79 ? 1215 HOH A O 1 HETATM 4533 O O . HOH O 9 . ? -41.311 -25.059 14.388 1.00 38.60 ? 1216 HOH A O 1 HETATM 4534 O O . HOH O 9 . ? 6.974 -25.338 7.592 1.00 34.05 ? 1217 HOH A O 1 HETATM 4535 O O . HOH O 9 . ? 14.548 -19.385 29.998 1.00 30.65 ? 1218 HOH A O 1 HETATM 4536 O O . HOH O 9 . ? -31.880 -28.685 30.341 1.00 34.06 ? 1219 HOH A O 1 HETATM 4537 O O . HOH O 9 . ? -25.806 -25.664 -13.250 1.00 26.80 ? 1220 HOH A O 1 HETATM 4538 O O . HOH O 9 . ? -21.094 -42.516 1.684 1.00 27.63 ? 1221 HOH A O 1 HETATM 4539 O O . HOH O 9 . ? -4.361 -24.235 -2.145 1.00 38.07 ? 1222 HOH A O 1 HETATM 4540 O O . HOH O 9 . ? -37.876 -14.268 22.809 1.00 31.15 ? 1223 HOH A O 1 HETATM 4541 O O . HOH O 9 . ? -31.160 -5.829 8.065 1.00 28.34 ? 1224 HOH A O 1 HETATM 4542 O O . HOH O 9 . ? -40.989 -27.451 6.290 0.50 18.04 ? 1225 HOH A O 1 HETATM 4543 O O . HOH O 9 . ? -36.776 -35.998 18.639 0.50 21.99 ? 1226 HOH A O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 GLY 1 1 1 GLY GLY A . n A 1 2 ALA 2 2 2 ALA ALA A . n A 1 3 ILE 3 3 3 ILE ILE A . n A 1 4 GLU 4 4 4 GLU GLU A . n A 1 5 ALA 5 5 5 ALA ALA A . n A 1 6 CYS 6 6 6 CYS CYS A . n A 1 7 LEU 7 7 7 LEU LEU A . n A 1 8 SER 8 8 8 SER SER A . n A 1 9 ALA 9 9 9 ALA ALA A . n A 1 10 ALA 10 10 10 ALA ALA A . n A 1 11 GLY 11 11 11 GLY GLY A . n A 1 12 VAL 12 12 12 VAL VAL A . n A 1 13 PRO 13 13 13 PRO PRO A . n A 1 14 ILE 14 14 14 ILE ILE A . n A 1 15 ASP 15 15 15 ASP ASP A . n A 1 16 ILE 16 16 16 ILE ILE A . n A 1 17 PRO 17 17 17 PRO PRO A . n A 1 18 GLY 18 18 18 GLY GLY A . n A 1 19 THR 19 19 19 THR THR A . n A 1 20 ALA 20 20 20 ALA ALA A . n A 1 21 ASP 21 21 21 ASP ASP A . n A 1 22 TYR 22 22 22 TYR TYR A . n A 1 23 GLU 23 23 23 GLU GLU A . n A 1 24 ARG 24 24 24 ARG ARG A . n A 1 25 ASP 25 25 25 ASP ASP A . n A 1 26 VAL 26 26 26 VAL VAL A . n A 1 27 GLU 27 27 27 GLU GLU A . n A 1 28 PRO 28 28 28 PRO PRO A . n A 1 29 PHE 29 29 29 PHE PHE A . n A 1 30 ASN 30 30 30 ASN ASN A . n A 1 31 ILE 31 31 31 ILE ILE A . n A 1 32 ARG 32 32 32 ARG ARG A . n A 1 33 LEU 33 33 33 LEU LEU A . n A 1 34 PRO 34 34 34 PRO PRO A . n A 1 35 TYR 35 35 35 TYR TYR A . n A 1 36 ILE 36 36 36 ILE ILE A . n A 1 37 PRO 37 37 37 PRO PRO A . n A 1 38 THR 38 38 38 THR THR A . n A 1 39 ALA 39 39 39 ALA ALA A . n A 1 40 ILE 40 40 40 ILE ILE A . n A 1 41 ALA 41 41 41 ALA ALA A . n A 1 42 GLN 42 42 42 GLN GLN A . n A 1 43 THR 43 43 43 THR THR A . n A 1 44 GLN 44 44 44 GLN GLN A . n A 1 45 THR 45 45 45 THR THR A . n A 1 46 THR 46 46 46 THR THR A . n A 1 47 ALA 47 47 47 ALA ALA A . n A 1 48 HIS 48 48 48 HIS HIS A . n A 1 49 ILE 49 49 49 ILE ILE A . n A 1 50 GLN 50 50 50 GLN GLN A . n A 1 51 SER 51 51 51 SER SER A . n A 1 52 ALA 52 52 52 ALA ALA A . n A 1 53 VAL 53 53 53 VAL VAL A . n A 1 54 GLN 54 54 54 GLN GLN A . n A 1 55 CYS 55 55 55 CYS CYS A . n A 1 56 ALA 56 56 56 ALA ALA A . n A 1 57 LYS 57 57 57 LYS LYS A . n A 1 58 LYS 58 58 58 LYS LYS A . n A 1 59 LEU 59 59 59 LEU LEU A . n A 1 60 ASN 60 60 60 ASN ASN A . n A 1 61 LEU 61 61 61 LEU LEU A . n A 1 62 LYS 62 62 62 LYS LYS A . n A 1 63 VAL 63 63 63 VAL VAL A . n A 1 64 SER 64 64 64 SER SER A . n A 1 65 ALA 65 65 65 ALA ALA A . n A 1 66 LYS 66 66 66 LYS LYS A . n A 1 67 SER 67 67 67 SER SER A . n A 1 68 GLY 68 68 68 GLY GLY A . n A 1 69 GLY 69 69 69 GLY GLY A . n A 1 70 HIS 70 70 70 HIS HIS A . n A 1 71 SER 71 71 71 SER SER A . n A 1 72 TYR 72 72 72 TYR TYR A . n A 1 73 ALA 73 73 73 ALA ALA A . n A 1 74 SER 74 74 74 SER SER A . n A 1 75 PHE 75 75 75 PHE PHE A . n A 1 76 GLY 76 76 76 GLY GLY A . n A 1 77 PHE 77 77 77 PHE PHE A . n A 1 78 GLY 78 78 78 GLY GLY A . n A 1 79 GLY 79 79 79 GLY GLY A . n A 1 80 GLU 80 80 80 GLU GLU A . n A 1 81 ASN 81 81 81 ASN ASN A . n A 1 82 GLY 82 82 82 GLY GLY A . n A 1 83 HIS 83 83 83 HIS HIS A . n A 1 84 LEU 84 84 84 LEU LEU A . n A 1 85 MET 85 85 85 MET MET A . n A 1 86 VAL 86 86 86 VAL VAL A . n A 1 87 GLN 87 87 87 GLN GLN A . n A 1 88 LEU 88 88 88 LEU LEU A . n A 1 89 ASP 89 89 89 ASP ASP A . n A 1 90 ARG 90 90 90 ARG ARG A . n A 1 91 MET 91 91 91 MET MET A . n A 1 92 ILE 92 92 92 ILE ILE A . n A 1 93 ASP 93 93 93 ASP ASP A . n A 1 94 VAL 94 94 94 VAL VAL A . n A 1 95 ILE 95 95 95 ILE ILE A . n A 1 96 SER 96 96 96 SER SER A . n A 1 97 TYR 97 97 97 TYR TYR A . n A 1 98 ASN 98 98 98 ASN ASN A . n A 1 99 ASP 99 99 99 ASP ASP A . n A 1 100 LYS 100 100 100 LYS LYS A . n A 1 101 THR 101 101 101 THR THR A . n A 1 102 GLY 102 102 102 GLY GLY A . n A 1 103 ILE 103 103 103 ILE ILE A . n A 1 104 ALA 104 104 104 ALA ALA A . n A 1 105 HIS 105 105 105 HIS HIS A . n A 1 106 VAL 106 106 106 VAL VAL A . n A 1 107 GLU 107 107 107 GLU GLU A . n A 1 108 PRO 108 108 108 PRO PRO A . n A 1 109 GLY 109 109 109 GLY GLY A . n A 1 110 ALA 110 110 110 ALA ALA A . n A 1 111 ARG 111 111 111 ARG ARG A . n A 1 112 LEU 112 112 112 LEU LEU A . n A 1 113 GLY 113 113 113 GLY GLY A . n A 1 114 HIS 114 114 114 HIS HIS A . n A 1 115 LEU 115 115 115 LEU LEU A . n A 1 116 ALA 116 116 116 ALA ALA A . n A 1 117 THR 117 117 117 THR THR A . n A 1 118 VAL 118 118 118 VAL VAL A . n A 1 119 LEU 119 119 119 LEU LEU A . n A 1 120 ASN 120 120 120 ASN ASN A . n A 1 121 ASP 121 121 121 ASP ASP A . n A 1 122 LYS 122 122 122 LYS LYS A . n A 1 123 TYR 123 123 123 TYR TYR A . n A 1 124 GLY 124 124 124 GLY GLY A . n A 1 125 ARG 125 125 125 ARG ARG A . n A 1 126 ALA 126 126 126 ALA ALA A . n A 