diff --git a/build.gradle b/build.gradle index c2c41298..ee4bc11f 100644 --- a/build.gradle +++ b/build.gradle @@ -18,7 +18,7 @@ apply plugin: 'groovy' apply plugin: 'java' group = 'cz.siret' -version = '2.5.0-dev.4.2' +version = '2.5.0-dev.4.3' description = 'Ligand binding site prediction based on machine learning.' diff --git a/src/main/groovy/cz/siret/prank/geom/Struct.groovy b/src/main/groovy/cz/siret/prank/geom/Struct.groovy index c548c2b6..d337a59e 100644 --- a/src/main/groovy/cz/siret/prank/geom/Struct.groovy +++ b/src/main/groovy/cz/siret/prank/geom/Struct.groovy @@ -217,8 +217,8 @@ class Struct { } private static int getLastTerminalResidue(List chainGroups) { - for (int i=chainGroups.size()-1; i<=0; i--) { - if (isTerminalResidue(chainGroups[i])) { + for (int i=chainGroups.size()-1; i>=0; i--) { + if (isAminoAcidResidueHeuristic(i, chainGroups) && isTerminalResidue(chainGroups[i])) { return i } } @@ -231,17 +231,22 @@ class Struct { int n = chainGroups.size() List res = new ArrayList<>(n) - log.info "groups in chain {}: {}", getAuthorId(chain), n + log.info "all groups in chain {}: {}", getAuthorId(chain), n - int lastTerminalResidueIdx = getLastTerminalResidue(chainGroups) + //int lastTerminalResidueIdx = getLastTerminalResidue(chainGroups) + //log.info "lastTerminalResidueIdx: {}", lastTerminalResidueIdx for (int i=0; i!=n; i++) { + Group g = chainGroups[i] if (isAminoAcidResidueHeuristic(i, chainGroups)) { - Group g = chainGroups[i] res.add g - if (i == lastTerminalResidueIdx) { - break // this is done so amino acid ligands at the end are excluded - } + + // Note: commented out because this just doesn't work in proteins with discontinued chains (OXT atom is not present at the last residue) + //if (i == lastTerminalResidueIdx) { + // break // this is done so amino acid ligands at the end are excluded + //} + } else { + log.warn "group {} ({}) considered non-protein", i, g.getPDBName() } } diff --git a/src/test/groovy/cz/siret/prank/DiscontinuedChainsTest.groovy b/src/test/groovy/cz/siret/prank/DiscontinuedChainsTest.groovy index d8b4b775..bdcb58e8 100644 --- a/src/test/groovy/cz/siret/prank/DiscontinuedChainsTest.groovy +++ b/src/test/groovy/cz/siret/prank/DiscontinuedChainsTest.groovy @@ -14,8 +14,11 @@ import static org.junit.jupiter.api.Assertions.assertEquals @CompileStatic class DiscontinuedChainsTest { - String PDB_1O6U = 'src/test/resources/data/tricky_cases/1o6u.pdb' - String CIF_1O6U = 'src/test/resources/data/tricky_cases/1o6u.cif' + String DIR = 'src/test/resources/data/tricky_cases/' + String PDB_1O6U = DIR +'1o6u.pdb' + String CIF_1O6U = DIR +'1o6u.cif' + String PDB_1UWY = DIR +'1uwy.pdb' + String CIF_1UWY = DIR +'1uwy.cif' @Test void discontinuedChainsLoading_1O6U_pdb() throws Exception { @@ -57,11 +60,44 @@ class DiscontinuedChainsTest { def chainA = prot.getResidueChain('A') def chainC = prot.getResidueChain('C') - assertEquals(394, chainA.length, "Expected length of chain A") + assertEquals(394, chainA.length, "Expected length of chain A") // TODO pdb says different assertEquals(387, chainC.length, "Expected length of chain C") assertEquals(10203, prot.allAtoms.count, "Expected number of all structure atoms") assertEquals(9311, prot.proteinAtoms.count, "Expected number of protein atoms") } + + + @Test + void discontinuedChainsLoading_1UWY_pdb() throws Exception { + Protein prot = Protein.load(PDB_1UWY) + + def chainA = prot.getResidueChain('A') + + log.info "All Atoms: {}", prot.allAtoms.count + log.info "Protein Atoms: {}", prot.proteinAtoms.count + log.info "Chain A Length: {}", chainA.length + + assertEquals(394, chainA.length, "Expected length of chain A") // TODO pdb says 426! + assertEquals(3230, prot.allAtoms.count, "Expected number of all structure atoms") + assertEquals(3116, prot.proteinAtoms.count, "Expected number of protein atoms") + + } + + @Test + void discontinuedChainsLoading_1UWY_cif() throws Exception { + Protein prot = Protein.load(CIF_1UWY) + + def chainA = prot.getResidueChain('A') + + log.info "All Atoms: {}", prot.allAtoms.count + log.info "Protein Atoms: {}", prot.proteinAtoms.count + log.info "Chain A Length: {}", chainA.length + + assertEquals(394, chainA.length, "Expected length of chain A") // TODO pdb says 426! + assertEquals(3230, prot.allAtoms.count, "Expected number of all structure atoms") + assertEquals(3116, prot.proteinAtoms.count, "Expected number of protein atoms") + + } } diff --git a/src/test/resources/data/tricky_cases/1uwy.cif b/src/test/resources/data/tricky_cases/1uwy.cif new file mode 100644 index 00000000..65a20506 --- /dev/null +++ b/src/test/resources/data/tricky_cases/1uwy.cif @@ -0,0 +1,6327 @@ +data_1UWY +# +_entry.id 1UWY +# +_audit_conform.dict_name mmcif_pdbx.dic +_audit_conform.dict_version 5.382 +_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic +# +loop_ +_database_2.database_id +_database_2.database_code +_database_2.pdbx_database_accession +_database_2.pdbx_DOI +PDB 1UWY pdb_00001uwy 10.2210/pdb1uwy/pdb +PDBE EBI-14571 ? ? +WWPDB D_1290014571 ? ? +# +_pdbx_database_status.status_code REL +_pdbx_database_status.entry_id 1UWY +_pdbx_database_status.deposit_site PDBE +_pdbx_database_status.process_site PDBE +_pdbx_database_status.SG_entry . +_pdbx_database_status.recvd_initial_deposition_date 2004-02-17 +_pdbx_database_status.pdb_format_compatible Y +_pdbx_database_status.status_code_sf ? +_pdbx_database_status.status_code_mr ? +_pdbx_database_status.status_code_cs ? +_pdbx_database_status.methods_development_category ? +_pdbx_database_status.status_code_nmr_data ? +# +loop_ +_audit_author.name +_audit_author.pdbx_ordinal +'Maskos, K.' 1 +'Reverter, D.' 2 +'Bode, W.' 3 +# +_citation.id primary +_citation.title +'Crystal Structure of Human Carboxypeptidase M, a Membrane-Bound Enzyme that Regulates Peptide Hormone Activity' +_citation.journal_abbrev J.Mol.Biol. +_citation.journal_volume 338 +_citation.page_first 257 +_citation.page_last ? +_citation.year 2004 +_citation.journal_id_ASTM JMOBAK +_citation.country UK +_citation.journal_id_ISSN 0022-2836 +_citation.journal_id_CSD 0070 +_citation.book_publisher ? +_citation.pdbx_database_id_PubMed 15066430 +_citation.pdbx_database_id_DOI 10.1016/J.JMB.2004.02.058 +# +loop_ +_citation_author.citation_id +_citation_author.name +_citation_author.ordinal +_citation_author.identifier_ORCID +primary 'Reverter, D.' 1 ? +primary 'Maskos, K.' 2 ? +primary 'Tan, F.' 3 ? +primary 'Skidgel, R.' 4 ? +primary 'Bode, W.' 5 ? +# +_cell.entry_id 1UWY +_cell.length_a 85.830 +_cell.length_b 85.830 +_cell.length_c 124.540 +_cell.angle_alpha 90.00 +_cell.angle_beta 90.00 +_cell.angle_gamma 120.00 +_cell.Z_PDB 6 +_cell.pdbx_unique_axis ? +# +_symmetry.entry_id 1UWY +_symmetry.space_group_name_H-M 'P 32 2 1' +_symmetry.pdbx_full_space_group_name_H-M ? +_symmetry.cell_setting ? +_symmetry.Int_Tables_number 154 +# +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 'CARBOXYPEPTIDASE M' 48716.297 1 3.4.17.12 +? ? ? +2 branched man '2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose' 424.401 1 ? +? ? ? +3 non-polymer syn 'ZINC ION' 65.409 1 ? +? ? ? +4 water nat water 18.015 25 ? +? ? ? +# +_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 +;LDFNYHRQEGMEAFLKTVAQNYSSVTHLHSIGKSVKGRNLWVLVVGRFPKEHRIGIPEFKYVANMHGDETVGRELLLHLI +DYLVTSDGKDPEITNLINSTRIHIMPSMNPDGFEAVKKPDCYYSIGRENYNQYDLNRNFPDAFEYNNVSRQPETVAVMKW +LKTETFVLSANLHGGALVASYPFDNGVQATGALYSRSLTPDDDVFQYLAHTYASRNPNMKKGDECKNKMNFPNGVTNGYS +WYPLQGGMQDYNYIWAQCFEITLELSCCKYPREEKLPSFWNNNKASLIEYIKQVHLGVKGQVFDQNGNPLPNVIVEVQDR +KHICPYRTNKYGEYYLLLLPGSYIINVTVPGHDPHITKVIIPEKSQNFSALKKDILLPFQGQLDSIPVSNPSCPMIPLYR +NLPDHSAATKPSLFLFLVSLLHIFFK +; +_entity_poly.pdbx_seq_one_letter_code_can +;LDFNYHRQEGMEAFLKTVAQNYSSVTHLHSIGKSVKGRNLWVLVVGRFPKEHRIGIPEFKYVANMHGDETVGRELLLHLI +DYLVTSDGKDPEITNLINSTRIHIMPSMNPDGFEAVKKPDCYYSIGRENYNQYDLNRNFPDAFEYNNVSRQPETVAVMKW +LKTETFVLSANLHGGALVASYPFDNGVQATGALYSRSLTPDDDVFQYLAHTYASRNPNMKKGDECKNKMNFPNGVTNGYS +WYPLQGGMQDYNYIWAQCFEITLELSCCKYPREEKLPSFWNNNKASLIEYIKQVHLGVKGQVFDQNGNPLPNVIVEVQDR +KHICPYRTNKYGEYYLLLLPGSYIINVTVPGHDPHITKVIIPEKSQNFSALKKDILLPFQGQLDSIPVSNPSCPMIPLYR +NLPDHSAATKPSLFLFLVSLLHIFFK +; +_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 LEU n +1 2 ASP n +1 3 PHE n +1 4 ASN n +1 5 TYR n +1 6 HIS n +1 7 ARG n +1 8 GLN n +1 9 GLU n +1 10 GLY n +1 11 MET n +1 12 GLU n +1 13 ALA n +1 14 PHE n +1 15 LEU n +1 16 LYS n +1 17 THR n +1 18 VAL n +1 19 ALA n +1 20 GLN n +1 21 ASN n +1 22 TYR n +1 23 SER n +1 24 SER n +1 25 VAL n +1 26 THR n +1 27 HIS n +1 28 LEU n +1 29 HIS n +1 30 SER n +1 31 ILE n +1 32 GLY n +1 33 LYS n +1 34 SER n +1 35 VAL n +1 36 LYS n +1 37 GLY n +1 38 ARG n +1 39 ASN n +1 40 LEU n +1 41 TRP n +1 42 VAL n +1 43 LEU n +1 44 VAL n +1 45 VAL n +1 46 GLY n +1 47 ARG n +1 48 PHE n +1 49 PRO n +1 50 LYS n +1 51 GLU n +1 52 HIS n +1 53 ARG n +1 54 ILE n +1 55 GLY n +1 56 ILE n +1 57 PRO n +1 58 GLU n +1 59 PHE n +1 60 LYS n +1 61 TYR n +1 62 VAL n +1 63 ALA n +1 64 ASN n +1 65 MET n +1 66 HIS n +1 67 GLY n +1 68 ASP n +1 69 GLU n +1 70 THR n +1 71 VAL n +1 72 GLY n +1 73 ARG n +1 74 GLU n +1 75 LEU n +1 76 LEU n +1 77 LEU n +1 78 HIS n +1 79 LEU n +1 80 ILE n +1 81 ASP n +1 82 TYR n +1 83 LEU n +1 84 VAL n +1 85 THR n +1 86 SER n +1 87 ASP n +1 88 GLY n +1 89 LYS n +1 90 ASP n +1 91 PRO n +1 92 GLU n +1 93 ILE n +1 94 THR n +1 95 ASN n +1 96 LEU n +1 97 ILE n +1 98 ASN n +1 99 SER n +1 100 THR n +1 101 ARG n +1 102 ILE n +1 103 HIS n +1 104 ILE n +1 105 MET n +1 106 PRO n +1 107 SER n +1 108 MET n +1 109 ASN n +1 110 PRO n +1 111 ASP n +1 112 GLY n +1 113 PHE n +1 114 GLU n +1 115 ALA n +1 116 VAL n +1 117 LYS n +1 118 LYS n +1 119 PRO n +1 120 ASP n +1 121 CYS n +1 122 TYR n +1 123 TYR n +1 124 SER n +1 125 ILE n +1 126 GLY n +1 127 ARG n +1 128 GLU n +1 129 ASN n +1 130 TYR n +1 131 ASN n +1 132 GLN n +1 133 TYR n +1 134 ASP n +1 135 LEU n +1 136 ASN n +1 137 ARG n +1 138 ASN n +1 139 PHE n +1 140 PRO n +1 141 ASP n +1 142 ALA n +1 143 PHE n +1 144 GLU n +1 145 TYR n +1 146 ASN n +1 147 ASN n +1 148 VAL n +1 149 SER n +1 150 ARG n +1 151 GLN n +1 152 PRO n +1 153 GLU n +1 154 THR n +1 155 VAL n +1 156 ALA n +1 157 VAL n +1 158 MET n +1 159 LYS n +1 160 TRP n +1 161 LEU n +1 162 LYS n +1 163 THR n +1 164 GLU n +1 165 THR n +1 166 PHE n +1 167 VAL n +1 168 LEU n +1 169 SER n +1 170 ALA n +1 171 ASN n +1 172 LEU n +1 173 HIS n +1 174 GLY n +1 175 GLY n +1 176 ALA n +1 177 LEU n +1 178 VAL n +1 179 ALA n +1 180 SER n +1 181 TYR n +1 182 PRO n +1 183 PHE n +1 184 ASP n +1 185 ASN n +1 186 GLY n +1 187 VAL n +1 188 GLN n +1 189 ALA n +1 190 THR n +1 191 GLY n +1 192 ALA n +1 193 LEU n +1 194 TYR n +1 195 SER n +1 196 ARG n +1 197 SER n +1 198 LEU n +1 199 THR n +1 200 PRO n +1 201 ASP n +1 202 ASP n +1 203 ASP n +1 204 VAL n +1 205 PHE n +1 206 GLN n +1 207 TYR n +1 208 LEU n +1 209 ALA n +1 210 HIS n +1 211 THR n +1 212 TYR n +1 213 ALA n +1 214 SER n +1 215 ARG n +1 216 ASN n +1 217 PRO n +1 218 ASN n +1 219 MET n +1 220 LYS n +1 221 LYS n +1 222 GLY n +1 223 ASP n +1 224 GLU n +1 225 CYS n +1 226 LYS n +1 227 ASN n +1 228 LYS n +1 229 MET n +1 230 ASN n +1 231 PHE n +1 232 PRO n +1 233 ASN n +1 234 GLY n +1 235 VAL n +1 236 THR n +1 237 ASN n +1 238 GLY n +1 239 TYR n +1 240 SER n +1 241 TRP n +1 242 TYR n +1 243 PRO n +1 244 LEU n +1 245 GLN n +1 246 GLY n +1 247 GLY n +1 248 MET n +1 249 GLN n +1 250 ASP n +1 251 TYR n +1 252 ASN n +1 253 TYR n +1 254 ILE n +1 255 TRP n +1 256 ALA n +1 257 GLN n +1 258 CYS n +1 259 PHE n +1 260 GLU n +1 261 ILE n +1 262 THR n +1 263 LEU n +1 264 GLU n +1 265 LEU n +1 266 SER n +1 267 CYS n +1 268 CYS n +1 269 LYS n +1 270 TYR n +1 271 PRO n +1 272 ARG n +1 273 GLU n +1 274 GLU n +1 275 LYS n +1 276 LEU n +1 277 PRO n +1 278 SER n +1 279 PHE n +1 280 TRP n +1 281 ASN n +1 282 ASN n +1 283 ASN n +1 284 LYS n +1 285 ALA n +1 286 SER n +1 287 LEU n +1 288 ILE n +1 289 GLU n +1 290 TYR n +1 291 ILE n +1 292 LYS n +1 293 GLN n +1 294 VAL n +1 295 HIS n +1 296 LEU n +1 297 GLY n +1 298 VAL n +1 299 LYS n +1 300 GLY n +1 301 GLN n +1 302 VAL n +1 303 PHE n +1 304 ASP n +1 305 GLN n +1 306 ASN n +1 307 GLY n +1 308 ASN n +1 309 PRO n +1 310 LEU n +1 311 PRO n +1 312 ASN n +1 313 VAL n +1 314 ILE n +1 315 VAL n +1 316 GLU n +1 317 VAL n +1 318 GLN n +1 319 ASP n +1 320 ARG n +1 321 LYS n +1 322 HIS n +1 323 ILE n +1 324 CYS n +1 325 PRO n +1 326 TYR n +1 327 ARG n +1 328 THR n +1 329 ASN n +1 330 LYS n +1 331 TYR n +1 332 GLY n +1 333 GLU n +1 334 TYR n +1 335 TYR n +1 336 LEU n +1 337 LEU n +1 338 LEU n +1 339 LEU n +1 340 PRO n +1 341 GLY n +1 342 SER n +1 343 TYR n +1 344 ILE n +1 345 ILE n +1 346 ASN n +1 347 VAL n +1 348 THR n +1 349 VAL n +1 350 PRO n +1 351 GLY n +1 352 HIS n +1 353 ASP n +1 354 PRO n +1 355 HIS n +1 356 ILE n +1 357 THR n +1 358 LYS n +1 359 VAL n +1 360 ILE n +1 361 ILE n +1 362 PRO n +1 363 GLU n +1 364 LYS n +1 365 SER n +1 366 GLN n +1 367 ASN n +1 368 PHE n +1 369 SER n +1 370 ALA n +1 371 LEU n +1 372 LYS n +1 373 LYS n +1 374 ASP n +1 375 ILE n +1 376 LEU n +1 377 LEU n +1 378 PRO n +1 379 PHE n +1 380 GLN n +1 381 GLY n +1 382 GLN n +1 383 LEU n +1 384 ASP n +1 385 SER n +1 386 ILE n +1 387 PRO n +1 388 VAL n +1 389 SER n +1 390 ASN n +1 391 PRO n +1 392 SER n +1 393 CYS n +1 394 PRO n +1 395 MET n +1 396 ILE n +1 397 PRO n +1 398 LEU n +1 399 TYR n +1 400 ARG n +1 401 ASN n +1 402 LEU n +1 403 PRO n +1 404 ASP n +1 405 HIS n +1 406 SER n +1 407 ALA n +1 408 ALA n +1 409 THR n +1 410 LYS n +1 411 PRO n +1 412 SER n +1 413 LEU n +1 414 PHE n +1 415 LEU n +1 416 PHE n +1 417 LEU n +1 418 VAL n +1 419 SER n +1 420 LEU n +1 421 LEU n +1 422 HIS n +1 423 ILE n +1 424 PHE n +1 425 PHE n +1 426 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 HUMAN +_entity_src_gen.gene_src_genus ? +_entity_src_gen.pdbx_gene_src_gene ? +_entity_src_gen.gene_src_species ? +_entity_src_gen.gene_src_strain ? +_entity_src_gen.gene_src_tissue ? +_entity_src_gen.gene_src_tissue_fraction ? +_entity_src_gen.gene_src_details ? +_entity_src_gen.pdbx_gene_src_fragment ? +_entity_src_gen.pdbx_gene_src_scientific_name 'HOMO SAPIENS' +_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 +_entity_src_gen.pdbx_gene_src_variant ? +_entity_src_gen.pdbx_gene_src_cell_line ? +_entity_src_gen.pdbx_gene_src_atcc ? +_entity_src_gen.pdbx_gene_src_organ ? +_entity_src_gen.pdbx_gene_src_organelle ? +_entity_src_gen.pdbx_gene_src_cell ? +_entity_src_gen.pdbx_gene_src_cellular_location ? +_entity_src_gen.host_org_common_name ? +_entity_src_gen.pdbx_host_org_scientific_name 'SPODOPTERA FRUGIPERDA' +_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 7108 +_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 SF9 +_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 BACULOVIRUS +_entity_src_gen.pdbx_host_org_vector ? +_entity_src_gen.host_org_details ? +_entity_src_gen.expression_system_id ? +_entity_src_gen.plasmid_name PVL1393 +_entity_src_gen.plasmid_details ? +_entity_src_gen.pdbx_description ? +# +_struct_ref.id 1 +_struct_ref.db_name UNP +_struct_ref.db_code CBPM_HUMAN +_struct_ref.entity_id 1 +_struct_ref.pdbx_seq_one_letter_code ? +_struct_ref.pdbx_align_begin ? +_struct_ref.pdbx_db_accession P14384 +_struct_ref.pdbx_db_isoform ? +# +_struct_ref_seq.align_id 1 +_struct_ref_seq.ref_id 1 +_struct_ref_seq.pdbx_PDB_id_code 1UWY +_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 426 +_struct_ref_seq.pdbx_seq_align_end_ins_code ? +_struct_ref_seq.pdbx_db_accession P14384 +_struct_ref_seq.db_align_beg 18 +_struct_ref_seq.pdbx_db_align_beg_ins_code ? +_struct_ref_seq.db_align_end 443 +_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 426 +# +loop_ +_chem_comp.id +_chem_comp.type +_chem_comp.mon_nstd_flag +_chem_comp.name +_chem_comp.pdbx_synonyms +_chem_comp.formula +_chem_comp.formula_weight +ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 +ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 +ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 +ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 +CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 +GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 +GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 +GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 +HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 +HOH non-polymer . WATER ? 'H2 O' 18.015 +ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 +LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 +LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 +MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 +NAG 'D-saccharide, beta linking' . 2-acetamido-2-deoxy-beta-D-glucopyranose +;N-acetyl-beta-D-glucosamine; 2-acetamido-2-deoxy-beta-D-glucose; 2-acetamido-2-deoxy-D-glucose; 2-acetamido-2-deoxy-glucose; N-ACETYL-D-GLUCOSAMINE +; +'C8 H15 N O6' 221.208 +PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 +PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 +SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 +THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 +TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 +TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 +VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 +ZN non-polymer . 'ZINC ION' ? 'Zn 2' 65.409 +# +_exptl.entry_id 1UWY +_exptl.method 'X-RAY DIFFRACTION' +_exptl.crystals_number 1 +# +_exptl_crystal.id 1 +_exptl_crystal.density_meas ? +_exptl_crystal.density_Matthews 3.37 +_exptl_crystal.density_percent_sol 54.75 +_exptl_crystal.description ? +# +_exptl_crystal_grow.crystal_id 1 +_exptl_crystal_grow.method ? +_exptl_crystal_grow.temp ? +_exptl_crystal_grow.temp_details ? +_exptl_crystal_grow.pH 6.50 +_exptl_crystal_grow.pdbx_pH_range ? +_exptl_crystal_grow.pdbx_details 'pH 6.50' +# +_diffrn.id 1 +_diffrn.ambient_temp 100.0 +_diffrn.ambient_temp_details ? +_diffrn.crystal_id 1 +# +_diffrn_detector.diffrn_id 1 +_diffrn_detector.detector 'IMAGE PLATE' +_diffrn_detector.type MARRESEARCH +_diffrn_detector.pdbx_collection_date 2001-11-15 +_diffrn_detector.details MIRRORS +# +_diffrn_radiation.diffrn_id 1 +_diffrn_radiation.wavelength_id 1 +_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M +_diffrn_radiation.monochromator ? +_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' +_diffrn_radiation.pdbx_scattering_type x-ray +# +_diffrn_radiation_wavelength.id 1 +_diffrn_radiation_wavelength.wavelength 1.5418 +_diffrn_radiation_wavelength.wt 1.0 +# +_diffrn_source.diffrn_id 1 +_diffrn_source.source 'ROTATING ANODE' +_diffrn_source.type 'RIGAKU RUH3R' +_diffrn_source.pdbx_synchrotron_site ? +_diffrn_source.pdbx_synchrotron_beamline ? +_diffrn_source.pdbx_wavelength 1.5418 +_diffrn_source.pdbx_wavelength_list ? +# +_reflns.pdbx_diffrn_id 1 +_reflns.pdbx_ordinal 1 +_reflns.entry_id 1UWY +_reflns.observed_criterion_sigma_I 2.000 +_reflns.observed_criterion_sigma_F ? +_reflns.d_resolution_low 30.000 +_reflns.d_resolution_high 2.900 +_reflns.number_obs 19598 +_reflns.number_all ? +_reflns.percent_possible_obs 97.8 +_reflns.pdbx_Rmerge_I_obs 0.06100 +_reflns.pdbx_Rsym_value ? +_reflns.pdbx_netI_over_sigmaI ? +_reflns.B_iso_Wilson_estimate ? +_reflns.pdbx_redundancy 4.200 +# +_reflns_shell.pdbx_diffrn_id 1 +_reflns_shell.pdbx_ordinal 1 +_reflns_shell.d_res_high 3.00 +_reflns_shell.d_res_low 3.16 +_reflns_shell.percent_possible_all 99.1 +_reflns_shell.Rmerge_I_obs 0.27100 +_reflns_shell.pdbx_Rsym_value ? +_reflns_shell.meanI_over_sigI_obs ? +_reflns_shell.pdbx_redundancy 3.90 +# +_refine.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine.entry_id 1UWY +_refine.pdbx_diffrn_id 1 +_refine.pdbx_TLS_residual_ADP_flag ? +_refine.ls_number_reflns_obs 18185 +_refine.ls_number_reflns_all ? +_refine.pdbx_ls_sigma_I ? +_refine.pdbx_ls_sigma_F 2 +_refine.pdbx_data_cutoff_high_absF ? +_refine.pdbx_data_cutoff_low_absF ? +_refine.pdbx_data_cutoff_high_rms_absF ? +_refine.ls_d_res_low 30.0 +_refine.ls_d_res_high 3.0 +_refine.ls_percent_reflns_obs 97.8 +_refine.ls_R_factor_obs 0.206 +_refine.ls_R_factor_all ? +_refine.ls_R_factor_R_work 0.206 +_refine.ls_R_factor_R_free 0.286 +_refine.ls_R_factor_R_free_error ? +_refine.ls_R_factor_R_free_error_details ? +_refine.ls_percent_reflns_R_free 7.0 +_refine.ls_number_reflns_R_free 1413 +_refine.ls_number_parameters ? +_refine.ls_number_restraints ? +_refine.occupancy_min ? +_refine.occupancy_max ? +_refine.correlation_coeff_Fo_to_Fc ? +_refine.correlation_coeff_Fo_to_Fc_free ? +_refine.B_iso_mean 54.2 +_refine.aniso_B[1][1] ? +_refine.aniso_B[2][2] ? +_refine.aniso_B[3][3] ? +_refine.aniso_B[1][2] ? +_refine.aniso_B[1][3] ? +_refine.aniso_B[2][3] ? +_refine.solvent_model_details ? +_refine.solvent_model_param_ksol ? +_refine.solvent_model_param_bsol ? +_refine.pdbx_solvent_vdw_probe_radii ? +_refine.pdbx_solvent_ion_probe_radii ? +_refine.pdbx_solvent_shrinkage_radii ? +_refine.pdbx_ls_cross_valid_method ? +_refine.details 'THIS ENTRY HAS SOME RESIDUES MODELED WITH AN OCCUPANCY OF 0.00' +_refine.pdbx_starting_model 'PDB ENTRY 1QMU' +_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' +_refine.pdbx_isotropic_thermal_model ? +_refine.pdbx_stereochemistry_target_values ? +_refine.pdbx_stereochem_target_val_spec_case ? +_refine.pdbx_R_Free_selection_details RANDOM +_refine.pdbx_overall_ESU_R ? +_refine.pdbx_overall_ESU_R_Free ? +_refine.overall_SU_ML ? +_refine.pdbx_overall_phase_error ? +_refine.overall_SU_B ? +_refine.overall_SU_R_Cruickshank_DPI ? +_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 3176 +_refine_hist.pdbx_number_atoms_nucleic_acid 0 +_refine_hist.pdbx_number_atoms_ligand 29 +_refine_hist.number_atoms_solvent 25 +_refine_hist.number_atoms_total 3230 +_refine_hist.d_res_high 3.0 +_refine_hist.d_res_low 30.0 +# +loop_ +_refine_ls_restr.type +_refine_ls_restr.dev_ideal +_refine_ls_restr.dev_ideal_target +_refine_ls_restr.weight +_refine_ls_restr.number +_refine_ls_restr.pdbx_refine_id +_refine_ls_restr.pdbx_restraint_function +c_bond_d 0.012 ? ? ? 'X-RAY DIFFRACTION' ? +c_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg 1.78 ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? +c_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? +c_mcbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? +c_mcangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? +c_scbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? +c_scangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? +# +_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' +_refine_ls_shell.pdbx_total_number_of_bins_used 10 +_refine_ls_shell.d_res_high 3.0 +_refine_ls_shell.d_res_low 3.16 +_refine_ls_shell.number_reflns_R_work 1580 +_refine_ls_shell.R_factor_R_work ? +_refine_ls_shell.percent_reflns_obs 99.1 +_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 ? +# +_struct.entry_id 1UWY +_struct.title 'Crystal structure of human carboxypeptidase M' +_struct.pdbx_model_details ? +_struct.pdbx_CASP_flag ? +_struct.pdbx_model_type_details ? +# +_struct_keywords.entry_id 1UWY +_struct_keywords.pdbx_keywords HYDROLASE +_struct_keywords.text +;METALLOPEPTIDASE, CARBOXYPEPTIDASE, GPI-ANCHOR, METALLOPROTEASE, ZINC, LIPOPROTEIN, HYDROLASE, STRUCTURAL PROTEOMICS IN EUROPE, SPINE, STRUCTURAL GENOMICS +; +# +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 ? +# +_struct_biol.id 1 +# +loop_ +_struct_conf.conf_type_id +_struct_conf.id +_struct_conf.pdbx_PDB_helix_id +_struct_conf.beg_label_comp_id +_struct_conf.beg_label_asym_id +_struct_conf.beg_label_seq_id +_struct_conf.pdbx_beg_PDB_ins_code +_struct_conf.end_label_comp_id +_struct_conf.end_label_asym_id +_struct_conf.end_label_seq_id +_struct_conf.pdbx_end_PDB_ins_code +_struct_conf.beg_auth_comp_id +_struct_conf.beg_auth_asym_id +_struct_conf.beg_auth_seq_id +_struct_conf.end_auth_comp_id +_struct_conf.end_auth_asym_id +_struct_conf.end_auth_seq_id +_struct_conf.pdbx_PDB_helix_class +_struct_conf.details +_struct_conf.pdbx_PDB_helix_length +HELX_P HELX_P1 1 ARG A 7 ? TYR A 22 ? ARG A 7 TYR A 22 1 ? 