1 127 ILE 127 127 127 ILE ILE A . n A 1 128 SER 128 128 128 SER SER A . n A 1 129 HIS 129 129 129 HIS HIS A . n A 1 130 GLY 130 130 130 GLY GLY A . n A 1 131 THR 131 131 131 THR THR A . n A 1 132 CYS 132 132 132 CYS CYS A . n A 1 133 PRO 133 133 133 PRO PRO A . n A 1 134 GLY 134 134 134 GLY GLY A . n A 1 135 VAL 135 135 135 VAL VAL A . n A 1 136 GLY 136 136 136 GLY GLY A . n A 1 137 ILE 137 137 137 ILE ILE A . n A 1 138 SER 138 138 138 SER SER A . n A 1 139 GLY 139 139 139 GLY GLY A . n A 1 140 HIS 140 140 140 HIS HIS A . n A 1 141 PHE 141 141 141 PHE PHE A . n A 1 142 ALA 142 142 142 ALA ALA A . n A 1 143 HIS 143 143 143 HIS HIS A . n A 1 144 GLY 144 144 144 GLY GLY A . n A 1 145 GLY 145 145 145 GLY GLY A . n A 1 146 PHE 146 146 146 PHE PHE A . n A 1 147 GLY 147 147 147 GLY GLY A . n A 1 148 PHE 148 148 148 PHE PHE A . n A 1 149 SER 149 149 149 SER SER A . n A 1 150 SER 150 150 150 SER SER A . n A 1 151 HIS 151 151 151 HIS HIS A . n A 1 152 MET 152 152 152 MET MET A . n A 1 153 HIS 153 153 153 HIS HIS A . n A 1 154 GLY 154 154 154 GLY GLY A . n A 1 155 LEU 155 155 155 LEU LEU A . n A 1 156 ALA 156 156 156 ALA ALA A . n A 1 157 VAL 157 157 157 VAL VAL A . n A 1 158 ASP 158 158 158 ASP ASP A . n A 1 159 SER 159 159 159 SER SER A . n A 1 160 VAL 160 160 160 VAL VAL A . n A 1 161 VAL 161 161 161 VAL VAL A . n A 1 162 GLY 162 162 162 GLY GLY A . n A 1 163 VAL 163 163 163 VAL VAL A . n A 1 164 THR 164 164 164 THR THR A . n A 1 165 VAL 165 165 165 VAL VAL A . n A 1 166 VAL 166 166 166 VAL VAL A . n A 1 167 LEU 167 167 167 LEU LEU A . n A 1 168 ALA 168 168 168 ALA ALA A . n A 1 169 ASP 169 169 169 ASP ASP A . n A 1 170 GLY 170 170 170 GLY GLY A . n A 1 171 ARG 171 171 171 ARG ARG A . n A 1 172 ILE 172 172 172 ILE ILE A . n A 1 173 VAL 173 173 173 VAL VAL A . n A 1 174 GLU 174 174 174 GLU GLU A . n A 1 175 ALA 175 175 175 ALA ALA A . n A 1 176 SER 176 176 176 SER SER A . n A 1 177 ALA 177 177 177 ALA ALA A . n A 1 178 THR 178 178 178 THR THR A . n A 1 179 GLU 179 179 179 GLU GLU A . n A 1 180 ASN 180 180 180 ASN ASN A . n A 1 181 ALA 181 181 181 ALA ALA A . n A 1 182 ASP 182 182 182 ASP ASP A . n A 1 183 LEU 183 183 183 LEU LEU A . n A 1 184 PHE 184 184 184 PHE PHE A . n A 1 185 TRP 185 185 185 TRP TRP A . n A 1 186 GLY 186 186 186 GLY GLY A . n A 1 187 ILE 187 187 187 ILE ILE A . n A 1 188 LYS 188 188 188 LYS LYS A . n A 1 189 GLY 189 189 189 GLY GLY A . n A 1 190 ALA 190 190 190 ALA ALA A . n A 1 191 GLY 191 191 191 GLY GLY A . n A 1 192 SER 192 192 192 SER SER A . n A 1 193 ASN 193 193 193 ASN ASN A . n A 1 194 PHE 194 194 194 PHE PHE A . n A 1 195 GLY 195 195 195 GLY GLY A . n A 1 196 ILE 196 196 196 ILE ILE A . n A 1 197 VAL 197 197 197 VAL VAL A . n A 1 198 ALA 198 198 198 ALA ALA A . n A 1 199 VAL 199 199 199 VAL VAL A . n A 1 200 TRP 200 200 200 TRP TRP A . n A 1 201 LYS 201 201 201 LYS LYS A . n A 1 202 LEU 202 202 202 LEU LEU A . n A 1 203 ALA 203 203 203 ALA ALA A . n A 1 204 THR 204 204 204 THR THR A . n A 1 205 PHE 205 205 205 PHE PHE A . n A 1 206 PRO 206 206 206 PRO PRO A . n A 1 207 ALA 207 207 207 ALA ALA A . n A 1 208 PRO 208 208 208 PRO PRO A . n A 1 209 LYS 209 209 209 LYS LYS A . n A 1 210 VAL 210 210 210 VAL VAL A . n A 1 211 LEU 211 211 211 LEU LEU A . n A 1 212 THR 212 212 212 THR THR A . n A 1 213 ARG 213 213 213 ARG ARG A . n A 1 214 PHE 214 214 214 PHE PHE A . n A 1 215 GLY 215 215 215 GLY GLY A . n A 1 216 VAL 216 216 216 VAL VAL A . n A 1 217 THR 217 217 217 THR THR A . n A 1 218 LEU 218 218 218 LEU LEU A . n A 1 219 ASN 219 219 219 ASN ASN A . n A 1 220 TRP 220 220 220 TRP TRP A . n A 1 221 LYS 221 221 221 LYS LYS A . n A 1 222 ASN 222 222 222 ASN ASN A . n A 1 223 LYS 223 223 223 LYS LYS A . n A 1 224 THR 224 224 224 THR THR A . n A 1 225 SER 225 225 225 SER SER A . n A 1 226 ALA 226 226 226 ALA ALA A . n A 1 227 LEU 227 227 227 LEU LEU A . n A 1 228 LYS 228 228 228 LYS LYS A . n A 1 229 GLY 229 229 229 GLY GLY A . n A 1 230 ILE 230 230 230 ILE ILE A . n A 1 231 GLU 231 231 231 GLU GLU A . n A 1 232 ALA 232 232 232 ALA ALA A . n A 1 233 VAL 233 233 233 VAL VAL A . n A 1 234 GLU 234 234 234 GLU GLU A . n A 1 235 ASP 235 235 235 ASP ASP A . n A 1 236 TYR 236 236 236 TYR TYR A . n A 1 237 ALA 237 237 237 ALA ALA A . n A 1 238 ARG 238 238 238 ARG ARG A . n A 1 239 TRP 239 239 239 TRP TRP A . n A 1 240 VAL 240 240 240 VAL VAL A . n A 1 241 ALA 241 241 241 ALA ALA A . n A 1 242 PRO 242 242 242 PRO PRO A . n A 1 243 ARG 243 243 243 ARG ARG A . n A 1 244 GLU 244 244 244 GLU GLU A . n A 1 245 VAL 245 245 245 VAL VAL A . n A 1 246 ASN 246 246 246 ASN ASN A . n A 1 247 PHE 247 247 247 PHE PHE A . n A 1 248 ARG 248 248 248 ARG ARG A . n A 1 249 ILE 249 249 249 ILE ILE A . n A 1 250 GLY 250 250 250 GLY GLY A . n A 1 251 ASP 251 251 251 ASP ASP A . n A 1 252 TYR 252 252 252 TYR TYR A . n A 1 253 GLY 253 253 253 GLY GLY A . n A 1 254 ALA 254 254 254 ALA ALA A . n A 1 255 GLY 255 255 255 GLY GLY A . n A 1 256 ASN 256 256 256 ASN ASN A . n A 1 257 PRO 257 257 257 PRO PRO A . n A 1 258 GLY 258 258 258 GLY GLY A . n A 1 259 ILE 259 259 259 ILE ILE A . n A 1 260 GLU 260 260 260 GLU GLU A . n A 1 261 GLY 261 261 261 GLY GLY A . n A 1 262 LEU 262 262 262 LEU LEU A . n A 1 263 TYR 263 263 263 TYR TYR A . n A 1 264 TYR 264 264 264 TYR TYR A . n A 1 265 GLY 265 265 265 GLY GLY A . n A 1 266 THR 266 266 266 THR