16 +HELX_P HELX_P2 2 THR A 70 ? ASP A 87 ? THR A 70 ASP A 87 1 ? 18 +HELX_P HELX_P3 3 ASP A 90 ? THR A 100 ? ASP A 90 THR A 100 1 ? 11 +HELX_P HELX_P4 4 ASN A 109 ? VAL A 116 ? ASN A 109 VAL A 116 1 ? 8 +HELX_P HELX_P5 5 GLN A 151 ? GLU A 164 ? GLN A 151 GLU A 164 1 ? 14 +HELX_P HELX_P6 6 VAL A 187 ? GLY A 191 ? VAL A 187 GLY A 191 5 ? 5 +HELX_P HELX_P7 7 GLY A 191 ? SER A 195 ? GLY A 191 SER A 195 5 ? 5 +HELX_P HELX_P8 8 ASP A 201 ? ARG A 215 ? ASP A 201 ARG A 215 1 ? 15 +HELX_P HELX_P9 9 GLY A 247 ? TRP A 255 ? GLY A 247 TRP A 255 1 ? 9 +HELX_P HELX_P10 10 ARG A 272 ? GLU A 274 ? ARG A 272 GLU A 274 5 ? 3 +HELX_P HELX_P11 11 LYS A 275 ? ASN A 282 ? LYS A 275 ASN A 282 1 ? 8 +HELX_P HELX_P12 12 ASN A 283 ? LYS A 292 ? ASN A 283 LYS A 292 1 ? 10 +HELX_P HELX_P13 13 GLN A 293 ? LEU A 296 ? GLN A 293 LEU A 296 5 ? 4 +# +_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 +_struct_conn.pdbx_role +disulf1 disulf ? ? A CYS 121 SG ? ? ? 1_555 A CYS 268 SG ? ? A CYS 121 A CYS 268 1_555 ? ? ? ? ? ? ? 2.036 ? ? +disulf2 disulf ? ? A CYS 225 SG ? ? ? 1_555 A CYS 267 SG ? ? A CYS 225 A CYS 267 1_555 ? ? ? ? ? ? ? 2.024 ? ? +disulf3 disulf ? ? A CYS 324 SG ? ? ? 1_555 A CYS 393 SG ? ? A CYS 324 A CYS 393 1_555 ? ? ? ? ? ? ? 2.032 ? ? +covale1 covale one ? A ASN 98 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 98 B NAG 1 1_555 ? ? ? ? ? ? ? 1.461 ? N-Glycosylation +covale2 covale one ? A ASP 223 OD1 ? ? ? 4_655 B NAG . O6 ? ? A ASP 223 B NAG 2 1_555 ? ? ? ? ? ? ? 1.936 ? ? +covale3 covale both ? B NAG . O4 ? ? ? 1_555 B NAG . C1 ? ? B NAG 1 B NAG 2 1_555 ? ? ? ? ? ? ? 1.386 ? ? +metalc1 metalc ? ? A HIS 66 ND1 ? ? ? 1_555 C ZN . ZN ? ? A HIS 66 A ZN 1405 1_555 ? ? ? ? ? ? ? 2.236 ? ? +metalc2 metalc ? ? A GLU 69 OE1 ? ? ? 1_555 C ZN . ZN ? ? A GLU 69 A ZN 1405 1_555 ? ? ? ? ? ? ? 2.264 ? ? +metalc3 metalc ? ? A GLU 69 OE2 ? ? ? 1_555 C ZN . ZN ? ? A GLU 69 A ZN 1405 1_555 ? ? ? ? ? ? ? 2.119 ? ? +metalc4 metalc ? ? A HIS 173 ND1 ? ? ? 1_555 C ZN . ZN ? ? A HIS 173 A ZN 1405 1_555 ? ? ? ? ? ? ? 2.127 ? ? +# +loop_ +_struct_conn_type.id +_struct_conn_type.criteria +_struct_conn_type.reference +disulf ? ? +covale ? ? +metalc ? ? +# +_struct_mon_prot_cis.pdbx_id 1 +_struct_mon_prot_cis.label_comp_id PRO +_struct_mon_prot_cis.label_seq_id 182 +_struct_mon_prot_cis.label_asym_id A +_struct_mon_prot_cis.label_alt_id . +_struct_mon_prot_cis.pdbx_PDB_ins_code ? +_struct_mon_prot_cis.auth_comp_id PRO +_struct_mon_prot_cis.auth_seq_id 182 +_struct_mon_prot_cis.auth_asym_id A +_struct_mon_prot_cis.pdbx_label_comp_id_2 PHE +_struct_mon_prot_cis.pdbx_label_seq_id_2 183 +_struct_mon_prot_cis.pdbx_label_asym_id_2 A +_struct_mon_prot_cis.pdbx_PDB_ins_code_2 ? +_struct_mon_prot_cis.pdbx_auth_comp_id_2 PHE +_struct_mon_prot_cis.pdbx_auth_seq_id_2 183 +_struct_mon_prot_cis.pdbx_auth_asym_id_2 A +_struct_mon_prot_cis.pdbx_PDB_model_num 1 +_struct_mon_prot_cis.pdbx_omega_angle 0.19 +# +loop_ +_struct_sheet.id +_struct_sheet.type +_struct_sheet.number_strands +_struct_sheet.details +AA ? 5 ? +AB ? 8 ? +AC ? 3 ? +AD ? 3 ? +AE ? 3 ? +# +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 +AA 1 2 ? anti-parallel +AA 2 3 ? anti-parallel +AA 3 4 ? parallel +AA 4 5 ? parallel +AB 1 2 ? anti-parallel +AB 2 3 ? anti-parallel +AB 3 4 ? parallel +AB 4 5 ? parallel +AB 5 6 ? parallel +AB 6 7 ? anti-parallel +AB 7 8 ? parallel +AC 1 2 ? anti-parallel +AC 2 3 ? parallel +AD 1 2 ? anti-parallel +AD 2 3 ? parallel +AE 1 2 ? anti-parallel +AE 2 3 ? 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 +AA 1 THR A 26 ? LYS A 33 ? THR A 26 LYS A 33 +AA 2 ASN A 39 ? VAL A 45 ? ASN A 39 VAL A 45 +AA 3 ARG A 101 ? MET A 105 ? ARG A 101 MET A 105 +AA 4 GLU A 58 ? ALA A 63 ? GLU A 58 ALA A 63 +AA 5 PHE A 166 ? LEU A 168 ? PHE A 166 LEU A 168 +AB 1 THR A 26 ? LYS A 33 ? THR A 26 LYS A 33 +AB 2 ASN A 39 ? VAL A 45 ? ASN A 39 VAL A 45 +AB 3 ARG A 101 ? MET A 105 ? ARG A 101 MET A 105 +AB 4 GLU A 58 ? ALA A 63 ? GLU A 58 ALA A 63 +AB 5 ASN A 171 ? HIS A 173 ? ASN A 171 HIS A 173 +AB 6 THR A 262 ? SER A 266 ? THR A 262 SER A 266 +AB 7 ALA A 176 ? TYR A 181 ? ALA A 176 TYR A 181 +AB 8 VAL A 235 ? ASN A 237 ? VAL A 235 ASN A 237 +AC 1 GLU A 333 ? LEU A 336 ? GLU A 333 LEU A 336 +AC 2 VAL A 298 ? PHE A 303 ? VAL A 298 PHE A 303 +AC 3 LEU A 371 ? LYS A 372 ? LEU A 371 LYS A 372 +AD 1 GLU A 333 ? LEU A 336 ? GLU A 333 LEU A 336 +AD 2 VAL A 298 ? PHE A 303 ? VAL A 298 PHE A 303 +AD 3 ILE A 375 ? LEU A 376 ? ILE A 375 LEU A 376 +AE 1 ILE A 314 ? VAL A 317 ? ILE A 314 VAL A 317 +AE 2 GLY A 341 ? THR A 348 ? GLY A 341 THR A 348 +AE 3 HIS A 355 ? ILE A 361 ? HIS A 355 ILE A 361 +# +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 +AA 1 2 N ILE A 31 ? N ILE A 31 O LEU A 40 ? O LEU A 40 +AA 2 3 N VAL A 45 ? N VAL A 45 O ILE A 102 ? O ILE A 102 +AA 3 4 N HIS A 103 ? N HIS A 103 O PHE A 59 ? O PHE A 59 +AA 4 5 O GLU A 58 ? O GLU A 58 N VAL A 167 ? N VAL A 167 +AB 1 2 N ILE A 31 ? N ILE A 31 O LEU A 40 ? O LEU A 40 +AB 2 3 N VAL A 45 ? N VAL A 45 O ILE A 102 ? O ILE A 102 +AB 3 4 N HIS A 103 ? N HIS A 103 O PHE A 59 ? O PHE A 59 +AB 4 5 O VAL A 62 ? O VAL A 62 N LEU A 172 ? N LEU A 172 +AB 5 6 N HIS A 173 ? N HIS A 173 O LEU A 263 ? O LEU A 263 +AB 6 7 N SER A 266 ? N SER A 266 O ALA A 176 ? O ALA A 176 +AB 7 8 N TYR A 181 ? N TYR A 181 O THR A 236 ? O THR A 236 +AC 1 2 N LEU A 336 ? N LEU A 336 O VAL A 298 ? O VAL A 298 +AC 2 3 N LYS A 299 ? N LYS A 299 O LEU A 371 ? O LEU A 371 +AD 1 2 N LEU A 336 ? N LEU A 336 O VAL A 298 ? O VAL A 298 +AD 2 3 N PHE A 303 ? N PHE A 303 O ILE A 375 ? O ILE A 375 +AE 1 2 N GLU A 316 ? N GLU A 316 O ASN A 346 ? O ASN A 346 +AE 2 3 N VAL A 347 ? N VAL A 347 O HIS A 355 ? O HIS A 355 +# +_database_PDB_matrix.entry_id 1UWY +_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 1UWY +_atom_sites.fract_transf_matrix[1][1] 0.011651 +_atom_sites.fract_transf_matrix[1][2] 0.006727 +_atom_sites.fract_transf_matrix[1][3] 0.000000 +_atom_sites.fract_transf_matrix[2][1] 0.000000 +_atom_sites.fract_transf_matrix[2][2] 0.013453 +_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] 0.008029 +_atom_sites.fract_transf_vector[1] 0.00000 +_atom_sites.fract_transf_vector[2] 0.00000 +_atom_sites.fract_transf_vector[3] 0.00000 +# +loop_ +_atom_type.symbol +C +N +O +S +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 . LEU A 1 1 ? 67.900 10.791 -7.918 1.00 52.69 ? 1 LEU A N 1 +ATOM 2 C CA . LEU A 1 1 ? 68.597 9.815 -7.040 1.00 52.26 ? 1 LEU A CA 1 +ATOM 3 C C . LEU A 1 1 ? 67.982 8.431 -7.156 1.00 54.73 ? 1 LEU A C 1 +ATOM 4 O O . LEU A 1 1 ? 66.843 8.263 -7.623 1.00 54.55 ? 1 LEU A O 1 +ATOM 5 C CB . LEU A 1 1 ? 68.512 10.249 -5.578 1.00 49.24 ? 1 LEU A CB 1 +ATOM 6 C CG . LEU A 1 1 ? 69.775 10.012 -4.765 1.00 46.18 ? 1 LEU A CG 1 +ATOM 7 C CD1 . LEU A 1 1 ? 69.418 9.981 -3.323 1.00 43.53 ? 1 LEU A CD1 1 +ATOM 8 C CD2 . LEU A 1 1 ? 70.444 8.726 -5.192 1.00 46.38 ? 1 LEU A CD2 1 +ATOM 9 N N . ASP A 1 2 ? 68.748 7.442 -6.714 1.00 56.52 ? 2 ASP A N 1 +ATOM 10 C CA . ASP A 1 2 ? 68.308 6.065 -6.736 1.00 58.44 ? 2 ASP A CA 1 +ATOM 11 C C . ASP A 1 2 ? 67.476 5.841 -5.482 1.00 58.79 ? 2 ASP A C 1 +ATOM 12 O O . ASP A 1 2 ? 67.573 6.604 -4.518 1.00 58.33 ? 2 ASP A O 1 +ATOM 13 C CB . ASP A 1 2 ? 69.511 5.157 -6.712 1.00 60.67 ? 2 ASP A CB 1 +ATOM 14 C CG . ASP A 1 2 ? 70.169 5.147 -5.375 1.00 62.81 ? 2 ASP A CG 1 +ATOM 15 O OD1 . ASP A 1 2 ? 69.660 4.413 -4.501 1.00 64.06 ? 2 ASP A OD1 1 +ATOM 16 O OD2 . ASP A 1 2 ? 71.169 5.887 -5.193 1.00 63.89 ? 2 ASP A OD2 1 +ATOM 17 N N . PHE A 1 3 ? 66.678 4.778 -5.490 1.00 59.54 ? 3 PHE A N 1 +ATOM 18 C CA . PHE A 1 3 ? 65.806 4.473 -4.367 1.00 59.39 ? 3 PHE A CA 1 +ATOM 19 C C . PHE A 1 3 ? 66.254 3.400 -3.409 1.00 59.81 ? 3 PHE A C 1 +ATOM 20 O O . PHE A 1 3 ? 65.503 2.496 -3.117 1.00 61.69 ? 3 PHE A O 1 +ATOM 21 C CB . PHE A 1 3 ? 64.411 4.134 -4.872 1.00 57.48 ? 3 PHE A CB 1 +ATOM 22 C CG . PHE A 1 3 ? 63.569 5.332 -5.094 1.00 57.25 ? 3 PHE A CG 1 +ATOM 23 C CD1 . PHE A 1 3 ? 63.049 6.032 -4.008 1.00 58.21 ? 3 PHE A CD1 1 +ATOM 24 C CD2 . PHE A 1 3 ? 63.304 5.781 -6.373 1.00 56.24 ? 3 PHE A CD2 1 +ATOM 25 C CE1 . PHE A 1 3 ? 62.270 7.170 -4.192 1.00 57.45 ? 3 PHE A CE1 1 +ATOM 26 C CE2 . PHE A 1 3 ? 62.533 6.908 -6.577 1.00 56.39 ? 3 PHE A CE2 1 +ATOM 27 C CZ . PHE A 1 3 ? 62.012 7.607 -5.483 1.00 58.18 ? 3 PHE A CZ 1 +ATOM 28 N N . ASN A 1 4 ? 67.475 3.488 -2.920 1.00 60.15 ? 4 ASN A N 1 +ATOM 29 C CA . ASN A 1 4 ? 67.945 2.527 -1.952 1.00 61.03 ? 4 ASN A CA 1 +ATOM 30 C C . ASN A 1 4 ? 68.375 3.374 -0.793 1.00 61.96 ? 4 ASN A C 1 +ATOM 31 O O . ASN A 1 4 ? 68.232 4.597 -0.834 1.00 61.86 ? 4 ASN A O 1 +ATOM 32 C CB . ASN A 1 4 ? 69.116 1.750 -2.497 1.00 63.63 ? 4 ASN A CB 1 +ATOM 33 C CG . ASN A 1 4 ? 68.726 0.911 -3.668 1.00 67.05 ? 4 ASN A CG 1 +ATOM 34 O OD1 . ASN A 1 4 ? 67.965 -0.044 -3.523 1.00 69.19 ? 4 ASN A OD1 1 +ATOM 35 N ND2 . ASN A 1 4 ? 69.217 1.271 -4.853 1.00 68.65 ? 4 ASN A ND2 1 +ATOM 36 N N . TYR A 1 5 ? 68.889 2.751 0.255 1.00 62.16 ? 5 TYR A N 1 +ATOM 37 C CA . TYR A 1 5 ? 69.303 3.545 1.377 1.00 62.26 ? 5 TYR A CA 1 +ATOM 38 C C . TYR A 1 5 ? 70.569 4.263 1.046 1.00 62.34 ? 5 TYR A C 1 +ATOM 39 O O . TYR A 1 5 ? 71.304 3.868 0.149 1.00 62.54 ? 5 TYR A O 1 +ATOM 40 C CB . TYR A 1 5 ? 69.449 2.680 2.605 1.00 63.28 ? 5 TYR A CB 1 +ATOM 41 C CG . TYR A 1 5 ? 68.121 2.507 3.257 1.00 65.06 ? 5 TYR A CG 1 +ATOM 42 C CD1 . TYR A 1 5 ? 67.621 1.243 3.550 1.00 66.34 ? 5 TYR A CD1 1 +ATOM 43 C CD2 . TYR A 1 5 ? 67.323 3.617 3.528 1.00 66.06 ? 5 TYR A CD2 1 +ATOM 44 C CE1 . TYR A 1 5 ? 66.347 1.083 4.097 1.00 67.22 ? 5 TYR A CE1 1 +ATOM 45 C CE2 . TYR A 1 5 ? 66.052 3.476 4.070 1.00 67.28 ? 5 TYR A CE2 1 +ATOM 46 C CZ . TYR A 1 5 ? 65.571 2.207 4.355 1.00 67.89 ? 5 TYR A CZ 1 +ATOM 47 O OH . TYR A 1 5 ? 64.331 2.066 4.929 1.00 69.36 ? 5 TYR A OH 1 +ATOM 48 N N . HIS A 1 6 ? 70.799 5.354 1.753 1.00 62.66 ? 6 HIS A N 1 +ATOM 49 C CA . HIS A 1 6 ? 71.978 6.154 1.522 1.00 63.20 ? 6 HIS A CA 1 +ATOM 50 C C . HIS A 1 6 ? 72.693 6.440 2.819 1.00 63.63 ? 6 HIS A C 1 +ATOM 51 O O . HIS A 1 6 ? 72.472 7.491 3.429 1.00 64.14 ? 6 HIS A O 1 +ATOM 52 C CB . HIS A 1 6 ? 71.604 7.482 0.859 1.00 63.39 ? 6 HIS A CB 1 +ATOM 53 C CG . HIS A 1 6 ? 71.120 7.346 -0.552 1.00 63.64 ? 6 HIS A CG 1 +ATOM 54 N ND1 . HIS A 1 6 ? 69.819 7.020 -0.868 1.00 64.31 ? 6 HIS A ND1 1 +ATOM 55 C CD2 . HIS A 1 6 ? 71.765 7.496 -1.732 1.00 63.61 ? 6 HIS A CD2 1 +ATOM 56 C CE1 . HIS A 1 6 ? 69.682 6.976 -2.179 1.00 63.58 ? 6 HIS A CE1 1 +ATOM 57 N NE2 . HIS A 1 6 ? 70.848 7.262 -2.726 1.00 64.68 ? 6 HIS A NE2 1 +ATOM 58 N N . ARG A 1 7 ? 73.547 5.518 3.246 1.00 63.03 ? 7 ARG A N 1 +ATOM 59 C CA . ARG A 1 7 ? 74.294 5.740 4.471 1.00 63.71 ? 7 ARG A CA 1 +ATOM 60 C C . ARG A 1 7 ? 75.104 7.051 4.317 1.00 64.91 ? 7 ARG A C 1 +ATOM 61 O O . ARG A 1 7 ? 74.981 7.748 3.305 1.00 64.72 ? 7 ARG A O 1 +ATOM 62 C CB . ARG A 1 7 ? 75.200 4.542 4.747 1.00 62.88 ? 7 ARG A CB 1 +ATOM 63 C CG . ARG A 1 7 ? 74.702 3.224 4.133 1.00 61.23 ? 7 ARG A CG 1 +ATOM 64 C CD . ARG A 1 7 ? 75.039 2.068 5.034 1.00 59.70 ? 7 ARG A CD 1 +ATOM 65 N NE . ARG A 1 7 ? 74.221 2.191 6.227 1.00 62.82 ? 7 ARG A NE 1 +ATOM 66 C CZ . ARG A 1 7 ? 74.621 1.969 7.477 1.00 63.86 ? 7 ARG A CZ 1 +ATOM 67 N NH1 . ARG A 1 7 ? 73.745 2.132 8.462 1.00 65.89 ? 7 ARG A NH1 1 +ATOM 68 N NH2 . ARG A 1 7 ? 75.865 1.587 7.752 1.00 62.30 ? 7 ARG A NH2 1 +ATOM 69 N N . GLN A 1 8 ? 75.936 7.383 5.302 1.00 66.46 ? 8 GLN A N 1 +ATOM 70 C CA . GLN A 1 8 ? 76.697 8.645 5.281 1.00 67.21 ? 8 GLN A CA 1 +ATOM 71 C C . GLN A 1 8 ? 77.484 8.982 4.036 1.00 67.05 ? 8 GLN A C 1 +ATOM 72 O O . GLN A 1 8 ? 77.367 10.087 3.493 1.00 67.20 ? 8 GLN A O 1 +ATOM 73 C CB . GLN A 1 8 ? 77.651 8.723 6.464 1.00 68.51 ? 8 GLN A CB 1 +ATOM 74 C CG . GLN A 1 8 ? 78.489 9.991 6.484 1.00 70.93 ? 8 GLN A CG 1 +ATOM 75 C CD . GLN A 1 8 ? 79.689 9.872 7.417 1.00 73.53 ? 8 GLN A CD 1 +ATOM 76 O OE1 . GLN A 1 8 ? 79.547 9.891 8.647 1.00 74.05 ? 8 GLN A OE1 1 +ATOM 77 N NE2 . GLN A 1 8 ? 80.882 9.728 6.831 1.00 73.98 ? 8 GLN A NE2 1 +ATOM 78 N N . GLU A 1 9 ? 78.316 8.049 3.607 1.00 66.68 ? 9 GLU A N 1 +ATOM 79 C CA . GLU A 1 9 ? 79.110 8.280 2.426 1.00 66.88 ? 9 GLU A CA 1 +ATOM 80 C C . GLU A 1 9 ? 78.213 8.797 1.287 1.00 67.16 ? 9 GLU A C 1 +ATOM 81 O O . GLU A 1 9 ? 78.204 9.995 0.980 1.00 67.32 ? 9 GLU A O 1 +ATOM 82 C CB . GLU A 1 9 ? 79.777 6.981 1.987 1.00 99.99 ? 9 GLU A CB 1 +ATOM 83 C CG . GLU A 1 9 ? 80.724 6.512 3.064 0.0000 99.99 ? 9 GLU A CG 1 +ATOM 84 C CD . GLU A 1 9 ? 81.941 7.433 3.109 0.0000 99.99 ? 9 GLU A CD 1 +ATOM 85 O OE1 . GLU A 1 9 ? 81.877 8.434 3.870 0.0000 99.99 ? 9 GLU A OE1 1 +ATOM 86 O OE2 . GLU A 1 9 ? 82.923 7.127 2.381 0.0000 99.99 ? 9 GLU A OE2 1 +ATOM 87 N N . GLY A 1 10 ? 77.441 7.894 0.692 1.00 66.58 ? 10 GLY A N 1 +ATOM 88 C CA . GLY A 1 10 ? 76.575 8.243 -0.422 1.00 67.17 ? 10 GLY A CA 1 +ATOM 89 C C . GLY A 1 10 ? 75.585 9.393 -0.300 1.00 68.11 ? 10 GLY A C 1 +ATOM 90 O O . GLY A 1 10 ? 75.325 10.100 -1.290 1.00 68.82 ? 10 GLY A O 1 +ATOM 91 N N . MET A 1 11 ? 75.003 9.580 0.881 1.00 67.12 ? 11 MET A N 1 +ATOM 92 C CA . MET A 1 11 ? 74.049 10.663 1.057 1.00 66.47 ? 11 MET A CA 1 +ATOM 93 C C . MET A 1 11 ? 74.853 11.949 1.007 1.00 66.87 ? 11 MET A C 1 +ATOM 94 O O . MET A 1 11 ? 74.520 12.886 0.264 1.00 66.47 ? 11 MET A O 1 +ATOM 95 C CB . MET A 1 11 ? 73.339 10.518 2.398 1.00 66.20 ? 11 MET A CB 1 +ATOM 96 C CG . MET A 1 11 ? 72.285 11.567 2.659 1.00 64.64 ? 11 MET A CG 1 +ATOM 97 S SD . MET A 1 11 ? 72.708 12.523 4.120 1.00 63.50 ? 11 MET A SD 1 +ATOM 98 C CE . MET A 1 11 ? 72.913 11.246 5.353 1.00 62.92 ? 11 MET A CE 1 +ATOM 99 N N . GLU A 1 12 ? 75.925 11.971 1.801 1.00 66.93 ? 12 GLU A N 1 +ATOM 100 C CA . GLU A 1 12 ? 76.838 13.111 1.856 1.00 66.68 ? 12 GLU A CA 1 +ATOM 101 C C . GLU A 1 12 ? 77.184 13.424 0.408 1.00 64.85 ? 12 GLU A C 1 +ATOM 102 O O . GLU A 1 12 ? 76.985 14.536 -0.091 1.00 63.43 ? 12 GLU A O 1 +ATOM 103 C CB . GLU A 1 12 ? 78.102 12.721 2.611 1.00 67.18 ? 12 GLU A CB 1 +ATOM 104 C CG . GLU A 1 12 ? 78.563 13.770 3.583 1.00 71.32 ? 12 GLU A CG 1 +ATOM 105 C CD . GLU A 1 12 ? 79.454 13.177 4.649 1.00 75.16 ? 12 GLU A CD 1 +ATOM 106 O OE1 . GLU A 1 12 ? 79.644 13.818 5.724 1.00 74.86 ? 12 GLU A OE1 1 +ATOM 107 O OE2 . GLU A 1 12 ? 79.964 12.054 4.393 1.00 77.21 ? 12 GLU A OE2 1 +ATOM 108 N N . ALA A 1 13 ? 77.703 12.399 -0.254 1.00 63.04 ? 13 ALA A N 1 +ATOM 109 C CA . ALA A 1 13 ? 78.062 12.483 -1.648 1.00 61.06 ? 13 ALA A CA 1 +ATOM 110 C C . ALA A 1 13 ? 76.974 13.265 -2.375 1.00 59.69 ? 13 ALA A C 1 +ATOM 111 O O . ALA A 1 13 ? 77.189 14.425 -2.734 1.00 59.41 ? 13 ALA A O 1 +ATOM 112 C CB . ALA A 1 13 ? 78.183 11.084 -2.218 1.00 60.89 ? 13 ALA A CB 1 +ATOM 113 N N . PHE A 1 14 ? 75.815 12.620 -2.556 1.00 57.64 ? 14 PHE A N 1 +ATOM 114 C CA . PHE A 1 14 ? 74.647 13.195 -3.227 1.00 55.64 ? 14 PHE A CA 1 +ATOM 115 C C . PHE A 1 14 ? 74.577 14.686 -3.017 1.00 55.42 ? 14 PHE A C 1 +ATOM 116 O O . PHE A 1 14 ? 74.603 15.493 -3.954 1.00 53.37 ? 14 PHE A O 1 +ATOM 117 C CB . PHE A 1 14 ? 73.355 12.576 -2.676 1.00 54.65 ? 14 PHE A CB 1 +ATOM 118 C CG . PHE A 1 14 ? 72.103 13.250 -3.178 1.00 53.71 ? 14 PHE A CG 1 +ATOM 119 C CD1 . PHE A 1 14 ? 71.390 14.110 -2.366 1.00 54.21 ? 14 PHE A CD1 1 +ATOM 120 C CD2 . PHE A 1 14 ? 71.673 13.065 -4.497 1.00 54.32 ? 14 PHE A CD2 1 +ATOM 121 C CE1 . PHE A 1 14 ? 70.266 14.783 -2.855 1.00 55.08 ? 14 PHE A CE1 1 +ATOM 122 C CE2 . PHE A 1 14 ? 70.546 13.734 -5.007 1.00 53.17 ? 14 PHE A CE2 1 +ATOM 123 C CZ . PHE A 1 14 ? 69.845 14.592 -4.187 1.00 54.49 ? 14 PHE A CZ 1 +ATOM 124 N N . LEU A 1 15 ? 74.465 15.030 -1.746 1.00 55.88 ? 15 LEU A N 1 +ATOM 125 C CA . LEU A 1 15 ? 74.391 16.407 -1.320 1.00 56.29 ? 15 LEU A CA 1 +ATOM 126 C C . LEU A 1 15 ? 75.479 17.241 -2.011 1.00 56.34 ? 15 LEU A C 1 +ATOM 127 O O . LEU A 1 15 ? 75.188 18.054 -2.885 1.00 55.45 ? 15 LEU A O 1 +ATOM 128 C CB . LEU A 1 15 ? 74.527 16.438 0.208 1.00 55.28 ? 15 LEU A CB 1 +ATOM 129 C CG . LEU A 1 15 ? 73.389 15.719 0.935 1.00 52.91 ? 15 LEU A CG 1 +ATOM 130 C CD1 . LEU A 1 15 ? 73.891 15.174 2.232 1.00 51.77 ? 15 LEU A CD1 1 +ATOM 131 C CD2 . LEU A 1 15 ? 72.231 16.678 1.140 1.00 51.12 ? 15 LEU A CD2 1 +ATOM 132 N N . LYS A 1 16 ? 76.729 17.021 -1.616 1.00 57.64 ? 16 LYS A N 1 +ATOM 133 C CA . LYS A 1 16 ? 77.867 17.732 -2.183 1.00 58.44 ? 16 LYS A CA 1 +ATOM 134 C C . LYS A 1 16 ? 77.728 17.883 -3.700 1.00 59.64 ? 16 LYS A C 1 +ATOM 135 O O . LYS A 1 16 ? 78.025 18.939 -4.281 1.00 59.23 ? 16 LYS A O 1 +ATOM 136 C CB . LYS A 1 16 ? 79.138 16.956 -1.882 1.00 57.69 ? 16 LYS A CB 1 +ATOM 137 C CG . LYS A 1 16 ? 79.538 16.913 -0.448 1.00 55.54 ? 16 LYS A CG 1 +ATOM 138 C CD . LYS A 1 16 ? 80.745 16.003 -0.313 1.00 55.21 ? 16 LYS A CD 1 +ATOM 139 C CE . LYS A 1 16 ? 81.348 16.136 1.060 1.00 55.93 ? 16 LYS A CE 1 +ATOM 140 N NZ . LYS A 1 16 ? 81.448 17.583 1.388 1.00 56.98 ? 16 LYS A NZ 1 +ATOM 141 N N . THR A 1 17 ? 77.293 16.805 -4.340 1.00 60.50 ? 17 THR A N 1 +ATOM 142 C CA . THR A 1 17 ? 77.124 16.825 -5.774 1.00 60.87 ? 17 THR A CA 1 +ATOM 143 C C . THR A 1 17 ? 75.986 17.762 -6.114 1.00 61.99 ? 17 THR A C 1 +ATOM 144 O O . THR A 1 17 ? 76.147 18.582 -7.006 1.00 64.63 ? 17 THR A O 1 +ATOM 145 C CB . THR A 1 17 ? 76.835 15.427 -6.346 1.00 60.60 ? 17 THR A CB 1 +ATOM 146 O OG1 . THR A 1 17 ? 77.843 14.511 -5.907 1.00 61.27 ? 17 THR A OG1 1 +ATOM 147 C CG2 . THR A 1 17 ? 76.867 15.464 -7.858 1.00 60.29 ? 17 THR A CG2 1 +ATOM 148 N N . VAL A 1 18 ? 74.842 17.673 -5.423 1.00 61.88 ? 18 VAL A N 1 +ATOM 149 C CA . VAL A 1 18 ? 73.724 18.589 -5.726 1.00 60.71 ? 18 VAL A CA 1 +ATOM 150 C C . VAL A 1 18 ? 74.250 19.999 -5.560 1.00 60.84 ? 18 VAL A C 1 +ATOM 151 O O . VAL A 1 18 ? 73.787 20.925 -6.225 1.00 59.96 ? 18 VAL A O 1 +ATOM 152 C CB . VAL A 1 18 ? 72.522 18.408 -4.769 1.00 60.09 ? 18 VAL A CB 1 +ATOM 153 C CG1 . VAL A 1 18 ? 71.392 19.381 -5.127 1.00 57.71 ? 18 VAL A CG1 1 +ATOM 154 C CG2 . VAL A 1 18 ? 72.028 16.988 -4.844 1.00 59.81 ? 18 VAL A CG2 1 +ATOM 155 N N . ALA A 1 19 ? 75.241 20.119 -4.673 1.00 61.59 ? 19 ALA A N 1 +ATOM 156 C CA . ALA A 1 19 ? 75.911 21.371 -4.345 1.00 62.90 ? 19 ALA A CA 1 +ATOM 157 C C . ALA A 1 19 ? 76.560 21.969 -5.578 1.00 64.31 ? 19 ALA A C 1 +ATOM 158 O O . ALA A 1 19 ? 76.372 23.151 -5.885 1.00 64.61 ? 19 ALA A O 1 +ATOM 159 C CB . ALA A 1 19 ? 76.953 21.120 -3.290 1.00 62.60 ? 19 ALA A CB 1 +ATOM 160 N N . GLN A 1 20 ? 77.326 21.137 -6.275 1.00 66.21 ? 20 GLN A N 1 +ATOM 161 C CA . GLN A 1 20 ? 78.018 21.516 -7.510 1.00 68.25 ? 20 GLN A CA 1 +ATOM 162 C C . GLN A 1 20 ? 77.056 21.719 -8.677 1.00 67.77 ? 20 GLN A C 1 +ATOM 163 O O . GLN A 1 20 ? 76.846 22.850 -9.131 1.00 68.40 ? 20 GLN A O 1 +ATOM 164 C CB . GLN A 1 20 ? 79.028 20.435 -7.872 1.00 71.14 ? 20 GLN A CB 1 +ATOM 165 C CG . GLN A 1 20 ? 79.984 20.164 -6.724 1.00 76.12 ? 20 GLN A CG 1 +ATOM 166 C CD . GLN A 1 20 ? 80.724 21.432 -6.307 1.00 78.57 ? 20 GLN A CD 1 +ATOM 167 O OE1 . GLN A 1 20 ? 81.222 21.541 -5.173 1.00 80.02 ? 20 GLN A OE1 1 +ATOM 168 N NE2 . GLN A 1 20 ? 80.809 22.400 -7.234 1.00 78.33 ? 20 GLN A NE2 1 +ATOM 169 N N . ASN A 1 21 ? 76.476 20.620 -9.155 1.00 66.20 ? 21 ASN A N 1 +ATOM 170 C CA . ASN A 1 21 ? 75.537 20.660 -10.265 1.00 65.74 ? 21 ASN A CA 1 +ATOM 171 C C . ASN A 1 21 ? 74.416 21.686 -10.209 1.00 65.33 ? 21 ASN A C 1 +ATOM 172 O O . ASN A 1 21 ? 73.807 21.961 -11.241 1.00 64.89 ? 21 ASN A O 1 +ATOM 173 C CB . ASN A 1 21 ? 74.906 19.296 -10.471 1.00 67.24 ? 21 ASN A CB 1 +ATOM 174 C CG . ASN A 1 21 ? 75.705 18.419 -11.397 1.00 69.32 ? 21 ASN A CG 1 +ATOM 175 O OD1 . ASN A 1 21 ? 76.876 18.114 -11.126 1.00 70.51 ? 21 ASN A OD1 1 +ATOM 176 N ND2 . ASN A 1 21 ? 75.078 17.997 -12.505 1.00 69.45 ? 21 ASN A ND2 1 +ATOM 177 N N . TYR A 1 22 ? 74.116 22.237 -9.030 1.00 65.05 ? 22 TYR A N 1 +ATOM 178 C CA . TYR A 1 22 ? 73.039 23.235 -8.923 1.00 64.77 ? 22 TYR A CA 1 +ATOM 179 C C . TYR A 1 22 ? 73.322 24.471 -8.060 1.00 65.82 ? 22 TYR A C 1 +ATOM 180 O O . TYR A 1 22 ? 72.380 25.144 -7.633 1.00 66.89 ? 22 TYR A O 1 +ATOM 181 C CB . TYR A 1 22 ? 71.742 22.588 -8.408 1.00 62.53 ? 22 TYR A CB 1 +ATOM 182 C CG . TYR A 1 22 ? 71.162 21.540 -9.325 1.00 59.48 ? 22 TYR A CG 1 +ATOM 183 C CD1 . TYR A 1 22 ? 71.632 20.236 -9.294 1.00 57.49 ? 22 TYR A CD1 1 +ATOM 184 C CD2 . TYR A 1 22 ? 70.190 21.873 -10.272 1.00 58.14 ? 22 TYR A CD2 1 +ATOM 185 C CE1 . TYR A 1 22 ? 71.162 19.292 -10.183 1.00 56.42 ? 22 TYR A CE1 1 +ATOM 186 C CE2 . TYR A 1 22 ? 69.710 20.938 -11.163 1.00 56.65 ? 22 TYR A CE2 1 +ATOM 187 C CZ . TYR A 1 22 ? 70.207 19.645 -11.115 1.00 56.78 ? 22 TYR A CZ 1 +ATOM 188 O OH . TYR A 1 22 ? 69.775 18.697 -12.011 1.00 55.85 ? 22 TYR A OH 1 +ATOM 189 N N . SER A 1 23 ? 74.598 24.778 -7.812 1.00 66.03 ? 23 SER A N 1 +ATOM 190 C CA . SER A 1 23 ? 74.984 25.934 -6.989 1.00 65.63 ? 23 SER A CA 1 +ATOM 191 C C . SER A 1 23 ? 74.145 27.212 -7.194 1.00 64.63 ? 23 SER A C 1 +ATOM 192 O O . SER A 1 23 ? 74.020 28.034 -6.285 1.00 65.31 ? 23 SER A O 1 +ATOM 193 C CB . SER A 1 23 ? 76.457 26.243 -7.216 1.00 65.45 ? 23 SER A CB 1 +ATOM 194 O OG . SER A 1 23 ? 76.747 26.159 -8.597 1.00 65.89 ? 23 SER A OG 1 +ATOM 195 N N . SER A 1 24 ? 73.566 27.370 -8.377 1.00 62.46 ? 24 SER A N 1 +ATOM 196 C CA . SER A 1 24 ? 72.743 28.534 -8.679 1.00 60.82 ? 24 SER A CA 1 +ATOM 197 C C . SER A 1 24 ? 71.533 28.684 -7.766 1.00 60.86 ? 24 SER A C 1 +ATOM 198 O O . SER A 1 24 ? 70.986 29.782 -7.619 1.00 60.72 ? 24 SER A O 1 +ATOM 199 C CB . SER A 1 24 ? 72.245 28.453 -10.121 1.00 60.06 ? 24 SER A CB 1 +ATOM 200 O OG . SER A 1 24 ? 70.917 28.933 -10.219 1.00 57.76 ? 24 SER A OG 1 +ATOM 201 N N . VAL A 1 25 ? 71.095 27.582 -7.168 1.00 60.88 ? 25 VAL A N 1 +ATOM 202 C CA . VAL A 1 25 ? 69.915 27.627 -6.312 1.00 61.08 ? 25 VAL A CA 1 +ATOM 203 C C . VAL A 1 25 ? 69.962 26.679 -5.109 1.00 61.03 ? 25 VAL A C 1 +ATOM 204 O O . VAL A 1 25 ? 68.929 26.304 -4.551 1.00 60.00 ? 25 VAL A O 1 +ATOM 205 C CB . VAL A 1 25 ? 68.613 27.378 -7.148 1.00 60.87 ? 25 VAL A CB 1 +ATOM 206 C CG1 . VAL A 1 25 ? 68.319 28.594 -8.046 1.00 59.99 ? 25 VAL A CG1 1 +ATOM 207 C CG2 . VAL A 1 25 ? 68.761 26.117 -7.996 1.00 60.65 ? 25 VAL A CG2 1 +ATOM 208 N N . THR A 1 26 ? 71.172 26.318 -4.702 1.00 61.03 ? 26 THR A N 1 +ATOM 209 C CA . THR A 1 26 ? 71.361 25.451 -3.551 1.00 61.43 ? 26 THR A CA 1 +ATOM 210 C C . THR A 1 26 ? 72.594 25.895 -2.766 1.00 62.52 ? 26 THR A C 1 +ATOM 211 O O . THR A 1 26 ? 73.434 26.635 -3.282 1.00 62.78 ? 26 THR A O 1 +ATOM 212 C CB . THR A 1 26 ? 71.575 23.991 -3.971 1.00 60.96 ? 26 THR A CB 1 +ATOM 213 O OG1 . THR A 1 26 ? 72.900 23.829 -4.502 1.00 59.75 ? 26 THR A OG1 1 +ATOM 214 C CG2 . THR A 1 26 ? 70.567 23.598 -5.021 1.00 61.35 ? 26 THR A CG2 1 +ATOM 215 N N . HIS A 1 27 ? 72.682 25.439 -1.514 1.00 63.16 ? 27 HIS A N 1 +ATOM 216 C CA . HIS A 1 27 ? 73.809 25.719 -0.620 1.00 62.58 ? 27 HIS A CA 1 +ATOM 217 C C . HIS A 1 27 ? 73.784 24.652 0.464 1.00 61.32 ? 27 HIS A C 1 +ATOM 218 O O . HIS A 1 27 ? 72.743 24.416 1.073 1.00 60.56 ? 