THR A . n A 1 267 PRO 267 267 267 PRO PRO A . n A 1 268 GLU 268 268 268 GLU GLU A . n A 1 269 GLN 269 269 269 GLN GLN A . n A 1 270 TRP 270 270 270 TRP TRP A . n A 1 271 ARG 271 271 271 ARG ARG A . n A 1 272 ALA 272 272 272 ALA ALA A . n A 1 273 ALA 273 273 273 ALA ALA A . n A 1 274 PHE 274 274 274 PHE PHE A . n A 1 275 GLN 275 275 275 GLN GLN A . n A 1 276 PRO 276 276 276 PRO PRO A . n A 1 277 LEU 277 277 277 LEU LEU A . n A 1 278 LEU 278 278 278 LEU LEU A . n A 1 279 ASP 279 279 279 ASP ASP A . n A 1 280 THR 280 280 280 THR THR A . n A 1 281 LEU 281 281 281 LEU LEU A . n A 1 282 PRO 282 282 282 PRO PRO A . n A 1 283 ALA 283 283 283 ALA ALA A . n A 1 284 GLY 284 284 284 GLY GLY A . n A 1 285 TYR 285 285 285 TYR TYR A . n A 1 286 VAL 286 286 286 VAL VAL A . n A 1 287 VAL 287 287 287 VAL VAL A . n A 1 288 ASN 288 288 288 ASN ASN A . n A 1 289 PRO 289 289 289 PRO PRO A . n A 1 290 THR 290 290 290 THR THR A . n A 1 291 THR 291 291 291 THR THR A . n A 1 292 SER 292 292 292 SER SER A . n A 1 293 LEU 293 293 293 LEU LEU A . n A 1 294 ASN 294 294 294 ASN ASN A . n A 1 295 TRP 295 295 295 TRP TRP A . n A 1 296 ILE 296 296 296 ILE ILE A . n A 1 297 GLU 297 297 297 GLU GLU A . n A 1 298 SER 298 298 298 SER SER A . n A 1 299 VAL 299 299 299 VAL VAL A . n A 1 300 LEU 300 300 300 LEU LEU A . n A 1 301 SER 301 301 301 SER SER A . n A 1 302 TYR 302 302 302 TYR TYR A . n A 1 303 SER 303 303 303 SER SER A . n A 1 304 ASN 304 304 304 ASN ASN A . n A 1 305 PHE 305 305 305 PHE PHE A . n A 1 306 ASP 306 306 306 ASP ASP A . n A 1 307 HIS 307 307 307 HIS HIS A . n A 1 308 VAL 308 308 308 VAL VAL A . n A 1 309 ASP 309 309 309 ASP ASP A . n A 1 310 PHE 310 310 310 PHE PHE A . n A 1 311 ILE 311 311 311 ILE ILE A . n A 1 312 THR 312 312 312 THR THR A . n A 1 313 PRO 313 313 313 PRO PRO A . n A 1 314 GLN 314 314 314 GLN GLN A . n A 1 315 PRO 315 315 315 PRO PRO A . n A 1 316 VAL 316 316 316 VAL VAL A . n A 1 317 GLU 317 317 317 GLU GLU A . n A 1 318 ASN 318 318 318 ASN ASN A . n A 1 319 PHE 319 319 319 PHE PHE A . n A 1 320 TYR 320 320 320 TYR TYR A . n A 1 321 ALA 321 321 321 ALA ALA A . n A 1 322 LYS 322 322 322 LYS LYS A . n A 1 323 SER 323 323 323 SER SER A . n A 1 324 LEU 324 324 324 LEU LEU A . n A 1 325 THR 325 325 325 THR THR A . n A 1 326 LEU 326 326 326 LEU LEU A . n A 1 327 LYS 327 327 327 LYS LYS A . n A 1 328 SER 328 328 328 SER SER A . n A 1 329 ILE 329 329 329 ILE ILE A . n A 1 330 LYS 330 330 330 LYS LYS A . n A 1 331 GLY 331 331 331 GLY GLY A . n A 1 332 ASP 332 332 332 ASP ASP A . n A 1 333 ALA 333 333 333 ALA ALA A . n A 1 334 VAL 334 334 334 VAL VAL A . n A 1 335 LYS 335 335 335 LYS LYS A . n A 1 336 ASN 336 336 336 ASN ASN A . n A 1 337 PHE 337 337 337 PHE PHE A . n A 1 338 VAL 338 338 338 VAL VAL A . n A 1 339 ASP 339 339 339 ASP ASP A . n A 1 340 TYR 340 340 340 TYR TYR A . n A 1 341 TYR 341 341 341 TYR TYR A . n A 1 342 PHE 342 342 342 PHE PHE A . n A 1 343 ASP 343 343 343 ASP ASP A . n A 1 344 VAL 344 344 344 VAL VAL A . n A 1 345 SER 345 345 345 SER SER A . n A 1 346 ASN 346 346 346 ASN ASN A . n A 1 347 LYS 347 347 347 LYS LYS A . n A 1 348 VAL 348 348 348 VAL VAL A . n A 1 349 LYS 349 349 349 LYS LYS A . n A 1 350 ASP 350 350 350 ASP ASP A . n A 1 351 ARG 351 351 351 ARG ARG A . n A 1 352 PHE 352 352 352 PHE PHE A . n A 1 353 TRP 353 353 353 TRP TRP A . n A 1 354 PHE 354 354 354 PHE PHE A . n A 1 355 TYR 355 355 355 TYR TYR A . n A 1 356 GLN 356 356 356 GLN GLN A . n A 1 357 LEU 357 357 357 LEU LEU A . n A 1 358 ASP 358 358 358 ASP ASP A . n A 1 359 VAL 359 359 359 VAL VAL A . n A 1 360 HIS 360 360 360 HIS HIS A . n A 1 361 GLY 361 361 361 GLY GLY A . n A 1 362 GLY 362 362 362 GLY GLY A . n A 1 363 LYS 363 363 363 LYS LYS A . n A 1 364 ASN 364 364 364 ASN ASN A . n A 1 365 SER 365 365 365 SER SER A . n A 1 366 GLN 366 366 366 GLN GLN A . n A 1 367 VAL 367 367 367 VAL VAL A . n A 1 368 THR 368 368 368 THR THR A . n A 1 369 LYS 369 369 369 LYS LYS A . n A 1 370 VAL 370 370 370 VAL VAL A . n A 1 371 THR 371 371 371 THR THR A . n A 1 372 ASN 372 372 372 ASN ASN A . n A 1 373 ALA 373 373 373 ALA ALA A . n A 1 374 GLU 374 374 374 GLU GLU A . n A 1 375 THR 375 375 375 THR THR A . n A 1 376 ALA 376 376 376 ALA ALA A . n A 1 377 TYR 377 377 377 TYR TYR A . n A 1 378 PRO 378 378 378 PRO PRO A . n A 1 379 HIS 379 379 379 HIS HIS A . n A 1 380 ARG 380 380 380 ARG ARG A . n A 1 381 ASP 381 381 381 ASP ASP A . n A 1 382 LYS 382 382 382 LYS LYS A . n A 1 383 LEU 383 383 383 LEU LEU A . n A 1 384 TRP 384 384 384 TRP TRP A . n A 1 385 LEU 385 385 385 LEU LEU A . n A 1 386 ILE 386 386 386 ILE ILE A . n A 1 387 GLN 387 387 387 GLN GLN A . n A 1 388 PHE 388 388 388 PHE PHE A . n A 1 389 TYR 389 389 389 TYR TYR A . n A 1 390 ASP 390 390 390 ASP ASP A . n A 1 391 ARG 391 391 391 ARG ARG A . n A 1 392 TYR 392 392 392 TYR TYR A . n A 1 393 ASP 393 393 393 ASP ASP A . n A 1 394 ASN 394 394 394 ASN ASN A . n A 1 395 ASN 395 395 395 ASN ASN A . n A 1 396 GLN 396 396 396 GLN GLN A . n A 1 397 THR 397 397 397 THR THR A . n A 1 398 TYR 398 398 398 TYR TYR A . n A 1 399 PRO 399 399 399 PRO PRO A . n A 1 400 GLU 400 400 400 GLU GLU A . n A 1 401 THR 401 401 401 THR THR A . n A 1 402 SER 402 402 402 SER SER A . n A 1 403 PHE 403 403 403 PHE PHE A . n A 1 404 LYS 404 404 404 LYS LYS A . n A 1 405 PHE 405 405 405 PHE PHE A . n A 1 406 LEU 406 406 406 LEU LEU A . n A 1 407 ASP 407 407 407 ASP ASP A . n A 1 408 GLY 408 408 408 GLY GLY A . n A 1 409 TRP 409 409 409 TRP TRP A . n A 1 410 VAL 410 410 410 VAL VAL A . n A 1 411 ASN 411 411 411 ASN ASN A . n A 1 412 SER 412 412 412 SER SER A . n A 1 413 VAL 413 413 413 VAL VAL A . n A 1 414 THR 414 414 414 THR THR A . n A 1 415 LYS 415 415 415 LYS LYS A . n A 1 416 ALA 416 416 416 ALA ALA A . n A 1 417 LEU 417 417 417 LEU LEU A . n A 1 418 PRO 418 418 418 PRO PRO A . n A 1 419 LYS 419 419 419 LYS LYS A . n A 1 420 SER 420 420 420 SER SER A . n A 1 421 ASP 421 421 421 ASP ASP A . n A 1 422 TRP 422 422 422 TRP TRP A . n A 1 423 GLY 423 423 423 GLY GLY A . n A 1 424 MET 424 424 424 MET MET A . n A 1 425 TYR 425 425 425 TYR TYR A . n A 1 426 ILE 426 426 426 ILE ILE A . n A 1 427 ASN 427 427 427 ASN ASN A . n A 1 428 TYR 428 428 428 TYR TYR A . n A 1 429 ALA 429 429 429 ALA ALA A . n A 1 430 ASP 430 430 430 ASP ASP A . n A 1 431 PRO 431 431 431 PRO PRO A . n A 1 432 ARG 432 432 432 ARG ARG A . n A 1 433 MET 433 433 433 MET MET A . n A 1 434 ASP 434 434 434 ASP ASP A . n A 1 435 ARG 435 435 435 ARG ARG A . n A 1 436 ASP 436 436 436 ASP ASP A . n A 1 437 TYR 437 437 437 TYR TYR A . n A 1 438 ALA 438 438 438 ALA ALA A . n A 1 439 THR 439 439 439 THR THR A . n A 1 440 LYS 440 440 440 LYS LYS A . n A 1 441 VAL 441 441 441 VAL VAL A . n A 1 442 TYR 442 442 442 TYR TYR A . n A 1 443 TYR 443 443 443 TYR TYR A . n A 1 444 GLY 444 444 444 GLY GLY A . n A 1 445 GLU 445 445 445 GLU GLU A . n A 1 446 ASN 446 446 446 ASN ASN A . n A 1 447 LEU 447 447 447 LEU LEU A . n A 1 448 ALA 448 448 448 ALA ALA A . n A 1 449 ARG 449 449 449 ARG ARG A . n A 1 450 LEU 450 450 450 LEU LEU A . n A 1 451 GLN 451 451 451 GLN GLN A . n A 1 452 LYS 452 452 452 LYS LYS A . n A 1 453 LEU 453 453 453 LEU LEU A . n A 1 454 LYS 454 454 454 LYS LYS A . n A 1 455 ALA 455 455 455 ALA ALA A . n A 1 456 LYS 456 456 456 LYS LYS A . n A 1 457 PHE 457 457 457 PHE PHE A . n A 1 458 ASP 458 458 458 ASP ASP A . n A 1 459 PRO 459 459 459 PRO PRO A . n A 1 460 THR 460 460 460 THR THR A . n A 1 461 ASP 461 461 461 ASP ASP A . n A 1 462 ARG 462 462 462 ARG ARG A . n A 1 463 PHE 463 463 463 PHE PHE A . n A 1 464 TYR 464 464 464 TYR TYR A . n A 1 465 TYR 465 465 465 TYR TYR A . n A 1 466 PRO 466 466 466 PRO PRO A . n A 1 467 GLN 467 467 467 GLN GLN A . n A 1 468 ALA 468 468 468 ALA ALA A . n A 1 469 VAL 469 469 469 VAL VAL A . n A 1 470 ARG 470 470 470 ARG ARG A . n A 1 471 PRO 471 471 471 PRO PRO A . n A 1 472 VAL 472 472 472 VAL VAL A . n A 1 473 LYS 473 473 473 LYS LYS A . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code B 2 FAD 1 501 501 FAD FAD A . C 3 NAG 1 502 502 NAG NAG A . D 4 ZN 1 601 601 ZN ZN A . E 4 ZN 1 602 602 ZN ZN A . F 4 ZN 1 603 603 ZN ZN A . G 5 ABL 1 604 604 ABL ABL A . H 5 ABL 1 605 605 ABL ABL A . I 6 TRS 1 606 606 TRS TRS A . J 7 SO4 1 607 607 SO4 SO4 A . K 8 CL 1 608 608 CL CL A . L 8 CL 1 609 609 CL CL A . M 8 CL 1 610 610 CL CL A . N 8 CL 1 611 611 CL CL A . O 9 HOH 1 612 612 HOH HOH A . O 9 HOH 2 613 613 HOH HOH A . O 9 HOH 3 614 614 HOH HOH A . O 9 HOH 4 615 615 HOH HOH A . O 9 HOH 5 616 616 HOH HOH A . O 9 HOH 6 617 617 HOH HOH A . O 9 HOH 7 618 618 HOH HOH A . O 9 HOH 8 619 619 HOH HOH A . O 9 HOH 9 620 620 HOH HOH A . O 9 HOH 10 621 621 HOH HOH A . O 9 HOH 11 622 622 HOH HOH A . O 9 HOH 12 623 623 HOH HOH A . O 9 HOH 13 624 624 HOH HOH A . O 9 HOH 14 625 625 HOH HOH A . O 9 HOH 15 626 626 HOH HOH A . O 9 HOH 16 627 627 HOH HOH A . O 9 HOH 17 630 630 HOH HOH A . O 9 HOH 18 631 631 HOH HOH A . O 9 HOH 19 632 632 HOH HOH A . O 9 HOH 20 633 633 HOH HOH A . O 9 HOH 21 634 634 HOH HOH A . O 9 HOH 22 635 635 HOH HOH A . O 9 HOH 23 636 636 HOH HOH A . O 9 HOH 24 637 637 HOH HOH A . O 9 HOH 25 638 638 HOH HOH A . O 9 HOH 26 639 639 HOH HOH A . O 9 HOH 27 640 640 HOH HOH A . O 9 HOH 28 641 641 HOH HOH A . O 9 HOH 29 642 642 HOH HOH A . O 9 HOH 30 643 643 HOH HOH A . O 9 HOH 31 644 644 HOH HOH A . O 9 HOH 32 645 645 HOH HOH A . O 9 HOH 33 646 646 HOH HOH A . O 9 HOH 34 647 647 HOH HOH A . O 9 HOH 35 648 648 HOH HOH A . O 9 HOH 36 649 649 HOH HOH A . O 9 HOH 37 650 650 HOH HOH A . O 9 HOH 38 651 651 HOH HOH A . O 9 HOH 39 652 652 HOH HOH A . O 9 HOH 40 653 653 HOH HOH A . O 9 HOH 41 654 654 HOH HOH A . O 9 HOH 42 655 655 HOH HOH A . O 9 HOH 43 656 656 HOH HOH A . O 9 HOH 44 657 657 HOH HOH A . O 9 HOH 45 658 658 HOH HOH A . O 9 HOH 46 659 659 HOH HOH A . O 9 HOH 47 660 660 HOH HOH A . O 9 HOH 48 661 661 HOH HOH A . O 9 HOH 49 662 662 HOH HOH A . O 9 HOH 50 663 663 HOH HOH A . O 9 HOH 51 664 664 HOH HOH A . O 9 HOH 52 665 665 HOH HOH A . O 9 HOH 53 666 666 HOH HOH A . O 9 HOH 54 667 667 HOH HOH A . O 9 HOH 55 668 668 HOH HOH A . O 9 HOH 56 669 669 HOH HOH A . O 9 HOH 57 670 670 HOH HOH A . O 9 HOH 58 671 671 HOH HOH A . O 9 HOH 59 672 672 HOH HOH A . O 9 HOH 60 673 673 HOH HOH A . O 9 HOH 61 674 674 HOH HOH A . O 9 HOH 62 675 675 HOH HOH A . O 9 HOH 63 676 676 HOH HOH A . O 9 HOH 64 677 677 HOH HOH A . O 9 HOH 65 678 678 HOH HOH A . O 9 HOH 66 679 679 HOH HOH A . O 9 HOH 67 680 680 HOH HOH A . O 9 HOH 68 681 681 HOH HOH A . O 9 HOH 69 682 682 HOH HOH A . O 9 HOH 70 683 683 HOH HOH A . O 9 HOH 71 684 684 HOH HOH A . O 9 HOH 72 685 685 HOH HOH A . O 9 HOH 73 686 686 HOH HOH A . O 9 HOH 74 687 687 HOH HOH A . O 9 HOH 75 688 688 HOH HOH