27 HIS A O 1 +ATOM 219 C CB . HIS A 1 27 ? 73.698 27.125 0.011 1.00 64.79 ? 27 HIS A CB 1 +ATOM 220 C CG . HIS A 1 27 ? 74.756 27.417 1.041 1.00 65.93 ? 27 HIS A CG 1 +ATOM 221 N ND1 . HIS A 1 27 ? 75.965 26.753 1.084 1.00 66.61 ? 27 HIS A ND1 1 +ATOM 222 C CD2 . HIS A 1 27 ? 74.796 28.324 2.047 1.00 65.83 ? 27 HIS A CD2 1 +ATOM 223 C CE1 . HIS A 1 27 ? 76.702 27.239 2.067 1.00 65.10 ? 27 HIS A CE1 1 +ATOM 224 N NE2 . HIS A 1 27 ? 76.017 28.193 2.666 1.00 65.15 ? 27 HIS A NE2 1 +ATOM 225 N N . LEU A 1 28 ? 74.924 23.999 0.675 1.00 60.16 ? 28 LEU A N 1 +ATOM 226 C CA . LEU A 1 28 ? 75.056 22.952 1.679 1.00 60.33 ? 28 LEU A CA 1 +ATOM 227 C C . LEU A 1 28 ? 76.053 23.379 2.744 1.00 61.28 ? 28 LEU A C 1 +ATOM 228 O O . LEU A 1 28 ? 77.121 23.879 2.415 1.00 61.78 ? 28 LEU A O 1 +ATOM 229 C CB . LEU A 1 28 ? 75.563 21.654 1.041 1.00 59.62 ? 28 LEU A CB 1 +ATOM 230 C CG . LEU A 1 28 ? 76.384 20.733 1.972 1.00 60.46 ? 28 LEU A CG 1 +ATOM 231 C CD1 . LEU A 1 28 ? 75.465 20.133 3.005 1.00 61.60 ? 28 LEU A CD1 1 +ATOM 232 C CD2 . LEU A 1 28 ? 77.092 19.616 1.203 1.00 60.01 ? 28 LEU A CD2 1 +ATOM 233 N N . HIS A 1 29 ? 75.705 23.195 4.017 1.00 61.78 ? 29 HIS A N 1 +ATOM 234 C CA . HIS A 1 29 ? 76.618 23.516 5.107 1.00 61.64 ? 29 HIS A CA 1 +ATOM 235 C C . HIS A 1 29 ? 76.385 22.572 6.265 1.00 61.58 ? 29 HIS A C 1 +ATOM 236 O O . HIS A 1 29 ? 75.659 21.587 6.118 1.00 62.06 ? 29 HIS A O 1 +ATOM 237 C CB . HIS A 1 29 ? 76.499 24.993 5.543 1.00 63.72 ? 29 HIS A CB 1 +ATOM 238 C CG . HIS A 1 29 ? 75.213 25.374 6.223 1.00 65.36 ? 29 HIS A CG 1 +ATOM 239 N ND1 . HIS A 1 29 ? 73.971 25.194 5.648 1.00 67.11 ? 29 HIS A ND1 1 +ATOM 240 C CD2 . HIS A 1 29 ? 74.993 26.053 7.377 1.00 65.58 ? 29 HIS A CD2 1 +ATOM 241 C CE1 . HIS A 1 29 ? 73.045 25.751 6.412 1.00 66.81 ? 29 HIS A CE1 1 +ATOM 242 N NE2 . HIS A 1 29 ? 73.640 26.281 7.466 1.00 66.19 ? 29 HIS A NE2 1 +ATOM 243 N N . SER A 1 30 ? 77.008 22.839 7.406 1.00 60.59 ? 30 SER A N 1 +ATOM 244 C CA . SER A 1 30 ? 76.821 21.971 8.564 1.00 60.50 ? 30 SER A CA 1 +ATOM 245 C C . SER A 1 30 ? 76.674 22.760 9.863 1.00 60.25 ? 30 SER A C 1 +ATOM 246 O O . SER A 1 30 ? 77.565 23.508 10.247 1.00 60.89 ? 30 SER A O 1 +ATOM 247 C CB . SER A 1 30 ? 77.980 20.980 8.675 1.00 59.44 ? 30 SER A CB 1 +ATOM 248 O OG . SER A 1 30 ? 77.781 20.107 9.776 1.00 60.86 ? 30 SER A OG 1 +ATOM 249 N N . ILE A 1 31 ? 75.551 22.591 10.546 1.00 59.65 ? 31 ILE A N 1 +ATOM 250 C CA . ILE A 1 31 ? 75.354 23.331 11.762 1.00 60.08 ? 31 ILE A CA 1 +ATOM 251 C C . ILE A 1 31 ? 76.105 22.722 12.942 1.00 60.79 ? 31 ILE A C 1 +ATOM 252 O O . ILE A 1 31 ? 76.057 23.231 14.066 1.00 60.52 ? 31 ILE A O 1 +ATOM 253 C CB . ILE A 1 31 ? 73.863 23.470 12.091 1.00 60.37 ? 31 ILE A CB 1 +ATOM 254 C CG1 . ILE A 1 31 ? 73.712 24.141 13.471 1.00 62.56 ? 31 ILE A CG1 1 +ATOM 255 C CG2 . ILE A 1 31 ? 73.192 22.102 12.088 1.00 59.67 ? 31 ILE A CG2 1 +ATOM 256 C CD1 . ILE A 1 31 ? 74.437 25.525 13.656 1.00 59.23 ? 31 ILE A CD1 1 +ATOM 257 N N . GLY A 1 32 ? 76.820 21.634 12.702 1.00 61.07 ? 32 GLY A N 1 +ATOM 258 C CA . GLY A 1 32 ? 77.568 21.048 13.800 1.00 61.92 ? 32 GLY A CA 1 +ATOM 259 C C . GLY A 1 32 ? 77.971 19.628 13.506 1.00 62.76 ? 32 GLY A C 1 +ATOM 260 O O . GLY A 1 32 ? 77.895 19.202 12.348 1.00 63.49 ? 32 GLY A O 1 +ATOM 261 N N . LYS A 1 33 ? 78.413 18.902 14.535 1.00 63.33 ? 33 LYS A N 1 +ATOM 262 C CA . LYS A 1 33 ? 78.796 17.496 14.368 1.00 64.58 ? 33 LYS A CA 1 +ATOM 263 C C . LYS A 1 33 ? 78.265 16.622 15.505 1.00 64.28 ? 33 LYS A C 1 +ATOM 264 O O . LYS A 1 33 ? 78.116 17.074 16.639 1.00 62.43 ? 33 LYS A O 1 +ATOM 265 C CB . LYS A 1 33 ? 80.316 17.372 14.345 1.00 99.99 ? 33 LYS A CB 1 +ATOM 266 C CG . LYS A 1 33 ? 80.859 17.995 13.065 0.0000 99.99 ? 33 LYS A CG 1 +ATOM 267 C CD . LYS A 1 33 ? 82.370 17.804 13.007 0.0000 99.99 ? 33 LYS A CD 1 +ATOM 268 C CE . LYS A 1 33 ? 82.923 18.493 11.764 0.0000 99.99 ? 33 LYS A CE 1 +ATOM 269 N NZ . LYS A 1 33 ? 84.373 18.269 11.682 0.0000 99.99 ? 33 LYS A NZ 1 +ATOM 270 N N . SER A 1 34 ? 77.962 15.369 15.188 1.00 65.31 ? 34 SER A N 1 +ATOM 271 C CA . SER A 1 34 ? 77.441 14.457 16.198 1.00 67.32 ? 34 SER A CA 1 +ATOM 272 C C . SER A 1 34 ? 78.497 14.263 17.266 1.00 67.73 ? 34 SER A C 1 +ATOM 273 O O . SER A 1 34 ? 79.524 14.939 17.258 1.00 68.29 ? 34 SER A O 1 +ATOM 274 C CB . SER A 1 34 ? 77.124 13.095 15.596 1.00 67.23 ? 34 SER A CB 1 +ATOM 275 O OG . SER A 1 34 ? 78.303 12.319 15.525 1.00 67.15 ? 34 SER A OG 1 +ATOM 276 N N . VAL A 1 35 ? 78.245 13.347 18.192 1.00 67.72 ? 35 VAL A N 1 +ATOM 277 C CA . VAL A 1 35 ? 79.232 13.090 19.218 1.00 68.51 ? 35 VAL A CA 1 +ATOM 278 C C . VAL A 1 35 ? 80.216 12.130 18.588 1.00 69.86 ? 35 VAL A C 1 +ATOM 279 O O . VAL A 1 35 ? 81.068 11.575 19.283 1.00 71.81 ? 35 VAL A O 1 +ATOM 280 C CB . VAL A 1 35 ? 78.653 12.408 20.485 1.00 67.58 ? 35 VAL A CB 1 +ATOM 281 C CG1 . VAL A 1 35 ? 77.703 13.321 21.183 1.00 67.82 ? 35 VAL A CG1 1 +ATOM 282 C CG2 . VAL A 1 35 ? 77.973 11.130 20.123 1.00 66.99 ? 35 VAL A CG2 1 +ATOM 283 N N . LYS A 1 36 ? 80.097 11.919 17.277 1.00 69.65 ? 36 LYS A N 1 +ATOM 284 C CA . LYS A 1 36 ? 81.009 11.006 16.591 1.00 69.56 ? 36 LYS A CA 1 +ATOM 285 C C . LYS A 1 36 ? 81.719 11.699 15.436 1.00 69.12 ? 36 LYS A C 1 +ATOM 286 O O . LYS A 1 36 ? 82.393 11.065 14.636 1.00 69.48 ? 36 LYS A O 1 +ATOM 287 C CB . LYS A 1 36 ? 80.232 9.818 16.035 1.00 99.99 ? 36 LYS A CB 1 +ATOM 288 C CG . LYS A 1 36 ? 81.208 8.755 15.542 0.0000 99.99 ? 36 LYS A CG 1 +ATOM 289 C CD . LYS A 1 36 ? 81.741 7.965 16.732 0.0000 99.99 ? 36 LYS A CD 1 +ATOM 290 C CE . LYS A 1 36 ? 82.792 6.969 16.251 0.0000 99.99 ? 36 LYS A CE 1 +ATOM 291 N NZ . LYS A 1 36 ? 83.203 6.109 17.370 0.0000 99.99 ? 36 LYS A NZ 1 +ATOM 292 N N . GLY A 1 37 ? 81.569 13.007 15.345 1.00 68.88 ? 37 GLY A N 1 +ATOM 293 C CA . GLY A 1 37 ? 82.237 13.713 14.276 1.00 70.62 ? 37 GLY A CA 1 +ATOM 294 C C . GLY A 1 37 ? 81.507 13.639 12.952 1.00 72.08 ? 37 GLY A C 1 +ATOM 295 O O . GLY A 1 37 ? 82.040 14.049 11.914 1.00 73.03 ? 37 GLY A O 1 +ATOM 296 N N . ARG A 1 38 ? 80.287 13.109 12.979 1.00 72.46 ? 38 ARG A N 1 +ATOM 297 C CA . ARG A 1 38 ? 79.473 13.009 11.766 1.00 70.57 ? 38 ARG A CA 1 +ATOM 298 C C . ARG A 1 38 ? 78.909 14.392 11.483 1.00 69.49 ? 38 ARG A C 1 +ATOM 299 O O . ARG A 1 38 ? 78.676 15.191 12.403 1.00 68.88 ? 38 ARG A O 1 +ATOM 300 C CB . ARG A 1 38 ? 78.340 12.008 11.967 1.00 70.42 ? 38 ARG A CB 1 +ATOM 301 C CG . ARG A 1 38 ? 78.817 10.609 12.280 1.00 69.19 ? 38 ARG A CG 1 +ATOM 302 C CD . ARG A 1 38 ? 78.512 9.656 11.146 1.00 68.64 ? 38 ARG A CD 1 +ATOM 303 N NE . ARG A 1 38 ? 78.954 8.300 11.441 1.00 68.98 ? 38 ARG A NE 1 +ATOM 304 C CZ . ARG A 1 38 ? 78.794 7.703 12.619 1.00 69.96 ? 38 ARG A CZ 1 +ATOM 305 N NH1 . ARG A 1 38 ? 78.210 8.351 13.620 1.00 70.32 ? 38 ARG A NH1 1 +ATOM 306 N NH2 . ARG A 1 38 ? 79.186 6.442 12.791 1.00 70.58 ? 38 ARG A NH2 1 +ATOM 307 N N . ASN A 1 39 ? 78.671 14.675 10.214 1.00 68.24 ? 39 ASN A N 1 +ATOM 308 C CA . ASN A 1 39 ? 78.179 15.992 9.857 1.00 67.43 ? 39 ASN A CA 1 +ATOM 309 C C . ASN A 1 39 ? 76.672 16.221 9.787 1.00 66.55 ? 39 ASN A C 1 +ATOM 310 O O . ASN A 1 39 ? 75.885 15.385 9.303 1.00 67.82 ? 39 ASN A O 1 +ATOM 311 C CB . ASN A 1 39 ? 78.848 16.443 8.571 1.00 66.51 ? 39 ASN A CB 1 +ATOM 312 C CG . ASN A 1 39 ? 79.888 17.471 8.826 1.00 66.73 ? 39 ASN A CG 1 +ATOM 313 O OD1 . ASN A 1 39 ? 79.595 18.655 8.847 1.00 67.09 ? 39 ASN A OD1 1 +ATOM 314 N ND2 . ASN A 1 39 ? 81.111 17.030 9.075 1.00 67.77 ? 39 ASN A ND2 1 +ATOM 315 N N . LEU A 1 40 ? 76.276 17.378 10.289 1.00 63.03 ? 40 LEU A N 1 +ATOM 316 C CA . LEU A 1 40 ? 74.886 17.724 10.305 1.00 59.95 ? 40 LEU A CA 1 +ATOM 317 C C . LEU A 1 40 ? 74.595 18.598 9.109 1.00 58.81 ? 40 LEU A C 1 +ATOM 318 O O . LEU A 1 40 ? 74.316 19.782 9.238 1.00 58.97 ? 40 LEU A O 1 +ATOM 319 C CB . LEU A 1 40 ? 74.582 18.427 11.623 1.00 59.58 ? 40 LEU A CB 1 +ATOM 320 C CG . LEU A 1 40 ? 74.878 17.559 12.855 1.00 57.47 ? 40 LEU A CG 1 +ATOM 321 C CD1 . LEU A 1 40 ? 73.898 17.913 13.952 1.00 56.65 ? 40 LEU A CD1 1 +ATOM 322 C CD2 . LEU A 1 40 ? 74.741 16.083 12.528 1.00 57.48 ? 40 LEU A CD2 1 +ATOM 323 N N . TRP A 1 41 ? 74.646 17.989 7.934 1.00 58.24 ? 41 TRP A N 1 +ATOM 324 C CA . TRP A 1 41 ? 74.433 18.710 6.687 1.00 57.62 ? 41 TRP A CA 1 +ATOM 325 C C . TRP A 1 41 ? 73.040 19.237 6.517 1.00 55.96 ? 41 TRP A C 1 +ATOM 326 O O . TRP A 1 41 ? 72.073 18.580 6.860 1.00 57.05 ? 41 TRP A O 1 +ATOM 327 C CB . TRP A 1 41 ? 74.732 17.814 5.481 1.00 60.23 ? 41 TRP A CB 1 +ATOM 328 C CG . TRP A 1 41 ? 76.010 17.061 5.578 1.00 63.50 ? 41 TRP A CG 1 +ATOM 329 C CD1 . TRP A 1 41 ? 76.177 15.781 6.022 1.00 64.25 ? 41 TRP A CD1 1 +ATOM 330 C CD2 . TRP A 1 41 ? 77.316 17.557 5.285 1.00 66.09 ? 41 TRP A CD2 1 +ATOM 331 N NE1 . TRP A 1 41 ? 77.508 15.444 6.029 1.00 65.95 ? 41 TRP A NE1 1 +ATOM 332 C CE2 . TRP A 1 41 ? 78.234 16.516 5.581 1.00 67.37 ? 41 TRP A CE2 1 +ATOM 333 C CE3 . TRP A 1 41 ? 77.805 18.781 4.805 1.00 66.47 ? 41 TRP A CE3 1 +ATOM 334 C CZ2 . TRP A 1 41 ? 79.619 16.662 5.414 1.00 68.02 ? 41 TRP A CZ2 1 +ATOM 335 C CZ3 . TRP A 1 41 ? 79.172 18.927 4.642 1.00 67.49 ? 41 TRP A CZ3 1 +ATOM 336 C CH2 . TRP A 1 41 ? 80.068 17.869 4.947 1.00 67.97 ? 41 TRP A CH2 1 +ATOM 337 N N . VAL A 1 42 ? 72.943 20.427 5.961 1.00 54.05 ? 42 VAL A N 1 +ATOM 338 C CA . VAL A 1 42 ? 71.655 21.026 5.673 1.00 52.49 ? 42 VAL A CA 1 +ATOM 339 C C . VAL A 1 42 ? 71.809 21.457 4.232 1.00 52.91 ? 42 VAL A C 1 +ATOM 340 O O . VAL A 1 42 ? 72.904 21.822 3.795 1.00 52.33 ? 42 VAL A O 1 +ATOM 341 C CB . VAL A 1 42 ? 71.412 22.278 6.508 1.00 51.78 ? 42 VAL A CB 1 +ATOM 342 C CG1 . VAL A 1 42 ? 70.073 22.867 6.185 1.00 49.83 ? 42 VAL A CG1 1 +ATOM 343 C CG2 . VAL A 1 42 ? 71.530 21.943 7.956 1.00 51.54 ? 42 VAL A CG2 1 +ATOM 344 N N . LEU A 1 43 ? 70.730 21.393 3.476 1.00 53.11 ? 43 LEU A N 1 +ATOM 345 C CA . LEU A 1 43 ? 70.793 21.837 2.096 1.00 53.44 ? 43 LEU A CA 1 +ATOM 346 C C . LEU A 1 43 ? 69.670 22.840 1.926 1.00 53.50 ? 43 LEU A C 1 +ATOM 347 O O . LEU A 1 43 ? 68.507 22.538 2.209 1.00 53.77 ? 43 LEU A O 1 +ATOM 348 C CB . LEU A 1 43 ? 70.620 20.670 1.138 1.00 53.59 ? 43 LEU A CB 1 +ATOM 349 C CG . LEU A 1 43 ? 70.928 20.951 -0.334 1.00 54.78 ? 43 LEU A CG 1 +ATOM 350 C CD1 . LEU A 1 43 ? 71.263 19.617 -1.025 1.00 55.52 ? 43 LEU A CD1 1 +ATOM 351 C CD2 . LEU A 1 43 ? 69.745 21.662 -1.012 1.00 54.07 ? 43 LEU A CD2 1 +ATOM 352 N N . VAL A 1 44 ? 70.010 24.051 1.504 1.00 52.97 ? 44 VAL A N 1 +ATOM 353 C CA . VAL A 1 44 ? 68.976 25.041 1.335 1.00 51.81 ? 44 VAL A CA 1 +ATOM 354 C C . VAL A 1 44 ? 68.705 25.156 -0.119 1.00 50.96 ? 44 VAL A C 1 +ATOM 355 O O . VAL A 1 44 ? 69.605 25.025 -0.923 1.00 51.26 ? 44 VAL A O 1 +ATOM 356 C CB . VAL A 1 44 ? 69.383 26.396 1.886 1.00 51.75 ? 44 VAL A CB 1 +ATOM 357 C CG1 . VAL A 1 44 ? 68.169 27.320 1.905 1.00 51.75 ? 44 VAL A CG1 1 +ATOM 358 C CG2 . VAL A 1 44 ? 69.949 26.232 3.283 1.00 52.08 ? 44 VAL A CG2 1 +ATOM 359 N N . VAL A 1 45 ? 67.452 25.381 -0.451 1.00 51.08 ? 45 VAL A N 1 +ATOM 360 C CA . VAL A 1 45 ? 67.050 25.497 -1.829 1.00 54.08 ? 45 VAL A CA 1 +ATOM 361 C C . VAL A 1 45 ? 66.267 26.771 -1.962 1.00 57.54 ? 45 VAL A C 1 +ATOM 362 O O . VAL A 1 45 ? 65.210 26.917 -1.360 1.00 59.03 ? 45 VAL A O 1 +ATOM 363 C CB . VAL A 1 45 ? 66.135 24.339 -2.258 1.00 52.48 ? 45 VAL A CB 1 +ATOM 364 C CG1 . VAL A 1 45 ? 65.652 24.575 -3.671 1.00 51.55 ? 45 VAL A CG1 1 +ATOM 365 C CG2 . VAL A 1 45 ? 66.873 23.009 -2.152 1.00 51.89 ? 45 VAL A CG2 1 +ATOM 366 N N . GLY A 1 46 ? 66.769 27.701 -2.758 1.00 60.54 ? 46 GLY A N 1 +ATOM 367 C CA . GLY A 1 46 ? 66.047 28.943 -2.910 1.00 63.32 ? 46 GLY A CA 1 +ATOM 368 C C . GLY A 1 46 ? 66.573 29.698 -4.089 1.00 65.81 ? 46 GLY A C 1 +ATOM 369 O O . GLY A 1 46 ? 67.611 29.326 -4.650 1.00 64.91 ? 46 GLY A O 1 +ATOM 370 N N . ARG A 1 47 ? 65.859 30.760 -4.456 1.00 68.89 ? 47 ARG A N 1 +ATOM 371 C CA . ARG A 1 47 ? 66.255 31.585 -5.587 1.00 71.79 ? 47 ARG A CA 1 +ATOM 372 C C . ARG A 1 47 ? 67.636 32.157 -5.278 1.00 72.60 ? 47 ARG A C 1 +ATOM 373 O O . ARG A 1 47 ? 68.563 32.036 -6.085 1.00 74.17 ? 47 ARG A O 1 +ATOM 374 C CB . ARG A 1 47 ? 65.223 32.691 -5.826 1.00 73.27 ? 47 ARG A CB 1 +ATOM 375 C CG . ARG A 1 47 ? 65.258 33.270 -7.229 1.00 75.79 ? 47 ARG A CG 1 +ATOM 376 C CD . ARG A 1 47 ? 65.607 32.187 -8.249 1.00 78.27 ? 47 ARG A CD 1 +ATOM 377 N NE . ARG A 1 47 ? 64.582 31.151 -8.378 1.00 79.92 ? 47 ARG A NE 1 +ATOM 378 C CZ . ARG A 1 47 ? 64.786 29.977 -8.977 1.00 81.50 ? 47 ARG A CZ 1 +ATOM 379 N NH1 . ARG A 1 47 ? 65.981 29.689 -9.493 1.00 81.66 ? 47 ARG A NH1 1 +ATOM 380 N NH2 . ARG A 1 47 ? 63.795 29.094 -9.075 1.00 81.57 ? 47 ARG A NH2 1 +ATOM 381 N N . PHE A 1 48 ? 67.781 32.758 -4.105 1.00 72.13 ? 48 PHE A N 1 +ATOM 382 C CA . PHE A 1 48 ? 69.073 33.273 -3.725 1.00 72.31 ? 48 PHE A CA 1 +ATOM 383 C C . PHE A 1 48 ? 69.494 32.485 -2.506 1.00 71.36 ? 48 PHE A C 1 +ATOM 384 O O . PHE A 1 48 ? 69.360 32.964 -1.394 1.00 71.23 ? 48 PHE A O 1 +ATOM 385 C CB . PHE A 1 48 ? 69.018 34.757 -3.354 1.00 74.52 ? 48 PHE A CB 1 +ATOM 386 C CG . PHE A 1 48 ? 67.798 35.496 -3.867 1.00 76.85 ? 48 PHE A CG 1 +ATOM 387 C CD1 . PHE A 1 48 ? 66.706 35.741 -3.019 1.00 76.92 ? 48 PHE A CD1 1 +ATOM 388 C CD2 . PHE A 1 48 ? 67.763 36.007 -5.175 1.00 77.96 ? 48 PHE A CD2 1 +ATOM 389 C CE1 . PHE A 1 48 ? 65.596 36.486 -3.455 1.00 76.84 ? 48 PHE A CE1 1 +ATOM 390 C CE2 . PHE A 1 48 ? 66.655 36.759 -5.627 1.00 78.65 ? 48 PHE A CE2 1 +ATOM 391 C CZ . PHE A 1 48 ? 65.568 36.997 -4.758 1.00 77.95 ? 48 PHE A CZ 1 +ATOM 392 N N . PRO A 1 49 ? 69.975 31.245 -2.687 1.00 71.79 ? 49 PRO A N 1 +ATOM 393 C CA . PRO A 1 49 ? 70.397 30.470 -1.501 1.00 72.06 ? 49 PRO A CA 1 +ATOM 394 C C . PRO A 1 49 ? 71.590 31.113 -0.799 1.00 71.90 ? 49 PRO A C 1 +ATOM 395 O O . PRO A 1 49 ? 72.254 31.987 -1.381 1.00 72.44 ? 49 PRO A O 1 +ATOM 396 C CB . PRO A 1 49 ? 70.739 29.087 -2.074 1.00 71.36 ? 49 PRO A CB 1 +ATOM 397 C CG . PRO A 1 49 ? 71.069 29.377 -3.516 1.00 71.51 ? 49 PRO A CG 1 +ATOM 398 C CD . PRO A 1 49 ? 70.058 30.432 -3.913 1.00 70.81 ? 49 PRO A CD 1 +ATOM 399 N N . LYS A 1 50 ? 71.850 30.692 0.440 1.00 70.75 ? 50 LYS A N 1 +ATOM 400 C CA . LYS A 1 50 ? 72.978 31.214 1.252 1.00 70.21 ? 50 LYS A CA 1 +ATOM 401 C C . LYS A 1 50 ? 72.694 32.456 2.123 1.00 68.00 ? 50 LYS A C 1 +ATOM 402 O O . LYS A 1 50 ? 73.399 32.700 3.112 1.00 68.24 ? 50 LYS A O 1 +ATOM 403 C CB . LYS A 1 50 ? 74.228 31.497 0.368 1.00 70.56 ? 50 LYS A CB 1 +ATOM 404 C CG . LYS A 1 50 ? 75.464 32.059 1.109 1.00 68.49 ? 50 LYS A CG 1 +ATOM 405 C CD . LYS A 1 50 ? 76.622 32.286 0.151 0.0000 69.31 ? 50 LYS A CD 1 +ATOM 406 C CE . LYS A 1 50 ? 77.840 32.835 0.875 0.0000 69.18 ? 50 LYS A CE 1 +ATOM 407 N NZ . LYS A 1 50 ? 78.981 33.065 -0.054 0.0000 69.31 ? 50 LYS A NZ 1 +ATOM 408 N N . GLU A 1 51 ? 71.676 33.233 1.776 1.00 64.82 ? 51 GLU A N 1 +ATOM 409 C CA . GLU A 1 51 ? 71.377 34.420 2.561 1.00 61.77 ? 51 GLU A CA 1 +ATOM 410 C C . GLU A 1 51 ? 69.893 34.689 2.721 1.00 57.23 ? 51 GLU A C 1 +ATOM 411 O O . GLU A 1 51 ? 69.147 34.771 1.751 1.00 54.29 ? 51 GLU A O 1 +ATOM 412 C CB . GLU A 1 51 ? 72.068 35.637 1.938 1.00 65.63 ? 51 GLU A CB 1 +ATOM 413 C CG . GLU A 1 51 ? 71.826 35.798 0.431 1.00 70.14 ? 51 GLU A CG 1 +ATOM 414 C CD . GLU A 1 51 ? 72.620 36.957 -0.197 1.00 72.96 ? 51 GLU A CD 1 +ATOM 415 O OE1 . GLU A 1 51 ? 72.352 37.266 -1.391 1.00 73.71 ? 51 GLU A OE1 1 +ATOM 416 O OE2 . GLU A 1 51 ? 73.500 37.548 0.494 1.00 72.92 ? 51 GLU A OE2 1 +ATOM 417 N N . HIS A 1 52 ? 69.453 34.823 3.957 1.00 53.31 ? 52 HIS A N 1 +ATOM 418 C CA . HIS A 1 52 ? 68.050 35.093 4.140 1.00 51.68 ? 52 HIS A CA 1 +ATOM 419 C C . HIS A 1 52 ? 67.796 36.365 3.365 1.00 50.15 ? 52 HIS A C 1 +ATOM 420 O O . HIS A 1 52 ? 68.704 37.156 3.177 1.00 51.06 ? 52 HIS A O 1 +ATOM 421 C CB . HIS A 1 52 ? 67.693 35.298 5.622 1.00 50.95 ? 52 HIS A CB 1 +ATOM 422 C CG . HIS A 1 52 ? 66.510 36.187 5.828 1.00 49.59 ? 52 HIS A CG 1 +ATOM 423 N ND1 . HIS A 1 52 ? 65.262 35.886 5.328 1.00 50.39 ? 52 HIS A ND1 1 +ATOM 424 C CD2 . HIS A 1 52 ? 66.412 37.427 6.361 1.00 48.91 ? 52 HIS A CD2 1 +ATOM 425 C CE1 . HIS A 1 52 ? 64.450 36.908 5.536 1.00 50.73 ? 52 HIS A CE1 1 +ATOM 426 N NE2 . HIS A 1 52 ? 65.124 37.857 6.159 1.00 48.70 ? 52 HIS A NE2 1 +ATOM 427 N N . ARG A 1 53 ? 66.572 36.547 2.894 1.00 48.54 ? 53 ARG A N 1 +ATOM 428 C CA . ARG A 1 53 ? 66.222 37.751 2.170 1.00 47.68 ? 53 ARG A CA 1 +ATOM 429 C C . ARG A 1 53 ? 64.885 38.276 2.685 1.00 47.81 ? 53 ARG A C 1 +ATOM 430 O O . ARG A 1 53 ? 63.911 37.544 2.742 1.00 49.29 ? 53 ARG A O 1 +ATOM 431 C CB . ARG A 1 53 ? 66.108 37.446 0.680 1.00 99.99 ? 53 ARG A CB 1 +ATOM 432 C CG . ARG A 1 53 ? 67.400 36.804 0.191 0.0000 99.99 ? 53 ARG A CG 1 +ATOM 433 C CD . ARG A 1 53 ? 68.533 37.822 0.263 0.0000 99.99 ? 53 ARG A CD 1 +ATOM 434 N NE . ARG A 1 53 ? 68.229 39.013 -0.563 0.0000 99.99 ? 53 ARG A NE 1 +ATOM 435 C CZ . ARG A 1 53 ? 69.153 39.898 -0.924 0.0000 99.99 ? 53 ARG A CZ 1 +ATOM 436 N NH1 . ARG A 1 53 ? 70.428 39.774 -0.564 0.0000 99.99 ? 53 ARG A NH1 1 +ATOM 437 N NH2 . ARG A 1 53 ? 68.771 40.932 -1.669 0.0000 99.99 ? 53 ARG A NH2 1 +ATOM 438 N N . ILE A 1 54 ? 64.861 39.539 3.095 1.00 47.48 ? 54 ILE A N 1 +ATOM 439 C CA . ILE A 1 54 ? 63.650 40.187 3.574 1.00 47.90 ? 54 ILE A CA 1 +ATOM 440 C C . ILE A 1 54 ? 62.446 39.793 2.692 1.00 49.03 ? 54 ILE A C 1 +ATOM 441 O O . ILE A 1 54 ? 62.499 39.915 1.463 1.00 49.93 ? 54 ILE A O 1 +ATOM 442 C CB . ILE A 1 54 ? 63.833 41.749 3.538 1.00 46.86 ? 54 ILE A CB 1 +ATOM 443 C CG1 . ILE A 1 54 ? 64.520 42.232 4.814 1.00 47.77 ? 54 ILE A CG1 1 +ATOM 444 C CG2 . ILE A 1 54 ? 62.507 42.450 3.372 1.00 44.32 ? 54 ILE A CG2 1 +ATOM 445 C CD1 . ILE A 1 54 ? 65.944 41.751 4.969 1.00 48.87 ? 54 ILE A CD1 1 +ATOM 446 N N . GLY A 1 55 ? 61.365 39.301 3.292 1.00 48.21 ? 55 GLY A N 1 +ATOM 447 C CA . GLY A 1 55 ? 60.218 38.968 2.460 1.00 46.30 ? 55 GLY A CA 1 +ATOM 448 C C . GLY A 1 55 ? 60.036 37.505 2.138 1.00 44.88 ? 55 GLY A C 1 +ATOM 449 O O . GLY A 1 55 ? 58.922 37.006 2.207 1.00 44.94 ? 55 GLY A O 1 +ATOM 450 N N . ILE A 1 56 ? 61.106 36.819 1.758 1.00 43.87 ? 56 ILE A N 1 +ATOM 451 C CA . ILE A 1 56 ? 60.998 35.403 1.474 1.00 43.96 ? 56 ILE A CA 1 +ATOM 452 C C . ILE A 1 56 ? 61.151 34.674 2.812 1.00 45.62 ? 56 ILE A C 1 +ATOM 453 O O . ILE A 1 56 ? 62.161 34.828 3.503 1.00 45.35 ? 56 ILE A O 1 +ATOM 454 C CB . ILE A 1 56 ? 62.064 34.935 0.441 1.00 42.34 ? 56 ILE A CB 1 +ATOM 455 C CG1 . ILE A 1 56 ? 63.486 35.175 0.960 1.00 43.50 ? 56 ILE A CG1 1 +ATOM 456 C CG2 . ILE A 1 56 ? 61.887 35.723 -0.866 1.00 38.45 ? 56 ILE A CG2 1 +ATOM 457 C CD1 . ILE A 1 56 ? 64.003 34.292 2.112 1.00 42.47 ? 56 ILE A CD1 1 +ATOM 458 N N . PRO A 1 57 ? 60.121 33.901 3.213 1.00 46.71 ? 57 PRO A N 1 +ATOM 459 C CA . PRO A 1 57 ? 60.108 33.148 4.460 1.00 47.66 ? 57 PRO A CA 1 +ATOM 460 C C . PRO A 1 57 ? 61.037 31.948 4.449 1.00 48.59 ? 57 PRO A C 1 +ATOM 461 O O . PRO A 1 57 ? 61.236 31.319 3.413 1.00 47.89 ? 57 PRO A O 1 +ATOM 462 C CB . PRO A 1 57 ? 58.655 32.712 4.574 1.00 47.78 ? 57 PRO A CB 1 +ATOM 463 C CG . PRO A 1 57 ? 57.920 33.713 3.795 1.00 47.59 ? 57 PRO A CG 1 +ATOM 464 C CD . PRO A 1 57 ? 58.789 33.829 2.594 1.00 47.49 ? 57 PRO A CD 1 +ATOM 465 N N . GLU A 1 58 ? 61.584 31.633 5.623 1.00 50.63 ? 58 GLU A N 1 +ATOM 466 C CA . GLU A 1 58 ? 62.481 30.490 5.796 1.00 51.80 ? 58 GLU A CA 1 +ATOM 467 C C . GLU A 1 58 ? 61.664 29.231 6.166 1.00 51.77 ? 58 GLU A C 1 +ATOM 468 O O . GLU A 1 58 ? 60.662 29.323 6.899 1.00 52.13 ? 58 GLU A O 1 +ATOM 469 C CB . GLU A 1 58 ? 63.512 30.811 6.881 1.00 51.50 ? 58 GLU A CB 1 +ATOM 470 C CG . GLU A 1 58 ? 64.330 32.043 6.544 1.00 54.17 ? 58 GLU A CG 1 +ATOM 471 C CD . GLU A 1 58 ? 65.112 31.883 5.237 1.00 55.40 ? 58 GLU A CD 1 +ATOM 472 O OE1 . GLU A 1 58 ? 65.439 32.907 4.582 1.00 55.14 ? 58 GLU A OE1 1 +ATOM 473 O OE2 . GLU A 1 58 ? 65.406 30.725 4.875 1.00 54.90 ? 58 GLU A OE2 1 +ATOM 474 N N . PHE A 1 59 ? 62.076 28.076 5.632 1.00 50.51 ? 59 PHE A N 1 +ATOM 475 C CA . PHE A 1 59 ? 61.389 26.811 5.888 1.00 48.93 ? 59 PHE A CA 1 +ATOM 476 C C . PHE A 1 59 ? 62.337 25.616 6.064 1.00 48.08 ? 59 PHE A C 1 +ATOM 477 O O . PHE A 1 59 ? 63.333 25.484 5.335 1.00 46.36 ? 59 PHE A O 1 +ATOM 478 C CB . PHE A 1 59 ? 60.411 26.511 4.755 1.00 49.48 ? 59 PHE A CB 1 +ATOM 479 C CG . PHE A 1 59 ? 59.669 25.211 4.929 1.00 51.51 ? 59 PHE A CG 1 +ATOM 480 C CD1 . PHE A 1 59 ? 60.333 23.984 4.820 1.00 51.73 ? 59 PHE A CD1 1 +ATOM 481 C CD2 . PHE A 1 59 ? 58.310 25.207 5.224 1.00 51.79 ? 59 PHE A CD2 1 +ATOM 482 C CE1 . PHE A 1 59 ? 59.669 22.787 5.004 1.00 50.21 ? 59 PHE A CE1 1 +ATOM 483 C CE2 . PHE A 1 59 ? 57.630 24.004 5.408 1.00 51.31 ? 59 PHE A CE2 1 +ATOM 484 C CZ . PHE A 1 59 ? 58.318 22.796 5.298 1.00 51.70 ? 59 PHE A CZ 1 +ATOM 485 N N . LYS A 1 60 ? 62.026 24.738 7.028 1.00 46.31 ? 60 LYS A N 1 +ATOM 486 C CA . LYS A 1 60 ? 62.870 23.571 7.240 1.00 43.77 ? 60 LYS A CA 1 +ATOM 487 C C . LYS A 1 60 ? 62.184 22.241 7.447 1.00 42.68 ? 60 LYS A C 1 +ATOM 488 O O . LYS A 1 60 ? 61.001 22.129 7.782 1.00 43.06 ? 60 LYS A O 1 +ATOM 489 C CB . LYS A 1 60 ? 63.869 23.804 8.366 1.00 43.24 ? 60 LYS A CB 1 +ATOM 490 C CG . LYS A 1 60 ? 63.291 24.432 9.589 1.00 45.13 ? 60 LYS A CG 1 +ATOM 491 C CD . LYS A 1 60 ? 64.383 24.681 10.617 1.00 47.24 ? 60 LYS A CD 1 +ATOM 492 C CE . LYS A 1 60 ? 63.806 25.352 11.859 1.00 49.33 ? 60 LYS A CE 1 +ATOM 493 N NZ . LYS A 1 60 ? 62.740 24.523 12.517 1.00 50.51 ? 60 LYS A NZ 1 +ATOM 494 N N . TYR A 1 61 ? 62.974 21.218 7.189 1.00 40.73 ? 61 TYR A N 1 +ATOM 495 C CA . TYR A 1 61 ? 62.547 19.858 7.306 1.00 39.29 ? 61 TYR A CA 1 +ATOM 496 C C . TYR A 1 61 ? 63.702 19.160 7.986 1.00 38.68 ? 61 TYR A C 1 +ATOM 497 O O . TYR A 1 61 ? 64.746 18.973 7.403 1.00 38.12 ? 61 TYR A O 1 +ATOM 498 C CB . TYR A 1 61 ? 62.318 19.239 5.920 1.00 38.45 ? 61 TYR A CB 1 +ATOM 499 C CG . TYR A 1 61 ? 60.906 19.342 5.363 1.00 37.61 ? 61 TYR A CG 1 +ATOM 500 C CD1 . TYR A 1 61 ? 59.795 19.101 6.158 1.00 37.84 ? 61 TYR A CD1 1 +ATOM 501 C CD2 . TYR A 1 61 ? 60.688 19.624 4.019 1.00 39.59 ? 61 TYR A CD2 1 +ATOM 502 C CE1 . TYR A 1 61 ? 58.484 19.142 5.623 1.00 37.78 ? 61 TYR A CE1 1 +ATOM 503 C CE2 . TYR A 1 61 ? 59.379 19.666 3.467 1.00 39.11 ? 61 TYR A CE2 1 +ATOM 504 C CZ . TYR A 1 61 ? 58.282 19.433 4.279 1.00 37.66 ? 61 TYR A CZ 1 +ATOM 505 O OH . TYR A 1 61 ? 57.004 19.590 3.778 1.00 33.21 ? 61 TYR A OH 1 +ATOM 506 N N . VAL A 1 62 ? 63.535 18.820 9.247 1.00 38.85 ? 62 VAL A N 1 +ATOM 507 C CA . VAL A 1 62 ? 64.577 18.101 9.941 1.00 39.23 ? 62 VAL A CA 1 +ATOM 508 C C . VAL A 1 62 ? 64.008 16.692 9.980 1.00 41.52 ? 62 VAL A C 1 +ATOM 509 O O . VAL A 1 62 ? 62.791 16.535 10.061 1.00 43.39 ? 62 VAL A O 1 +ATOM 510 C CB . VAL A 1 62 ? 64.792 18.682 11.318 1.00 36.66 ? 62 VAL A CB 1 +ATOM 511 C CG1 . VAL A 1 62 ? 65.630 17.781 12.153 1.00 36.62 ? 62 VAL A CG1 1 +ATOM 512 C CG2 . VAL A 1 62 ? 65.499 19.985 11.163 1.00 37.00 ? 62 VAL A CG2 1 +ATOM 513 N N . ALA A 1 63 ? 64.865 15.676 9.859 1.00 41.74 ? 63 ALA A N 1 +ATOM 514 C CA . ALA A 1 63 ? 64.422 14.291 9.847 1.00 40.56 ? 63 ALA A CA 1 +ATOM 515 C C . ALA A 1 63 ? 65.549 13.423 10.362 1.00 42.64 ? 63 ALA A C 1 +ATOM 516 O O . ALA A 1 63 ? 66.678 13.879 10.481 1.00 44.02 ? 63 ALA A O 1 +ATOM 517 C CB . ALA A 1 63 ? 64.076 13.882 8.452 1.00 35.27 ? 63 ALA A CB 1 +ATOM 518 N N . ASN A 1 64 ? 65.209 12.181 10.695 1.00 44.69 ? 64 ASN A N 1 +ATOM 519 C CA . ASN A 1 64 ? 66.128 11.156 11.164 1.00 44.01 ? 64 ASN A CA 1 +ATOM 520 C C . ASN A 1 64 ? 