A . O 9 HOH 76 689 689 HOH HOH A . O 9 HOH 77 690 690 HOH HOH A . O 9 HOH 78 691 691 HOH HOH A . O 9 HOH 79 692 692 HOH HOH A . O 9 HOH 80 693 693 HOH HOH A . O 9 HOH 81 694 694 HOH HOH A . O 9 HOH 82 695 695 HOH HOH A . O 9 HOH 83 696 696 HOH HOH A . O 9 HOH 84 697 697 HOH HOH A . O 9 HOH 85 698 698 HOH HOH A . O 9 HOH 86 699 699 HOH HOH A . O 9 HOH 87 700 700 HOH HOH A . O 9 HOH 88 701 701 HOH HOH A . O 9 HOH 89 702 702 HOH HOH A . O 9 HOH 90 703 703 HOH HOH A . O 9 HOH 91 704 704 HOH HOH A . O 9 HOH 92 705 705 HOH HOH A . O 9 HOH 93 706 706 HOH HOH A . O 9 HOH 94 707 707 HOH HOH A . O 9 HOH 95 708 708 HOH HOH A . O 9 HOH 96 709 709 HOH HOH A . O 9 HOH 97 710 710 HOH HOH A . O 9 HOH 98 711 711 HOH HOH A . O 9 HOH 99 712 712 HOH HOH A . O 9 HOH 100 713 713 HOH HOH A . O 9 HOH 101 714 714 HOH HOH A . O 9 HOH 102 715 715 HOH HOH A . O 9 HOH 103 716 716 HOH HOH A . O 9 HOH 104 717 717 HOH HOH A . O 9 HOH 105 718 718 HOH HOH A . O 9 HOH 106 719 719 HOH HOH A . O 9 HOH 107 720 720 HOH HOH A . O 9 HOH 108 721 721 HOH HOH A . O 9 HOH 109 722 722 HOH HOH A . O 9 HOH 110 723 723 HOH HOH A . O 9 HOH 111 724 724 HOH HOH A . O 9 HOH 112 725 725 HOH HOH A . O 9 HOH 113 726 726 HOH HOH A . O 9 HOH 114 727 727 HOH HOH A . O 9 HOH 115 728 728 HOH HOH A . O 9 HOH 116 729 729 HOH HOH A . O 9 HOH 117 730 730 HOH HOH A . O 9 HOH 118 731 731 HOH HOH A . O 9 HOH 119 732 732 HOH HOH A . O 9 HOH 120 733 733 HOH HOH A . O 9 HOH 121 734 734 HOH HOH A . O 9 HOH 122 735 735 HOH HOH A . O 9 HOH 123 736 736 HOH HOH A . O 9 HOH 124 737 737 HOH HOH A . O 9 HOH 125 738 738 HOH HOH A . O 9 HOH 126 739 739 HOH HOH A . O 9 HOH 127 740 740 HOH HOH A . O 9 HOH 128 741 741 HOH HOH A . O 9 HOH 129 742 742 HOH HOH A . O 9 HOH 130 743 743 HOH HOH A . O 9 HOH 131 744 744 HOH HOH A . O 9 HOH 132 745 745 HOH HOH A . O 9 HOH 133 746 746 HOH HOH A . O 9 HOH 134 747 747 HOH HOH A . O 9 HOH 135 748 748 HOH HOH A . O 9 HOH 136 749 749 HOH HOH A . O 9 HOH 137 750 750 HOH HOH A . O 9 HOH 138 751 751 HOH HOH A . O 9 HOH 139 752 752 HOH HOH A . O 9 HOH 140 753 753 HOH HOH A . O 9 HOH 141 754 754 HOH HOH A . O 9 HOH 142 755 755 HOH HOH A . O 9 HOH 143 756 756 HOH HOH A . O 9 HOH 144 757 757 HOH HOH A . O 9 HOH 145 758 758 HOH HOH A . O 9 HOH 146 759 759 HOH HOH A . O 9 HOH 147 760 760 HOH HOH A . O 9 HOH 148 761 761 HOH HOH A . O 9 HOH 149 762 762 HOH HOH A . O 9 HOH 150 763 763 HOH HOH A . O 9 HOH 151 764 764 HOH HOH A . O 9 HOH 152 765 765 HOH HOH A . O 9 HOH 153 766 766 HOH HOH A . O 9 HOH 154 767 767 HOH HOH A . O 9 HOH 155 768 768 HOH HOH A . O 9 HOH 156 769 769 HOH HOH A . O 9 HOH 157 770 770 HOH HOH A . O 9 HOH 158 771 771 HOH HOH A . O 9 HOH 159 772 772 HOH HOH A . O 9 HOH 160 773 773 HOH HOH A . O 9 HOH 161 774 774 HOH HOH A . O 9 HOH 162 775 775 HOH HOH A . O 9 HOH 163 776 776 HOH HOH A . O 9 HOH 164 777 777 HOH HOH A . O 9 HOH 165 778 778 HOH HOH A . O 9 HOH 166 779 779 HOH HOH A . O 9 HOH 167 780 780 HOH HOH A . O 9 HOH 168 781 781 HOH HOH A . O 9 HOH 169 782 782 HOH HOH A . O 9 HOH 170 783 783 HOH HOH A . O 9 HOH 171 784 784 HOH HOH A . O 9 HOH 172 785 785 HOH HOH A . O 9 HOH 173 786 786 HOH HOH A . O 9 HOH 174 787 787 HOH HOH A . O 9 HOH 175 788 788 HOH HOH A . O 9 HOH 176 789 789 HOH HOH A . O 9 HOH 177 790 790 HOH HOH A . O 9 HOH 178 791 791 HOH HOH A . O 9 HOH 179 792 792 HOH HOH A . O 9 HOH 180 793 793 HOH HOH A . O 9 HOH 181 794 794 HOH HOH A . O 9 HOH 182 795 795 HOH HOH A . O 9 HOH 183 796 796 HOH HOH A . O 9 HOH 184 797 797 HOH HOH A . O 9 HOH 185 798 798 HOH HOH A . O 9 HOH 186 799 799 HOH HOH A . O 9 HOH 187 800 800 HOH HOH A . O 9 HOH 188 801 801 HOH HOH A . O 9 HOH 189 802 802 HOH HOH A . O 9 HOH 190 803 803 HOH HOH A . O 9 HOH 191 804 804 HOH HOH A . O 9 HOH 192 805 805 HOH HOH A . O 9 HOH 193 806 806 HOH HOH A . O 9 HOH 194 807 807 HOH HOH A . O 9 HOH 195 808 808 HOH HOH A . O 9 HOH 196 809 809 HOH HOH A . O 9 HOH 197 810 810 HOH HOH A . O 9 HOH 198 811 811 HOH HOH A . O 9 HOH 199 812 812 HOH HOH A . O 9 HOH 200 813 813 HOH HOH A . O 9 HOH 201 814 814 HOH HOH A . O 9 HOH 202 815 815 HOH HOH A . O 9 HOH 203 816 816 HOH HOH A . O 9 HOH 204 817 817 HOH HOH A . O 9 HOH 205 818 818 HOH HOH A . O 9 HOH 206 819 819 HOH HOH A . O 9 HOH 207 820 820 HOH HOH A . O 9 HOH 208 821 821 HOH HOH A . O 9 HOH 209 822 822 HOH HOH A . O 9 HOH 210 823 823 HOH HOH A . O 9 HOH 211 824 824 HOH HOH A . O 9 HOH 212 825 825 HOH HOH A . O 9 HOH 213 826 826 HOH HOH A . O 9 HOH 214 827 827 HOH HOH A . O 9 HOH 215 828 828 HOH HOH A . O 9 HOH 216 829 829 HOH HOH A . O 9 HOH 217 830 830 HOH HOH A . O 9 HOH 218 831 831 HOH HOH A . O 9 HOH 219 832 832 HOH HOH A . O 9 HOH 220 833 833 HOH HOH A . O 9 HOH 221 834 834 HOH HOH A . O 9 HOH 222 835 835 HOH HOH A . O 9 HOH 223 836 836 HOH HOH A . O 9 HOH 224 837 837 HOH HOH A . O 9 HOH 225 838 838 HOH HOH A . O 9 HOH 226 839 839 HOH HOH A . O 9 HOH 227 840 840 HOH HOH A . O 9 HOH 228 841 841 HOH HOH A . O 9 HOH 229 842 842 HOH HOH A . O 9 HOH 230 843 843 HOH HOH A . O 9 HOH 231 844 844 HOH HOH A . O 9 HOH 232 845 845 HOH HOH A . O 9 HOH 233 846 846 HOH HOH A . O 9 HOH 234 847 847 HOH HOH A . O 9 HOH 235 848 848 HOH HOH A . O 9 HOH 236 849 849 HOH HOH A . O 9 HOH 237 850 850 HOH HOH A . O 9 HOH 238 851 851 HOH HOH A . O 9 HOH 239 852 852 HOH HOH A . O 9 HOH 240 853 853 HOH HOH A . O 9 HOH 241 854 854 HOH HOH A . O 9 HOH 242 855 855 HOH HOH A . O 9 HOH 243 856 856 HOH HOH A . O 9 HOH 244 857 857 HOH HOH A . O 9 HOH 245 858 858 HOH HOH A . O 9 HOH 246 859 859 HOH HOH A . O 9 HOH 247 860 860 HOH HOH A . O 9 HOH 248 861 861 HOH HOH A . O 9 HOH 249 862 862 HOH HOH A . O 9 HOH 250 863 863 HOH HOH A . O 9 HOH 251 864 864 HOH HOH A . O 9 HOH 252 865 865 HOH HOH A . O 9 HOH 253 866 866 HOH HOH A . O 9 HOH 254 867 867 HOH HOH A . O 9 HOH 255 868 868 HOH HOH A . O 9 HOH 256 869 869 HOH HOH A . O 9 HOH 257 870 870 HOH HOH A . O 9 HOH 258 871 871 HOH HOH A . O 9 HOH 259 872 872 HOH HOH A . O 9 HOH 260 873 873 HOH HOH A . O 9 HOH 261 874 874 HOH HOH A . O 9 HOH 262 875 875 HOH HOH A . O 9 HOH 263 876 876 HOH HOH A . O 9 HOH 264 877 877 HOH HOH A . O 9 HOH 265 878 878 HOH HOH A . O 9 HOH 266 879 879 HOH HOH A . O 9 HOH 267 880 880 HOH HOH A . O 9 HOH 268 881 881 HOH HOH A . O 9 HOH 269 882 882 HOH HOH A . O 9 HOH 270 883 883 HOH HOH A . O 9 HOH 271 884 884 HOH HOH A . O 9 HOH 272 885 885 HOH HOH A . O 9 HOH 273 886 886 HOH HOH A . O 9 HOH 274 887 887 HOH HOH A . O 9 HOH 275 888 888 HOH HOH A . O 9 HOH 276 889 889 HOH HOH A . O 9 HOH 277 890 890 HOH HOH A . O 9 HOH 278 891 891 HOH HOH A . O 9 HOH 279 892 892 HOH HOH A . O 9 HOH 280 893 893 HOH HOH A . O 9 HOH 281 894 894 HOH HOH A . O 9 HOH 282 895 895 HOH HOH A . O 9 HOH 283 896 896 HOH HOH A . O 9 HOH 284 897 897 HOH HOH A . O 9 HOH 285 898 898 HOH HOH A . O 9 HOH 286 899 899 HOH HOH A . O 9 HOH 287 900 900 HOH HOH A . O 9 HOH 288 901 901 HOH HOH A . O 9 HOH 289 902 902 HOH HOH A . O 9 HOH 290 903 903 HOH HOH A . O 9 HOH 291 904 904 HOH HOH A . O 9 HOH 292 905 905 HOH HOH A . O 9 HOH 293 906 906 HOH HOH A . O 9 HOH 294 907 907 HOH HOH A . O 9 HOH 295 908 908 HOH HOH A . O 9 HOH 296 909 909 HOH HOH A . O 9 HOH 297 910 910 HOH HOH A . O 9 HOH 298 911 911 HOH HOH A . O 9 HOH 299 912 912 HOH HOH A . O 9 HOH 300 913 913 HOH HOH A . O 9 HOH 301 914 914 HOH HOH A . O 9 HOH 302 915 915 HOH HOH A . O 9 HOH 303 916 916 HOH HOH A . O 9 HOH 304 917 917 HOH HOH A . O 9 HOH 305 918 918 HOH HOH A . O 9 HOH 306 919 919 HOH HOH A . O 9 HOH 307 920 920 HOH HOH A . O 9 HOH 308 921 921 HOH HOH A . O 9 HOH 309 922 922 HOH HOH A . O 9 HOH 310 923 923 HOH HOH A . O 9 HOH 311 924 924 HOH HOH A . O 9 HOH 312 925 925 HOH HOH A . O 9 HOH 313 926 926 HOH HOH A . O 9 HOH 314 927 927 HOH HOH A . O 9 HOH 315 928 928 HOH HOH A . O 9 HOH 316 929 929 HOH HOH A . O 9 HOH 317 930 930 HOH HOH A . O 9 HOH 318 931 931 HOH HOH A . O 9 HOH 319 932 932 HOH HOH A . O 9 HOH 320 933 933 HOH HOH A . O 9 HOH 321 934 934 HOH HOH A . O 9 HOH 322 935 935 HOH HOH A . O 9 HOH 323 936 936 HOH HOH A . O 9 HOH 324 937 937 HOH HOH A . O 9 HOH 325 938 938 HOH HOH A . O 9 HOH 326 939 939 HOH HOH A . O 9 HOH 327 940 940 HOH HOH A . O 9 HOH 328 941 941 HOH HOH A . O 9 HOH 329 942 942 HOH HOH A . O 9 HOH 330 943 943 HOH HOH A . O 9 HOH 331 944 944 HOH HOH A . O 9 HOH 332 945 945 HOH HOH A . O 9 HOH 333 946 946 HOH HOH A . O 9 HOH 334 947 947 HOH HOH A . O 9 HOH 335 948 948 HOH HOH A . O 9 HOH 336 949 949 HOH HOH A . O 9 HOH 337 950 950 HOH HOH A . O 9 HOH 338 951 951 HOH HOH A . O 9 HOH 339 952 952 HOH HOH A . O 9 HOH 340 953 953 HOH HOH A . O 9 HOH 341 954 954 HOH HOH A . O 9 HOH 342 955 955 HOH HOH A . O 9 HOH 343 956 956 HOH HOH A . O 9 HOH 344 957 957 HOH HOH A . O 9 HOH 345 958 958 HOH HOH A . O 9 HOH 346 959 959 HOH HOH A . O 9 HOH 347 960 960 HOH HOH A . O 9 HOH 348 961 961 HOH HOH A . O 9 HOH 349 962 962 HOH HOH A . O 9 HOH 350 963 963 HOH HOH A . O 9 HOH 351 964 964 HOH HOH A . O 9 HOH 352 965 965 HOH HOH A . O 9 HOH 353 966 966 HOH HOH A . O 9 HOH 354 967 967 HOH HOH A . O 9 HOH 355 968 968 HOH HOH A . O 9 HOH 356 969 969 HOH HOH A . O 9 HOH 357 970 970 HOH HOH A . O 9 HOH 358 971 971 HOH HOH A . O 9 HOH 359 972 972 HOH HOH A . O 9 HOH 360 973 973 HOH HOH A . O 9 HOH 361 974 974 HOH HOH A . O 9 HOH 362 975 975 HOH HOH A . O 9 HOH 363 976 976 HOH HOH A . O 9 HOH 364 977 977 HOH HOH A . O 9 HOH 365 978 978 HOH HOH A . O 9 HOH 366 979 979 HOH HOH A . O 9 HOH 367 980 980 HOH HOH A . O 9 HOH 368 981 981 HOH HOH A . O 9 HOH 369 982 982 HOH HOH A . O 9 HOH 370 983 983 HOH HOH A . O 9 HOH 371 984 984 HOH HOH A . O 9 HOH 372 985 985 HOH HOH A . O 9 HOH 373 986 986 HOH HOH A . O 9 HOH 374 987 987 HOH HOH A . O 9 HOH 375 988 988 HOH HOH A . O 9 HOH 376 989 989 HOH HOH A . O 9 HOH 377 990 990 HOH HOH A . O 9 HOH 378 991 991 HOH HOH A . O 9 HOH 379 992 992 HOH HOH A . O 9 HOH 380 993 993 HOH HOH A . O 9 HOH 381 994 994 HOH HOH A . O 9 HOH 382 995 995 HOH HOH A . O 9 HOH 383 996 996 HOH HOH A . O 9 HOH 384 997 997 HOH HOH A . O 9 HOH 385 998 998 HOH HOH A . O 9 HOH 386 999 999 HOH HOH A . O 9 HOH 387 1000 1000 HOH HOH A . O 9 HOH 388 1001 1001 HOH HOH A . O 9 HOH 389 1002 1002 HOH HOH A . O 9 HOH 390 1003 1003 HOH HOH A . O 9 HOH 391 1004 1004 HOH HOH A . O 9 HOH 392 1005 1005 HOH HOH A . O 9 HOH 393 1006 1006 HOH HOH A . O 9 HOH 394 1007 1007 HOH HOH A . O 9 HOH 395 1008 1008 HOH HOH A . O 9 HOH 396 1009 1009 HOH HOH A . O 9 HOH 397 1010 1010 HOH HOH A . O 9 HOH 398 1011 1011 HOH HOH A . O 9 HOH 399 1012 1012 HOH HOH A . O 9 HOH 400 1013 1013 HOH HOH A . O 9 HOH 401 1014 1014 HOH HOH A . O 9 HOH 402 1015 1015 HOH HOH A . O 9 HOH 403 1016 1016 HOH HOH A . O 9 HOH 404 1017 1017 HOH HOH A . O 9 HOH 405 1018 1018 HOH HOH A . O 9 HOH 406 1019 1019 HOH HOH A . O 