66.713 11.377 12.531 1.00 44.00 ? 64 ASN A C 1 +ATOM 521 O O . ASN A 1 64 ? 67.736 10.788 12.846 1.00 44.27 ? 64 ASN A O 1 +ATOM 522 C CB . ASN A 1 64 ? 67.246 10.961 10.134 1.00 45.69 ? 64 ASN A CB 1 +ATOM 523 C CG . ASN A 1 64 ? 67.914 9.586 10.225 1.00 48.07 ? 64 ASN A CG 1 +ATOM 524 O OD1 . ASN A 1 64 ? 67.252 8.544 10.329 1.00 48.00 ? 64 ASN A OD1 1 +ATOM 525 N ND2 . ASN A 1 64 ? 69.240 9.582 10.157 1.00 49.18 ? 64 ASN A ND2 1 +ATOM 526 N N . MET A 1 65 ? 66.070 12.197 13.356 1.00 45.06 ? 65 MET A N 1 +ATOM 527 C CA . MET A 1 65 ? 66.570 12.442 14.716 1.00 46.93 ? 65 MET A CA 1 +ATOM 528 C C . MET A 1 65 ? 66.550 11.149 15.576 1.00 48.26 ? 65 MET A C 1 +ATOM 529 O O . MET A 1 65 ? 67.213 11.035 16.634 1.00 48.34 ? 65 MET A O 1 +ATOM 530 C CB . MET A 1 65 ? 65.759 13.551 15.385 1.00 47.72 ? 65 MET A CB 1 +ATOM 531 C CG . MET A 1 65 ? 64.375 13.168 15.882 1.00 47.20 ? 65 MET A CG 1 +ATOM 532 S SD . MET A 1 65 ? 63.891 14.432 17.086 1.00 49.01 ? 65 MET A SD 1 +ATOM 533 C CE . MET A 1 65 ? 62.612 15.190 16.209 1.00 49.58 ? 65 MET A CE 1 +ATOM 534 N N . HIS A 1 66 ? 65.768 10.178 15.118 1.00 48.92 ? 66 HIS A N 1 +ATOM 535 C CA . HIS A 1 66 ? 65.717 8.875 15.759 1.00 49.24 ? 66 HIS A CA 1 +ATOM 536 C C . HIS A 1 66 ? 66.482 7.969 14.791 1.00 49.88 ? 66 HIS A C 1 +ATOM 537 O O . HIS A 1 66 ? 66.005 7.666 13.684 1.00 49.68 ? 66 HIS A O 1 +ATOM 538 C CB . HIS A 1 66 ? 64.274 8.411 15.933 1.00 50.01 ? 66 HIS A CB 1 +ATOM 539 C CG . HIS A 1 66 ? 63.573 9.074 17.080 1.00 51.53 ? 66 HIS A CG 1 +ATOM 540 N ND1 . HIS A 1 66 ? 62.202 9.086 17.213 1.00 50.27 ? 66 HIS A ND1 1 +ATOM 541 C CD2 . HIS A 1 66 ? 64.062 9.763 18.139 1.00 51.51 ? 66 HIS A CD2 1 +ATOM 542 C CE1 . HIS A 1 66 ? 61.877 9.761 18.302 1.00 50.54 ? 66 HIS A CE1 1 +ATOM 543 N NE2 . HIS A 1 66 ? 62.987 10.182 18.881 1.00 50.46 ? 66 HIS A NE2 1 +ATOM 544 N N . GLY A 1 67 ? 67.690 7.586 15.206 1.00 49.38 ? 67 GLY A N 1 +ATOM 545 C CA . GLY A 1 67 ? 68.538 6.746 14.391 1.00 47.83 ? 67 GLY A CA 1 +ATOM 546 C C . GLY A 1 67 ? 67.769 5.917 13.398 1.00 47.66 ? 67 GLY A C 1 +ATOM 547 O O . GLY A 1 67 ? 67.687 6.254 12.216 1.00 47.36 ? 67 GLY A O 1 +ATOM 548 N N . ASP A 1 68 ? 67.163 4.852 13.909 1.00 47.90 ? 68 ASP A N 1 +ATOM 549 C CA . ASP A 1 68 ? 66.409 3.899 13.106 1.00 48.45 ? 68 ASP A CA 1 +ATOM 550 C C . ASP A 1 68 ? 65.214 4.350 12.260 1.00 48.18 ? 68 ASP A C 1 +ATOM 551 O O . ASP A 1 68 ? 64.759 3.579 11.415 1.00 49.17 ? 68 ASP A O 1 +ATOM 552 C CB . ASP A 1 68 ? 65.975 2.733 13.993 1.00 49.61 ? 68 ASP A CB 1 +ATOM 553 C CG . ASP A 1 68 ? 65.163 3.174 15.199 1.00 53.63 ? 68 ASP A CG 1 +ATOM 554 O OD1 . ASP A 1 68 ? 64.795 4.371 15.333 1.00 53.58 ? 68 ASP A OD1 1 +ATOM 555 O OD2 . ASP A 1 68 ? 64.872 2.291 16.031 1.00 57.37 ? 68 ASP A OD2 1 +ATOM 556 N N . GLU A 1 69 ? 64.692 5.562 12.457 1.00 46.73 ? 69 GLU A N 1 +ATOM 557 C CA . GLU A 1 69 ? 63.543 5.997 11.659 1.00 44.67 ? 69 GLU A CA 1 +ATOM 558 C C . GLU A 1 69 ? 64.014 6.566 10.334 1.00 45.96 ? 69 GLU A C 1 +ATOM 559 O O . GLU A 1 69 ? 64.172 7.783 10.182 1.00 47.22 ? 69 GLU A O 1 +ATOM 560 C CB . GLU A 1 69 ? 62.718 7.009 12.432 1.00 42.00 ? 69 GLU A CB 1 +ATOM 561 C CG . GLU A 1 69 ? 61.967 6.375 13.584 1.00 39.93 ? 69 GLU A CG 1 +ATOM 562 C CD . GLU A 1 69 ? 61.480 7.381 14.585 1.00 38.97 ? 69 GLU A CD 1 +ATOM 563 O OE1 . GLU A 1 69 ? 61.438 7.046 15.781 1.00 38.40 ? 69 GLU A OE1 1 +ATOM 564 O OE2 . GLU A 1 69 ? 61.138 8.507 14.182 1.00 39.15 ? 69 GLU A OE2 1 +ATOM 565 N N . THR A 1 70 ? 64.185 5.654 9.371 1.00 45.60 ? 70 THR A N 1 +ATOM 566 C CA . THR A 1 70 ? 64.712 5.921 8.034 1.00 44.17 ? 70 THR A CA 1 +ATOM 567 C C . THR A 1 70 ? 63.866 6.465 6.866 1.00 44.94 ? 70 THR A C 1 +ATOM 568 O O . THR A 1 70 ? 64.421 7.030 5.923 1.00 43.83 ? 70 THR A O 1 +ATOM 569 C CB . THR A 1 70 ? 65.375 4.659 7.534 1.00 43.42 ? 70 THR A CB 1 +ATOM 570 O OG1 . THR A 1 70 ? 64.376 3.653 7.344 1.00 43.23 ? 70 THR A OG1 1 +ATOM 571 C CG2 . THR A 1 70 ? 66.370 4.159 8.550 1.00 42.57 ? 70 THR A CG2 1 +ATOM 572 N N . VAL A 1 71 ? 62.544 6.325 6.894 1.00 46.18 ? 71 VAL A N 1 +ATOM 573 C CA . VAL A 1 71 ? 61.770 6.800 5.732 1.00 46.16 ? 71 VAL A CA 1 +ATOM 574 C C . VAL A 1 71 ? 61.995 8.262 5.393 1.00 46.44 ? 71 VAL A C 1 +ATOM 575 O O . VAL A 1 71 ? 62.153 8.626 4.225 1.00 44.06 ? 71 VAL A O 1 +ATOM 576 C CB . VAL A 1 71 ? 60.241 6.602 5.906 1.00 45.03 ? 71 VAL A CB 1 +ATOM 577 C CG1 . VAL A 1 71 ? 59.518 7.012 4.629 1.00 43.27 ? 71 VAL A CG1 1 +ATOM 578 C CG2 . VAL A 1 71 ? 59.935 5.175 6.237 1.00 45.40 ? 71 VAL A CG2 1 +ATOM 579 N N . GLY A 1 72 ? 61.983 9.088 6.439 1.00 48.46 ? 72 GLY A N 1 +ATOM 580 C CA . GLY A 1 72 ? 62.143 10.524 6.282 1.00 49.17 ? 72 GLY A CA 1 +ATOM 581 C C . GLY A 1 72 ? 63.529 10.890 5.796 1.00 49.30 ? 72 GLY A C 1 +ATOM 582 O O . GLY A 1 72 ? 63.684 11.876 5.064 1.00 50.81 ? 72 GLY A O 1 +ATOM 583 N N . ARG A 1 73 ? 64.530 10.109 6.201 1.00 46.38 ? 73 ARG A N 1 +ATOM 584 C CA . ARG A 1 73 ? 65.892 10.371 5.797 1.00 43.98 ? 73 ARG A CA 1 +ATOM 585 C C . ARG A 1 73 ? 65.831 10.326 4.290 1.00 44.51 ? 73 ARG A C 1 +ATOM 586 O O . ARG A 1 73 ? 66.239 11.255 3.596 1.00 43.70 ? 73 ARG A O 1 +ATOM 587 C CB . ARG A 1 73 ? 66.807 9.274 6.331 1.00 42.88 ? 73 ARG A CB 1 +ATOM 588 C CG . ARG A 1 73 ? 68.268 9.498 6.087 1.00 42.74 ? 73 ARG A CG 1 +ATOM 589 C CD . ARG A 1 73 ? 69.106 8.319 6.585 1.00 44.17 ? 73 ARG A CD 1 +ATOM 590 N NE . ARG A 1 73 ? 70.345 8.773 7.226 1.00 46.71 ? 73 ARG A NE 1 +ATOM 591 C CZ . ARG A 1 73 ? 71.572 8.613 6.727 1.00 48.11 ? 73 ARG A CZ 1 +ATOM 592 N NH1 . ARG A 1 73 ? 72.638 9.075 7.395 1.00 48.54 ? 73 ARG A NH1 1 +ATOM 593 N NH2 . ARG A 1 73 ? 71.738 7.988 5.568 1.00 46.85 ? 73 ARG A NH2 1 +ATOM 594 N N . GLU A 1 74 ? 65.243 9.255 3.784 1.00 45.29 ? 74 GLU A N 1 +ATOM 595 C CA . GLU A 1 74 ? 65.159 9.073 2.354 1.00 46.96 ? 74 GLU A CA 1 +ATOM 596 C C . GLU A 1 74 ? 64.178 9.969 1.632 1.00 48.80 ? 74 GLU A C 1 +ATOM 597 O O . GLU A 1 74 ? 64.405 10.312 0.473 1.00 51.14 ? 74 GLU A O 1 +ATOM 598 C CB . GLU A 1 74 ? 64.858 7.622 2.041 1.00 46.34 ? 74 GLU A CB 1 +ATOM 599 C CG . GLU A 1 74 ? 65.903 6.659 2.603 1.00 47.37 ? 74 GLU A CG 1 +ATOM 600 C CD . GLU A 1 74 ? 67.318 6.965 2.132 1.00 45.96 ? 74 GLU A CD 1 +ATOM 601 O OE1 . GLU A 1 74 ? 67.449 7.644 1.086 1.00 45.46 ? 74 GLU A OE1 1 +ATOM 602 O OE2 . GLU A 1 74 ? 68.281 6.513 2.801 1.00 42.86 ? 74 GLU A OE2 1 +ATOM 603 N N . LEU A 1 75 ? 63.085 10.351 2.285 1.00 49.73 ? 75 LEU A N 1 +ATOM 604 C CA . LEU A 1 75 ? 62.118 11.227 1.627 1.00 49.67 ? 75 LEU A CA 1 +ATOM 605 C C . LEU A 1 75 ? 62.737 12.611 1.418 1.00 50.43 ? 75 LEU A C 1 +ATOM 606 O O . LEU A 1 75 ? 62.560 13.228 0.366 1.00 50.25 ? 75 LEU A O 1 +ATOM 607 C CB . LEU A 1 75 ? 60.834 11.332 2.453 1.00 48.42 ? 75 LEU A CB 1 +ATOM 608 C CG . LEU A 1 75 ? 60.113 10.004 2.672 1.00 47.76 ? 75 LEU A CG 1 +ATOM 609 C CD1 . LEU A 1 75 ? 58.762 10.294 3.252 1.00 48.37 ? 75 LEU A CD1 1 +ATOM 610 C CD2 . LEU A 1 75 ? 59.949 9.257 1.364 1.00 47.10 ? 75 LEU A CD2 1 +ATOM 611 N N . LEU A 1 76 ? 63.491 13.081 2.417 1.00 51.36 ? 76 LEU A N 1 +ATOM 612 C CA . LEU A 1 76 ? 64.137 14.398 2.343 1.00 50.32 ? 76 LEU A CA 1 +ATOM 613 C C . LEU A 1 76 ? 65.211 14.468 1.266 1.00 49.58 ? 76 LEU A C 1 +ATOM 614 O O . LEU A 1 76 ? 65.356 15.502 0.625 1.00 50.65 ? 76 LEU A O 1 +ATOM 615 C CB . LEU A 1 76 ? 64.723 14.819 3.710 1.00 48.42 ? 76 LEU A CB 1 +ATOM 616 C CG . LEU A 1 76 ? 63.696 15.171 4.799 1.00 46.07 ? 76 LEU A CG 1 +ATOM 617 C CD1 . LEU A 1 76 ? 64.359 15.924 5.930 1.00 44.61 ? 76 LEU A CD1 1 +ATOM 618 C CD2 . LEU A 1 76 ? 62.609 16.023 4.200 1.00 44.52 ? 76 LEU A CD2 1 +ATOM 619 N N . LEU A 1 77 ? 65.968 13.394 1.056 1.00 48.55 ? 77 LEU A N 1 +ATOM 620 C CA . LEU A 1 77 ? 66.982 13.442 0.005 1.00 47.64 ? 77 LEU A CA 1 +ATOM 621 C C . LEU A 1 77 ? 66.249 13.537 -1.313 1.00 46.98 ? 77 LEU A C 1 +ATOM 622 O O . LEU A 1 77 ? 66.557 14.401 -2.150 1.00 46.71 ? 77 LEU A O 1 +ATOM 623 C CB . LEU A 1 77 ? 67.864 12.206 0.039 1.00 45.30 ? 77 LEU A CB 1 +ATOM 624 C CG . LEU A 1 77 ? 68.749 12.279 1.276 1.00 45.02 ? 77 LEU A CG 1 +ATOM 625 C CD1 . LEU A 1 77 ? 69.264 10.908 1.633 1.00 46.92 ? 77 LEU A CD1 1 +ATOM 626 C CD2 . LEU A 1 77 ? 69.887 13.221 1.017 1.00 44.30 ? 77 LEU A CD2 1 +ATOM 627 N N . HIS A 1 78 ? 65.252 12.671 -1.463 1.00 45.29 ? 78 HIS A N 1 +ATOM 628 C CA . HIS A 1 78 ? 64.452 12.625 -2.666 1.00 46.25 ? 78 HIS A CA 1 +ATOM 629 C C . HIS A 1 78 ? 63.640 13.907 -2.878 1.00 46.05 ? 78 HIS A C 1 +ATOM 630 O O . HIS A 1 78 ? 63.378 14.318 -4.013 1.00 44.86 ? 78 HIS A O 1 +ATOM 631 C CB . HIS A 1 78 ? 63.550 11.384 -2.637 1.00 47.91 ? 78 HIS A CB 1 +ATOM 632 C CG . HIS A 1 78 ? 64.229 10.129 -3.103 1.00 49.06 ? 78 HIS A CG 1 +ATOM 633 N ND1 . HIS A 1 78 ? 64.439 9.846 -4.437 1.00 49.80 ? 78 HIS A ND1 1 +ATOM 634 C CD2 . HIS A 1 78 ? 64.756 9.088 -2.413 1.00 49.38 ? 78 HIS A CD2 1 +ATOM 635 C CE1 . HIS A 1 78 ? 65.066 8.686 -4.547 1.00 49.89 ? 78 HIS A CE1 1 +ATOM 636 N NE2 . HIS A 1 78 ? 65.270 8.205 -3.334 1.00 48.91 ? 78 HIS A NE2 1 +ATOM 637 N N . LEU A 1 79 ? 63.229 14.545 -1.791 1.00 46.36 ? 79 LEU A N 1 +ATOM 638 C CA . LEU A 1 79 ? 62.490 15.793 -1.938 1.00 46.35 ? 79 LEU A CA 1 +ATOM 639 C C . LEU A 1 79 ? 63.493 16.734 -2.573 1.00 47.88 ? 79 LEU A C 1 +ATOM 640 O O . LEU A 1 79 ? 63.217 17.352 -3.593 1.00 49.39 ? 79 LEU A O 1 +ATOM 641 C CB . LEU A 1 79 ? 62.078 16.363 -0.591 1.00 43.45 ? 79 LEU A CB 1 +ATOM 642 C CG . LEU A 1 79 ? 61.481 17.754 -0.717 1.00 40.87 ? 79 LEU A CG 1 +ATOM 643 C CD1 . LEU A 1 79 ? 60.200 17.701 -1.496 1.00 40.07 ? 79 LEU A CD1 1 +ATOM 644 C CD2 . LEU A 1 79 ? 61.226 18.305 0.637 1.00 41.66 ? 79 LEU A CD2 1 +ATOM 645 N N . ILE A 1 80 ? 64.663 16.817 -1.945 1.00 48.34 ? 80 ILE A N 1 +ATOM 646 C CA . ILE A 1 80 ? 65.778 17.641 -2.398 1.00 49.29 ? 80 ILE A CA 1 +ATOM 647 C C . ILE A 1 80 ? 65.989 17.599 -3.922 1.00 50.33 ? 80 ILE A C 1 +ATOM 648 O O . ILE A 1 80 ? 65.964 18.640 -4.611 1.00 48.79 ? 80 ILE A O 1 +ATOM 649 C CB . ILE A 1 80 ? 67.083 17.197 -1.677 1.00 48.46 ? 80 ILE A CB 1 +ATOM 650 C CG1 . ILE A 1 80 ? 67.260 18.019 -0.386 1.00 46.41 ? 80 ILE A CG1 1 +ATOM 651 C CG2 . ILE A 1 80 ? 68.266 17.296 -2.623 1.00 48.01 ? 80 ILE A CG2 1 +ATOM 652 C CD1 . ILE A 1 80 ? 68.519 17.721 0.369 1.00 44.62 ? 80 ILE A CD1 1 +ATOM 653 N N . ASP A 1 81 ? 66.207 16.390 -4.431 1.00 51.29 ? 81 ASP A N 1 +ATOM 654 C CA . ASP A 1 81 ? 66.397 16.197 -5.854 1.00 52.15 ? 81 ASP A CA 1 +ATOM 655 C C . ASP A 1 81 ? 65.194 16.792 -6.575 1.00 50.53 ? 81 ASP A C 1 +ATOM 656 O O . ASP A 1 81 ? 65.332 17.708 -7.348 1.00 49.38 ? 81 ASP A O 1 +ATOM 657 C CB . ASP A 1 81 ? 66.525 14.702 -6.181 1.00 55.62 ? 81 ASP A CB 1 +ATOM 658 C CG . ASP A 1 81 ? 66.835 14.451 -7.657 1.00 59.23 ? 81 ASP A CG 1 +ATOM 659 O OD1 . ASP A 1 81 ? 67.912 13.876 -7.951 1.00 61.09 ? 81 ASP A OD1 1 +ATOM 660 O OD2 . ASP A 1 81 ? 66.006 14.839 -8.520 1.00 59.43 ? 81 ASP A OD2 1 +ATOM 661 N N . TYR A 1 82 ? 64.009 16.265 -6.304 1.00 51.02 ? 82 TYR A N 1 +ATOM 662 C CA . TYR A 1 82 ? 62.776 16.758 -6.925 1.00 51.25 ? 82 TYR A CA 1 +ATOM 663 C C . TYR A 1 82 ? 62.858 18.253 -7.215 1.00 51.72 ? 82 TYR A C 1 +ATOM 664 O O . TYR A 1 82 ? 62.786 18.696 -8.363 1.00 52.43 ? 82 TYR A O 1 +ATOM 665 C CB . TYR A 1 82 ? 61.596 16.523 -5.989 1.00 49.18 ? 82 TYR A CB 1 +ATOM 666 C CG . TYR A 1 82 ? 60.243 16.870 -6.566 1.00 47.32 ? 82 TYR A CG 1 +ATOM 667 C CD1 . TYR A 1 82 ? 59.684 16.108 -7.578 1.00 45.85 ? 82 TYR A CD1 1 +ATOM 668 C CD2 . TYR A 1 82 ? 59.476 17.888 -6.022 1.00 48.08 ? 82 TYR A CD2 1 +ATOM 669 C CE1 . TYR A 1 82 ? 58.401 16.330 -8.026 1.00 44.61 ? 82 TYR A CE1 1 +ATOM 670 C CE2 . TYR A 1 82 ? 58.177 18.120 -6.473 1.00 47.87 ? 82 TYR A CE2 1 +ATOM 671 C CZ . TYR A 1 82 ? 57.653 17.327 -7.476 1.00 46.20 ? 82 TYR A CZ 1 +ATOM 672 O OH . TYR A 1 82 ? 56.368 17.536 -7.915 1.00 48.49 ? 82 TYR A OH 1 +ATOM 673 N N . LEU A 1 83 ? 62.998 19.023 -6.144 1.00 51.57 ? 83 LEU A N 1 +ATOM 674 C CA . LEU A 1 83 ? 63.087 20.466 -6.228 1.00 49.49 ? 83 LEU A CA 1 +ATOM 675 C C . LEU A 1 83 ? 64.154 20.898 -7.216 1.00 49.06 ? 83 LEU A C 1 +ATOM 676 O O . LEU A 1 83 ? 63.821 21.475 -8.239 1.00 49.22 ? 83 LEU A O 1 +ATOM 677 C CB . LEU A 1 83 ? 63.359 21.035 -4.842 1.00 48.89 ? 83 LEU A CB 1 +ATOM 678 C CG . LEU A 1 83 ? 62.214 20.849 -3.847 1.00 46.05 ? 83 LEU A CG 1 +ATOM 679 C CD1 . LEU A 1 83 ? 62.762 20.680 -2.444 1.00 42.41 ? 83 LEU A CD1 1 +ATOM 680 C CD2 . LEU A 1 83 ? 61.274 22.040 -3.963 1.00 45.93 ? 83 LEU A CD2 1 +ATOM 681 N N . VAL A 1 84 ? 65.430 20.629 -6.963 1.00 48.94 ? 84 VAL A N 1 +ATOM 682 C CA . VAL A 1 84 ? 66.399 21.079 -7.963 1.00 50.19 ? 84 VAL A CA 1 +ATOM 683 C C . VAL A 1 84 ? 66.007 20.744 -9.423 1.00 50.82 ? 84 VAL A C 1 +ATOM 684 O O . VAL A 1 84 ? 65.960 21.633 -10.271 1.00 52.18 ? 84 VAL A O 1 +ATOM 685 C CB . VAL A 1 84 ? 67.849 20.576 -7.683 1.00 49.21 ? 84 VAL A CB 1 +ATOM 686 C CG1 . VAL A 1 84 ? 68.369 21.231 -6.433 1.00 49.21 ? 84 VAL A CG1 1 +ATOM 687 C CG2 . VAL A 1 84 ? 67.897 19.085 -7.568 1.00 49.45 ? 84 VAL A CG2 1 +ATOM 688 N N . THR A 1 85 ? 65.683 19.489 -9.717 1.00 51.12 ? 85 THR A N 1 +ATOM 689 C CA . THR A 1 85 ? 65.312 19.108 -11.083 1.00 50.70 ? 85 THR A CA 1 +ATOM 690 C C . THR A 1 85 ? 63.933 19.590 -11.600 1.00 50.68 ? 85 THR A C 1 +ATOM 691 O O . THR A 1 85 ? 63.663 19.557 -12.803 1.00 50.62 ? 85 THR A O 1 +ATOM 692 C CB . THR A 1 85 ? 65.440 17.576 -11.263 1.00 50.22 ? 85 THR A CB 1 +ATOM 693 O OG1 . THR A 1 85 ? 64.496 16.893 -10.420 1.00 49.11 ? 85 THR A OG1 1 +ATOM 694 C CG2 . THR A 1 85 ? 66.869 17.139 -10.903 1.00 49.75 ? 85 THR A CG2 1 +ATOM 695 N N . SER A 1 86 ? 63.062 20.040 -10.710 1.00 50.32 ? 86 SER A N 1 +ATOM 696 C CA . SER A 1 86 ? 61.764 20.522 -11.154 1.00 51.20 ? 86 SER A CA 1 +ATOM 697 C C . SER A 1 86 ? 61.905 22.009 -11.438 1.00 52.39 ? 86 SER A C 1 +ATOM 698 O O . SER A 1 86 ? 61.138 22.581 -12.229 1.00 51.57 ? 86 SER A O 1 +ATOM 699 C CB . SER A 1 86 ? 60.706 20.321 -10.070 1.00 50.49 ? 86 SER A CB 1 +ATOM 700 O OG . SER A 1 86 ? 60.736 19.019 -9.535 1.00 49.77 ? 86 SER A OG 1 +ATOM 701 N N . ASP A 1 87 ? 62.883 22.624 -10.765 1.00 54.09 ? 87 ASP A N 1 +ATOM 702 C CA . ASP A 1 87 ? 63.169 24.049 -10.905 1.00 55.09 ? 87 ASP A CA 1 +ATOM 703 C C . ASP A 1 87 ? 63.395 24.368 -12.380 1.00 55.89 ? 87 ASP A C 1 +ATOM 704 O O . ASP A 1 87 ? 64.304 23.808 -13.030 1.00 55.91 ? 87 ASP A O 1 +ATOM 705 C CB . ASP A 1 87 ? 64.420 24.443 -10.112 1.00 55.48 ? 87 ASP A CB 1 +ATOM 706 C CG . ASP A 1 87 ? 64.628 25.957 -10.067 1.00 58.11 ? 87 ASP A CG 1 +ATOM 707 O OD1 . ASP A 1 87 ? 65.762 26.409 -9.746 1.00 57.21 ? 87 ASP A OD1 1 +ATOM 708 O OD2 . ASP A 1 87 ? 63.638 26.692 -10.345 1.00 58.17 ? 87 ASP A OD2 1 +ATOM 709 N N . GLY A 1 88 ? 62.557 25.257 -12.903 1.00 54.72 ? 88 GLY A N 1 +ATOM 710 C CA . GLY A 1 88 ? 62.679 25.631 -14.291 1.00 54.78 ? 88 GLY A CA 1 +ATOM 711 C C . GLY A 1 88 ? 61.715 24.920 -15.220 1.00 55.05 ? 88 GLY A C 1 +ATOM 712 O O . GLY A 1 88 ? 61.176 25.542 -16.138 1.00 56.29 ? 88 GLY A O 1 +ATOM 713 N N . LYS A 1 89 ? 61.483 23.630 -15.016 1.00 54.02 ? 89 LYS A N 1 +ATOM 714 C CA . LYS A 1 89 ? 60.567 22.937 -15.898 1.00 54.19 ? 89 LYS A CA 1 +ATOM 715 C C . LYS A 1 89 ? 59.119 22.998 -15.391 1.00 54.59 ? 89 LYS A C 1 +ATOM 716 O O . LYS A 1 89 ? 58.213 23.366 -16.144 1.00 55.07 ? 89 LYS A O 1 +ATOM 717 C CB . LYS A 1 89 ? 61.012 21.504 -16.062 1.00 55.36 ? 89 LYS A CB 1 +ATOM 718 C CG . LYS A 1 89 ? 62.480 21.365 -16.348 1.00 58.90 ? 89 LYS A CG 1 +ATOM 719 C CD . LYS A 1 89 ? 63.025 20.078 -15.729 1.00 62.24 ? 89 LYS A CD 1 +ATOM 720 C CE . LYS A 1 89 ? 64.424 19.743 -16.235 1.00 64.44 ? 89 LYS A CE 1 +ATOM 721 N NZ . LYS A 1 89 ? 64.411 19.327 -17.674 1.00 66.02 ? 89 LYS A NZ 1 +ATOM 722 N N . ASP A 1 90 ? 58.880 22.638 -14.130 1.00 53.74 ? 90 ASP A N 1 +ATOM 723 C CA . ASP A 1 90 ? 57.523 22.702 -13.625 1.00 52.39 ? 90 ASP A CA 1 +ATOM 724 C C . ASP A 1 90 ? 57.301 24.103 -13.118 1.00 53.16 ? 90 ASP A C 1 +ATOM 725 O O . ASP A 1 90 ? 58.041 24.587 -12.261 1.00 54.12 ? 90 ASP A O 1 +ATOM 726 C CB . ASP A 1 90 ? 57.283 21.701 -12.492 1.00 51.71 ? 90 ASP A CB 1 +ATOM 727 C CG . ASP A 1 90 ? 55.900 21.884 -11.838 1.00 53.67 ? 90 ASP A CG 1 +ATOM 728 O OD1 . ASP A 1 90 ? 55.040 20.966 -11.892 1.00 52.51 ? 90 ASP A OD1 1 +ATOM 729 O OD2 . ASP A 1 90 ? 55.659 22.972 -11.267 1.00 55.33 ? 90 ASP A OD2 1 +ATOM 730 N N . PRO A 1 91 ? 56.282 24.789 -13.641 1.00 53.70 ? 91 PRO A N 1 +ATOM 731 C CA . PRO A 1 91 ? 56.027 26.149 -13.180 1.00 55.17 ? 91 PRO A CA 1 +ATOM 732 C C . PRO A 1 91 ? 55.706 26.227 -11.686 1.00 55.92 ? 91 PRO A C 1 +ATOM 733 O O . PRO A 1 91 ? 56.555 26.696 -10.916 1.00 56.89 ? 91 PRO A O 1 +ATOM 734 C CB . PRO A 1 91 ? 54.870 26.616 -14.077 1.00 54.30 ? 91 PRO A CB 1 +ATOM 735 C CG . PRO A 1 91 ? 54.136 25.389 -14.322 1.00 54.53 ? 91 PRO A CG 1 +ATOM 736 C CD . PRO A 1 91 ? 55.232 24.360 -14.573 1.00 55.31 ? 91 PRO A CD 1 +ATOM 737 N N . GLU A 1 92 ? 54.525 25.752 -11.271 1.00 55.46 ? 92 GLU A N 1 +ATOM 738 C CA . GLU A 1 92 ? 54.145 25.833 -9.867 1.00 54.58 ? 92 GLU A CA 1 +ATOM 739 C C . GLU A 1 92 ? 55.314 25.630 -8.928 1.00 54.64 ? 92 GLU A C 1 +ATOM 740 O O . GLU A 1 92 ? 55.596 26.515 -8.103 1.00 55.37 ? 92 GLU A O 1 +ATOM 741 C CB . GLU A 1 92 ? 53.053 24.845 -9.483 1.00 55.54 ? 92 GLU A CB 1 +ATOM 742 C CG . GLU A 1 92 ? 52.760 24.925 -7.977 1.00 58.78 ? 92 GLU A CG 1 +ATOM 743 C CD . GLU A 1 92 ? 51.543 24.136 -7.507 1.00 60.61 ? 92 GLU A CD 1 +ATOM 744 O OE1 . GLU A 1 92 ? 51.584 22.881 -7.500 1.00 60.16 ? 92 GLU A OE1 1 +ATOM 745 O OE2 . GLU A 1 92 ? 50.543 24.792 -7.130 1.00 61.65 ? 92 GLU A OE2 1 +ATOM 746 N N . ILE A 1 93 ? 56.004 24.492 -9.026 1.00 52.87 ? 93 ILE A N 1 +ATOM 747 C CA . ILE A 1 93 ? 57.141 24.287 -8.131 1.00 51.23 ? 93 ILE A CA 1 +ATOM 748 C C . ILE A 1 93 ? 58.169 25.391 -8.306 1.00 50.98 ? 93 ILE A C 1 +ATOM 749 O O . ILE A 1 93 ? 58.687 25.898 -7.322 1.00 49.29 ? 93 ILE A O 1 +ATOM 750 C CB . ILE A 1 93 ? 57.842 22.960 -8.336 1.00 49.53 ? 93 ILE A CB 1 +ATOM 751 C CG1 . ILE A 1 93 ? 59.115 22.945 -7.506 1.00 48.16 ? 93 ILE A CG1 1 +ATOM 752 C CG2 . ILE A 1 93 ? 58.207 22.793 -9.758 1.00 52.25 ? 93 ILE A CG2 1 +ATOM 753 C CD1 . ILE A 1 93 ? 59.828 21.660 -7.521 1.00 47.19 ? 93 ILE A CD1 1 +ATOM 754 N N . THR A 1 94 ? 58.465 25.773 -9.544 1.00 51.69 ? 94 THR A N 1 +ATOM 755 C CA . THR A 1 94 ? 59.420 26.850 -9.732 1.00 54.85 ? 94 THR A CA 1 +ATOM 756 C C . THR A 1 94 ? 58.956 28.121 -8.999 1.00 56.50 ? 94 THR A C 1 +ATOM 757 O O . THR A 1 94 ? 59.750 28.731 -8.272 1.00 56.63 ? 94 THR A O 1 +ATOM 758 C CB . THR A 1 94 ? 59.681 27.144 -11.230 1.00 54.76 ? 94 THR A CB 1 +ATOM 759 O OG1 . THR A 1 94 ? 60.872 26.458 -11.644 1.00 54.68 ? 94 THR A OG1 1 +ATOM 760 C CG2 . THR A 1 94 ? 59.887 28.637 -11.464 1.00 54.80 ? 94 THR A CG2 1 +ATOM 761 N N . ASN A 1 95 ? 57.687 28.514 -9.175 1.00 57.61 ? 95 ASN A N 1 +ATOM 762 C CA . ASN A 1 95 ? 57.152 29.699 -8.489 1.00 58.26 ? 95 ASN A CA 1 +ATOM 763 C C . ASN A 1 95 ? 57.506 29.562 -7.015 1.00 58.59 ? 95 ASN A C 1 +ATOM 764 O O . ASN A 1 95 ? 57.967 30.500 -6.394 1.00 59.23 ? 95 ASN A O 1 +ATOM 765 C CB . ASN A 1 95 ? 55.623 29.794 -8.587 1.00 59.47 ? 95 ASN A CB 1 +ATOM 766 C CG . ASN A 1 95 ? 55.115 30.060 -10.004 1.00 61.80 ? 95 ASN A CG 1 +ATOM 767 O OD1 . ASN A 1 95 ? 55.174 29.190 -10.885 1.00 61.57 ? 95 ASN A OD1 1 +ATOM 768 N ND2 . ASN A 1 95 ? 54.592 31.266 -10.224 1.00 62.33 ? 95 ASN A ND2 1 +ATOM 769 N N . LEU A 1 96 ? 57.282 28.383 -6.453 1.00 58.78 ? 96 LEU A N 1 +ATOM 770 C CA . LEU A 1 96 ? 57.593 28.141 -5.051 1.00 59.34 ? 96 LEU A CA 1 +ATOM 771 C C . LEU A 1 96 ? 59.104 28.318 -4.745 1.00 60.60 ? 96 LEU A C 1 +ATOM 772 O O . LEU A 1 96 ? 59.492 29.222 -3.976 1.00 59.72 ? 96 LEU A O 1 +ATOM 773 C CB . LEU A 1 96 ? 57.156 26.721 -4.673 1.00 58.59 ? 96 LEU A CB 1 +ATOM 774 C CG . LEU A 1 96 ? 57.112 26.299 -3.202 1.00 56.91 ? 96 LEU A CG 1 +ATOM 775 C CD1 . LEU A 1 96 ? 55.712 26.533 -2.685 1.00 56.26 ? 96 LEU A CD1 1 +ATOM 776 C CD2 . LEU A 1 96 ? 57.501 24.835 -3.050 1.00 55.38 ? 96 LEU A CD2 1 +ATOM 777 N N . ILE A 1 97 ? 59.945 27.453 -5.337 1.00 61.49 ? 97 ILE A N 1 +ATOM 778 C CA . ILE A 1 97 ? 61.403 27.486 -5.118 1.00 61.97 ? 97 ILE A CA 1 +ATOM 779 C C . ILE A 1 97 ? 61.913 28.900 -5.249 1.00 62.88 ? 97 ILE A C 1 +ATOM 780 O O . ILE A 1 97 ? 62.915 29.250 -4.643 1.00 62.89 ? 97 ILE A O 1 +ATOM 781 C CB . ILE A 1 97 ? 62.193 26.625 -6.131 1.00 61.83 ? 97 ILE A CB 1 +ATOM 782 C CG1 . ILE A 1 97 ? 61.260 25.655 -6.844 1.00 62.37 ? 97 ILE A CG1 1 +ATOM 783 C CG2 . ILE A 1 97 ? 63.281 25.842 -5.410 1.00 60.52 ? 97 ILE A CG2 1 +ATOM 784 C CD1 . ILE A 1 97 ? 61.944 24.778 -7.855 1.00 62.64 ? 97 ILE A CD1 1 +ATOM 785 N N . ASN A 1 98 ? 61.241 29.696 -6.080 1.00 64.19 ? 98 ASN A N 1 +ATOM 786 C CA . ASN A 1 98 ? 61.602 31.095 -6.245 1.00 64.68 ? 98 ASN A CA 1 +ATOM 787 C C . ASN A 1 98 ? 61.228 31.697 -4.886 1.00 62.71 ? 98 ASN A C 1 +ATOM 788 O O . ASN A 1 98 ? 62.076 31.855 -4.007 1.00 62.91 ? 98 ASN A O 1 +ATOM 789 C CB . ASN A 1 98 ? 60.770 31.764 -7.361 1.00 68.57 ? 98 ASN A CB 1 +ATOM 790 C CG . ASN A 1 98 ? 61.273 31.441 -8.763 0.0000 74.12 ? 98 ASN A CG 1 +ATOM 791 O OD1 . ASN A 1 98 ? 61.565 30.288 -9.075 0.0000 74.01 ? 98 ASN A OD1 1 +ATOM 792 N ND2 . ASN A 1 98 ? 61.351 32.465 -9.614 1.00 79.29 ? 98 ASN A ND2 1 +ATOM 793 N N . SER A 1 99 ? 59.935 31.964 -4.721 1.00 60.21 ? 99 SER A N 1 +ATOM 794 C CA . SER A 1 99 ? 59.332 32.558 -3.521 1.00 57.53 ? 99 SER A CA 1 +ATOM 795 C C . SER A 1 99 ? 59.712 32.102 -2.103 1.00 55.15 ? 99 SER A C 1 +ATOM 796 O O . SER A 1 99 ? 59.262 32.720 -1.146 1.00 53.82 ? 99 SER A O 1 +ATOM 797 C CB . SER A 1 99 ? 57.816 32.450 -3.616 1.00 57.45 ? 99 SER A CB 1 +ATOM 798 O OG . SER A 1 99 ? 57.416 31.200 -3.080 1.00 59.25 ? 99 SER A OG 1 +ATOM 799 N N . THR A 1 100 ? 60.498 31.044 -1.935 1.00 52.97 ? 100 THR A N 1 +ATOM 800 C CA . THR A 1 100 ? 60.851 30.626 -0.571 1.00 51.46 ? 100 THR A CA 1 +ATOM 801 C C . THR A 1 100 ? 62.276 30.156 -0.458 1.00 50.82 ? 100 THR A C 1 +ATOM 802 O O . THR A 1 100 ? 62.930 29.942 -1.460 1.00 53.95 ? 100 THR A O 1 +ATOM 803 C CB . THR A 1 100 ? 59.986 29.460 -0.110 1.00 50.66 ? 100 THR A CB 1 +ATOM 804 O OG1 . THR A 1 100 ? 58.642 29.665 -0.574 1.00 52.07 ? 100 THR A OG1 1 +ATOM 805 C CG2 . THR A 1 100 ? 60.017 29.342 1.418 1.00 47.39 ? 100 THR A CG2 1 +ATOM 806 N N . ARG A 1 101 ? 62.772 30.004 0.759 1.00 48.55 ? 101 ARG A N 1 +ATOM 807 C CA . ARG A 1 101 ? 64.117 29.485 0.954 1.00 46.11 ? 101 ARG A CA 1 +ATOM 808 C C . ARG A 1 101 ? 63.942 28.280 1.869 1.00 46.76 ? 101 ARG A C 1 +ATOM 809 O O . ARG A 1 101 ? 63.730 28.404 3.070 1.00 46.72 ? 101 ARG A O 1 +ATOM 810 C CB . ARG A 1 101 ? 65.023 30.519 1.582 1.00 44.38 ? 101 ARG A CB 1 +ATOM 811 C CG . ARG A 1 101 ? 66.369 29.965 1.950 1.00 44.08 ? 101 ARG A CG 1 +ATOM 812 C CD . ARG A 1 101 ? 67.474 30.758 1.325 1.00 43.72 ? 101 ARG A CD 1 +ATOM 813 N NE . ARG A 1 101 ? 68.692 30.761 2.130 1.00 42.48 ? 101 ARG A NE 1 +ATOM 814 C CZ . ARG A 1 101 ? 68.734 31.152 3.398 1.00 41.11 ? 101 ARG A CZ 1 +ATOM 815 N NH1 . ARG A 1 101 ? 69.885 31.136 4.061 1.00 39.54 ? 101 ARG A NH1 1 +ATOM 816 N NH2 . ARG A 1 101 ? 67.615 31.545 4.000 1.00 38.63 ? 101 ARG A NH2 1 +ATOM 817 N N . ILE A 1 102 ? 64.018 27.110 1.254 1.00 47.33 ? 102 ILE A N 1 +ATOM 818 C CA . ILE A 1 102 ? 63.810 25.813 1.881 1.00 47.50 ? 102 ILE A CA 1 +ATOM 819 C C . ILE A 1 102 ? 65.116 25.181 2.402 1.00 48.07 ? 102 ILE A C 1 +ATOM 820 O O . ILE A 1 102 ? 66.055 24.974 1.648 1.00 49.06 ? 102 ILE A O 1 +ATOM 821 C CB . ILE A 1 102 ? 63.081 24.900 0.816 1.00 46.64 ? 102 ILE A CB 1 +ATOM 822 C CG1 . ILE A 1 102 ? 61.718 25.506 0.477 1.00 47.42 ? 102 ILE A CG1 1 +ATOM 823 C CG2 . ILE A 1 102 ? 62.864 23.518 1.311 1.00 48.21 ? 102 ILE A CG2 1 +ATOM 824 C CD1 . ILE A 1 102 ? 61.025 24.880 -0.712 1.00 47.88 ? 102 ILE A CD1 1 +ATOM 825 N N . HIS A 1 103 ? 65.186 24.895 3.699 1.00 48.52 ? 103 HIS A N 1 +ATOM 826 C CA . HIS A 1 103 ? 66.384 24.277 4.255 1.00 48.79 ? 103 HIS A CA 1 +ATOM 827 C C . HIS A 1 103 ? 66.032 22.847 4.572 1.00 49.43 ? 103 HIS A C 1 +ATOM 828 O O . HIS A 1 103 ? 65.032 22.598 5.233 1.00 50.56 ? 103 HIS A O 1 +ATOM 829 C CB . HIS A 1 103 ? 66.817 24.910 5.582 1.00 49.15 ? 103 HIS A CB 1 +ATOM 830 C CG . HIS A 1 103 ? 67.098 26.381 5.525 1.00 48.90 ? 103 HIS A CG 1 +ATOM 831 N ND1 . HIS A 1 103 ? 68.267 26.926 6.018 1.00 47.59 ? 103 HIS A ND1 1 +ATOM 832 C CD2 . HIS A 1 103 ? 66.316 27.427 5.162 1.00 48.01 ? 103 HIS A CD2 1 +ATOM 833 C CE1 . HIS A 1 103 ? 68.184 28.243 5.969 1.00 48.21 ? 103 HIS A CE1 1 +ATOM 834 N NE2 . HIS A 1 103 ? 67.011 28.573 5.456 1.00 47.13 ? 103 HIS A NE2 1 +ATOM 835 N N . ILE A 1 104 ? 66.858 21.910 4.135 1.00 49.25 ? 104 ILE A N 1 +ATOM 836 C CA . ILE A 1 104 ? 66.604 20.514 4.411 1.00 48.38 ? 104 ILE A CA 1 +ATOM 837 C C . ILE A 1 104 ? 67.753 19.866 5.170 1.00 50.74 ? 104 ILE A C 1 +ATOM 838 O O . ILE A 1 104 ? 68.934 20.077 4.876 1.00 50.20 ? 104 ILE A O 1 +ATOM 839 C CB . ILE A 1 104 ? 66.352 19.747 3.125 1.00 46.64 ? 104 ILE A CB 1 +ATOM 840 C CG1 . ILE A 1 104 ? 65.131 20.330 2.414 1.00 46.28 ? 104 ILE A CG1 1 +ATOM 841 C CG2 . ILE A 1 104 ? 66.140 18.290 3.430 1.00 46.28 ? 104 ILE A CG2 1 +ATOM 842 C CD1 . ILE A 1 104 ? 64.988 19.910 0.963 1.00 44.43 ? 104 ILE A CD1 1 +ATOM 843 N N . MET A 1 105 ? 67.374 19.087 6.179 1.00 53.86 ? 105 MET A N 1 +ATOM 844 C CA . MET A 1 105 ? 68.297 18.350 7.038 1.00 55.47 ? 105 MET A CA 1 +ATOM 845 C C . MET A 1 105 ? 67.872 16.888 7.033 1.00 56.17 ? 105 MET A C 1 +ATOM 846 O O . MET A 1 105 ? 67.099 16.467 7.886 1.00 57.69 ? 105 MET A O 1 +ATOM 847 C CB . MET A 1 105 ? 68.244 18.879 8.477 1.00 55.27 ? 105 MET A CB 1 +ATOM 848 C CG . MET A 1 105 ? 69.175 18.160 9.441 1.00 56.87 ? 105 MET A CG 1 +ATOM 849 S SD . MET A 1 105 ? 69.220 18.899 11.105 1.00 60.01 ? 105 MET A SD 1 +ATOM 850 C CE . MET A 1 105 ? 70.889 19.519 11.153 1.00 58.43 ? 105 MET A CE 1 +ATOM 851 N N . PRO A 1 106 ? 68.373 16.100 6.068 1.00 56.05 ? 106 PRO A N 1 +ATOM 852 C CA . PRO A 1 106 ? 68.065 14.678 5.928 1.00 55.56 ? 106 PRO A CA 1 +ATOM 853 C C . PRO A 1 106 ? 68.295 13.817 7.186 1.00 55.88 ? 106 PRO A C 1 +ATOM 854 O O . PRO A 1 106 ? 67.527 12.887 7.442 1.00 55.81 ? 106 PRO A O 1 +ATOM 855 C CB . PRO A 1 106 ? 68.969 14.262 4.776 1.00 55.48 ? 106 PRO A CB 1 +ATOM 856 C CG . PRO A 1 106 ? 70.149 15.162 4.956 1.00 55.41 ? 106 PRO A CG 1 +ATOM 857 C CD . PRO A 1 106 ? 69.459 16.473 5.149 1.00 55.44 ? 106 PRO A CD 1 +ATOM 858 N N . SER A 1 107 ? 69.331 14.115 7.977 1.00 56.00 ? 107 SER A N 1 +ATOM 859 C CA . SER A 1 107 ? 69.588 13.298 9.173 1.00 56.22 ? 107 SER A CA 1 +ATOM 860 C C . SER A 1 107 ? 70.272 13.922 10.437 1.00 57.11 ? 107 SER A C 1 +ATOM 861 O O . SER A 1 107 ? 71.506 13.886 10.571 1.00 58.07 ? 107 SER A O 1 +ATOM 862 C CB . SER A 1 107 ? 70.344 12.042 8.733 1.00 53.65 ? 107 SER A CB 1 +ATOM 863 O OG . SER A 1 107 ? 70.809 11.324 9.845 1.00 52.91 ? 107 SER A OG 1 +ATOM 864 N N . MET A 1 108 ? 69.451 14.450 11.365 1.00 56.19 ? 108 MET A N 1 +ATOM 865 C CA . MET A 1 108 ? 69.891 15.062 12.636 1.00 55.26 ? 108 MET A CA 1 +ATOM 866 C C . MET A 1 108 ? 70.641 14.116 13.600 1.00 56.72 ? 108 MET A C 1 +ATOM 867 O O . MET A 1 108 ? 71.322 14.550 14.530 1.00 56.46 ? 108 MET A O 1 +ATOM 868 C CB . MET A 1 108 ? 68.677 15.656 13.363 1.00 52.70 ? 108 MET A CB 1 +ATOM 869 C CG . MET A 1 108 ? 68.912 16.124 14.811 1.00 49.16 ? 108 MET A CG 1 +ATOM 870 S SD . MET A 1 108 ? 67.452 16.988 15.481 1.00 47.23 ? 108 MET A SD 1 +ATOM 871 C CE . MET A 1 108 ? 68.066 17.826 16.944 1.00 42.86 ? 108 MET A CE 1 +ATOM 872 N N . ASN A 1 109 ? 70.510 12.820 13.380 1.00 58.44 ? 109 ASN A N 1 +ATOM 873 C CA . ASN A 1 109 ? 71.165 11.831 14.225 1.00 60.35 ? 109 ASN A CA 1 +ATOM 874 C C . ASN A 1 109 ? 71.636 10.750 13.270 1.00 61.37 ? 109 ASN A C 1 +ATOM 875 O O . ASN A 1 109 ? 70.948 9.755 13.028 1.00 61.38 ? 109 ASN A O 1 +ATOM 876 C CB . ASN A 1 109 ? 70.176 11.247 15.250 1.00 60.36 ? 109 ASN A CB 1 +ATOM 877 C CG . ASN A 1 109 ? 70.720 10.015 15.982 1.00 61.05 ? 109 ASN A CG 1 +ATOM 878 O OD1 . ASN A 1 109 ? 69.961 9.313 16.651 1.00 60.44 ? 109 ASN A OD1 1 +ATOM 879 N ND2 . ASN A 1 109 ? 72.029 9.754 15.862 1.00 60.17 ? 109 ASN A ND2 1 +ATOM 880 N N . PRO A 1 110 ? 72.809 10.959 12.679 1.00 61.49 ? 110 PRO A N 1 +ATOM 881 C CA . PRO A 1 110 ? 73.342 9.971 11.746 1.00 60.53 ? 110 PRO A CA 1 +ATOM 882 C C . PRO A 1 110 ? 74.105 8.849 12.443 1.00 60.31 ? 110 PRO A C 1 +ATOM 883 O O . PRO A 1 110 ? 74.192 7.749 11.912 1.00 60.16 ? 110 PRO A O 1 +ATOM 884 C CB . PRO A 1 110 ? 74.205 10.811 10.830 1.00 60.95 ? 110 PRO A CB 1 +ATOM 885 C CG . PRO A 1 110 ? 74.717 11.869 11.783 1.00 61.90 ? 110 PRO A CG 1 +ATOM 886 C CD . PRO A 1 110 ? 73.516 12.247 12.576 1.00 61.00 ? 110 PRO A CD 1 +ATOM 887 N N . ASP A 1 111 ? 74.655 9.105 13.629 1.00 59.91 ? 111 ASP A N 1 +ATOM 888 C CA . ASP A 1 111 ? 75.370 8.033 14.330 1.00 60.16 ? 111 ASP A CA 1 +ATOM 889 C C . ASP A 1 111 ? 74.346 6.912 14.619 1.00 60.61 ? 111 ASP A C 1 +ATOM 890 O O . ASP A 1 111 ? 74.648 5.710 14.538 1.00 60.19 ? 111 ASP A O 1 +ATOM 891 C CB . ASP A 1 111 ? 75.937 8.498 15.678 1.00 60.16 ? 111 ASP A CB 1 +ATOM 892 C CG . ASP A 1 111 ? 76.531 9.871 15.634 1.00 60.41 ? 111 ASP A CG 1 +ATOM 893 O OD1 . ASP A 1 111 ? 76.152 10.654 14.733 1.00 61.24 ? 111 ASP A OD1 1 +ATOM 894 O OD2 . ASP A 1 111 ? 77.355 10.164 16.528 1.00 58.43 ? 111 ASP A OD2 1 +ATOM 895 N N . GLY A 1 112 ? 73.133 7.323 14.984 1.00 59.63 ? 112 GLY A N 1 +ATOM 896 C CA . GLY A 1 112 ? 72.103 6.353 15.273 1.00 57.67 ? 112 GLY A CA 1 +ATOM 897 C C . GLY A 1 112 ? 71.821 5.524 14.042 1.00 56.20 ? 112 GLY A C 1 +ATOM 898 O O . GLY A 1 112 ? 71.828 4.301 14.085 1.00 56.27 ? 112 GLY A O 1 +ATOM 899 N N . PHE A 1 113 ? 71.580 6.198 12.931 1.00 55.13 ? 113 PHE A N 1 +ATOM 900 C CA . PHE A 1 113 ? 71.293 5.502 11.705 1.00 54.61 ? 113 PHE A CA 1 +ATOM 901 C C . PHE A 1 113 ? 72.401 4.553 11.339 1.00 54.81 ? 113 PHE A C 1 +ATOM 902 O O . PHE A 1 113 ? 72.160 3.370 11.114 1.00 55.96 ? 113 PHE A O 1 +ATOM 903 C CB . PHE A 1 113 ? 71.117 6.466 10.560 1.00 55.45 ? 113 PHE A CB 1 +ATOM 904 C CG . PHE A 1 113 ? 71.109 5.792 9.232 1.00 56.97 ? 113 PHE A CG 1 +ATOM 905 C CD1 . PHE A 1 113 ? 69.975 5.125 8.785 1.00 56.28 ? 113 PHE A CD1 1 +ATOM 906 C CD2 . PHE A 1 113 ? 72.259 5.764 8.449 1.00 57.73 ? 113 PHE A CD2 1 +ATOM 907 C CE1 . PHE A 1 113 ? 69.983 4.436 7.581 1.00 56.05 ? 113 PHE A CE1 1 +ATOM 908 C CE2 . PHE A 1 113 ? 72.274 5.073 7.238 1.00 58.17 ? 113 PHE A CE2 1 +ATOM 909 C CZ . PHE A 1 113 ? 71.132 4.408 6.807 1.00 57.09 ? 113 PHE A CZ 1 +ATOM 910 N N . GLU A 1 114 ? 73.618 5.068 11.253 1.00 54.08 ? 114 GLU A N 1 +ATOM 911 C CA . GLU A 1 114 ? 74.738 4.220 10.889 1.00 54.76 ? 114 GLU A CA 1 +ATOM 912 C C . GLU A 1 114 ? 74.829 3.020 11.827 1.00 53.65 ? 114 GLU A C 1 +ATOM 913 O O . GLU A 1 114 ? 74.998 1.883 11.395 1.00 54.41 ? 114 GLU A O 1 +ATOM 914 C CB . GLU A 1 114 ? 76.050 5.003 10.949 1.00 57.69 ? 114 GLU A CB 1 +ATOM 915 C CG . GLU A 1 114 ? 75.975 6.415 10.395 1.00 62.74 ? 114 GLU A CG 1 +ATOM 916 C CD . GLU A 1 114 ? 75.707 6.471 8.896 1.00 66.09 ? 114 GLU A CD 1 +ATOM 917 O OE1 . GLU A 1 114 ? 75.115 7.494 8.453 1.00 66.74 ? 114 GLU A OE1 1 +ATOM 918 O OE2 . GLU A 1 114 ? 76.097 5.512 8.171 1.00 66.91 ? 114 GLU A OE2 1 +ATOM 919 N N . ALA A 1 115 ? 74.705 3.268 13.115 1.00 51.61 ? 115 ALA A N 1 +ATOM 920 C CA . ALA A 1 115 ? 74.815 2.202 14.081 1.00 51.48 ? 115 ALA A CA 1 +ATOM 921 C C . ALA A 1 115 ? 74.123 0.884 13.761 1.00 52.02 ? 115 ALA A C 1 +ATOM 922 O O . ALA A 1 115 ? 74.706 -0.184 13.966 1.00 51.85 ? 115 ALA A O 1 +ATOM 923 C CB . ALA A 1 115 ? 74.344 2.700 15.412 1.00 53.64 ? 115 ALA A CB 1 +ATOM 924 N N . VAL A 1 116 ? 72.879 0.936 13.277 1.00 53.33 ? 116 VAL A N 1 +ATOM 925 C CA . VAL A 1 116 ? 72.132 -0.306 12.997 1.00 52.90 ? 116 VAL A CA 1 +ATOM 926 C C . VAL A 1 116 ? 72.585 -0.980 11.725 1.00 52.94 ? 116 VAL A C 1 +ATOM 927 O O . VAL A 1 116 ? 72.663 -0.352 10.663 1.00 52.23 ? 116 VAL A O 1 +ATOM 928 C CB . VAL A 1 116 ? 70.590 -0.089 12.904 1.00 51.10 ? 116 VAL A CB 1 +ATOM 929 C CG1 . VAL A 1 116 ? 70.106 0.814 14.023 1.00 48.57 ? 116 VAL A CG1 1 +ATOM 930 C CG2 . VAL A 1 116 ? 70.235 0.479 11.580 1.00 51.95 ? 116 VAL A CG2 1 +ATOM 931 N N . LYS A 1 117 ? 72.895 -2.264 11.852 1.00 53.36 ? 117 LYS A N 1 +ATOM 932 C CA . LYS A 1 117 ? 73.347 -3.060 10.726 1.00 53.49 ? 117 LYS A CA 1 +ATOM 933 C C . LYS A 1 117 ? 72.287 -4.089 10.337 1.00 54.08 ? 117 LYS A C 1 +ATOM 934 O O . LYS A 1 117 ? 72.269 -4.570 9.200 1.00 54.63 ? 117 LYS A O 1 +ATOM 935 C CB . LYS A 1 117 ? 74.665 -3.752 11.072 1.00 52.28 ? 117 LYS A CB 1 +ATOM 936 C CG . LYS A 1 117 ? 75.782 -2.805 11.516 1.00 53.75 ? 117 LYS A CG 1 +ATOM 937 C CD . LYS A 1 117 ? 75.804 -1.509 10.694 1.00 55.78 ? 117 LYS A CD 1 +ATOM 938 C CE . LYS A 1 117 ? 77.210 -1.083 10.243 1.00 56.41 ? 117 LYS A CE 1 +ATOM 939 N NZ . LYS A 1 117 ? 77.584 -1.617 8.876 1.00 56.13 ? 117 LYS A NZ 1 +ATOM 940 N N . LYS A 1 118 ? 71.405 -4.409 11.285 1.00 54.60 ? 118 LYS A N 1 +ATOM 941 C CA . LYS A 1 118 ? 70.325 -5.372 11.080 1.00 54.61 ? 118 LYS A CA 1 +ATOM 942 C C . LYS A 1 118 ? 68.996 -4.623 11.201 1.00 55.29 ? 118 LYS A C 1 +ATOM 943 O O . LYS A 1 118 ? 68.412 -4.588 12.286 1.00 55.79 ? 118 LYS A O 1 +ATOM 944 C CB . LYS A 1 118 ? 70.404 -6.472 12.133 1.00 99.99 ? 118 LYS A CB 1 +ATOM 945 C CG . LYS A 1 118 ? 71.638 -7.331 11.881 0.0000 99.99 ? 118 LYS A CG 1 +ATOM 946 C CD . LYS A 1 118 ? 71.675 -8.474 12.889 0.0000 99.99 ? 118 LYS A CD 1 +ATOM 947 C CE . LYS A 1 118 ? 72.948 -9.290 12.685 0.0000 99.99 ? 118 LYS A CE 1 +ATOM 948 N NZ . LYS A 1 118 ? 72.962 -10.421 13.624 0.0000 99.99 ? 118 LYS A NZ 1 +ATOM 949 N N . PRO A 1 119 ? 68.504 -4.025 10.089 1.00 55.51 ? 119 PRO A N 1 +ATOM 950 C CA . PRO A 1 119 ? 67.257 -3.244 9.950 1.00 56.00 ? 119 PRO A CA 1 +ATOM 951 C C . PRO A 1 119 ? 66.014 -3.901 10.556 1.00 55.71 ? 119 PRO A C 1 +ATOM 952 O O . PRO A 1 119 ? 65.924 -5.122 10.593 1.00 56.87 ? 119 PRO A O 1 +ATOM 953 C CB . PRO A 1 119 ? 67.147 -3.023 8.431 1.00 56.00 ? 119 PRO A CB 1 +ATOM 954 C CG . PRO A 1 119 ? 67.876 -4.181 7.855 1.00 56.79 ? 119 PRO A CG 1 +ATOM 955 C CD . PRO A 1 119 ? 69.083 -4.292 8.763 1.00 56.60 ? 119 PRO A CD 1 +ATOM 956 N N . ASP A 1 120 ? 65.044 -3.109 11.013 1.00 55.56 ? 120 ASP A N 1 +ATOM 957 C CA . ASP A 1 120 ? 63.869 -3.697 11.674 1.00 55.35 ? 120 ASP A CA 1 +ATOM 958 C C . ASP A 1 120 ? 62.681 -2.734 11.954 1.00 53.59 ? 120 ASP A C 1 +ATOM 959 O O . ASP A 1 120 ? 62.874 -1.551 12.173 1.00 55.38 ? 120 ASP A O 1 +ATOM 960 C CB . ASP A 1 120 ? 64.374 -4.344 12.970 1.00 57.12 ? 120 ASP A CB 1 +ATOM 961 C CG . ASP A 1 120 ? 63.278 -4.921 13.796 1.00 59.08 ? 120 ASP A CG 1 +ATOM 962 O OD1 . ASP A 1 120 ? 62.784 -4.187 14.681 1.00 59.50 ? 120 ASP A OD1 1 +ATOM 963 O OD2 . ASP A 1 120 ? 62.910 -6.098 13.552 1.00 60.51 ? 120 ASP A OD2 1 +ATOM 964 N N . CYS A 1 121 ? 61.454 -3.234 11.982 1.00 50.85 ? 121 CYS A N 1 +ATOM 965 C CA . CYS A 1 121 ? 60.319 -2.347 12.178 1.00 49.49 ? 121 CYS A CA 1 +ATOM 966 C C . CYS A 1 121 ? 60.003 -1.719 13.517 1.00 49.19 ? 121 CYS A C 1 +ATOM 967 O O . CYS A 1 121 ? 59.505 -0.593 13.548 1.00 49.34 ? 121 CYS A O 1 +ATOM 968 C CB . CYS A 1 121 ? 59.062 -3.012 11.681 1.00 49.61 ? 121 CYS A CB 1 +ATOM 969 S SG . CYS A 1 121 ? 59.055 -3.256 9.882 1.00 53.70 ? 121 CYS A SG 1 +ATOM 970 N N . TYR A 1 122 ? 60.252 -2.422 14.623 1.00 48.22 ? 122 TYR A N 1 +ATOM 971 C CA . TYR A 1 122 ? 59.957 -1.844 15.929 1.00 46.00 ? 122 TYR A CA 1 +ATOM 972 C C . TYR A 1 122 ? 61.162 -1.501 16.838 1.00 45.65 ? 122 TYR A C 1 +ATOM 973 O O . TYR A 1 122 ? 61.054 -0.563 17.628 1.00 46.95 ? 122 TYR A O 1 +ATOM 974 C CB . TYR A 1 122 ? 58.974 -2.727 16.701 1.00 46.60 ? 122 TYR A CB 1 +ATOM 975 C CG . TYR A 1 122 ? 57.837 -3.344 15.899 1.00 44.83 ? 122 TYR A CG 1 +ATOM 976 C CD1 . TYR A 1 122 ? 58.053 -4.445 15.096 1.00 45.48 ? 122 TYR A CD1 1 +ATOM 977 C CD2 . TYR A 1 122 ? 56.552 -2.827 15.958 1.00 43.66 ? 122 TYR A CD2 1 +ATOM 978 C CE1 . TYR A 1 122 ? 57.025 -5.015 14.370 1.00 46.28 ? 122 TYR A CE1 1 +ATOM 979 C CE2 . TYR A 1 122 ? 55.510 -3.387 15.234 1.00 43.43 ? 122 TYR A CE2 1 +ATOM 980 C CZ . TYR A 1 122 ? 55.752 -4.477 14.440 1.00 45.90 ? 122 TYR A CZ 1 +ATOM 981 O OH . TYR A 1 122 ? 54.743 -5.041 13.683 1.00 48.27 ? 122 TYR A OH 1 +ATOM 982 N N . TYR A 1 123 ? 62.297 -2.210 16.753 1.00 44.11 ? 123 TYR A N 1 +ATOM 983 C CA . TYR A 1 123 ? 63.454 -1.873 17.621 1.00 43.40 ? 123 TYR A CA 1 +ATOM 984 C C . TYR A 1 123 ? 64.865 -1.994 17.021 1.00 43.91 ? 123 TYR A C 1 +ATOM 985 O O . TYR A 1 123 ? 65.085 -2.738 16.087 1.00 43.78 ? 123 TYR A O 1 +ATOM 986 C CB . TYR A 1 123 ? 63.449 -2.709 18.906 1.00 41.49 ? 123 TYR A CB 1 +ATOM 987 C CG . TYR A 1 123 ? 62.134 -2.792 19.643 1.00 41.32 ? 123 TYR A CG 1 +ATOM 988 C CD1 . TYR A 1 123 ? 61.263 -3.859 19.422 1.00 41.67 ? 123 TYR A CD1 1 +ATOM 989 C CD2 . TYR A 1 123 ? 61.764 -1.819 20.582 1.00 40.70 ? 123 TYR A CD2 1 +ATOM 990 C CE1 . TYR A 1 123 ? 60.051 -3.961 20.116 1.00 41.87 ? 123 TYR A CE1 1 +ATOM 991 C CE2 . TYR A 1 123 ? 60.558 -1.915 21.289 1.00 40.32 ? 123 TYR A CE2 1 +ATOM 992 C CZ . TYR A 1 123 ? 59.706 -2.992 21.050 1.00 42.11 ? 123 TYR A CZ 1 +ATOM 993 O OH . TYR A 1 123 ? 58.524 -3.138 21.752 1.00 44.79 ? 123 TYR A OH 1 +ATOM 994 N N . SER A 1 124 ? 65.822 -1.261 17.587 1.00 46.41 ? 124 SER A N 1 +ATOM 995 C CA . SER A 1 124 ? 67.213 -1.300 17.121 1.00 49.83 ? 124 SER A CA 1 +ATOM 996 C C . SER A 1 124 ? 68.245 -0.598 18.027 1.00 52.04 ? 124 SER A C 1 +ATOM 997 O O . SER A 1 124 ? 67.918 0.020 19.056 1.00 52.72 ? 124 SER A O 1 +ATOM 998 C CB . SER A 1 124 ? 67.348 -0.681 15.730 1.00 50.41 ? 124 SER A CB 1 +ATOM 999 O OG . SER A 1 124 ? 67.436 0.748 15.812 1.00 51.49 ? 124 SER A OG 1 +ATOM 1000 N N . ILE A 1 125 ? 69.499 -0.704 17.587 1.00 52.85 ? 125 ILE A N 1 +ATOM 1001 C CA . ILE A 1 125 ? 70.662 -0.129 18.240 1.00 53.29 ? 125 ILE A CA 1 +ATOM 1002 C C . ILE A 1 125 ? 70.666 1.389 18.013 1.00 54.73 ? 125 ILE A C 1 +ATOM 1003 O O . ILE A 1 125 ? 71.316 2.133 18.750 1.00 56.03 ? 125 ILE A O 1 +ATOM 1004 C CB . ILE A 1 125 ? 71.948 -0.779 17.633 1.00 53.42 ? 125 ILE A CB 1 +ATOM 1005 C CG1 . ILE A 1 125 ? 72.180 -2.150 18.270 1.00 54.46 ? 125 ILE A CG1 1 +ATOM 1006 C CG2 . ILE A 1 125 ? 73.161 0.142 17.766 1.00 53.19 ? 125 ILE A CG2 1 +ATOM 1007 C CD1 . ILE A 1 125 ? 72.525 -2.133 19.770 1.00 53.95 ? 125 ILE A CD1 1 +ATOM 1008 N N . GLY A 1 126 ? 69.947 1.841 16.982 1.00 55.07 ? 126 GLY A N 1 +ATOM 1009 C CA . GLY A 1 126 ? 69.883 3.262 16.663 1.00 54.69 ? 126 GLY A CA 1 +ATOM 1010 C C . GLY A 1 126 ? 68.705 3.894 17.373 1.00 54.82 ? 126 GLY A C 1 +ATOM 1011 O O . GLY A 1 126 ? 68.113 3.222 18.226 1.00 58.34 ? 126 GLY A O 1 +ATOM 1012 N N . ARG A 1 127 ? 68.355 5.139 17.031 1.00 51.58 ? 127 ARG A N 1 +ATOM 1013 C CA . ARG A 1 127 ? 67.247 5.865 17.663 1.00 48.76 ? 127 ARG A CA 1 +ATOM 1014 C C . ARG A 1 127 ? 67.831 6.962 18.521 1.00 48.68 ? 127 ARG A C 1 +ATOM 1015 O O . ARG A 1 127 ? 67.737 8.148 18.180 1.00 49.66 ? 127 ARG A O 1 +ATOM 1016 C CB . ARG A 1 127 ? 66.393 4.939 18.539 1.00 46.84 ? 127 ARG A CB 1 +ATOM 1017 C CG . ARG A 1 127 ? 65.677 5.598 19.692 1.00 46.43 ? 127 ARG A CG 1 +ATOM 1018 C CD . ARG A 1 127 ? 64.182 5.770 19.439 1.00 48.12 ? 127 ARG A CD 1 +ATOM 1019 N NE . ARG A 1 127 ? 63.500 6.444 20.546 1.00 46.78 ? 127 ARG A NE 1 +ATOM 1020 C CZ . ARG A 1 127 ? 62.289 6.984 20.456 1.00 47.50 ? 127 ARG A CZ 1 +ATOM 1021 N NH1 . ARG A 1 127 ? 61.739 7.575 21.503 1.00 48.41 ? 127 ARG A NH1 1 +ATOM 1022 N NH2 . ARG A 1 127 ? 61.624 6.944 19.313 1.00 47.66 ? 127 ARG A NH2 1 +ATOM 1023 N N . GLU A 1 128 ? 68.425 6.543 19.637 1.00 47.86 ? 128 GLU A N 1 +ATOM 1024 C CA . GLU A 1 128 ? 69.076 7.412 20.608 1.00 48.21 ? 128 GLU A CA 1 +ATOM 1025 C C . GLU A 1 128 ? 70.334 8.020 19.971 1.00 50.37 ? 128 GLU A C 1 +ATOM 1026 O O . GLU A 1 128 ? 70.791 7.529 18.945 1.00 52.15 ? 128 GLU A O 1 +ATOM 1027 C CB . GLU A 1 128 ? 69.505 6.574 21.806 1.00 48.18 ? 128 GLU A CB 1 +ATOM 1028 C CG . GLU A 1 128 ? 68.398 6.026 22.681 1.00 48.78 ? 128 GLU A CG 1 +ATOM 1029 C CD . GLU A 1 128 ? 67.717 4.722 22.205 1.00 50.38 ? 128 GLU A CD 1 +ATOM 1030 O OE1 . GLU A 1 128 ? 66.665 4.434 22.824 1.00 51.27 ? 128 GLU A OE1 1 +ATOM 1031 O OE2 . GLU A 1 128 ? 68.181 3.985 21.282 1.00 46.69 ? 128 GLU A OE2 1 +ATOM 1032 N N . ASN A 1 129 ? 70.901 9.078 20.549 1.00 51.88 ? 129 ASN A N 1 +ATOM 1033 C CA . ASN A 1 129 ? 72.134 9.656 19.993 1.00 54.24 ? 129 ASN A CA 1 +ATOM 1034 C C . ASN A 1 129 ? 73.217 8.719 20.549 1.00 56.90 ? 129 ASN A C 1 +ATOM 1035 O O . ASN A 1 129 ? 72.869 7.778 21.295 1.00 56.96 ? 129 ASN A O 1 +ATOM 1036 C CB . ASN A 1 129 ? 72.319 11.119 20.446 1.00 53.62 ? 129 ASN A CB 1 +ATOM 1037 C CG . ASN A 1 129 ? 73.222 11.272 21.668 1.00 54.46 ? 129 ASN A CG 1 +ATOM 1038 O OD1 . ASN A 1 129 ? 73.077 10.574 22.681 1.00 55.47 ? 129 ASN A OD1 1 +ATOM 1039 N ND2 . ASN A 1 129 ? 74.144 12.213 21.583 1.00 53.58 ? 129 ASN A ND2 1 +ATOM 1040 N N . TYR A 1 130 ? 74.502 8.935 20.233 1.00 58.16 ? 130 TYR A N 1 +ATOM 1041 C CA . TYR A 1 130 ? 75.513 7.975 20.717 1.00 59.33 ? 130 TYR A CA 1 +ATOM 1042 C C . TYR A 1 130 ? 75.634 7.785 22.228 1.00 59.09 ? 130 TYR A C 1 +ATOM 1043 O O . TYR A 1 130 ? 76.172 6.779 22.689 1.00 57.62 ? 130 TYR A O 1 +ATOM 1044 C CB . TYR A 1 130 ? 76.891 8.265 20.114 1.00 60.80 ? 130 TYR A CB 1 +ATOM 1045 C CG . TYR A 1 130 ? 77.977 7.303 20.584 1.00 62.24 ? 130 TYR A CG 1 +ATOM 1046 C CD1 . TYR A 1 130 ? 78.736 7.569 21.742 1.00 62.57 ? 130 TYR A CD1 1 +ATOM 1047 C CD2 . TYR A 1 130 ? 78.223 6.114 19.892 1.00 63.08 ? 130 TYR A CD2 1 +ATOM 1048 C CE1 . TYR A 1 130 ? 79.716 6.668 22.196 1.00 63.55 ? 130 TYR A CE1 1 +ATOM 1049 C CE2 . TYR A 1 130 ? 79.197 5.197 20.334 1.00 64.78 ? 130 TYR A CE2 1 +ATOM 1050 C CZ . TYR A 1 130 ? 79.942 5.478 21.485 1.00 65.14 ? 130 TYR A CZ 1 +ATOM 1051 O OH . TYR A 1 130 ? 80.901 4.573 21.909 1.00 63.52 ? 130 TYR A OH 1 +ATOM 1052 N N . ASN A 1 131 ? 75.124 8.740 22.995 1.00 60.11 ? 131 ASN A N 1 +ATOM 1053 C CA . ASN A 1 131 ? 75.162 8.642 24.445 1.00 61.19 ? 131 ASN A CA 1 +ATOM 1054 C C . ASN A 1 131 ? 73.852 8.076 24.975 1.00 61.54 ? 131 ASN A C 1 +ATOM 1055 O O . ASN A 1 131 ? 73.488 8.316 26.127 1.00 62.37 ? 131 ASN A O 1 +ATOM 1056 C CB . ASN A 1 131 ? 75.407 10.008 25.071 1.00 62.96 ? 131 ASN A CB 1 +ATOM 1057 C CG . ASN A 1 131 ? 76.636 10.668 24.531 1.00 63.16 ? 131 ASN A CG 1 +ATOM 1058 O OD1 . ASN A 1 131 ? 77.576 9.992 24.089 1.00 63.35 ? 131 ASN A OD1 1 +ATOM 1059 N ND2 . ASN A 1 131 ? 76.655 11.994 24.569 1.00 63.20 ? 131 ASN A ND2 1 +ATOM 1060 N N . GLN A 1 132 ? 73.143 7.348 24.112 1.00 60.95 ? 132 GLN A N 1 +ATOM 1061 C CA . GLN A 1 132 ? 71.890 6.690 24.463 1.00 59.35 ? 132 GLN A CA 1 +ATOM 1062 C C . GLN A 1 132 ? 70.755 7.666 24.770 1.00 58.92 ? 132 GLN A C 1 +ATOM 1063 O O . GLN A 1 132 ? 69.697 7.270 25.247 1.00 58.04 ? 132 GLN A O 1 +ATOM 1064 C CB . GLN A 1 132 ? 72.115 5.751 25.664 1.00 57.84 ? 132 GLN A CB 1 +ATOM 1065 C CG . GLN A 1 132 ? 73.357 4.875 25.557 1.00 57.33 ? 132 GLN A CG 1 +ATOM 1066 C CD . GLN A 1 132 ? 73.337 3.711 26.531 1.00 59.17 ? 132 GLN A CD 1 +ATOM 1067 O OE1 . GLN A 1 132 ? 72.583 3.731 27.497 1.00 61.64 ? 132 GLN A OE1 1 +ATOM 1068 N NE2 . GLN A 1 132 ? 74.169 2.695 26.288 1.00 58.83 ? 132 GLN A NE2 1 +ATOM 1069 N N . TYR A 1 133 ? 70.953 8.943 24.496 1.00 58.66 ? 133 TYR A N 1 +ATOM 1070 C CA . TYR A 1 133 ? 69.886 9.888 24.781 1.00 60.06 ? 133 TYR A CA 1 +ATOM 1071 C C . TYR A 1 133 ? 68.819 9.975 23.682 1.00 60.13 ? 133 TYR A C 1 +ATOM 1072 O O . TYR A 1 133 ? 69.087 9.706 22.513 1.00 61.04 ? 133 TYR A O 1 +ATOM 1073 C CB . TYR A 1 133 ? 70.476 11.259 24.997 1.00 61.17 ? 133 TYR A CB 1 +ATOM 1074 C CG . TYR A 1 133 ? 71.126 11.487 26.332 1.00 63.78 ? 133 TYR A CG 1 +ATOM 1075 C CD1 . TYR A 1 133 ? 70.357 11.750 27.457 1.00 64.59 ? 133 TYR A CD1 1 +ATOM 1076 C CD2 . TYR A 1 133 ? 72.507 11.621 26.435 1.00 65.23 ? 133 TYR A CD2 1 +ATOM 1077 C CE1 . TYR A 1 133 ? 70.938 12.171 28.647 1.00 65.10 ? 133 TYR A CE1 1 +ATOM 1078 C CE2 . TYR A 1 133 ? 73.102 12.045 27.619 1.00 66.33 ? 133 TYR A CE2 1 +ATOM 1079 C CZ . TYR A 1 133 ? 72.308 12.330 28.718 1.00 65.95 ? 133 TYR A CZ 1 +ATOM 1080 O OH . TYR A 1 133 ? 72.873 12.869 29.852 1.00 65.31 ? 133 TYR A OH 1 +ATOM 1081 N N . ASP A 1 134 ? 67.597 10.342 24.051 1.00 59.97 ? 134 ASP A N 1 +ATOM 1082 C CA . ASP A 1 134 ? 66.554 10.483 23.042 1.00 58.99 ? 134 ASP A CA 1 +ATOM 1083 C C . ASP A 1 134 ? 66.582 11.934 22.600 1.00 58.19 ? 134 ASP A C 1 +ATOM 1084 O O . ASP A 1 134 ? 66.249 12.858 23.360 1.00 57.21 ? 134 ASP A O 1 +ATOM 1085 C CB . ASP A 1 134 ? 65.175 10.161 23.602 1.00 61.07 ? 134 ASP A CB 1 +ATOM 1086 C CG . ASP A 1 134 ? 64.133 9.977 22.508 1.00 62.64 ? 134 ASP A CG 1 +ATOM 1087 O OD1 . ASP A 1 134 ? 64.164 10.745 21.509 1.00 62.81 ? 134 ASP A OD1 1 +ATOM 1088 O OD2 . ASP A 1 134 ? 63.283 9.066 22.660 1.00 64.30 ? 134 ASP A OD2 1 +ATOM 1089 N N . LEU A 1 135 ? 66.984 12.144 21.364 1.00 56.82 ? 135 LEU A N 1 +ATOM 1090 C CA . LEU A 1 135 ? 67.063 13.496 20.896 1.00 56.29 ? 135 LEU A CA 1 +ATOM 1091 C C . LEU A 1 135 ? 65.743 14.250 20.902 1.00 55.75 ? 135 LEU A C 1 +ATOM 1092 O O . LEU A 1 135 ? 65.747 15.473 20.788 1.00 56.77 ? 135 LEU A O 1 +ATOM 1093 C CB . LEU A 1 135 ? 67.689 13.514 19.512 1.00 56.42 ? 135 LEU A CB 1 +ATOM 1094 C CG . LEU A 1 135 ? 69.203 13.377 19.576 1.00 55.18 ? 135 LEU A CG 1 +ATOM 1095 C CD1 . LEU A 1 135 ? 69.722 13.169 18.194 1.00 57.18 ? 135 LEU A CD1 1 +ATOM 1096 C CD2 . LEU A 1 135 ? 69.818 14.611 20.186 1.00 54.50 ? 135 LEU A CD2 1 +ATOM 1097 N N . ASN A 1 136 ? 64.610 13.563 21.020 1.00 53.18 ? 136 ASN A N 1 +ATOM 1098 C CA . ASN A 1 136 ? 63.372 14.316 21.037 1.00 51.16 ? 136 ASN A CA 1 +ATOM 1099 C C . ASN A 1 136 ? 62.812 14.407 22.437 1.00 50.50 ? 136 ASN A C 1 +ATOM 1100 O O . ASN A 1 136 ? 61.636 14.699 22.639 1.00 50.01 ? 136 ASN A O 1 +ATOM 1101 C CB . ASN A 1 136 ? 62.336 13.731 20.085 1.00 51.06 ? 136 ASN A CB 1 +ATOM 1102 C CG . ASN A 1 136 ? 61.284 14.760 19.670 1.00 50.81 ? 136 ASN A CG 1 +ATOM 1103 O OD1 . ASN A 1 136 ? 61.568 15.714 18.945 1.00 50.84 ? 136 ASN A OD1 1 +ATOM 1104 N ND2 . ASN A 1 136 ? 60.072 14.578 20.149 1.00 51.07 ? 136 ASN A ND2 1 +ATOM 1105 N N . ARG A 1 137 ? 63.672 14.145 23.408 1.00 51.21 ? 137 ARG A N 1 +ATOM 1106 C CA . ARG A 1 137 ? 63.308 14.239 24.817 1.00 53.00 ? 137 ARG A CA 1 +ATOM 1107 C C . ARG A 1 137 ? 64.400 15.100 25.463 1.00 53.20 ? 137 ARG A C 1 +ATOM 1108 O O . ARG A 1 137 ? 64.436 15.266 26.676 1.00 52.57 ? 137 ARG A O 1 +ATOM 1109 C CB . ARG A 1 137 ? 63.303 12.854 25.482 1.00 53.51 ? 137 ARG A CB 1 +ATOM 1110 C CG . ARG A 1 137 ? 62.277 11.873 24.949 1.00 55.90 ? 137 ARG A CG 1 +ATOM 1111 C CD . ARG A 1 137 ? 61.898 10.795 25.982 1.00 58.99 ? 137 ARG A CD 1 +ATOM 1112 N NE . ARG A 1 137 ? 63.051 10.108 26.585 1.00 63.30 ? 137 ARG A NE 1 +ATOM 1113 C CZ . ARG A 1 137 ? 62.993 8.986 27.321 1.00 65.25 ? 137 ARG A CZ 1 +ATOM 1114 N NH1 . ARG A 1 137 ? 