9 HOH 407 1020 1020 HOH HOH A . O 9 HOH 408 1021 1021 HOH HOH A . O 9 HOH 409 1022 1022 HOH HOH A . O 9 HOH 410 1023 1023 HOH HOH A . O 9 HOH 411 1024 1024 HOH HOH A . O 9 HOH 412 1025 1025 HOH HOH A . O 9 HOH 413 1026 1026 HOH HOH A . O 9 HOH 414 1027 1027 HOH HOH A . O 9 HOH 415 1028 1028 HOH HOH A . O 9 HOH 416 1029 1029 HOH HOH A . O 9 HOH 417 1030 1030 HOH HOH A . O 9 HOH 418 1031 1031 HOH HOH A . O 9 HOH 419 1032 1032 HOH HOH A . O 9 HOH 420 1033 1033 HOH HOH A . O 9 HOH 421 1034 1034 HOH HOH A . O 9 HOH 422 1035 1035 HOH HOH A . O 9 HOH 423 1036 1036 HOH HOH A . O 9 HOH 424 1037 1037 HOH HOH A . O 9 HOH 425 1038 1038 HOH HOH A . O 9 HOH 426 1039 1039 HOH HOH A . O 9 HOH 427 1040 1040 HOH HOH A . O 9 HOH 428 1041 1041 HOH HOH A . O 9 HOH 429 1042 1042 HOH HOH A . O 9 HOH 430 1043 1043 HOH HOH A . O 9 HOH 431 1044 1044 HOH HOH A . O 9 HOH 432 1045 1045 HOH HOH A . O 9 HOH 433 1046 1046 HOH HOH A . O 9 HOH 434 1047 1047 HOH HOH A . O 9 HOH 435 1048 1048 HOH HOH A . O 9 HOH 436 1049 1049 HOH HOH A . O 9 HOH 437 1050 1050 HOH HOH A . O 9 HOH 438 1051 1051 HOH HOH A . O 9 HOH 439 1052 1052 HOH HOH A . O 9 HOH 440 1053 1053 HOH HOH A . O 9 HOH 441 1054 1054 HOH HOH A . O 9 HOH 442 1055 1055 HOH HOH A . O 9 HOH 443 1056 1056 HOH HOH A . O 9 HOH 444 1057 1057 HOH HOH A . O 9 HOH 445 1058 1058 HOH HOH A . O 9 HOH 446 1059 1059 HOH HOH A . O 9 HOH 447 1060 1060 HOH HOH A . O 9 HOH 448 1061 1061 HOH HOH A . O 9 HOH 449 1062 1062 HOH HOH A . O 9 HOH 450 1063 1063 HOH HOH A . O 9 HOH 451 1064 1064 HOH HOH A . O 9 HOH 452 1065 1065 HOH HOH A . O 9 HOH 453 1066 1066 HOH HOH A . O 9 HOH 454 1067 1067 HOH HOH A . O 9 HOH 455 1068 1068 HOH HOH A . O 9 HOH 456 1069 1069 HOH HOH A . O 9 HOH 457 1070 1070 HOH HOH A . O 9 HOH 458 1071 1071 HOH HOH A . O 9 HOH 459 1072 1072 HOH HOH A . O 9 HOH 460 1073 1073 HOH HOH A . O 9 HOH 461 1074 1074 HOH HOH A . O 9 HOH 462 1075 1075 HOH HOH A . O 9 HOH 463 1076 1076 HOH HOH A . O 9 HOH 464 1077 1077 HOH HOH A . O 9 HOH 465 1078 1078 HOH HOH A . O 9 HOH 466 1079 1079 HOH HOH A . O 9 HOH 467 1080 1080 HOH HOH A . O 9 HOH 468 1081 1081 HOH HOH A . O 9 HOH 469 1082 1082 HOH HOH A . O 9 HOH 470 1083 1083 HOH HOH A . O 9 HOH 471 1084 1084 HOH HOH A . O 9 HOH 472 1085 1085 HOH HOH A . O 9 HOH 473 1086 1086 HOH HOH A . O 9 HOH 474 1087 1087 HOH HOH A . O 9 HOH 475 1088 1088 HOH HOH A . O 9 HOH 476 1089 1089 HOH HOH A . O 9 HOH 477 1090 1090 HOH HOH A . O 9 HOH 478 1091 1091 HOH HOH A . O 9 HOH 479 1092 1092 HOH HOH A . O 9 HOH 480 1093 1093 HOH HOH A . O 9 HOH 481 1094 1094 HOH HOH A . O 9 HOH 482 1095 1095 HOH HOH A . O 9 HOH 483 1096 1096 HOH HOH A . O 9 HOH 484 1097 1097 HOH HOH A . O 9 HOH 485 1098 1098 HOH HOH A . O 9 HOH 486 1099 1099 HOH HOH A . O 9 HOH 487 1100 1100 HOH HOH A . O 9 HOH 488 1101 1101 HOH HOH A . O 9 HOH 489 1102 1102 HOH HOH A . O 9 HOH 490 1103 1103 HOH HOH A . O 9 HOH 491 1104 1104 HOH HOH A . O 9 HOH 492 1105 1105 HOH HOH A . O 9 HOH 493 1106 1106 HOH HOH A . O 9 HOH 494 1107 1107 HOH HOH A . O 9 HOH 495 1108 1108 HOH HOH A . O 9 HOH 496 1109 1109 HOH HOH A . O 9 HOH 497 1110 1110 HOH HOH A . O 9 HOH 498 1111 1111 HOH HOH A . O 9 HOH 499 1112 1112 HOH HOH A . O 9 HOH 500 1113 1113 HOH HOH A . O 9 HOH 501 1114 1114 HOH HOH A . O 9 HOH 502 1115 1115 HOH HOH A . O 9 HOH 503 1116 1116 HOH HOH A . O 9 HOH 504 1117 1117 HOH HOH A . O 9 HOH 505 1118 1118 HOH HOH A . O 9 HOH 506 1119 1119 HOH HOH A . O 9 HOH 507 1120 1120 HOH HOH A . O 9 HOH 508 1121 1121 HOH HOH A . O 9 HOH 509 1122 1122 HOH HOH A . O 9 HOH 510 1123 1123 HOH HOH A . O 9 HOH 511 1124 1124 HOH HOH A . O 9 HOH 512 1125 1125 HOH HOH A . O 9 HOH 513 1126 1126 HOH HOH A . O 9 HOH 514 1127 1127 HOH HOH A . O 9 HOH 515 1128 1128 HOH HOH A . O 9 HOH 516 1129 1129 HOH HOH A . O 9 HOH 517 1130 1130 HOH HOH A . O 9 HOH 518 1131 1131 HOH HOH A . O 9 HOH 519 1132 1132 HOH HOH A . O 9 HOH 520 1133 1133 HOH HOH A . O 9 HOH 521 1134 1134 HOH HOH A . O 9 HOH 522 1135 1135 HOH HOH A . O 9 HOH 523 1136 1136 HOH HOH A . O 9 HOH 524 1137 1137 HOH HOH A . O 9 HOH 525 1138 1138 HOH HOH A . O 9 HOH 526 1139 1139 HOH HOH A . O 9 HOH 527 1140 1140 HOH HOH A . O 9 HOH 528 1141 1141 HOH HOH A . O 9 HOH 529 1142 1142 HOH HOH A . O 9 HOH 530 1143 1143 HOH HOH A . O 9 HOH 531 1144 1144 HOH HOH A . O 9 HOH 532 1145 1145 HOH HOH A . O 9 HOH 533 1146 1146 HOH HOH A . O 9 HOH 534 1147 1147 HOH HOH A . O 9 HOH 535 1148 1148 HOH HOH A . O 9 HOH 536 1149 1149 HOH HOH A . O 9 HOH 537 1150 1150 HOH HOH A . O 9 HOH 538 1151 1151 HOH HOH A . O 9 HOH 539 1152 1152 HOH HOH A . O 9 HOH 540 1153 1153 HOH HOH A . O 9 HOH 541 1154 1154 HOH HOH A . O 9 HOH 542 1155 1155 HOH HOH A . O 9 HOH 543 1156 1156 HOH HOH A . O 9 HOH 544 1157 1157 HOH HOH A . O 9 HOH 545 1158 1158 HOH HOH A . O 9 HOH 546 1159 1159 HOH HOH A . O 9 HOH 547 1160 1160 HOH HOH A . O 9 HOH 548 1161 1161 HOH HOH A . O 9 HOH 549 1162 1162 HOH HOH A . O 9 HOH 550 1163 1163 HOH HOH A . O 9 HOH 551 1164 1164 HOH HOH A . O 9 HOH 552 1165 1165 HOH HOH A . O 9 HOH 553 1166 1166 HOH HOH A . O 9 HOH 554 1167 1167 HOH HOH A . O 9 HOH 555 1168 1168 HOH HOH A . O 9 HOH 556 1169 1169 HOH HOH A . O 9 HOH 557 1170 1170 HOH HOH A . O 9 HOH 558 1171 1171 HOH HOH A . O 9 HOH 559 1172 1172 HOH HOH A . O 9 HOH 560 1173 1173 HOH HOH A . O 9 HOH 561 1174 1174 HOH HOH A . O 9 HOH 562 1175 1175 HOH HOH A . O 