64.107 8.457 27.827 1.00 66.57 ? 137 ARG A NH1 1 +ATOM 1115 N NH2 . ARG A 1 137 ? 61.836 8.368 27.547 1.00 66.04 ? 137 ARG A NH2 1 +ATOM 1116 N N . ASN A 1 138 ? 65.249 15.679 24.613 1.00 53.75 ? 138 ASN A N 1 +ATOM 1117 C CA . ASN A 1 138 ? 66.417 16.450 25.022 1.00 52.71 ? 138 ASN A CA 1 +ATOM 1118 C C . ASN A 1 138 ? 66.454 17.974 24.889 1.00 51.56 ? 138 ASN A C 1 +ATOM 1119 O O . ASN A 1 138 ? 67.492 18.586 25.071 1.00 51.97 ? 138 ASN A O 1 +ATOM 1120 C CB . ASN A 1 138 ? 67.632 15.836 24.312 1.00 54.35 ? 138 ASN A CB 1 +ATOM 1121 C CG . ASN A 1 138 ? 68.943 16.447 24.752 1.00 55.82 ? 138 ASN A CG 1 +ATOM 1122 O OD1 . ASN A 1 138 ? 69.053 16.958 25.865 1.00 57.02 ? 138 ASN A OD1 1 +ATOM 1123 N ND2 . ASN A 1 138 ? 69.959 16.374 23.890 1.00 55.25 ? 138 ASN A ND2 1 +ATOM 1124 N N . PHE A 1 139 ? 65.338 18.610 24.591 1.00 51.12 ? 139 PHE A N 1 +ATOM 1125 C CA . PHE A 1 139 ? 65.356 20.069 24.482 1.00 50.02 ? 139 PHE A CA 1 +ATOM 1126 C C . PHE A 1 139 ? 64.750 20.707 25.740 1.00 50.07 ? 139 PHE A C 1 +ATOM 1127 O O . PHE A 1 139 ? 64.140 20.042 26.559 1.00 48.46 ? 139 PHE A O 1 +ATOM 1128 C CB . PHE A 1 139 ? 64.549 20.522 23.245 1.00 48.29 ? 139 PHE A CB 1 +ATOM 1129 C CG . PHE A 1 139 ? 65.227 20.249 21.913 1.00 46.51 ? 139 PHE A CG 1 +ATOM 1130 C CD1 . PHE A 1 139 ? 65.796 21.288 21.175 1.00 46.73 ? 139 PHE A CD1 1 +ATOM 1131 C CD2 . PHE A 1 139 ? 65.280 18.965 21.388 1.00 45.00 ? 139 PHE A CD2 1 +ATOM 1132 C CE1 . PHE A 1 139 ? 66.411 21.047 19.924 1.00 45.83 ? 139 PHE A CE1 1 +ATOM 1133 C CE2 . PHE A 1 139 ? 65.888 18.719 20.146 1.00 45.55 ? 139 PHE A CE2 1 +ATOM 1134 C CZ . PHE A 1 139 ? 66.455 19.762 19.410 1.00 44.30 ? 139 PHE A CZ 1 +ATOM 1135 N N . PRO A 1 140 ? 64.960 22.009 25.931 1.00 51.65 ? 140 PRO A N 1 +ATOM 1136 C CA . PRO A 1 140 ? 64.393 22.703 27.095 1.00 53.05 ? 140 PRO A CA 1 +ATOM 1137 C C . PRO A 1 140 ? 62.873 22.547 27.044 1.00 54.06 ? 140 PRO A C 1 +ATOM 1138 O O . PRO A 1 140 ? 62.297 22.505 25.958 1.00 55.13 ? 140 PRO A O 1 +ATOM 1139 C CB . PRO A 1 140 ? 64.812 24.145 26.860 1.00 51.10 ? 140 PRO A CB 1 +ATOM 1140 C CG . PRO A 1 140 ? 66.161 23.966 26.292 1.00 51.20 ? 140 PRO A CG 1 +ATOM 1141 C CD . PRO A 1 140 ? 66.038 22.807 25.330 1.00 51.17 ? 140 PRO A CD 1 +ATOM 1142 N N . ASP A 1 141 ? 62.215 22.481 28.193 1.00 55.20 ? 141 ASP A N 1 +ATOM 1143 C CA . ASP A 1 141 ? 60.771 22.309 28.177 1.00 56.99 ? 141 ASP A CA 1 +ATOM 1144 C C . ASP A 1 141 ? 59.983 23.410 28.875 1.00 58.37 ? 141 ASP A C 1 +ATOM 1145 O O . ASP A 1 141 ? 60.155 23.623 30.066 1.00 58.92 ? 141 ASP A O 1 +ATOM 1146 C CB . ASP A 1 141 ? 60.395 20.972 28.799 1.00 55.63 ? 141 ASP A CB 1 +ATOM 1147 C CG . ASP A 1 141 ? 59.007 20.573 28.447 1.00 56.36 ? 141 ASP A CG 1 +ATOM 1148 O OD1 . ASP A 1 141 ? 58.859 20.007 27.351 1.00 58.17 ? 141 ASP A OD1 1 +ATOM 1149 O OD2 . ASP A 1 141 ? 58.065 20.847 29.230 1.00 56.08 ? 141 ASP A OD2 1 +ATOM 1150 N N . ALA A 1 142 ? 59.100 24.081 28.139 1.00 60.03 ? 142 ALA A N 1 +ATOM 1151 C CA . ALA A 1 142 ? 58.291 25.168 28.695 1.00 61.97 ? 142 ALA A CA 1 +ATOM 1152 C C . ALA A 1 142 ? 57.303 24.678 29.750 1.00 63.60 ? 142 ALA A C 1 +ATOM 1153 O O . ALA A 1 142 ? 56.488 25.453 30.258 1.00 63.60 ? 142 ALA A O 1 +ATOM 1154 C CB . ALA A 1 142 ? 57.520 25.885 27.565 1.00 61.29 ? 142 ALA A CB 1 +ATOM 1155 N N . PHE A 1 143 ? 57.378 23.399 30.099 1.00 65.24 ? 143 PHE A N 1 +ATOM 1156 C CA . PHE A 1 143 ? 56.426 22.863 31.058 1.00 66.78 ? 143 PHE A CA 1 +ATOM 1157 C C . PHE A 1 143 ? 56.955 22.274 32.377 1.00 68.03 ? 143 PHE A C 1 +ATOM 1158 O O . PHE A 1 143 ? 56.322 22.430 33.416 1.00 68.35 ? 143 PHE A O 1 +ATOM 1159 C CB . PHE A 1 143 ? 55.556 21.828 30.347 1.00 66.09 ? 143 PHE A CB 1 +ATOM 1160 C CG . PHE A 1 143 ? 54.819 22.365 29.137 1.00 65.09 ? 143 PHE A CG 1 +ATOM 1161 C CD1 . PHE A 1 143 ? 55.207 21.991 27.843 1.00 64.85 ? 143 PHE A CD1 1 +ATOM 1162 C CD2 . PHE A 1 143 ? 53.699 23.188 29.290 1.00 63.23 ? 143 PHE A CD2 1 +ATOM 1163 C CE1 . PHE A 1 143 ? 54.481 22.422 26.721 1.00 63.23 ? 143 PHE A CE1 1 +ATOM 1164 C CE2 . PHE A 1 143 ? 52.968 23.624 28.181 1.00 61.44 ? 143 PHE A CE2 1 +ATOM 1165 C CZ . PHE A 1 143 ? 53.357 23.239 26.897 1.00 62.60 ? 143 PHE A CZ 1 +ATOM 1166 N N . GLU A 1 144 ? 58.107 21.618 32.349 1.00 69.91 ? 144 GLU A N 1 +ATOM 1167 C CA . GLU A 1 144 ? 58.654 20.997 33.556 1.00 72.39 ? 144 GLU A CA 1 +ATOM 1168 C C . GLU A 1 144 ? 60.145 20.743 33.379 1.00 72.98 ? 144 GLU A C 1 +ATOM 1169 O O . GLU A 1 144 ? 60.532 19.907 32.571 1.00 72.68 ? 144 GLU A O 1 +ATOM 1170 C CB . GLU A 1 144 ? 57.954 19.664 33.775 1.00 74.60 ? 144 GLU A CB 1 +ATOM 1171 C CG . GLU A 1 144 ? 57.944 18.826 32.481 1.00 77.98 ? 144 GLU A CG 1 +ATOM 1172 C CD . GLU A 1 144 ? 57.398 17.418 32.652 1.00 79.75 ? 144 GLU A CD 1 +ATOM 1173 O OE1 . GLU A 1 144 ? 58.073 16.571 33.286 1.00 80.61 ? 144 GLU A OE1 1 +ATOM 1174 O OE2 . GLU A 1 144 ? 56.286 17.160 32.143 1.00 81.18 ? 144 GLU A OE2 1 +ATOM 1175 N N . TYR A 1 145 ? 60.983 21.432 34.140 1.00 74.12 ? 145 TYR A N 1 +ATOM 1176 C CA . TYR A 1 145 ? 62.422 21.244 33.995 1.00 76.09 ? 145 TYR A CA 1 +ATOM 1177 C C . TYR A 1 145 ? 62.846 19.932 33.359 1.00 76.52 ? 145 TYR A C 1 +ATOM 1178 O O . TYR A 1 145 ? 62.605 18.847 33.905 1.00 76.67 ? 145 TYR A O 1 +ATOM 1179 C CB . TYR A 1 145 ? 63.135 21.374 35.332 1.00 76.99 ? 145 TYR A CB 1 +ATOM 1180 C CG . TYR A 1 145 ? 63.295 22.796 35.768 1.00 80.03 ? 145 TYR A CG 1 +ATOM 1181 C CD1 . TYR A 1 145 ? 62.350 23.404 36.604 1.00 80.12 ? 145 TYR A CD1 1 +ATOM 1182 C CD2 . TYR A 1 145 ? 64.386 23.552 35.331 1.00 81.38 ? 145 TYR A CD2 1 +ATOM 1183 C CE1 . TYR A 1 145 ? 62.488 24.729 37.001 1.00 80.50 ? 145 TYR A CE1 1 +ATOM 1184 C CE2 . TYR A 1 145 ? 64.534 24.880 35.714 1.00 82.11 ? 145 TYR A CE2 1 +ATOM 1185 C CZ . TYR A 1 145 ? 63.582 25.461 36.552 1.00 82.10 ? 145 TYR A CZ 1 +ATOM 1186 O OH . TYR A 1 145 ? 63.744 26.767 36.951 1.00 82.89 ? 145 TYR A OH 1 +ATOM 1187 N N . ASN A 1 146 ? 63.471 20.038 32.191 1.00 76.28 ? 146 ASN A N 1 +ATOM 1188 C CA . ASN A 1 146 ? 63.958 18.855 31.503 1.00 76.35 ? 146 ASN A CA 1 +ATOM 1189 C C . ASN A 1 146 ? 65.458 18.800 31.705 1.00 76.31 ? 146 ASN A C 1 +ATOM 1190 O O . ASN A 1 146 ? 66.223 18.446 30.805 1.00 76.57 ? 146 ASN A O 1 +ATOM 1191 C CB . ASN A 1 146 ? 63.671 18.909 30.009 1.00 76.32 ? 146 ASN A CB 1 +ATOM 1192 C CG . ASN A 1 146 ? 64.053 17.623 29.312 1.00 74.94 ? 146 ASN A CG 1 +ATOM 1193 O OD1 . ASN A 1 146 ? 64.451 17.624 28.148 1.00 73.82 ? 146 ASN A OD1 1 +ATOM 1194 N ND2 . ASN A 1 146 ? 63.924 16.511 30.028 1.00 74.79 ? 146 ASN A ND2 1 +ATOM 1195 N N . ASN A 1 147 ? 65.877 19.184 32.896 1.00 75.84 ? 147 ASN A N 1 +ATOM 1196 C CA . ASN A 1 147 ? 67.284 19.160 33.230 1.00 74.93 ? 147 ASN A CA 1 +ATOM 1197 C C . ASN A 1 147 ? 67.866 17.841 32.698 1.00 72.22 ? 147 ASN A C 1 +ATOM 1198 O O . ASN A 1 147 ? 67.586 16.763 33.225 1.00 72.97 ? 147 ASN A O 1 +ATOM 1199 C CB . ASN A 1 147 ? 67.429 19.253 34.753 1.00 77.04 ? 147 ASN A CB 1 +ATOM 1200 C CG . ASN A 1 147 ? 66.795 18.073 35.462 1.00 79.45 ? 147 ASN A CG 1 +ATOM 1201 O OD1 . ASN A 1 147 ? 65.816 17.487 34.964 1.00 81.47 ? 147 ASN A OD1 1 +ATOM 1202 N ND2 . ASN A 1 147 ? 67.340 17.710 36.626 1.00 80.01 ? 147 ASN A ND2 1 +ATOM 1203 N N . VAL A 1 148 ? 68.638 17.920 31.625 1.00 68.12 ? 148 VAL A N 1 +ATOM 1204 C CA . VAL A 1 148 ? 69.252 16.727 31.063 1.00 64.92 ? 148 VAL A CA 1 +ATOM 1205 C C . VAL A 1 148 ? 70.469 17.204 30.312 1.00 62.23 ? 148 VAL A C 1 +ATOM 1206 O O . VAL A 1 148 ? 70.575 18.376 29.990 1.00 61.12 ? 148 VAL A O 1 +ATOM 1207 C CB . VAL A 1 148 ? 68.305 15.969 30.079 1.00 64.99 ? 148 VAL A CB 1 +ATOM 1208 C CG1 . VAL A 1 148 ? 67.051 15.497 30.790 1.00 62.08 ? 148 VAL A CG1 1 +ATOM 1209 C CG2 . VAL A 1 148 ? 67.942 16.864 28.925 1.00 65.90 ? 148 VAL A CG2 1 +ATOM 1210 N N . SER A 1 149 ? 71.387 16.298 30.032 1.00 60.41 ? 149 SER A N 1 +ATOM 1211 C CA . SER A 1 149 ? 72.602 16.667 29.328 1.00 60.30 ? 149 SER A CA 1 +ATOM 1212 C C . SER A 1 149 ? 72.278 17.080 27.887 1.00 60.48 ? 149 SER A C 1 +ATOM 1213 O O . SER A 1 149 ? 72.078 16.213 27.035 1.00 60.88 ? 149 SER A O 1 +ATOM 1214 C CB . SER A 1 149 ? 73.560 15.473 29.343 1.00 59.69 ? 149 SER A CB 1 +ATOM 1215 O OG . SER A 1 149 ? 74.792 15.764 28.718 1.00 58.70 ? 149 SER A OG 1 +ATOM 1216 N N . ARG A 1 150 ? 72.208 18.386 27.605 1.00 59.61 ? 150 ARG A N 1 +ATOM 1217 C CA . ARG A 1 150 ? 71.906 18.830 26.234 1.00 58.82 ? 150 ARG A CA 1 +ATOM 1218 C C . ARG A 1 150 ? 72.983 18.218 25.367 1.00 57.76 ? 150 ARG A C 1 +ATOM 1219 O O . ARG A 1 150 ? 74.164 18.340 25.675 1.00 59.06 ? 150 ARG A O 1 +ATOM 1220 C CB . ARG A 1 150 ? 71.909 20.367 26.117 1.00 58.89 ? 150 ARG A CB 1 +ATOM 1221 C CG . ARG A 1 150 ? 70.544 21.029 26.344 1.00 59.18 ? 150 ARG A CG 1 +ATOM 1222 C CD . ARG A 1 150 ? 69.685 20.189 27.286 1.00 61.55 ? 150 ARG A CD 1 +ATOM 1223 N NE . ARG A 1 150 ? 68.455 20.819 27.756 1.00 63.97 ? 150 ARG A NE 1 +ATOM 1224 C CZ . ARG A 1 150 ? 68.401 22.012 28.355 1.00 66.80 ? 150 ARG A CZ 1 +ATOM 1225 N NH1 . ARG A 1 150 ? 69.510 22.736 28.538 1.00 66.34 ? 150 ARG A NH1 1 +ATOM 1226 N NH2 . ARG A 1 150 ? 67.245 22.459 28.845 1.00 67.29 ? 150 ARG A NH2 1 +ATOM 1227 N N . GLN A 1 151 ? 72.578 17.547 24.296 1.00 55.81 ? 151 GLN A N 1 +ATOM 1228 C CA . GLN A 1 151 ? 73.530 16.865 23.418 1.00 53.84 ? 151 GLN A CA 1 +ATOM 1229 C C . GLN A 1 151 ? 74.007 17.678 22.216 1.00 52.41 ? 151 GLN A C 1 +ATOM 1230 O O . GLN A 1 151 ? 73.330 18.602 21.761 1.00 53.65 ? 151 GLN A O 1 +ATOM 1231 C CB . GLN A 1 151 ? 72.910 15.556 22.925 1.00 53.36 ? 151 GLN A CB 1 +ATOM 1232 C CG . GLN A 1 151 ? 72.354 14.675 24.030 1.00 51.45 ? 151 GLN A CG 1 +ATOM 1233 C CD . GLN A 1 151 ? 73.422 14.115 24.960 1.00 49.05 ? 151 GLN A CD 1 +ATOM 1234 O OE1 . GLN A 1 151 ? 74.282 13.328 24.550 1.00 47.90 ? 151 GLN A OE1 1 +ATOM 1235 N NE2 . GLN A 1 151 ? 73.357 14.508 26.221 1.00 46.12 ? 151 GLN A NE2 1 +ATOM 1236 N N . PRO A 1 152 ? 75.169 17.313 21.662 1.00 49.93 ? 152 PRO A N 1 +ATOM 1237 C CA . PRO A 1 152 ? 75.762 17.988 20.512 1.00 48.84 ? 152 PRO A CA 1 +ATOM 1238 C C . PRO A 1 152 ? 74.742 18.347 19.463 1.00 49.80 ? 152 PRO A C 1 +ATOM 1239 O O . PRO A 1 152 ? 74.648 19.494 19.023 1.00 50.61 ? 152 PRO A O 1 +ATOM 1240 C CB . PRO A 1 152 ? 76.736 16.964 19.981 1.00 47.79 ? 152 PRO A CB 1 +ATOM 1241 C CG . PRO A 1 152 ? 77.159 16.287 21.176 1.00 49.27 ? 152 PRO A CG 1 +ATOM 1242 C CD . PRO A 1 152 ? 75.879 16.059 21.928 1.00 49.59 ? 152 PRO A CD 1 +ATOM 1243 N N . GLU A 1 153 ? 73.968 17.354 19.057 1.00 50.53 ? 153 GLU A N 1 +ATOM 1244 C CA . GLU A 1 153 ? 72.974 17.581 18.032 1.00 50.25 ? 153 GLU A CA 1 +ATOM 1245 C C . GLU A 1 153 ? 71.921 18.542 18.532 1.00 49.69 ? 153 GLU A C 1 +ATOM 1246 O O . GLU A 1 153 ? 71.563 19.492 17.839 1.00 48.65 ? 153 GLU A O 1 +ATOM 1247 C CB . GLU A 1 153 ? 72.345 16.264 17.613 1.00 49.73 ? 153 GLU A CB 1 +ATOM 1248 C CG . GLU A 1 153 ? 73.358 15.189 17.266 1.00 50.51 ? 153 GLU A CG 1 +ATOM 1249 C CD . GLU A 1 153 ? 73.899 14.482 18.502 1.00 51.18 ? 153 GLU A CD 1 +ATOM 1250 O OE1 . GLU A 1 153 ? 74.629 13.467 18.356 1.00 51.62 ? 153 GLU A OE1 1 +ATOM 1251 O OE2 . GLU A 1 153 ? 73.586 14.948 19.619 1.00 51.10 ? 153 GLU A OE2 1 +ATOM 1252 N N . THR A 1 154 ? 71.443 18.311 19.743 1.00 49.48 ? 154 THR A N 1 +ATOM 1253 C CA . THR A 1 154 ? 70.426 19.174 20.308 1.00 52.20 ? 154 THR A CA 1 +ATOM 1254 C C . THR A 1 154 ? 70.896 20.621 20.288 1.00 53.69 ? 154 THR A C 1 +ATOM 1255 O O . THR A 1 154 ? 70.153 21.541 19.868 1.00 52.94 ? 154 THR A O 1 +ATOM 1256 C CB . THR A 1 154 ? 70.130 18.787 21.746 1.00 53.31 ? 154 THR A CB 1 +ATOM 1257 O OG1 . THR A 1 154 ? 70.159 17.358 21.851 1.00 55.41 ? 154 THR A OG1 1 +ATOM 1258 C CG2 . THR A 1 154 ? 68.760 19.332 22.185 1.00 52.43 ? 154 THR A CG2 1 +ATOM 1259 N N . VAL A 1 155 ? 72.138 20.814 20.740 1.00 54.59 ? 155 VAL A N 1 +ATOM 1260 C CA . VAL A 1 155 ? 72.731 22.144 20.794 1.00 55.95 ? 155 VAL A CA 1 +ATOM 1261 C C . VAL A 1 155 ? 72.935 22.721 19.361 1.00 57.64 ? 155 VAL A C 1 +ATOM 1262 O O . VAL A 1 155 ? 72.455 23.827 19.055 1.00 58.07 ? 155 VAL A O 1 +ATOM 1263 C CB . VAL A 1 155 ? 74.059 22.113 21.627 1.00 54.25 ? 155 VAL A CB 1 +ATOM 1264 C CG1 . VAL A 1 155 ? 75.279 21.850 20.735 1.00 54.51 ? 155 VAL A CG1 1 +ATOM 1265 C CG2 . VAL A 1 155 ? 74.205 23.406 22.398 1.00 53.83 ? 155 VAL A CG2 1 +ATOM 1266 N N . ALA A 1 156 ? 73.608 21.968 18.488 1.00 57.44 ? 156 ALA A N 1 +ATOM 1267 C CA . ALA A 1 156 ? 73.832 22.404 17.117 1.00 57.53 ? 156 ALA A CA 1 +ATOM 1268 C C . ALA A 1 156 ? 72.550 23.025 16.606 1.00 58.08 ? 156 ALA A C 1 +ATOM 1269 O O . ALA A 1 156 ? 72.524 24.169 16.153 1.00 58.63 ? 156 ALA A O 1 +ATOM 1270 C CB . ALA A 1 156 ? 74.191 21.222 16.257 1.00 57.97 ? 156 ALA A CB 1 +ATOM 1271 N N . VAL A 1 157 ? 71.476 22.253 16.700 1.00 57.77 ? 157 VAL A N 1 +ATOM 1272 C CA . VAL A 1 157 ? 70.173 22.709 16.252 1.00 57.05 ? 157 VAL A CA 1 +ATOM 1273 C C . VAL A 1 157 ? 69.685 23.946 16.985 1.00 55.71 ? 157 VAL A C 1 +ATOM 1274 O O . VAL A 1 157 ? 69.193 24.878 16.362 1.00 54.54 ? 157 VAL A O 1 +ATOM 1275 C CB . VAL A 1 157 ? 69.131 21.585 16.383 1.00 57.21 ? 157 VAL A CB 1 +ATOM 1276 C CG1 . VAL A 1 157 ? 67.753 22.062 15.906 1.00 55.50 ? 157 VAL A CG1 1 +ATOM 1277 C CG2 . VAL A 1 157 ? 69.596 20.398 15.573 1.00 56.37 ? 157 VAL A CG2 1 +ATOM 1278 N N . MET A 1 158 ? 69.808 23.980 18.300 1.00 55.33 ? 158 MET A N 1 +ATOM 1279 C CA . MET A 1 158 ? 69.342 25.180 18.989 1.00 57.06 ? 158 MET A CA 1 +ATOM 1280 C C . MET A 1 158 ? 69.966 26.451 18.392 1.00 57.41 ? 158 MET A C 1 +ATOM 1281 O O . MET A 1 158 ? 69.245 27.417 18.074 1.00 56.87 ? 158 MET A O 1 +ATOM 1282 C CB . MET A 1 158 ? 69.615 25.071 20.485 1.00 56.13 ? 158 MET A CB 1 +ATOM 1283 C CG . MET A 1 158 ? 68.697 24.056 21.133 1.00 56.65 ? 158 MET A CG 1 +ATOM 1284 S SD . MET A 1 158 ? 69.148 23.580 22.791 1.00 56.37 ? 158 MET A SD 1 +ATOM 1285 C CE . MET A 1 158 ? 68.066 24.588 23.664 1.00 55.98 ? 158 MET A CE 1 +ATOM 1286 N N . LYS A 1 159 ? 71.293 26.432 18.217 1.00 57.17 ? 159 LYS A N 1 +ATOM 1287 C CA . LYS A 1 159 ? 72.014 27.561 17.632 1.00 56.22 ? 159 LYS A CA 1 +ATOM 1288 C C . LYS A 1 159 ? 71.498 27.771 16.222 1.00 56.31 ? 159 LYS A C 1 +ATOM 1289 O O . LYS A 1 159 ? 71.094 28.880 15.869 1.00 56.98 ? 159 LYS A O 1 +ATOM 1290 C CB . LYS A 1 159 ? 73.527 27.302 17.577 1.00 55.26 ? 159 LYS A CB 1 +ATOM 1291 C CG . LYS A 1 159 ? 74.338 28.462 17.020 0.0000 55.89 ? 159 LYS A CG 1 +ATOM 1292 C CD . LYS A 1 159 ? 75.834 28.180 17.080 0.0000 55.99 ? 159 LYS A CD 1 +ATOM 1293 C CE . LYS A 1 159 ? 76.314 28.014 18.515 0.0000 56.16 ? 159 LYS A CE 1 +ATOM 1294 N NZ . LYS A 1 159 ? 77.777 27.748 18.586 0.0000 56.23 ? 159 LYS A NZ 1 +ATOM 1295 N N . TRP A 1 160 ? 71.503 26.699 15.425 1.00 54.75 ? 160 TRP A N 1 +ATOM 1296 C CA . TRP A 1 160 ? 71.044 26.771 14.045 1.00 53.02 ? 160 TRP A CA 1 +ATOM 1297 C C . TRP A 1 160 ? 69.683 27.424 13.993 1.00 52.10 ? 160 TRP A C 1 +ATOM 1298 O O . TRP A 1 160 ? 69.400 28.229 13.123 1.00 50.94 ? 160 TRP A O 1 +ATOM 1299 C CB . TRP A 1 160 ? 70.985 25.368 13.444 1.00 54.07 ? 160 TRP A CB 1 +ATOM 1300 C CG . TRP A 1 160 ? 70.387 25.284 12.057 1.00 55.16 ? 160 TRP A CG 1 +ATOM 1301 C CD1 . TRP A 1 160 ? 70.654 26.092 10.985 1.00 54.97 ? 160 TRP A CD1 1 +ATOM 1302 C CD2 . TRP A 1 160 ? 69.386 24.351 11.616 1.00 55.34 ? 160 TRP A CD2 1 +ATOM 1303 N NE1 . TRP A 1 160 ? 69.874 25.726 9.908 1.00 54.81 ? 160 TRP A NE1 1 +ATOM 1304 C CE2 . TRP A 1 160 ? 69.090 24.658 10.270 1.00 55.74 ? 160 TRP A CE2 1 +ATOM 1305 C CE3 . TRP A 1 160 ? 68.705 23.286 12.231 1.00 53.21 ? 160 TRP A CE3 1 +ATOM 1306 C CZ2 . TRP A 1 160 ? 68.138 23.932 9.529 1.00 54.98 ? 160 TRP A CZ2 1 +ATOM 1307 C CZ3 . TRP A 1 160 ? 67.764 22.575 11.496 1.00 52.34 ? 160 TRP A CZ3 1 +ATOM 1308 C CH2 . TRP A 1 160 ? 67.490 22.899 10.163 1.00 52.79 ? 160 TRP A CH2 1 +ATOM 1309 N N . LEU A 1 161 ? 68.840 27.085 14.951 1.00 52.30 ? 161 LEU A N 1 +ATOM 1310 C CA . LEU A 1 161 ? 67.512 27.644 14.981 1.00 53.00 ? 161 LEU A CA 1 +ATOM 1311 C C . LEU A 1 161 ? 67.615 29.111 15.250 1.00 53.92 ? 161 LEU A C 1 +ATOM 1312 O O . LEU A 1 161 ? 66.650 29.853 15.067 1.00 55.13 ? 161 LEU A O 1 +ATOM 1313 C CB . LEU A 1 161 ? 66.672 26.985 16.063 1.00 52.81 ? 161 LEU A CB 1 +ATOM 1314 C CG . LEU A 1 161 ? 65.405 26.351 15.485 1.00 52.98 ? 161 LEU A CG 1 +ATOM 1315 C CD1 . LEU A 1 161 ? 65.812 25.213 14.536 1.00 52.61 ? 161 LEU A CD1 1 +ATOM 1316 C CD2 . LEU A 1 161 ? 64.503 25.844 16.605 1.00 51.96 ? 161 LEU A CD2 1 +ATOM 1317 N N . LYS A 1 162 ? 68.794 29.525 15.692 1.00 54.77 ? 162 LYS A N 1 +ATOM 1318 C CA . LYS A 1 162 ? 69.052 30.921 16.003 1.00 55.70 ? 162 LYS A CA 1 +ATOM 1319 C C . LYS A 1 162 ? 69.574 31.630 14.765 1.00 56.11 ? 162 LYS A C 1 +ATOM 1320 O O . LYS A 1 162 ? 69.332 32.814 14.563 1.00 56.73 ? 162 LYS A O 1 +ATOM 1321 C CB . LYS A 1 162 ? 70.082 31.026 17.123 1.00 56.25 ? 162 LYS A CB 1 +ATOM 1322 C CG . LYS A 1 162 ? 69.592 30.602 18.496 1.00 57.81 ? 162 LYS A CG 1 +ATOM 1323 C CD . LYS A 1 162 ? 70.721 30.732 19.537 1.00 59.63 ? 162 LYS A CD 1 +ATOM 1324 C CE . LYS A 1 162 ? 70.204 30.757 20.985 1.00 61.50 ? 162 LYS A CE 1 +ATOM 1325 N NZ . LYS A 1 162 ? 69.204 31.866 21.260 1.00 62.60 ? 162 LYS A NZ 1 +ATOM 1326 N N . THR A 1 163 ? 70.280 30.892 13.925 1.00 56.52 ? 163 THR A N 1 +ATOM 1327 C CA . THR A 1 163 ? 70.853 31.451 12.705 1.00 56.62 ? 163 THR A CA 1 +ATOM 1328 C C . THR A 1 163 ? 69.846 32.035 11.700 1.00 54.67 ? 163 THR A C 1 +ATOM 1329 O O . THR A 1 163 ? 70.210 32.857 10.877 1.00 54.67 ? 163 THR A O 1 +ATOM 1330 C CB . THR A 1 163 ? 71.700 30.388 11.973 1.00 59.13 ? 163 THR A CB 1 +ATOM 1331 O OG1 . THR A 1 163 ? 70.848 29.533 11.188 1.00 60.84 ? 163 THR A OG1 1 +ATOM 1332 C CG2 . THR A 1 163 ? 72.453 29.535 12.992 1.00 59.90 ? 163 THR A CG2 1 +ATOM 1333 N N . GLU A 1 164 ? 68.594 31.614 11.734 1.00 52.54 ? 164 GLU A N 1 +ATOM 1334 C CA . GLU A 1 164 ? 67.653 32.174 10.785 1.00 52.33 ? 164 GLU A CA 1 +ATOM 1335 C C . GLU A 1 164 ? 66.261 32.385 11.368 1.00 51.09 ? 164 GLU A C 1 +ATOM 1336 O O . GLU A 1 164 ? 65.878 31.794 12.380 1.00 51.45 ? 164 GLU A O 1 +ATOM 1337 C CB . GLU A 1 164 ? 67.557 31.287 9.539 1.00 53.84 ? 164 GLU A CB 1 +ATOM 1338 C CG . GLU A 1 164 ? 67.770 32.025 8.214 1.00 56.74 ? 164 GLU A CG 1 +ATOM 1339 C CD . GLU A 1 164 ? 69.041 31.546 7.470 1.00 60.08 ? 164 GLU A CD 1 +ATOM 1340 O OE1 . GLU A 1 164 ? 69.353 32.098 6.388 1.00 60.55 ? 164 GLU A OE1 1 +ATOM 1341 O OE2 . GLU A 1 164 ? 69.737 30.617 7.961 1.00 60.22 ? 164 GLU A OE2 1 +ATOM 1342 N N . THR A 1 165 ? 65.496 33.240 10.723 1.00 48.40 ? 165 THR A N 1 +ATOM 1343 C CA . THR A 1 165 ? 64.169 33.481 11.197 1.00 47.68 ? 165 THR A CA 1 +ATOM 1344 C C . THR A 1 165 ? 63.244 32.447 10.577 1.00 48.87 ? 165 THR A C 1 +ATOM 1345 O O . THR A 1 165 ? 62.434 32.754 9.682 1.00 51.24 ? 165 THR A O 1 +ATOM 1346 C CB . THR A 1 165 ? 63.734 34.866 10.820 1.00 47.65 ? 165 THR A CB 1 +ATOM 1347 O OG1 . THR A 1 165 ? 64.658 35.793 11.399 1.00 49.49 ? 165 THR A OG1 1 +ATOM 1348 C CG2 . THR A 1 165 ? 62.300 35.145 11.316 1.00 46.89 ? 165 THR A CG2 1 +ATOM 1349 N N . PHE A 1 166 ? 63.369 31.210 11.047 1.00 47.09 ? 166 PHE A N 1 +ATOM 1350 C CA . PHE A 1 166 ? 62.539 30.142 10.543 1.00 44.97 ? 166 PHE A CA 1 +ATOM 1351 C C . PHE A 1 166 ? 61.084 30.385 10.861 1.00 44.54 ? 166 PHE A C 1 +ATOM 1352 O O . PHE A 1 166 ? 60.726 30.652 12.000 1.00 44.65 ? 166 PHE A O 1 +ATOM 1353 C CB . PHE A 1 166 ? 63.005 28.842 11.135 1.00 45.70 ? 166 PHE A CB 1 +ATOM 1354 C CG . PHE A 1 166 ? 64.359 28.460 10.689 1.00 44.91 ? 166 PHE A CG 1 +ATOM 1355 C CD1 . PHE A 1 166 ? 65.415 28.458 11.575 1.00 44.68 ? 166 PHE A CD1 1 +ATOM 1356 C CD2 . PHE A 1 166 ? 64.574 28.087 9.367 1.00 44.63 ? 166 PHE A CD2 1 +ATOM 1357 C CE1 . PHE A 1 166 ? 66.673 28.080 11.153 1.00 46.59 ? 166 PHE A CE1 1 +ATOM 1358 C CE2 . PHE A 1 166 ? 65.809 27.711 8.935 1.00 44.98 ? 166 PHE A CE2 1 +ATOM 1359 C CZ . PHE A 1 166 ? 66.872 27.703 9.827 1.00 46.43 ? 166 PHE A CZ 1 +ATOM 1360 N N . VAL A 1 167 ? 60.250 30.301 9.833 1.00 44.85 ? 167 VAL A N 1 +ATOM 1361 C CA . VAL A 1 167 ? 58.829 30.545 9.970 1.00 44.27 ? 167 VAL A CA 1 +ATOM 1362 C C . VAL A 1 167 ? 58.031 29.297 10.128 1.00 44.16 ? 167 VAL A C 1 +ATOM 1363 O O . VAL A 1 167 ? 57.185 29.243 11.020 1.00 44.88 ? 167 VAL A O 1 +ATOM 1364 C CB . VAL A 1 167 ? 58.248 31.306 8.755 1.00 45.30 ? 167 VAL A CB 1 +ATOM 1365 C CG1 . VAL A 1 167 ? 56.689 31.211 8.750 1.00 43.95 ? 167 VAL A CG1 1 +ATOM 1366 C CG2 . VAL A 1 167 ? 58.688 32.788 8.810 1.00 45.59 ? 167 VAL A CG2 1 +ATOM 1367 N N . LEU A 1 168 ? 58.268 28.320 9.247 1.00 43.25 ? 168 LEU A N 1 +ATOM 1368 C CA . LEU A 1 168 ? 57.536 27.048 9.276 1.00 42.39 ? 168 LEU A CA 1 +ATOM 1369 C C . LEU A 1 168 ? 58.415 25.837 9.178 1.00 41.73 ? 168 LEU A C 1 +ATOM 1370 O O . LEU A 1 168 ? 59.319 25.782 8.336 1.00 41.92 ? 168 LEU A O 1 +ATOM 1371 C CB . LEU A 1 168 ? 56.508 26.988 8.161 1.00 43.82 ? 168 LEU A CB 1 +ATOM 1372 C CG . LEU A 1 168 ? 55.735 25.673 8.017 1.00 45.91 ? 168 LEU A CG 1 +ATOM 1373 C CD1 . LEU A 1 168 ? 55.206 25.165 9.360 1.00 46.79 ? 168 LEU A CD1 1 +ATOM 1374 C CD2 . LEU A 1 168 ? 54.586 25.918 7.041 1.00 46.71 ? 168 LEU A CD2 1 +ATOM 1375 N N . SER A 1 169 ? 58.126 24.849 10.021 1.00 40.70 ? 169 SER A N 1 +ATOM 1376 C CA . SER A 1 169 ? 58.939 23.637 10.066 1.00 41.49 ? 169 SER A CA 1 +ATOM 1377 C C . SER A 1 169 ? 58.159 22.312 10.143 1.00 43.19 ? 169 SER A C 1 +ATOM 1378 O O . SER A 1 169 ? 56.934 22.277 9.954 1.00 44.36 ? 169 SER A O 1 +ATOM 1379 C CB . SER A 1 169 ? 59.915 23.748 11.248 1.00 37.25 ? 169 SER A CB 1 +ATOM 1380 O OG . SER A 1 169 ? 60.757 22.622 11.324 1.00 33.30 ? 169 SER A OG 1 +ATOM 1381 N N . ALA A 1 170 ? 58.896 21.227 10.397 1.00 43.59 ? 170 ALA A N 1 +ATOM 1382 C CA . ALA A 1 170 ? 58.319 19.895 10.555 1.00 43.26 ? 170 ALA A CA 1 +ATOM 1383 C C . ALA A 1 170 ? 59.429 18.852 10.588 1.00 44.06 ? 170 ALA A C 1 +ATOM 1384 O O . ALA A 1 170 ? 60.151 18.694 9.593 1.00 45.50 ? 170 ALA A O 1 +ATOM 1385 C CB . ALA A 1 170 ? 57.376 19.608 9.437 1.00 42.36 ? 170 ALA A CB 1 +ATOM 1386 N N . ASN A 1 171 ? 59.578 18.154 11.722 1.00 43.08 ? 171 ASN A N 1 +ATOM 1387 C CA . ASN A 1 171 ? 60.621 17.130 11.865 1.00 43.62 ? 171 ASN A CA 1 +ATOM 1388 C C . ASN A 1 171 ? 60.026 15.735 11.622 1.00 43.64 ? 171 ASN A C 1 +ATOM 1389 O O . ASN A 1 171 ? 59.080 15.326 12.281 1.00 44.62 ? 171 ASN A O 1 +ATOM 1390 C CB . ASN A 1 171 ? 61.306 17.237 13.243 1.00 43.80 ? 171 ASN A CB 1 +ATOM 1391 C CG . ASN A 1 171 ? 60.489 16.623 14.357 1.00 46.25 ? 171 ASN A CG 1 +ATOM 1392 O OD1 . ASN A 1 171 ? 60.394 15.398 14.468 1.00 46.60 ? 171 ASN A OD1 1 +ATOM 1393 N ND2 . ASN A 1 171 ? 59.886 17.468 15.193 1.00 46.32 ? 171 ASN A ND2 1 +ATOM 1394 N N . LEU A 1 172 ? 60.593 15.013 10.656 1.00 43.79 ? 172 LEU A N 1 +ATOM 1395 C CA . LEU A 1 172 ? 60.083 13.711 10.246 1.00 42.24 ? 172 LEU A CA 1 +ATOM 1396 C C . LEU A 1 172 ? 60.448 12.514 11.107 1.00 43.92 ? 172 LEU A C 1 +ATOM 1397 O O . LEU A 1 172 ? 61.589 12.408 11.588 1.00 45.28 ? 172 LEU A O 1 +ATOM 1398 C CB . LEU A 1 172 ? 60.476 13.467 8.791 1.00 39.22 ? 172 LEU A CB 1 +ATOM 1399 C CG . LEU A 1 172 ? 60.186 14.631 7.822 1.00 37.01 ? 172 LEU A CG 1 +ATOM 1400 C CD1 . LEU A 1 172 ? 60.207 14.096 6.415 1.00 37.55 ? 172 LEU A CD1 1 +ATOM 1401 C CD2 . LEU A 1 172 ? 58.859 15.256 8.069 1.00 35.13 ? 172 LEU A CD2 1 +ATOM 1402 N N . HIS A 1 173 ? 59.459 11.622 11.286 1.00 44.18 ? 173 HIS A N 1 +ATOM 1403 C CA . HIS A 1 173 ? 59.567 10.395 12.100 1.00 44.75 ? 