9 HOH 563 1176 1176 HOH HOH A . O 9 HOH 564 1177 1177 HOH HOH A . O 9 HOH 565 1178 1178 HOH HOH A . O 9 HOH 566 1179 1179 HOH HOH A . O 9 HOH 567 1180 1180 HOH HOH A . O 9 HOH 568 1181 1181 HOH HOH A . O 9 HOH 569 1182 1182 HOH HOH A . O 9 HOH 570 1183 1183 HOH HOH A . O 9 HOH 571 1184 1184 HOH HOH A . O 9 HOH 572 1185 1185 HOH HOH A . O 9 HOH 573 1186 1186 HOH HOH A . O 9 HOH 574 1187 1187 HOH HOH A . O 9 HOH 575 1188 1188 HOH HOH A . O 9 HOH 576 1189 1189 HOH HOH A . O 9 HOH 577 1190 1190 HOH HOH A . O 9 HOH 578 1191 1191 HOH HOH A . O 9 HOH 579 1192 1192 HOH HOH A . O 9 HOH 580 1193 1193 HOH HOH A . O 9 HOH 581 1194 1194 HOH HOH A . O 9 HOH 582 1195 1195 HOH HOH A . O 9 HOH 583 1196 1196 HOH HOH A . O 9 HOH 584 1197 1197 HOH HOH A . O 9 HOH 585 1198 1198 HOH HOH A . O 9 HOH 586 1199 1199 HOH HOH A . O 9 HOH 587 1200 1200 HOH HOH A . O 9 HOH 588 1201 1201 HOH HOH A . O 9 HOH 589 1202 1202 HOH HOH A . O 9 HOH 590 1203 1203 HOH HOH A . O 9 HOH 591 1204 1204 HOH HOH A . O 9 HOH 592 1205 1205 HOH HOH A . O 9 HOH 593 1206 1206 HOH HOH A . O 9 HOH 594 1207 1207 HOH HOH A . O 9 HOH 595 1208 1208 HOH HOH A . O 9 HOH 596 1209 1209 HOH HOH A . O 9 HOH 597 1210 1210 HOH HOH A . O 9 HOH 598 1211 1211 HOH HOH A . O 9 HOH 599 1212 1212 HOH HOH A . O 9 HOH 600 1213 1213 HOH HOH A . O 9 HOH 601 1214 1214 HOH HOH A . O 9 HOH 602 1215 1215 HOH HOH A . O 9 HOH 603 1216 1216 HOH HOH A . O 9 HOH 604 1217 1217 HOH HOH A . O 9 HOH 605 1218 1218 HOH HOH A . O 9 HOH 606 1219 1219 HOH HOH A . O 9 HOH 607 1220 1220 HOH HOH A . O 9 HOH 608 1221 1221 HOH HOH A . O 9 HOH 609 1222 1222 HOH HOH A . O 9 HOH 610 1223 1223 HOH HOH A . O 9 HOH 611 1224 1224 HOH HOH A . O 9 HOH 612 1225 1225 HOH HOH A . O 9 HOH 613 1226 1226 HOH HOH A . # _pdbx_struct_mod_residue.id 1 _pdbx_struct_mod_residue.label_asym_id A _pdbx_struct_mod_residue.label_comp_id ASN _pdbx_struct_mod_residue.label_seq_id 222 _pdbx_struct_mod_residue.auth_asym_id A _pdbx_struct_mod_residue.auth_comp_id ASN _pdbx_struct_mod_residue.auth_seq_id 222 _pdbx_struct_mod_residue.PDB_ins_code ? _pdbx_struct_mod_residue.parent_comp_id ASN _pdbx_struct_mod_residue.details 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_struct_special_symmetry.id _pdbx_struct_special_symmetry.PDB_model_num _pdbx_struct_special_symmetry.auth_asym_id _pdbx_struct_special_symmetry.auth_comp_id _pdbx_struct_special_symmetry.auth_seq_id _pdbx_struct_special_symmetry.PDB_ins_code _pdbx_struct_special_symmetry.label_asym_id _pdbx_struct_special_symmetry.label_comp_id _pdbx_struct_special_symmetry.label_seq_id 1 1 A ZN 602 ? E ZN . 2 1 A ZN 603 ? F ZN . 3 1 A HOH 616 ? O HOH . 4 1 A HOH 704 ? O HOH . # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 OE2 ? A GLU 231 ? A GLU 231 ? 1_555 ZN ? F ZN . ? A ZN 603 ? 1_555 OD2 ? A ASP 235 ? A ASP 235 ? 1_555 118.9 ? 2 OD1 ? A ASP 306 ? A ASP 306 ? 1_555 ZN ? E ZN . ? A ZN 602 ? 1_555 ND1 ? A HIS 307 ? A HIS 307 ? 1_555 101.4 ? 3 ND1 ? A HIS 114 ? A HIS 114 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 OD1 ? A ASP 309 ? A ASP 309 ? 1_555 88.4 ? 4 ND1 ? A HIS 114 ? A HIS 114 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 O ? O HOH . ? A HOH 643 ? 1_555 115.7 ? 5 OD1 ? A ASP 309 ? A ASP 309 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 O ? O HOH . ? A HOH 643 ? 1_555 110.0 ? 6 ND1 ? A HIS 114 ? A HIS 114 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 O ? O HOH . ? A HOH 701 ? 1_555 112.9 ? 7 OD1 ? A ASP 309 ? A ASP 309 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 O ? O HOH . ? A HOH 701 ? 1_555 118.2 ? 8 O ? O HOH . ? A HOH 643 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 O ? O HOH . ? A HOH 701 ? 1_555 110.3 ? 9 ND1 ? A HIS 114 ? A HIS 114 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 OD2 ? A ASP 309 ? A ASP 309 ? 1_555 146.1 ? 10 OD1 ? A ASP 309 ? A ASP 309 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 OD2 ? A ASP 309 ? A ASP 309 ? 1_555 59.6 ? 11 O ? O HOH . ? A HOH 643 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 OD2 ? A ASP 309 ? A ASP 309 ? 1_555 87.8 ? 12 O ? O HOH . ? A HOH 701 ? 1_555 ZN ? D ZN . ? A ZN 601 ? 1_555 OD2 ? A ASP 309 ? A ASP 309 ? 1_555 77.4 ? # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2012-04-18 2 'Structure model' 1 1 2017-11-08 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Refinement description' # _pdbx_audit_revision_category.ordinal 1 _pdbx_audit_revision_category.revision_ordinal 2 _pdbx_audit_revision_category.data_content_type 'Structure model' _pdbx_audit_revision_category.category software # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal CrysalisPro 'data collection' . ? 1 MOLREP phasing . ? 2 REFMAC refinement 5.6.0060 ? 3 CrysalisPro 'data reduction' . ? 4 Jana2006 'data scaling' . ? 5 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 SER A 67 ? ? -103.76 -84.30 2 1 SER A 176 ? ? -172.54 -176.66 3 1 ALA A 190 ? ? -141.57 31.76 4 1 TYR A 428 ? ? -110.31 60.30 5 1 ARG A 432 ? ? -87.30 49.13 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 'FLAVIN-ADENINE DINUCLEOTIDE' FAD 3 N-ACETYL-D-GLUCOSAMINE NAG 4 'ZINC ION' ZN 5 '(2R,3R,4R,5R)-4,5-dihydroxy-2-(hydroxymethyl)-6-oxopiperidin-3-yl beta-D-glucopyranoside' ABL 6 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL TRS 7 'SULFATE ION' SO4 8 'CHLORIDE ION' CL 9 water HOH #