173 HIS A CA 1 +ATOM 1404 C C . HIS A 1 173 ? 58.903 9.175 11.473 1.00 44.54 ? 173 HIS A C 1 +ATOM 1405 O O . HIS A 1 173 ? 58.088 9.295 10.560 1.00 45.37 ? 173 HIS A O 1 +ATOM 1406 C CB . HIS A 1 173 ? 58.883 10.584 13.463 1.00 45.49 ? 173 HIS A CB 1 +ATOM 1407 C CG . HIS A 1 173 ? 59.651 11.425 14.432 1.00 45.82 ? 173 HIS A CG 1 +ATOM 1408 N ND1 . HIS A 1 173 ? 60.629 10.910 15.254 1.00 46.04 ? 173 HIS A ND1 1 +ATOM 1409 C CD2 . HIS A 1 173 ? 59.578 12.748 14.716 1.00 45.40 ? 173 HIS A CD2 1 +ATOM 1410 C CE1 . HIS A 1 173 ? 61.124 11.880 16.004 1.00 47.69 ? 173 HIS A CE1 1 +ATOM 1411 N NE2 . HIS A 1 173 ? 60.502 13.006 15.696 1.00 46.67 ? 173 HIS A NE2 1 +ATOM 1412 N N . GLY A 1 174 ? 59.228 8.007 12.021 1.00 43.71 ? 174 GLY A N 1 +ATOM 1413 C CA . GLY A 1 174 ? 58.632 6.756 11.579 1.00 43.90 ? 174 GLY A CA 1 +ATOM 1414 C C . GLY A 1 174 ? 58.243 5.910 12.794 1.00 44.65 ? 174 GLY A C 1 +ATOM 1415 O O . GLY A 1 174 ? 58.843 6.035 13.866 1.00 45.64 ? 174 GLY A O 1 +ATOM 1416 N N . GLY A 1 175 ? 57.252 5.040 12.642 1.00 43.91 ? 175 GLY A N 1 +ATOM 1417 C CA . GLY A 1 175 ? 56.818 4.205 13.756 1.00 43.96 ? 175 GLY A CA 1 +ATOM 1418 C C . GLY A 1 175 ? 55.302 4.245 13.936 1.00 43.92 ? 175 GLY A C 1 +ATOM 1419 O O . GLY A 1 175 ? 54.685 3.462 14.677 1.00 43.27 ? 175 GLY A O 1 +ATOM 1420 N N . ALA A 1 176 ? 54.708 5.198 13.243 1.00 42.87 ? 176 ALA A N 1 +ATOM 1421 C CA . ALA A 1 176 ? 53.288 5.389 13.264 1.00 43.05 ? 176 ALA A CA 1 +ATOM 1422 C C . ALA A 1 176 ? 53.093 6.116 11.960 1.00 43.77 ? 176 ALA A C 1 +ATOM 1423 O O . ALA A 1 176 ? 54.060 6.472 11.293 1.00 44.52 ? 176 ALA A O 1 +ATOM 1424 C CB . ALA A 1 176 ? 52.881 6.264 14.432 1.00 42.69 ? 176 ALA A CB 1 +ATOM 1425 N N . LEU A 1 177 ? 51.845 6.343 11.600 1.00 43.33 ? 177 LEU A N 1 +ATOM 1426 C CA . LEU A 1 177 ? 51.532 7.011 10.370 1.00 41.87 ? 177 LEU A CA 1 +ATOM 1427 C C . LEU A 1 177 ? 50.487 8.059 10.741 1.00 43.26 ? 177 LEU A C 1 +ATOM 1428 O O . LEU A 1 177 ? 49.284 7.818 10.645 1.00 44.50 ? 177 LEU A O 1 +ATOM 1429 C CB . LEU A 1 177 ? 50.979 5.981 9.403 1.00 40.73 ? 177 LEU A CB 1 +ATOM 1430 C CG . LEU A 1 177 ? 50.816 6.422 7.969 1.00 41.97 ? 177 LEU A CG 1 +ATOM 1431 C CD1 . LEU A 1 177 ? 52.188 6.679 7.375 1.00 42.56 ? 177 LEU A CD1 1 +ATOM 1432 C CD2 . LEU A 1 177 ? 50.089 5.355 7.196 1.00 41.53 ? 177 LEU A CD2 1 +ATOM 1433 N N . VAL A 1 178 ? 50.953 9.220 11.198 1.00 43.61 ? 178 VAL A N 1 +ATOM 1434 C CA . VAL A 1 178 ? 50.066 10.318 11.595 1.00 41.30 ? 178 VAL A CA 1 +ATOM 1435 C C . VAL A 1 178 ? 50.883 11.610 11.647 1.00 41.21 ? 178 VAL A C 1 +ATOM 1436 O O . VAL A 1 178 ? 52.119 11.580 11.697 1.00 41.01 ? 178 VAL A O 1 +ATOM 1437 C CB . VAL A 1 178 ? 49.477 10.065 12.986 1.00 40.03 ? 178 VAL A CB 1 +ATOM 1438 C CG1 . VAL A 1 178 ? 50.610 9.904 13.972 1.00 39.71 ? 178 VAL A CG1 1 +ATOM 1439 C CG2 . VAL A 1 178 ? 48.578 11.212 13.415 1.00 37.48 ? 178 VAL A CG2 1 +ATOM 1440 N N . ALA A 1 179 ? 50.182 12.737 11.638 1.00 39.66 ? 179 ALA A N 1 +ATOM 1441 C CA . ALA A 1 179 ? 50.800 14.043 11.693 1.00 38.29 ? 179 ALA A CA 1 +ATOM 1442 C C . ALA A 1 179 ? 50.436 14.647 13.024 1.00 38.60 ? 179 ALA A C 1 +ATOM 1443 O O . ALA A 1 179 ? 49.300 15.068 13.201 1.00 37.98 ? 179 ALA A O 1 +ATOM 1444 C CB . ALA A 1 179 ? 50.260 14.900 10.595 1.00 38.53 ? 179 ALA A CB 1 +ATOM 1445 N N . SER A 1 180 ? 51.401 14.737 13.936 1.00 39.43 ? 180 SER A N 1 +ATOM 1446 C CA . SER A 1 180 ? 51.146 15.263 15.278 1.00 42.52 ? 180 SER A CA 1 +ATOM 1447 C C . SER A 1 180 ? 51.470 16.751 15.476 1.00 45.02 ? 180 SER A C 1 +ATOM 1448 O O . SER A 1 180 ? 52.595 17.170 15.205 1.00 46.70 ? 180 SER A O 1 +ATOM 1449 C CB . SER A 1 180 ? 51.947 14.437 16.274 1.00 41.95 ? 180 SER A CB 1 +ATOM 1450 O OG . SER A 1 180 ? 51.433 14.569 17.573 1.00 42.67 ? 180 SER A OG 1 +ATOM 1451 N N . TYR A 1 181 ? 50.512 17.553 15.955 1.00 45.40 ? 181 TYR A N 1 +ATOM 1452 C CA . TYR A 1 181 ? 50.794 18.982 16.161 1.00 46.55 ? 181 TYR A CA 1 +ATOM 1453 C C . TYR A 1 181 ? 50.931 19.278 17.662 1.00 48.14 ? 181 TYR A C 1 +ATOM 1454 O O . TYR A 1 181 ? 50.575 18.433 18.468 1.00 50.22 ? 181 TYR A O 1 +ATOM 1455 C CB . TYR A 1 181 ? 49.720 19.857 15.492 1.00 45.66 ? 181 TYR A CB 1 +ATOM 1456 C CG . TYR A 1 181 ? 48.309 19.700 15.998 1.00 46.35 ? 181 TYR A CG 1 +ATOM 1457 C CD1 . TYR A 1 181 ? 47.468 18.682 15.527 1.00 47.40 ? 181 TYR A CD1 1 +ATOM 1458 C CD2 . TYR A 1 181 ? 47.785 20.619 16.903 1.00 46.45 ? 181 TYR A CD2 1 +ATOM 1459 C CE1 . TYR A 1 181 ? 46.105 18.601 15.953 1.00 47.51 ? 181 TYR A CE1 1 +ATOM 1460 C CE2 . TYR A 1 181 ? 46.452 20.554 17.333 1.00 47.54 ? 181 TYR A CE2 1 +ATOM 1461 C CZ . TYR A 1 181 ? 45.602 19.554 16.857 1.00 47.66 ? 181 TYR A CZ 1 +ATOM 1462 O OH . TYR A 1 181 ? 44.265 19.580 17.252 1.00 42.99 ? 181 TYR A OH 1 +ATOM 1463 N N . PRO A 1 182 ? 51.442 20.463 18.058 1.00 64.03 ? 182 PRO A N 1 +ATOM 1464 C CA . PRO A 1 182 ? 51.616 20.790 19.476 1.00 64.03 ? 182 PRO A CA 1 +ATOM 1465 C C . PRO A 1 182 ? 50.432 21.078 20.357 1.00 64.03 ? 182 PRO A C 1 +ATOM 1466 O O . PRO A 1 182 ? 49.358 21.339 19.862 1.00 64.03 ? 182 PRO A O 1 +ATOM 1467 C CB . PRO A 1 182 ? 52.531 21.987 19.405 1.00 64.03 ? 182 PRO A CB 1 +ATOM 1468 C CG . PRO A 1 182 ? 53.407 21.630 18.400 1.00 64.03 ? 182 PRO A CG 1 +ATOM 1469 C CD . PRO A 1 182 ? 52.472 21.182 17.302 1.00 64.03 ? 182 PRO A CD 1 +ATOM 1470 N N . PHE A 1 183 ? 50.644 21.147 21.671 1.00 64.03 ? 183 PHE A N 1 +ATOM 1471 C CA . PHE A 1 183 ? 51.946 20.965 22.296 1.00 64.03 ? 183 PHE A CA 1 +ATOM 1472 C C . PHE A 1 183 ? 52.114 19.482 22.572 1.00 64.03 ? 183 PHE A C 1 +ATOM 1473 O O . PHE A 1 183 ? 51.140 18.747 22.672 1.00 64.03 ? 183 PHE A O 1 +ATOM 1474 C CB . PHE A 1 183 ? 52.034 21.746 23.615 1.00 64.03 ? 183 PHE A CB 1 +ATOM 1475 C CG . PHE A 1 183 ? 52.008 23.252 23.476 1.00 64.03 ? 183 PHE A CG 1 +ATOM 1476 C CD1 . PHE A 1 183 ? 50.837 23.966 23.669 1.00 64.03 ? 183 PHE A CD1 1 +ATOM 1477 C CD2 . PHE A 1 183 ? 53.169 23.960 23.244 1.00 64.03 ? 183 PHE A CD2 1 +ATOM 1478 C CE1 . PHE A 1 183 ? 50.834 25.334 23.643 1.00 64.03 ? 183 PHE A CE1 1 +ATOM 1479 C CE2 . PHE A 1 183 ? 53.180 25.322 23.215 1.00 64.03 ? 183 PHE A CE2 1 +ATOM 1480 C CZ . PHE A 1 183 ? 52.012 26.017 23.416 1.00 64.03 ? 183 PHE A CZ 1 +ATOM 1481 N N . ASP A 1 184 ? 53.347 19.011 22.648 1.00 65.10 ? 184 ASP A N 1 +ATOM 1482 C CA . ASP A 1 184 ? 53.558 17.601 22.913 1.00 64.43 ? 184 ASP A CA 1 +ATOM 1483 C C . ASP A 1 184 ? 53.536 17.381 24.404 1.00 63.11 ? 184 ASP A C 1 +ATOM 1484 O O . ASP A 1 184 ? 53.494 16.253 24.871 1.00 63.46 ? 184 ASP A O 1 +ATOM 1485 C CB . ASP A 1 184 ? 54.893 17.150 22.324 1.00 65.82 ? 184 ASP A CB 1 +ATOM 1486 C CG . ASP A 1 184 ? 54.892 17.171 20.810 1.00 66.08 ? 184 ASP A CG 1 +ATOM 1487 O OD1 . ASP A 1 184 ? 55.988 16.996 20.228 1.00 67.63 ? 184 ASP A OD1 1 +ATOM 1488 O OD2 . ASP A 1 184 ? 53.802 17.355 20.213 1.00 63.85 ? 184 ASP A OD2 1 +ATOM 1489 N N . ASN A 1 185 ? 53.568 18.476 25.147 1.00 61.96 ? 185 ASN A N 1 +ATOM 1490 C CA . ASN A 1 185 ? 53.541 18.419 26.595 1.00 61.74 ? 185 ASN A CA 1 +ATOM 1491 C C . ASN A 1 185 ? 52.500 19.424 27.038 1.00 61.49 ? 185 ASN A C 1 +ATOM 1492 O O . ASN A 1 185 ? 52.137 20.311 26.283 1.00 60.37 ? 185 ASN A O 1 +ATOM 1493 C CB . ASN A 1 185 ? 54.912 18.790 27.152 1.00 62.52 ? 185 ASN A CB 1 +ATOM 1494 C CG . ASN A 1 185 ? 55.055 18.474 28.630 1.00 62.34 ? 185 ASN A CG 1 +ATOM 1495 O OD1 . ASN A 1 185 ? 56.123 18.672 29.233 1.00 60.71 ? 185 ASN A OD1 1 +ATOM 1496 N ND2 . ASN A 1 185 ? 53.978 17.979 29.225 1.00 63.89 ? 185 ASN A ND2 1 +ATOM 1497 N N . GLY A 1 186 ? 52.013 19.300 28.263 1.00 62.92 ? 186 GLY A N 1 +ATOM 1498 C CA . GLY A 1 186 ? 51.002 20.241 28.716 1.00 64.18 ? 186 GLY A CA 1 +ATOM 1499 C C . GLY A 1 186 ? 50.868 20.494 30.204 1.00 64.13 ? 186 GLY A C 1 +ATOM 1500 O O . GLY A 1 186 ? 51.632 19.990 31.025 1.00 64.39 ? 186 GLY A O 1 +ATOM 1501 N N . VAL A 1 187 ? 49.864 21.287 30.537 1.00 64.18 ? 187 VAL A N 1 +ATOM 1502 C CA . VAL A 1 187 ? 49.591 21.663 31.906 1.00 65.48 ? 187 VAL A CA 1 +ATOM 1503 C C . VAL A 1 187 ? 48.098 21.894 31.980 1.00 66.11 ? 187 VAL A C 1 +ATOM 1504 O O . VAL A 1 187 ? 47.477 22.200 30.959 1.00 65.16 ? 187 VAL A O 1 +ATOM 1505 C CB . VAL A 1 187 ? 50.318 22.978 32.262 1.00 65.65 ? 187 VAL A CB 1 +ATOM 1506 C CG1 . VAL A 1 187 ? 49.768 23.562 33.571 1.00 68.24 ? 187 VAL A CG1 1 +ATOM 1507 C CG2 . VAL A 1 187 ? 51.803 22.714 32.389 1.00 65.52 ? 187 VAL A CG2 1 +ATOM 1508 N N . GLN A 1 188 ? 47.526 21.750 33.181 1.00 66.53 ? 188 GLN A N 1 +ATOM 1509 C CA . GLN A 1 188 ? 46.086 21.951 33.386 1.00 66.08 ? 188 GLN A CA 1 +ATOM 1510 C C . GLN A 1 188 ? 45.575 23.226 32.669 1.00 64.75 ? 188 GLN A C 1 +ATOM 1511 O O . GLN A 1 188 ? 44.480 23.219 32.082 1.00 63.14 ? 188 GLN A O 1 +ATOM 1512 C CB . GLN A 1 188 ? 45.789 22.093 34.875 1.00 99.99 ? 188 GLN A CB 1 +ATOM 1513 C CG . GLN A 1 188 ? 44.338 21.709 35.144 0.0000 99.99 ? 188 GLN A CG 1 +ATOM 1514 C CD . GLN A 1 188 ? 43.407 22.890 34.914 0.0000 99.99 ? 188 GLN A CD 1 +ATOM 1515 O OE1 . GLN A 1 188 ? 43.855 23.978 34.557 0.0000 99.99 ? 188 GLN A OE1 1 +ATOM 1516 N NE2 . GLN A 1 188 ? 42.105 22.674 35.119 0.0000 99.99 ? 188 GLN A NE2 1 +ATOM 1517 N N . ALA A 1 189 ? 46.388 24.291 32.706 1.00 62.38 ? 189 ALA A N 1 +ATOM 1518 C CA . ALA A 1 189 ? 46.062 25.571 32.083 1.00 60.25 ? 189 ALA A CA 1 +ATOM 1519 C C . ALA A 1 189 ? 45.838 25.412 30.598 1.00 59.86 ? 189 ALA A C 1 +ATOM 1520 O O . ALA A 1 189 ? 45.108 26.179 29.986 1.00 59.00 ? 189 ALA A O 1 +ATOM 1521 C CB . ALA A 1 189 ? 47.171 26.566 32.328 1.00 58.76 ? 189 ALA A CB 1 +ATOM 1522 N N . THR A 1 190 ? 46.484 24.407 30.023 1.00 60.89 ? 190 THR A N 1 +ATOM 1523 C CA . THR A 1 190 ? 46.368 24.115 28.599 1.00 61.41 ? 190 THR A CA 1 +ATOM 1524 C C . THR A 1 190 ? 45.354 22.988 28.421 1.00 62.68 ? 190 THR A C 1 +ATOM 1525 O O . THR A 1 190 ? 44.965 22.665 27.296 1.00 62.55 ? 190 THR A O 1 +ATOM 1526 C CB . THR A 1 190 ? 47.718 23.643 28.003 1.00 61.15 ? 190 THR A CB 1 +ATOM 1527 O OG1 . THR A 1 190 ? 48.725 24.647 28.179 1.00 59.59 ? 190 THR A OG1 1 +ATOM 1528 C CG2 . THR A 1 190 ? 47.569 23.387 26.542 1.00 62.16 ? 190 THR A CG2 1 +ATOM 1529 N N . GLY A 1 191 ? 44.957 22.379 29.545 1.00 64.33 ? 191 GLY A N 1 +ATOM 1530 C CA . GLY A 1 191 ? 43.977 21.294 29.541 1.00 64.30 ? 191 GLY A CA 1 +ATOM 1531 C C . GLY A 1 191 ? 44.518 19.876 29.520 1.00 63.31 ? 191 GLY A C 1 +ATOM 1532 O O . GLY A 1 191 ? 44.037 19.035 28.757 1.00 61.36 ? 191 GLY A O 1 +ATOM 1533 N N . ALA A 1 192 ? 45.504 19.601 30.368 1.00 63.55 ? 192 ALA A N 1 +ATOM 1534 C CA . ALA A 1 192 ? 46.100 18.274 30.412 1.00 64.87 ? 192 ALA A CA 1 +ATOM 1535 C C . ALA A 1 192 ? 45.096 17.265 30.900 1.00 66.11 ? 192 ALA A C 1 +ATOM 1536 O O . ALA A 1 192 ? 45.204 16.077 30.593 1.00 66.84 ? 192 ALA A O 1 +ATOM 1537 C CB . ALA A 1 192 ? 47.301 18.261 31.309 1.00 64.49 ? 192 ALA A CB 1 +ATOM 1538 N N . LEU A 1 193 ? 44.110 17.745 31.654 1.00 67.05 ? 193 LEU A N 1 +ATOM 1539 C CA . LEU A 1 193 ? 43.075 16.874 32.202 1.00 67.38 ? 193 LEU A CA 1 +ATOM 1540 C C . LEU A 1 193 ? 42.042 16.418 31.157 1.00 68.06 ? 193 LEU A C 1 +ATOM 1541 O O . LEU A 1 193 ? 41.210 15.540 31.421 1.00 68.11 ? 193 LEU A O 1 +ATOM 1542 C CB . LEU A 1 193 ? 42.388 17.558 33.398 1.00 66.75 ? 193 LEU A CB 1 +ATOM 1543 C CG . LEU A 1 193 ? 43.217 17.713 34.685 1.00 65.53 ? 193 LEU A CG 1 +ATOM 1544 C CD1 . LEU A 1 193 ? 43.973 16.414 34.985 1.00 64.99 ? 193 LEU A CD1 1 +ATOM 1545 C CD2 . LEU A 1 193 ? 44.198 18.860 34.538 1.00 65.61 ? 193 LEU A CD2 1 +ATOM 1546 N N . TYR A 1 194 ? 42.088 17.019 29.971 1.00 68.56 ? 194 TYR A N 1 +ATOM 1547 C CA . TYR A 1 194 ? 41.182 16.614 28.906 1.00 67.93 ? 194 TYR A CA 1 +ATOM 1548 C C . TYR A 1 194 ? 41.994 15.812 27.930 1.00 67.42 ? 194 TYR A C 1 +ATOM 1549 O O . TYR A 1 194 ? 41.508 15.356 26.888 1.00 66.77 ? 194 TYR A O 1 +ATOM 1550 C CB . TYR A 1 194 ? 40.569 17.822 28.233 1.00 68.16 ? 194 TYR A CB 1 +ATOM 1551 C CG . TYR A 1 194 ? 39.515 18.426 29.101 1.00 68.96 ? 194 TYR A CG 1 +ATOM 1552 C CD1 . TYR A 1 194 ? 39.842 19.410 30.038 1.00 69.09 ? 194 TYR A CD1 1 +ATOM 1553 C CD2 . TYR A 1 194 ? 38.196 17.955 29.050 1.00 68.42 ? 194 TYR A CD2 1 +ATOM 1554 C CE1 . TYR A 1 194 ? 38.882 19.916 30.914 1.00 69.79 ? 194 TYR A CE1 1 +ATOM 1555 C CE2 . TYR A 1 194 ? 37.229 18.446 29.917 1.00 70.26 ? 194 TYR A CE2 1 +ATOM 1556 C CZ . TYR A 1 194 ? 37.580 19.429 30.857 1.00 70.23 ? 194 TYR A CZ 1 +ATOM 1557 O OH . TYR A 1 194 ? 36.645 19.884 31.768 1.00 70.41 ? 194 TYR A OH 1 +ATOM 1558 N N . SER A 1 195 ? 43.252 15.630 28.310 1.00 67.00 ? 195 SER A N 1 +ATOM 1559 C CA . SER A 1 195 ? 44.170 14.878 27.503 1.00 66.73 ? 195 SER A CA 1 +ATOM 1560 C C . SER A 1 195 ? 44.333 15.676 26.219 1.00 66.27 ? 195 SER A C 1 +ATOM 1561 O O . SER A 1 195 ? 44.244 15.149 25.113 1.00 66.59 ? 195 SER A O 1 +ATOM 1562 C CB . SER A 1 195 ? 43.588 13.486 27.241 1.00 66.66 ? 195 SER A CB 1 +ATOM 1563 O OG . SER A 1 195 ? 43.341 12.823 28.473 1.00 66.56 ? 195 SER A OG 1 +ATOM 1564 N N . ARG A 1 196 ? 44.555 16.970 26.386 1.00 64.81 ? 196 ARG A N 1 +ATOM 1565 C CA . ARG A 1 196 ? 44.746 17.841 25.252 1.00 63.85 ? 196 ARG A CA 1 +ATOM 1566 C C . ARG A 1 196 ? 45.527 19.045 25.735 1.00 63.75 ? 196 ARG A C 1 +ATOM 1567 O O . ARG A 1 196 ? 45.241 19.595 26.805 1.00 63.74 ? 196 ARG A O 1 +ATOM 1568 C CB . ARG A 1 196 ? 43.396 18.285 24.679 1.00 63.75 ? 196 ARG A CB 1 +ATOM 1569 C CG . ARG A 1 196 ? 42.884 19.615 25.205 1.00 63.92 ? 196 ARG A CG 1 +ATOM 1570 C CD . ARG A 1 196 ? 41.523 19.985 24.614 1.00 66.01 ? 196 ARG A CD 1 +ATOM 1571 N NE . ARG A 1 196 ? 40.403 19.249 25.209 1.00 66.69 ? 196 ARG A NE 1 +ATOM 1572 C CZ . ARG A 1 196 ? 39.130 19.434 24.877 0.0000 66.65 ? 196 ARG A CZ 1 +ATOM 1573 N NH1 . ARG A 1 196 ? 38.807 20.330 23.954 0.0000 66.75 ? 196 ARG A NH1 1 +ATOM 1574 N NH2 . ARG A 1 196 ? 38.178 18.725 25.468 0.0000 66.75 ? 196 ARG A NH2 1 +ATOM 1575 N N . SER A 1 197 ? 46.534 19.428 24.954 1.00 62.57 ? 197 SER A N 1 +ATOM 1576 C CA . SER A 1 197 ? 47.364 20.589 25.257 1.00 60.01 ? 197 SER A CA 1 +ATOM 1577 C C . SER A 1 197 ? 47.299 21.482 24.029 1.00 57.74 ? 197 SER A C 1 +ATOM 1578 O O . SER A 1 197 ? 47.930 21.217 23.016 1.00 56.15 ? 197 SER A O 1 +ATOM 1579 C CB . SER A 1 197 ? 48.816 20.169 25.545 1.00 60.87 ? 197 SER A CB 1 +ATOM 1580 O OG . SER A 1 197 ? 49.596 21.255 26.046 1.00 59.52 ? 197 SER A OG 1 +ATOM 1581 N N . LEU A 1 198 ? 46.525 22.548 24.128 1.00 56.57 ? 198 LEU A N 1 +ATOM 1582 C CA . LEU A 1 198 ? 46.373 23.442 23.000 1.00 56.17 ? 198 LEU A CA 1 +ATOM 1583 C C . LEU A 1 198 ? 47.247 24.714 22.975 1.00 55.68 ? 198 LEU A C 1 +ATOM 1584 O O . LEU A 1 198 ? 47.616 25.261 24.021 1.00 53.69 ? 198 LEU A O 1 +ATOM 1585 C CB . LEU A 1 198 ? 44.881 23.772 22.847 1.00 53.85 ? 198 LEU A CB 1 +ATOM 1586 C CG . LEU A 1 198 ? 44.077 22.484 22.621 1.00 51.85 ? 198 LEU A CG 1 +ATOM 1587 C CD1 . LEU A 1 198 ? 42.690 22.792 22.116 1.00 50.04 ? 198 LEU A CD1 1 +ATOM 1588 C CD2 . LEU A 1 198 ? 44.799 21.616 21.613 1.00 50.72 ? 198 LEU A CD2 1 +ATOM 1589 N N . THR A 1 199 ? 47.596 25.138 21.751 1.00 55.34 ? 199 THR A N 1 +ATOM 1590 C CA . THR A 1 199 ? 48.415 26.335 21.507 1.00 54.18 ? 199 THR A CA 1 +ATOM 1591 C C . THR A 1 199 ? 47.529 27.526 21.209 1.00 53.26 ? 199 THR A C 1 +ATOM 1592 O O . THR A 1 199 ? 46.332 27.365 20.967 1.00 52.52 ? 199 THR A O 1 +ATOM 1593 C CB . THR A 1 199 ? 49.333 26.190 20.285 1.00 52.71 ? 199 THR A CB 1 +ATOM 1594 O OG1 . THR A 1 199 ? 48.601 25.609 19.205 1.00 53.71 ? 199 THR A OG1 1 +ATOM 1595 C CG2 . THR A 1 199 ? 50.484 25.338 20.592 1.00 52.29 ? 199 THR A CG2 1 +ATOM 1596 N N . PRO A 1 200 ? 48.108 28.740 21.246 1.00 52.60 ? 200 PRO A N 1 +ATOM 1597 C CA . PRO A 1 200 ? 47.355 29.955 20.965 1.00 51.68 ? 200 PRO A CA 1 +ATOM 1598 C C . PRO A 1 200 ? 46.821 29.848 19.552 1.00 50.91 ? 200 PRO A C 1 +ATOM 1599 O O . PRO A 1 200 ? 45.738 30.372 19.233 1.00 50.05 ? 200 PRO A O 1 +ATOM 1600 C CB . PRO A 1 200 ? 48.408 31.041 21.122 1.00 51.54 ? 200 PRO A CB 1 +ATOM 1601 C CG . PRO A 1 200 ? 49.211 30.524 22.266 1.00 50.36 ? 200 PRO A CG 1 +ATOM 1602 C CD . PRO A 1 200 ? 49.405 29.082 21.862 1.00 52.81 ? 200 PRO A CD 1 +ATOM 1603 N N . ASP A 1 201 ? 47.577 29.127 18.724 1.00 49.67 ? 201 ASP A N 1 +ATOM 1604 C CA . ASP A 1 201 ? 47.217 28.925 17.319 1.00 50.45 ? 201 ASP A CA 1 +ATOM 1605 C C . ASP A 1 201 ? 46.860 27.457 17.025 1.00 50.30 ? 201 ASP A C 1 +ATOM 1606 O O . ASP A 1 201 ? 47.422 26.835 16.130 1.00 51.96 ? 201 ASP A O 1 +ATOM 1607 C CB . ASP A 1 201 ? 48.388 29.365 16.442 1.00 49.48 ? 201 ASP A CB 1 +ATOM 1608 C CG . ASP A 1 201 ? 49.014 30.632 16.936 1.00 49.98 ? 201 ASP A CG 1 +ATOM 1609 O OD1 . ASP A 1 201 ? 48.294 31.637 16.949 1.00 50.80 ? 201 ASP A OD1 1 +ATOM 1610 O OD2 . ASP A 1 201 ? 50.201 30.632 17.325 1.00 49.28 ? 201 ASP A OD2 1 +ATOM 1611 N N . ASP A 1 202 ? 45.914 26.898 17.760 1.00 49.09 ? 202 ASP A N 1 +ATOM 1612 C CA . ASP A 1 202 ? 45.561 25.503 17.549 1.00 48.05 ? 202 ASP A CA 1 +ATOM 1613 C C . ASP A 1 202 ? 44.904 25.323 16.179 1.00 47.27 ? 202 ASP A C 1 +ATOM 1614 O O . ASP A 1 202 ? 44.965 24.245 15.570 1.00 46.68 ? 202 ASP A O 1 +ATOM 1615 C CB . ASP A 1 202 ? 44.631 25.039 18.677 1.00 48.09 ? 202 ASP A CB 1 +ATOM 1616 C CG . ASP A 1 202 ? 44.423 23.548 18.685 1.00 47.90 ? 202 ASP A CG 1 +ATOM 1617 O OD1 . ASP A 1 202 ? 43.298 23.094 18.364 1.00 46.69 ? 202 ASP A OD1 1 +ATOM 1618 O OD2 . ASP A 1 202 ? 45.396 22.840 19.015 1.00 47.73 ? 202 ASP A OD2 1 +ATOM 1619 N N . ASP A 1 203 ? 44.284 26.386 15.690 1.00 45.19 ? 203 ASP A N 1 +ATOM 1620 C CA . ASP A 1 203 ? 43.631 26.311 14.404 1.00 44.38 ? 203 ASP A CA 1 +ATOM 1621 C C . ASP A 1 203 ? 44.635 26.213 13.257 1.00 43.46 ? 203 ASP A C 1 +ATOM 1622 O O . ASP A 1 203 ? 44.480 25.377 12.344 1.00 42.50 ? 203 ASP A O 1 +ATOM 1623 C CB . ASP A 1 203 ? 42.741 27.526 14.199 1.00 46.72 ? 203 ASP A CB 1 +ATOM 1624 C CG . ASP A 1 203 ? 43.497 28.818 14.307 1.00 48.13 ? 203 ASP A CG 1 +ATOM 1625 O OD1 . ASP A 1 203 ? 42.983 29.847 13.815 1.00 48.16 ? 203 ASP A OD1 1 +ATOM 1626 O OD2 . ASP A 1 203 ? 44.596 28.801 14.900 1.00 50.44 ? 203 ASP A OD2 1 +ATOM 1627 N N . VAL A 1 204 ? 45.654 27.068 13.271 1.00 40.99 ? 204 VAL A N 1 +ATOM 1628 C CA . VAL A 1 204 ? 46.618 26.979 12.210 1.00 39.93 ? 204 VAL A CA 1 +ATOM 1629 C C . VAL A 1 204 ? 47.324 25.642 12.364 1.00 40.23 ? 204 VAL A C 1 +ATOM 1630 O O . VAL A 1 204 ? 47.507 24.950 11.372 1.00 42.37 ? 204 VAL A O 1 +ATOM 1631 C CB . VAL A 1 204 ? 47.635 28.106 12.215 1.00 38.10 ? 204 VAL A CB 1 +ATOM 1632 C CG1 . VAL A 1 204 ? 48.380 28.095 13.480 1.00 41.56 ? 204 VAL A CG1 1 +ATOM 1633 C CG2 . VAL A 1 204 ? 48.623 27.898 11.102 1.00 37.76 ? 204 VAL A CG2 1 +ATOM 1634 N N . PHE A 1 205 ? 47.696 25.232 13.575 1.00 39.37 ? 205 PHE A N 1 +ATOM 1635 C CA . PHE A 1 205 ? 48.368 23.922 13.693 1.00 40.77 ? 205 PHE A CA 1 +ATOM 1636 C C . PHE A 1 205 ? 47.466 22.792 13.187 1.00 41.64 ? 205 PHE A C 1 +ATOM 1637 O O . PHE A 1 205 ? 47.919 21.885 12.484 1.00 41.27 ? 205 PHE A O 1 +ATOM 1638 C CB . PHE A 1 205 ? 48.825 23.621 15.128 1.00 39.08 ? 205 PHE A CB 1 +ATOM 1639 C CG . PHE A 1 205 ? 50.171 24.212 15.479 1.00 38.58 ? 205 PHE A CG 1 +ATOM 1640 C CD1 . PHE A 1 205 ? 51.337 23.746 14.864 1.00 38.67 ? 205 PHE A CD1 1 +ATOM 1641 C CD2 . PHE A 1 205 ? 50.278 25.242 16.436 1.00 37.71 ? 205 PHE A CD2 1 +ATOM 1642 C CE1 . PHE A 1 205 ? 52.602 24.295 15.201 1.00 38.05 ? 205 PHE A CE1 1 +ATOM 1643 C CE2 . PHE A 1 205 ? 51.528 25.794 16.775 1.00 35.78 ? 205 PHE A CE2 1 +ATOM 1644 C CZ . PHE A 1 205 ? 52.684 25.319 16.160 1.00 36.68 ? 205 PHE A CZ 1 +ATOM 1645 N N . GLN A 1 206 ? 46.188 22.832 13.534 1.00 42.39 ? 206 GLN A N 1 +ATOM 1646 C CA . GLN A 1 206 ? 45.306 21.804 13.024 1.00 43.78 ? 206 GLN A CA 1 +ATOM 1647 C C . GLN A 1 206 ? 45.275 21.875 11.491 1.00 44.53 ? 206 GLN A C 1 +ATOM 1648 O O . GLN A 1 206 ? 45.489 20.871 10.813 1.00 45.19 ? 206 GLN A O 1 +ATOM 1649 C CB . GLN A 1 206 ? 43.898 21.972 13.564 1.00 44.03 ? 206 GLN A CB 1 +ATOM 1650 C CG . GLN A 1 206 ? 43.705 21.520 14.975 1.00 45.23 ? 206 GLN A CG 1 +ATOM 1651 C CD . GLN A 1 206 ? 42.250 21.262 15.263 1.00 46.45 ? 206 GLN A CD 1 +ATOM 1652 O OE1 . GLN A 1 206 ? 41.593 20.537 14.518 1.00 47.52 ? 206 GLN A OE1 1 +ATOM 1653 N NE2 . GLN A 1 206 ? 41.732 21.852 16.338 1.00 46.38 ? 206 GLN A NE2 1 +ATOM 1654 N N . TYR A 1 207 ? 45.014 23.053 10.934 1.00 44.31 ? 207 TYR A N 1 +ATOM 1655 C CA . TYR A 1 207 ? 44.988 23.164 9.481 1.00 45.01 ? 207 TYR A CA 1 +ATOM 1656 C C . TYR A 1 207 ? 46.288 22.606 8.868 1.00 44.50 ? 207 TYR A C 1 +ATOM 1657 O O . TYR A 1 207 ? 46.262 21.922 7.854 1.00 43.03 ? 207 TYR A O 1 +ATOM 1658 C CB . TYR A 1 207 ? 44.754 24.629 9.086 1.00 45.85 ? 207 TYR A CB 1 +ATOM 1659 C CG . TYR A 1 207 ? 45.097 24.981 7.651 1.00 46.53 ? 207 TYR A CG 1 +ATOM 1660 C CD1 . TYR A 1 207 ? 46.441 25.099 7.244 1.00 48.27 ? 207 TYR A CD1 1 +ATOM 1661 C CD2 . TYR A 1 207 ? 44.103 25.202 6.707 1.00 44.09 ? 207 TYR A CD2 1 +ATOM 1662 C CE1 . TYR A 1 207 ? 46.783 25.420 5.946 1.00 47.34 ? 207 TYR A CE1 1 +ATOM 1663 C CE2 . TYR A 1 207 ? 44.433 25.532 5.396 1.00 46.29 ? 207 TYR A CE2 1 +ATOM 1664 C CZ . TYR A 1 207 ? 45.778 25.634 5.021 1.00 48.70 ? 207 TYR A CZ 1 +ATOM 1665 O OH . TYR A 1 207 ? 46.135 25.918 3.711 1.00 52.41 ? 207 TYR A OH 1 +ATOM 1666 N N . LEU A 1 208 ? 47.417 22.887 9.509 1.00 45.25 ? 208 LEU A N 1 +ATOM 1667 C CA . LEU A 1 208 ? 48.716 22.418 9.042 1.00 47.20 ? 208 LEU A CA 1 +ATOM 1668 C C . LEU A 1 208 ? 48.886 20.884 9.052 1.00 48.20 ? 208 LEU A C 1 +ATOM 1669 O O . LEU A 1 208 ? 49.489 20.314 8.140 1.00 48.37 ? 208 LEU A O 1 +ATOM 1670 C CB . LEU A 1 208 ? 49.841 23.043 9.885 1.00 47.66 ? 208 LEU A CB 1 +ATOM 1671 C CG . LEU A 1 208 ? 50.139 24.539 9.776 1.00 47.85 ? 208 LEU A CG 1 +ATOM 1672 C CD1 . LEU A 1 208 ? 51.491 24.852 10.400 1.00 46.72 ? 208 LEU A CD1 1 +ATOM 1673 C CD2 . LEU A 1 208 ? 50.153 24.928 8.316 1.00 48.63 ? 208 LEU A CD2 1 +ATOM 1674 N N . ALA A 1 209 ? 48.386 20.221 10.091 1.00 48.07 ? 209 ALA A N 1 +ATOM 1675 C CA . ALA A 1 209 ? 48.507 18.775 10.176 1.00 48.47 ? 209 ALA A CA 1 +ATOM 1676 C C . ALA A 1 209 ? 47.657 18.175 9.072 1.00 49.33 ? 209 ALA A C 1 +ATOM 1677 O O . ALA A 1 209 ? 48.077 17.272 8.344 1.00 48.85 ? 209 ALA A O 1 +ATOM 1678 C CB . ALA A 1 209 ? 48.013 18.300 11.519 1.00 48.86 ? 209 ALA A CB 1 +ATOM 1679 N N . HIS A 1 210 ? 46.444 18.695 8.959 1.00 50.32 ? 210 HIS A N 1 +ATOM 1680 C CA . HIS A 1 210 ? 45.517 18.226 7.960 1.00 50.91 ? 210 HIS A CA 1 +ATOM 1681 C C . HIS A 1 210 ? 46.059 18.492 6.588 1.00 49.67 ? 210 HIS A C 1 +ATOM 1682 O O . HIS A 1 210 ? 45.854 17.700 5.684 1.00 50.47 ? 210 HIS A O 1 +ATOM 1683 C CB . HIS A 1 210 ? 44.168 18.911 8.116 1.00 54.47 ? 210 HIS A CB 1 +ATOM 1684 C CG . HIS A 1 210 ? 43.284 18.266 9.137 1.00 59.69 ? 210 HIS A CG 1 +ATOM 1685 N ND1 . HIS A 1 210 ? 42.770 16.996 8.978 1.00 62.06 ? 210 HIS A ND1 1 +ATOM 1686 C CD2 . HIS A 1 210 ? 42.829 18.710 10.335 1.00 61.87 ? 210 HIS A CD2 1 +ATOM 1687 C CE1 . HIS A 1 210 ? 42.035 16.687 10.034 1.00 63.88 ? 210 HIS A CE1 1 +ATOM 1688 N NE2 . HIS A 1 210 ? 42.055 17.710 10.873 1.00 63.32 ? 210 HIS A NE2 1 +ATOM 1689 N N . THR A 1 211 ? 46.755 19.601 6.413 1.00 47.66 ? 211 THR A N 1 +ATOM 1690 C CA . THR A 1 211 ? 47.275 19.878 5.091 1.00 47.20 ? 211 THR A CA 1 +ATOM 1691 C C . THR A 1 211 ? 48.084 18.695 4.622 1.00 45.81 ? 211 THR A C 1 +ATOM 1692 O O . THR A 1 211 ? 47.804 18.107 3.572 1.00 44.26 ? 211 THR A O 1 +ATOM 1693 C CB . THR A 1 211 ? 48.177 21.137 5.066 1.00 48.84 ? 211 THR A CB 1 +ATOM 1694 O OG1 . THR A 1 211 ? 47.367 22.309 5.229 1.00 51.52 ? 211 THR A OG1 1 +ATOM 1695 C CG2 . THR A 1 211 ? 48.937 21.245 3.737 1.00 48.02 ? 211 THR A CG2 1 +ATOM 1696 N N . TYR A 1 212 ? 49.071 18.331 5.432 1.00 44.89 ? 212 TYR A N 1 +ATOM 1697 C CA . TYR A 1 212 ? 49.964 17.249 5.087 1.00 44.47 ? 212 TYR A CA 1 +ATOM 1698 C C . TYR A 1 212 ? 49.313 15.905 4.950 1.00 45.77 ? 212 TYR A C 1 +ATOM 1699 O O . TYR A 1 212 ? 49.488 15.239 3.930 1.00 46.20 ? 212 TYR A O 1 +ATOM 1700 C CB . TYR A 1 212 ? 51.103 17.147 6.087 1.00 42.61 ? 212 TYR A CB 1 +ATOM 1701 C CG . TYR A 1 212 ? 52.161 16.180 5.638 1.00 41.68 ? 212 TYR A CG 1 +ATOM 1702 C CD1 . TYR A 1 212 ? 51.939 14.818 5.686 1.00 40.97 ? 212 TYR A CD1 1 +ATOM 1703 C CD2 . TYR A 1 212 ? 53.366 16.631 5.111 1.00 41.94 ? 212 TYR A CD2 1 +ATOM 1704 C CE1 . TYR A 1 212 ? 52.875 13.932 5.224 1.00 40.88 ? 212 TYR A CE1 1 +ATOM 1705 C CE2 . TYR A 1 212 ? 54.315 15.741 4.640 1.00 41.37 ? 212 TYR A CE2 1 +ATOM 1706 C CZ . TYR A 1 212 ? 54.056 14.393 4.702 1.00 40.57 ? 212 TYR A CZ 1 +ATOM 1707 O OH . TYR A 1 212 ? 54.960 13.488 4.222 1.00 39.95 ? 212 TYR A OH 1 +ATOM 1708 N N . ALA A 1 213 ? 48.570 15.498 5.972 1.00 46.93 ? 213 ALA A N 1 +ATOM 1709 C CA . ALA A 1 213 ? 47.916 14.192 5.949 1.00 47.85 ? 213 ALA A CA 1 +ATOM 1710 C C . ALA A 1 213 ? 46.836 14.050 4.886 1.00 48.10 ? 213 ALA A C 1 +ATOM 1711 O O . ALA A 1 213 ? 46.723 13.004 4.261 1.00 48.98 ? 213 ALA A O 1 +ATOM 1712 C CB . ALA A 1 213 ? 47.336 13.876 7.312 1.00 47.97 ? 213 ALA A CB 1 +ATOM 1713 N N . SER A 1 214 ? 46.041 15.091 4.672 1.00 48.41 ? 214 SER A N 1 +ATOM 1714 C CA . SER A 1 214 ? 44.978 15.015 3.676 1.00 48.51 ? 214 SER A CA 1 +ATOM 1715 C C . SER A 1 214 ? 45.557 14.518 2.361 1.00 47.17 ? 214 SER A C 1 +ATOM 1716 O O . SER A 1 214 ? 44.877 13.836 1.607 1.00 46.65 ? 214 SER A O 1 +ATOM 1717 C CB . SER A 1 214 ? 44.325 16.387 3.467 1.00 49.45 ? 214 SER A CB 1 +ATOM 1718 O OG . SER A 1 214 ? 45.120 17.225 2.651 1.00 52.55 ? 214 SER A OG 1 +ATOM 1719 N N . ARG A 1 215 ? 46.821 14.854 2.117 1.00 46.00 ? 215 ARG A N 1 +ATOM 1720 C CA . ARG A 1 215 ? 47.530 14.459 0.912 1.00 45.97 ? 215 ARG A CA 1 +ATOM 1721 C C . ARG A 1 215 ? 48.290 13.146 0.966 1.00 45.92 ? 215 ARG A C 1 +ATOM 1722 O O . ARG A 1 215 ? 48.985 12.794 0.009 1.00 45.89 ? 215 ARG A O 1 +ATOM 1723 C CB . ARG A 1 215 ? 48.525 15.520 0.523 1.00 48.56 ? 215 ARG A CB 1 +ATOM 1724 C CG . ARG A 1 215 ? 47.993 16.517 -0.446 1.00 51.28 ? 215 ARG A CG 1 +ATOM 1725 C CD . ARG A 1 215 ? 47.222 17.602 0.228 1.00 49.97 ? 215 ARG A CD 1 +ATOM 1726 N NE . ARG A 1 215 ? 46.980 18.624 -0.760 1.00 50.51 ? 215 ARG A NE 1 +ATOM 1727 C CZ . ARG A 1 215 ? 46.419 19.790 -0.500 1.00 53.78 ? 215 ARG A CZ 1 +ATOM 1728 N NH1 . ARG A 1 215 ? 46.041 20.081 0.748 1.00 55.17 ? 215 ARG A NH1 1 +ATOM 1729 N NH2 . ARG A 1 215 ? 46.239 20.660 -1.494 1.00 53.62 ? 215 ARG A NH2 1 +ATOM 1730 N N . ASN A 1 216 ? 48.201 12.435 2.082 1.00 44.79 ? 216 ASN A N 1 +ATOM 1731 C CA . ASN A 1 216 ? 48.877 11.162 2.196 1.00 43.66 ? 216 ASN A CA 1 +ATOM 1732 C C . ASN A 1 216 ? 47.784 10.113 2.238 1.00 44.88 ? 216 ASN A C 1 +ATOM 1733 O O . ASN A 1 216 ? 47.093 9.943 3.239 1.00 43.69 ? 216 ASN A O 1 +ATOM 1734 C CB . ASN A 1 216 ? 49.724 11.108 3.464 1.00 43.02 ? 216 ASN A CB 1 +ATOM 1735 C CG . ASN A 1 216 ? 50.653 9.911 3.486 1.00 42.08 ? 216 ASN A CG 1 +ATOM 1736 O OD1 . ASN A 1 216 ? 50.280 8.820 2.999 1.00 42.77 ? 216 ASN A OD1 1 +ATOM 1737 N ND2 . ASN A 1 216 ? 51.858 10.088 4.052 1.00 36.57 ? 216 ASN A ND2 1 +ATOM 1738 N N . PRO A 1 217 ? 47.609 9.394 1.127 1.00 47.12 ? 217 PRO A N 1 +ATOM 1739 C CA . PRO A 1 217 ? 46.599 8.348 0.979 1.00 47.97 ? 217 PRO A CA 1 +ATOM 1740 C C . PRO A 1 217 ? 46.488 7.440 2.183 1.00 48.43 ? 217 PRO A C 1 +ATOM 1741 O O . PRO A 1 217 ? 45.390 7.134 2.636 1.00 47.04 ? 217 PRO A O 1 +ATOM 1742 C CB . PRO A 1 217 ? 47.067 7.595 -0.256 1.00 47.48 ? 217 PRO A CB 1 +ATOM 1743 C CG . PRO A 1 217 ? 47.686 8.646 -1.065 1.00 48.01 ? 217 PRO A CG 1 +ATOM 1744 C CD . PRO A 1 217 ? 48.504 9.402 -0.040 1.00 48.05 ? 217 PRO A CD 1 +ATOM 1745 N N . ASN A 1 218 ? 47.628 7.024 2.713 1.00 50.14 ? 218 ASN A N 1 +ATOM 1746 C CA . ASN A 1 218 ? 47.593 6.120 3.839 1.00 52.71 ? 218 ASN A CA 1 +ATOM 1747 C C . ASN A 1 218 ? 47.484 6.833 5.161 1.00 52.85 ? 218 ASN A C 1 +ATOM 1748 O O . ASN A 1 218 ? 46.788 6.384 6.059 1.00 53.68 ? 218 ASN A O 1 +ATOM 1749 C CB . ASN A 1 218 ? 48.824 5.231 3.808 1.00 55.95 ? 218 ASN A CB 1 +ATOM 1750 C CG . ASN A 1 218 ? 48.914 4.394 2.519 1.00 60.44 ? 218 ASN A CG 1 +ATOM 1751 O OD1 . ASN A 1 218 ? 50.018 4.084 2.048 1.00 62.36 ? 218 ASN A OD1 1 +ATOM 1752 N ND2 . ASN A 1 218 ? 47.751 4.014 1.951 1.00 60.91 ? 218 ASN A ND2 1 +ATOM 1753 N N . MET A 1 219 ? 48.155 7.963 5.280 1.00 53.83 ? 219 MET A N 1 +ATOM 1754 C CA . MET A 1 219 ? 48.128 8.704 6.521 1.00 53.75 ? 219 MET A CA 1 +ATOM 1755 C C . MET A 1 219 ? 46.719 9.143 6.743 1.00 55.09 ? 219 MET A C 1 +ATOM 1756 O O . MET A 1 219 ? 46.281 9.306 7.874 1.00 55.63 ? 219 MET A O 1 +ATOM 1757 C CB . MET A 1 219 ? 49.049 9.910 6.436 1.00 53.01 ? 219 MET A CB 1 +ATOM 1758 C CG . MET A 1 219 ? 49.138 10.701 7.709 1.00 54.67 ? 219 MET A CG 1 +ATOM 1759 S SD . MET A 1 219 ? 50.496 11.878 7.716 1.00 55.27 ? 219 MET A SD 1 +ATOM 1760 C CE . MET A 1 219 ? 51.874 10.818 8.187 1.00 53.02 ? 219 MET A CE 1 +ATOM 1761 N N . LYS A 1 220 ? 45.996 9.307 5.644 1.00 57.66 ? 220 LYS A N 1 +ATOM 1762 C CA . LYS A 1 220 ? 44.606 9.752 5.688 1.00 59.93 ? 220 LYS A CA 1 +ATOM 1763 C C . LYS A 1 220 ? 43.649 8.641 6.101 1.00 61.76 ? 220 LYS A C 1 +ATOM 1764 O O . LYS A 1 220 ? 42.575 8.926 6.630 1.00 60.72 ? 220 LYS A O 1 +ATOM 1765 C CB . LYS A 1 220 ? 44.216 10.305 4.323 1.00 59.98 ? 220 LYS A CB 1 +ATOM 1766 C CG . LYS A 1 220 ? 42.777 10.725 4.195 1.00 61.37 ? 220 LYS A CG 1 +ATOM 1767 C CD . LYS A 1 220 ? 42.534 11.326 2.816 1.00 63.72 ? 220 LYS A CD 1 +ATOM 1768 C CE . LYS A 1 220 ? 42.917 10.357 1.682 1.00 64.84 ? 220 LYS A CE 1 +ATOM 1769 N NZ . LYS A 1 220 ? 43.117 11.035 0.344 1.00 66.84 ? 220 LYS A NZ 1 +ATOM 1770 N N . LYS A 1 221 ? 44.056 7.387 5.853 1.00 64.88 ? 221 LYS A N 1 +ATOM 1771 C CA . LYS A 1 221 ? 43.273 6.184 6.190 1.00 67.71 ? 221 LYS A CA 1 +ATOM 1772 C C . LYS A 1 221 ? 42.912 6.127 7.663 1.00 68.62 ? 221 LYS A C 1 +ATOM 1773 O O . LYS A 1 221 ? 41.837 5.659 8.030 1.00 68.92 ? 221 LYS A O 1 +ATOM 1774 C CB . LYS A 1 221 ? 44.043 4.895 5.861 1.00 69.09 ? 221 LYS A CB 1 +ATOM 1775 C CG . LYS A 1 221 ? 44.061 4.468 4.384 1.00 71.06 ? 221 LYS A CG 1 +ATOM 1776 C CD . LYS A 1 221 ? 44.861 3.149 4.203 1.00 72.15 ? 221 LYS A CD 1 +ATOM 1777 C CE . LYS A 1 221 ? 46.211 3.177 4.972 1.00 72.31 ? 221 LYS A CE 1 +ATOM 1778 N NZ . LYS A 1 221 ? 47.027 1.919 4.921 1.00 71.19 ? 221 LYS A NZ 1 +ATOM 1779 N N . GLY A 1 222 ? 43.823 6.577 8.511 1.00 69.47 ? 222 GLY A N 1 +ATOM 1780 C CA . GLY A 1 222 ? 43.537 6.557 9.925 1.00 70.72 ? 222 GLY A CA 1 +ATOM 1781 C C . GLY A 1 222 ? 43.658 5.165 10.516 1.00 71.79 ? 222 GLY A C 1 +ATOM 1782 O O . GLY A 1 222 ? 44.279 5.003 11.563 1.00 72.78 ? 222 GLY A O 1 +ATOM 1783 N N . ASP A 1 223 ? 43.049 4.167 9.875 1.00 71.94 ? 223 ASP A N 1 +ATOM 1784 C CA . ASP A 1 223 ? 43.125 2.776 10.341 1.00 71.50 ? 223 ASP A CA 1 +ATOM 1785 C C . ASP A 1 223 ? 44.203 2.196 9.449 1.00 70.95 ? 223 ASP A C 1 +ATOM 1786 O O . ASP A 1 223 ? 43.901 1.642 8.385 1.00 71.72 ? 223 ASP A O 1 +ATOM 1787 C CB . ASP A 1 223 ? 41.774 2.093 10.157 1.00 99.99 ? 223 ASP A CB 1 +ATOM 1788 C CG . ASP A 1 223 ? 40.782 2.640 11.181 0.0000 99.99 ? 223 ASP A CG 1 +ATOM 1789 O OD1 . ASP A 1 223 ? 41.116 2.580 12.395 0.0000 99.99 ? 223 ASP A OD1 1 +ATOM 1790 O OD2 . ASP A 1 223 ? 39.701 3.114 10.740 0.0000 99.99 ? 223 ASP A OD2 1 +ATOM 1791 N N . GLU A 1 224 ? 45.458 2.334 9.873 1.00 69.24 ? 224 GLU A N 1 +ATOM 1792 C CA . GLU A 1 224 ? 46.570 1.886 9.051 1.00 68.50 ? 224 GLU A CA 1 +ATOM 1793 C C . GLU A 1 224 ? 47.676 1.056 9.703 1.00 67.63 ? 224 GLU A C 1 +ATOM 1794 O O . GLU A 1 224 ? 48.103 0.047 9.119 1.00 68.83 ? 224 GLU A O 1 +ATOM 1795 C CB . GLU A 1 224 ? 47.295 3.090 8.459 1.00 99.99 ? 224 GLU A CB 1 +ATOM 1796 C CG . GLU A 1 224 ? 47.797 2.747 7.077 0.0000 99.99 ? 224 GLU A CG 1 +ATOM 1797 C CD . GLU A 1 224 ? 48.854 1.650 7.178 0.0000 99.99 ? 224 GLU A CD 1 +ATOM 1798 O OE1 . GLU A 1 224 ? 48.456 0.457 7.121 0.0000 99.99 ? 224 GLU A OE1 1 +ATOM 1799 O OE2 . GLU A 1 224 ? 50.054 2.016 7.313 0.0000 99.99 ? 224 GLU A OE2 1 +ATOM 1800 N N . CYS A 1 225 ? 48.157 1.455 10.883 1.00 65.19 ? 225 CYS A N 1 +ATOM 1801 C CA . CYS A 1 225 ? 49.235 0.697 11.534 1.00 62.33 ? 225 CYS A CA 1 +ATOM 1802 C C . CYS A 1 225 ? 48.746 -0.400 12.456 1.00 61.91 ? 225 CYS A C 1 +ATOM 1803 O O . CYS A 1 225 ? 47.930 -0.167 13.343 1.00 61.05 ? 225 CYS A O 1 +ATOM 1804 C CB . CYS A 1 225 ? 50.176 1.626 12.298 1.00 59.80 ? 225 CYS A CB 1 +ATOM 1805 S SG . CYS A 1 225 ? 51.022 2.853 11.249 1.00 55.28 ? 225 CYS A SG 1 +ATOM 1806 N N . LYS A 1 226 ? 49.268 -1.602 12.238 1.00 62.63 ? 226 LYS A N 1 +ATOM 1807 C CA . LYS A 1 226 ? 48.876 -2.772 13.016 1.00 63.53 ? 226 LYS A CA 1 +ATOM 1808 C C . LYS A 1 226 ? 49.235 -2.705 14.486 1.00 63.45 ? 226 LYS A C 1 +ATOM 1809 O O . LYS A 1 226 ? 48.419 -2.294 15.320 1.00 64.23 ? 226 LYS A O 1 +ATOM 1810 C CB . LYS A 1 226 ? 49.475 -4.046 12.404 1.00 63.79 ? 226 LYS A CB 1 +ATOM 1811 C CG . LYS A 1 226 ? 48.714 -4.558 11.186 1.00 64.43 ? 226 LYS A CG 1 +ATOM 1812 C CD . LYS A 1 226 ? 49.630 -5.300 10.220 1.00 65.63 ? 226 LYS A CD 1 +ATOM 1813 C CE . LYS A 1 226 ? 50.647 -4.365 9.586 0.0000 65.44 ? 226 LYS A CE 1 +ATOM 1814 N NZ . LYS A 1 226 ? 49.988 -3.285 8.801 0.0000 65.64 ? 226 LYS A NZ 1 +ATOM 1815 N N . ASN A 1 227 ? 50.453 -3.109 14.812 1.00 62.16 ? 227 ASN A N 1 +ATOM 1816 C CA . ASN A 1 227 ? 50.864 -3.115 16.197 1.00 61.70 ? 227 ASN A CA 1 +ATOM 1817 C C . ASN A 1 227 ? 50.807 -1.716 16.849 1.00 61.90 ? 227 ASN A C 1 +ATOM 1818 O O . ASN A 1 227 ? 51.173 -1.535 18.011 1.00 63.82 ? 227 ASN A O 1 +ATOM 1819 C CB . ASN A 1 227 ? 52.250 -3.759 16.301 1.00 59.12 ? 227 ASN A CB 1 +ATOM 1820 C CG . ASN A 1 227 ? 52.261 -5.174 15.764 0.0000 60.05 ? 227 ASN A CG 1 +ATOM 1821 O OD1 . ASN A 1 227 ? 52.378 -5.394 14.559 0.0000 59.78 ? 227 ASN A OD1 1 +ATOM 1822 N ND2 . ASN A 1 227 ? 52.109 -6.143 16.655 0.0000 59.78 ? 227 ASN A ND2 1 +ATOM 1823 N N . LYS A 1 228 ? 50.300 -0.730 16.125 1.00 60.48 ? 228 LYS A N 1 +ATOM 1824 C CA . LYS A 1 228 ? 50.233 0.616 16.680 1.00 59.17 ? 228 LYS A CA 1 +ATOM 1825 C C . LYS A 1 228 ? 48.834 1.206 16.833 1.00 58.74 ? 228 LYS A C 1 +ATOM 1826 O O . LYS A 1 228 ? 47.851 0.663 16.340 1.00 58.81 ? 228 LYS A O 1 +ATOM 1827 C CB . LYS A 1 228 ? 51.050 1.575 15.812 1.00 57.73 ? 228 LYS A CB 1 +ATOM 1828 C CG . LYS A 1 228 ? 52.500 1.685 16.169 1.00 56.01 ? 228 LYS A CG 1 +ATOM 1829 C CD . LYS A 1 228 ? 53.307 0.595 15.535 1.00 55.27 ? 228 LYS A CD 1 +ATOM 1830 C CE . LYS A 1 228 ? 54.711 0.654 16.067 1.00 53.95 ? 228 LYS A CE 1 +ATOM 1831 N NZ . LYS A 1 228 ? 54.655 0.502 17.553 1.00 53.46 ? 228 LYS A NZ 1 +ATOM 1832 N N . MET A 1 229 ? 48.763 2.336 17.525 1.00 57.79 ? 229 MET A N 1 +ATOM 1833 C CA . MET A 1 229 ? 47.513 3.047 17.685 1.00 57.60 ? 229 MET A CA 1 +ATOM 1834 C C . MET A 1 229 ? 47.292 3.823 16.404 1.00 59.64 ? 229 MET A C 1 +ATOM 1835 O O . MET A 1 229 ? 48.249 4.146 15.688 1.00 60.22 ? 229 MET A O 1 +ATOM 1836 C CB . MET A 1 229 ? 47.591 4.057 18.812 1.00 56.77 ? 229 MET A CB 1 +ATOM 1837 C CG . MET A 1 229 ? 46.458 5.048 18.737 1.00 54.63 ? 229 MET A CG 1 +ATOM 1838 S SD . MET A 1 229 ? 46.172 5.858 20.254 1.00 52.44 ? 229 MET A SD 1 +ATOM 1839 C CE . MET A 1 229 ? 44.877 7.054 19.772 1.00 50.44 ? 229 MET A CE 1 +ATOM 1840 N N . ASN A 1 230 ? 46.038 4.149 16.120 1.00 60.75 ? 230 ASN A N 1 +ATOM 1841 C CA . ASN A 1 230 ? 45.733 4.895 14.911 1.00 62.04 ? 230 ASN A CA 1 +ATOM 1842 C C . ASN A 1 230 ? 44.848 6.111 15.177 1.00 61.85 ? 230 ASN A C 1 +ATOM 1843 O O . ASN A 1 230 ? 44.194 6.197 16.219 1.00 62.15 ? 230 ASN A O 1 +ATOM 1844 C CB . ASN A 1 230 ? 45.138 3.949 13.861 1.00 63.35 ? 230 ASN A CB 1 +ATOM 1845 C CG . ASN A 1 230 ? 46.207 3.068 13.207 1.00 65.01 ? 230 ASN A CG 1 +ATOM 1846 O OD1 . ASN A 1 230 ? 46.827 2.233 13.868 1.00 66.71 ? 230 ASN A OD1 1 +ATOM 1847 N ND2 . ASN A 1 230 ? 46.437 3.266 11.913 1.00 65.48 ? 230 ASN A ND2 1 +ATOM 1848 N N . PHE A 1 231 ? 44.841 7.055 14.238 1.00 60.51 ? 231 PHE A N 1 +ATOM 1849 C CA . PHE A 1 231 ? 44.090 8.288 14.414 1.00 59.56 ? 231 PHE A CA 1 +ATOM 1850 C C . PHE A 1 231 ? 43.140 8.524 13.251 1.00 60.65 ? 231 PHE A C 1 +ATOM 1851 O O . PHE A 1 231 ? 43.291 7.917 12.201 1.00 61.66 ? 231 PHE A O 1 +ATOM 1852 C CB . PHE A 1 231 ? 45.096 9.427 14.544 1.00 56.71 ? 231 PHE A CB 1 +ATOM 1853 C CG . PHE A 1 231 ? 46.301 9.057 15.360 1.00 53.53 ? 231 PHE A CG 1 +ATOM 1854 C CD1 . PHE A 1 231 ? 46.357 9.337 16.713 1.00 52.18 ? 231 PHE A CD1 1 +ATOM 1855 C CD2 . PHE A 1 231 ? 47.345 8.340 14.786 1.00 52.53 ? 231 PHE A CD2 1 +ATOM 1856 C CE1 . PHE A 1 231 ? 47.430 8.903 17.480 1.00 52.13 ? 231 PHE A CE1 1 +ATOM 1857 C CE2 . PHE A 1 231 ? 48.419 7.903 15.549 1.00 51.02 ? 231 PHE A CE2 1 +ATOM 1858 C CZ . PHE A 1 231 ? 48.462 8.182 16.896 1.00 51.05 ? 231 PHE A CZ 1 +ATOM 1859 N N . PRO A 1 232 ? 42.147 9.413 13.421 1.00 61.45 ? 232 PRO A N 1 +ATOM 1860 C CA . PRO A 1 232 ? 41.169 9.719 12.371 1.00 61.69 ? 232 PRO A CA 1 +ATOM 1861 C C . PRO A 1 232 ? 41.643 10.873 11.483 1.00 61.62 ? 232 PRO A C 1 +ATOM 1862 O O . PRO A 1 232 ? 41.941 11.960 11.965 1.00 62.64 ? 232 PRO A O 1 +ATOM 1863 C CB . PRO A 1 232 ? 39.946 10.095 13.173 1.00 62.22 ? 232 PRO A CB 1 +ATOM 1864 C CG . PRO A 1 232 ? 40.577 10.946 14.276 1.00 62.88 ? 232 PRO A CG 1 +ATOM 1865 C CD . PRO A 1 232 ? 41.851 10.177 14.650 1.00 62.05 ? 232 PRO A CD 1 +ATOM 1866 N N . ASN A 1 233 ? 41.700 10.641 10.183 1.00 61.37 ? 233 ASN A N 1 +ATOM 1867 C CA . ASN A 1 233 ? 42.159 11.668 9.258 1.00 61.43 ? 233 ASN A CA 1 +ATOM 1868 C C . ASN A 1 233 ? 43.655 11.793 9.362 1.00 60.13 ? 233 ASN A C 1 +ATOM 1869 O O . ASN A 1 233 ? 44.274 12.612 8.673 1.00 60.68 ? 233 ASN A O 1 +ATOM 1870 C CB . ASN A 1 233 ? 41.523 13.011 9.568 1.00 63.62 ? 233 ASN A CB 1 +ATOM 1871 C CG . ASN A 1 233 ? 40.029 12.951 9.501 1.00 66.00 ? 233 ASN A CG 1 +ATOM 1872 O OD1 . ASN A 1 233 ? 39.458 12.427 8.531 1.00 65.98 ? 233 ASN A OD1 1 +ATOM 1873 N ND2 . ASN A 1 233 ? 39.373 13.482 10.530 1.00 66.71 ? 233 ASN A ND2 1 +ATOM 1874 N N . GLY A 1 234 ? 44.225 10.979 10.241 1.00 57.56 ? 234 GLY A N 1 +ATOM 1875 C CA . GLY A 1 234 ? 45.658 10.967 10.421 1.00 54.89 ? 234 GLY A CA 1 +ATOM 1876 C C . GLY A 1 234 ? 46.254 12.148 11.147 1.00 52.74 ? 234 GLY A C 1 +ATOM 1877 O O . GLY A 1 234 ? 47.451 12.384 11.041 1.00 53.73 ? 234 GLY A O 1 +ATOM 1878 N N . VAL A 1 235 ? 45.449 12.902 11.872 1.00 49.70 ? 235 VAL A N 1 +ATOM 1879 C CA . VAL A 1 235 ? 46.007 14.019 12.580 1.00 49.33 ? 235 VAL A CA 1 +ATOM 1880 C C . VAL A 1 235 ? 45.624 13.867 14.023 1.00 50.34 ? 235 VAL A C 1 +ATOM 1881 O O . VAL A 1 235 ? 44.634 13.215 14.335 1.00 50.76 ? 235 VAL A O 1 +ATOM 1882 C CB . VAL A 1 235 ? 45.486 15.361 12.049 1.00 48.84 ? 235 VAL A CB 1 +ATOM 1883 C CG1 . VAL A 1 235 ? 45.591 15.391 10.568 1.00 49.71 ? 235 VAL A CG1 1 +ATOM 1884 C CG2 . VAL A 1 235 ? 44.067 15.587 12.461 1.00 49.77 ? 235 VAL A CG2 1 +ATOM 1885 N N . THR A 1 236 ? 46.405 14.488 14.898 1.00 51.18 ? 236 THR A N 1 +ATOM 1886 C CA . THR A 1 236 ? 46.175 14.421 16.331 1.00 52.07 ? 236 THR A CA 1 +ATOM 1887 C C . THR A 1 236 ? 47.033 15.439 17.081 1.00 53.15 ? 236 THR A C 1 +ATOM 1888 O O . THR A 1 236 ? 48.034 15.957 16.546 1.00 54.04 ? 236 THR A O 1 +ATOM 1889 C CB . THR A 1 236 ? 46.527 13.012 16.854 1.00 52.33 ? 236 THR A CB 1 +ATOM 1890 O OG1 . THR A 1 236 ? 46.864 13.059 18.248 1.00 51.97 ? 236 THR A OG1 1 +ATOM 1891 C CG2 . THR A 1 236 ? 47.693 12.462 16.076 1.00 52.57 ? 236 THR A CG2 1 +ATOM 1892 N N . ASN A 1 237 ? 46.625 15.729 18.317 1.00 52.29 ? 237 ASN A N 1 +ATOM 1893 C CA . ASN A 1 237 ? 47.378 16.623 19.173 1.00 50.48 ? 237 ASN A CA 1 +ATOM 1894 C C . ASN A 1 237 ? 48.474 15.754 19.787 1.00 48.87 ? 237 ASN A C 1 +ATOM 1895 O O . ASN A 1 237 ? 48.319 14.540 19.907 1.00 47.50 ? 237 ASN A O 1 +ATOM 1896 C CB . ASN A 1 237 ? 46.511 17.183 20.283 1.00 53.00 ? 237 ASN A CB 1 +ATOM 1897 C CG . ASN A 1 237 ? 47.206 18.285 21.042 1.00 56.16 ? 237 ASN A CG 1 +ATOM 1898 O OD1 . ASN A 1 237 ? 47.193 19.428 20.606 1.00 59.64 ? 237 ASN A OD1 1 +ATOM 1899 N ND2 . ASN A 1 237 ? 47.845 17.951 22.170 1.00 56.92 ? 237 ASN A ND2 1 +ATOM 1900 N N . GLY A 1 238 ? 49.576 16.381 20.180 1.00 47.88 ? 238 GLY A N 1 +ATOM 1901 C CA . GLY A 1 238 ? 50.695 15.647 20.744 1.00 47.46 ? 238 GLY A CA 1 +ATOM 1902 C C . GLY A 1 238 ? 50.369 14.974 22.044 1.00 47.27 ? 238 GLY A C 1 +ATOM 1903 O O . GLY A 1 238 ? 50.673 13.806 22.236 1.00 45.03 ? 238 GLY A O 1 +ATOM 1904 N N . TYR A 1 239 ? 49.741 15.745 22.927 1.00 49.40 ? 239 TYR A N 1 +ATOM 1905 C CA . TYR A 1 239 ? 49.329 15.303 24.252 1.00 49.99 ? 239 TYR A CA 1 +ATOM 1906 C C . TYR A 1 239 ? 48.255 14.211 24.146 1.00 50.01 ? 239 TYR A C 1 +ATOM 1907 O O . TYR A 1 239 ? 48.400 13.141 24.745 1.00 51.65 ? 239 TYR A O 1 +ATOM 1908 C CB . TYR A 1 239 ? 48.811 16.514 25.044 1.00 51.53 ? 239 TYR A CB 1 +ATOM 1909 C CG . TYR A 1 239 ? 49.020 16.404 26.538 1.00 53.38 ? 239 TYR A CG 1 +ATOM 1910 C CD1 . TYR A 1 239 ? 47.936 16.297 27.418 1.00 53.78 ? 239 TYR A CD1 1 +ATOM 1911 C CD2 . TYR A 1 239 ? 50.305 16.378 27.072 1.00 53.22 ? 239 TYR A CD2 1 +ATOM 1912 C CE1 . TYR A 1 239 ? 48.138 16.159 28.792 1.00 53.96 ? 239 TYR A CE1 1 +ATOM 1913 C CE2 . TYR A 1 239 ? 50.515 16.245 28.437 1.00 53.14 ? 239 TYR A CE2 1 +ATOM 1914 C CZ . TYR A 1 239 ? 49.435 16.130 29.291 1.00 54.01 ? 239 TYR A CZ 1 +ATOM 1915 O OH . TYR A 1 239 ? 49.668 15.956 30.637 1.00 54.53 ? 239 TYR A OH 1 +ATOM 1916 N N . SER A 1 240 ? 47.188 14.467 23.388 1.00 48.27 ? 240 SER A N 1 +ATOM 1917 C CA . SER A 1 240 ? 46.135 13.478 23.210 1.00 48.33 ? 240 SER A CA 1 +ATOM 1918 C C . SER A 1 240 ? 46.745 12.183 22.749 1.00 47.96 ? 240 SER A C 1 +ATOM 1919 O O . SER A 1 240 ? 46.091 11.155 22.714 1.00 48.48 ? 240 SER A O 1 +ATOM 1920 C CB . SER A 1 240 ? 45.144 13.917 22.155 1.00 50.17 ? 240 SER A CB 1 +ATOM 1921 O OG . SER A 1 240 ? 44.175 14.795 22.683 1.00 55.65 ? 240 SER A OG 1 +ATOM 1922 N N . TRP A 1 241 ? 48.005 12.237 22.360 1.00 47.95 ? 241 TRP A N 1 +ATOM 1923 C CA . TRP A 1 241 ? 48.680 11.039 21.909 1.00 47.84 ? 241 TRP A CA 1 +ATOM 1924 C C . TRP A 1 241 ? 49.558 10.525 23.019 1.00 49.56 ? 241 TRP A C 1 +ATOM 1925 O O . TRP A 1 241 ? 49.406 9.398 23.460 1.00 51.22 ? 241 TRP A O 1 +ATOM 1926 C CB . TRP A 1 241 ? 49.541 11.315 20.666 1.00 44.80 ? 241 TRP A CB 1 +ATOM 1927 C CG . TRP A 1 241 ? 50.117 10.074 20.085 1.00 40.81 ? 241 TRP A CG 1 +ATOM 1928 C CD1 . TRP A 1 241 ? 49.711 8.814 20.334 1.00 39.02 ? 241 TRP A CD1 1 +ATOM 1929 C CD2 . TRP A 1 241 ? 51.221 9.970 19.184 1.00 40.46 ? 241 TRP A CD2 1 +ATOM 1930 N NE1 . TRP A 1 241 ? 50.491 7.921 19.657 1.00 40.52 ? 241 TRP A NE1 1 +ATOM 1931 C CE2 . TRP A 1 241 ? 51.431 8.607 18.942 1.00 40.64 ? 241 TRP A CE2 1 +ATOM 1932 C CE3 . TRP A 1 241 ? 52.057 10.897 18.559 1.00 40.86 ? 241 TRP A CE3 1 +ATOM 1933 C CZ2 . TRP A 1 241 ? 52.443 8.144 18.106 1.00 40.69 ? 241 TRP A CZ2 1 +ATOM 1934 C CZ3 . TRP A 1 241 ? 53.068 10.435 17.725 1.00 39.07 ? 241 TRP A CZ3 1 +ATOM 1935 C CH2 . TRP A 1 241 ? 53.251 9.080 17.509 1.00 39.92 ? 241 TRP A CH2 1 +ATOM 1936 N N . TYR A 1 242 ? 50.464 11.373 23.483 1.00 50.98 ? 242 TYR A N 1 +ATOM 1937 C CA . TYR A 1 242 ? 51.400 10.991 24.513 1.00 51.65 ? 242 TYR A CA 1 +ATOM 1938 C C . TYR A 1 242 ? 52.239 12.180 24.930 1.00 50.73 ? 242 TYR A C 1 +ATOM 1939 O O . TYR A 1 242 ? 53.112 12.643 24.207 1.00 49.13 ? 242 TYR A O 1 +ATOM 1940 C CB . TYR A 1 242 ? 52.314 9.874 23.992 1.00 55.97 ? 242 TYR A CB 1 +ATOM 1941 C CG . TYR A 1 242 ? 53.395 9.414 24.961 1.00 62.37 ? 242 TYR A CG 1 +ATOM 1942 C CD1 . TYR A 1 242 ? 53.963 8.145 24.844 1.00 64.04 ? 242 TYR A CD1 1 +ATOM 1943 C CD2 . TYR A 1 242 ? 53.828 10.229 26.021 1.00 64.96 ? 242 TYR A CD2 1 +ATOM 1944 C CE1 . TYR A 1 242 ? 54.921 7.693 25.762 1.00 66.86 ? 242 TYR A CE1 1 +ATOM 1945 C CE2 . TYR A 1 242 ? 54.796 9.789 26.944 1.00 66.90 ? 242 TYR A CE2 1 +ATOM 1946 C CZ . TYR A 1 242 ? 55.338 8.516 26.813 1.00 67.76 ? 242 TYR A CZ 1 +ATOM 1947 O OH . TYR A 1 242 ? 56.278 8.065 27.732 1.00 68.30 ? 242 TYR A OH 1 +ATOM 1948 N N . PRO A 1 243 ? 51.984 12.681 26.126 1.00 50.68 ? 243 PRO A N 1 +ATOM 1949 C CA . PRO A 1 243 ? 52.694 13.816 26.700 1.00 50.97 ? 243 PRO A CA 1 +ATOM 1950 C C . PRO A 1 243 ? 54.145 13.577 26.451 1.00 50.43 ? 243 PRO A C 1 +ATOM 1951 O O . PRO A 1 243 ? 54.691 12.634 26.985 1.00 51.36 ? 243 PRO A O 1 +ATOM 1952 C CB . PRO A 1 243 ? 52.366 13.701 28.169 1.00 51.96 ? 243 PRO A CB 1 +ATOM 1953 C CG . PRO A 1 243 ? 50.953 13.199 28.132 1.00 52.34 ? 243 PRO A CG 1 +ATOM 1954 C CD . PRO A 1 243 ? 51.009 12.130 27.076 1.00 51.68 ? 243 PRO A CD 1 +ATOM 1955 N N . LEU A 1 244 ? 54.765 14.423 25.645 1.00 50.38 ? 244 LEU A N 1 +ATOM 1956 C CA . LEU A 1 244 ? 56.173 14.272 25.310 1.00 50.79 ? 244 LEU A CA 1 +ATOM 1957 C C . LEU A 1 244 ? 56.975 15.371 25.946 1.00 52.01 ? 244 LEU A C 1 +ATOM 1958 O O . LEU A 1 244 ? 56.801 16.534 25.607 1.00 53.84 ? 244 LEU A O 1 +ATOM 1959 C CB . LEU A 1 244 ? 56.335 14.360 23.806 1.00 50.55 ? 244 LEU A CB 1 +ATOM 1960 C CG . LEU A 1 244 ? 57.700 14.087 23.202 1.00 50.37 ? 244 LEU A CG 1 +ATOM 1961 C CD1 . LEU A 1 244 ? 58.148 12.643 23.464 1.00 49.45 ? 244 LEU A CD1 1 +ATOM 1962 C CD2 . LEU A 1 244 ? 57.579 14.352 21.722 1.00 51.32 ? 244 LEU A CD2 1 +ATOM 1963 N N . GLN A 1 245 ? 57.873 15.022 26.851 1.00 53.12 ? 245 GLN A N 1 +ATOM 1964 C CA . GLN A 1 245 ? 58.670 16.047 27.522 1.00 54.73 ? 245 GLN A CA 1 +ATOM 1965 C C . GLN A 1 245 ? 59.988 16.354 26.816 1.00 54.36 ? 245 GLN A C 1 +ATOM 1966 O O . GLN A 1 245 ? 60.778 15.455 26.498 1.00 53.49 ? 245 GLN A O 1 +ATOM 1967 C CB . GLN A 1 245 ? 58.949 15.621 28.965 1.00 57.59 ? 245 GLN A CB 1 +ATOM 1968 C CG . GLN A 1 245 ? 59.816 16.570 29.764 1.00 61.23 ? 245 GLN A CG 1 +ATOM 1969 C CD . GLN A 1 245 ? 60.253 15.969 31.092 1.00 63.22 ? 245 GLN A CD 1 +ATOM 1970 O OE1 . GLN A 1 245 ? 61.040 16.569 31.830 1.00 64.78 ? 245 GLN A OE1 1 +ATOM 1971 N NE2 . GLN A 1 245 ? 59.741 14.778 31.401 1.00 63.28 ? 245 GLN A NE2 1 +ATOM 1972 N N . GLY A 1 246 ? 60.219 17.638 26.577 1.00 54.02 ? 246 GLY A N 1 +ATOM 1973 C CA . GLY A 1 246 ? 61.444 18.056 25.921 1.00 54.78 ? 246 GLY A CA 1 +ATOM 1974 C C . GLY A 1 246 ? 61.615 17.671 24.460 1.00 54.43 ? 246 GLY A C 1 +ATOM 1975 O O . GLY A 1 246 ? 62.640 17.094 24.096 1.00 54.67 ? 246 GLY A O 1 +ATOM 1976 N N . GLY A 1 247 ? 60.631 18.000 23.627 1.00 53.96 ? 247 GLY A N 1 +ATOM 1977 C CA . GLY A 1 247 ? 60.708 17.672 22.216 1.00 53.66 ? 247 GLY A CA 1 +ATOM 1978 C C . GLY A 1 247 ? 60.964 18.893 21.346 1.00 53.86 ? 247 GLY A C 1 +ATOM 1979 O O . GLY A 1 247 ? 60.584 20.016 21.717 1.00 53.81 ? 247 GLY A O 1 +ATOM 1980 N N . MET A 1 248 ? 61.582 18.672 20.183 1.00 52.31 ? 248 MET A N 1 +ATOM 1981 C CA . MET A 1 248 ? 61.909 19.760 19.267 1.00 52.26 ? 248 MET A CA 1 +ATOM 1982 C C . MET A 1 248 ? 60.700 20.584 18.834 1.00 52.47 ? 248 MET A C 1 +ATOM 1983 O O . MET A 1 248 ? 60.765 21.801 18.725 1.00 52.15 ? 248 MET A O 1 +ATOM 1984 C CB . MET A 1 248 ? 62.613 19.212 18.027 1.00 51.81 ? 248 MET A CB 1 +ATOM 1985 C CG . MET A 1 248 ? 63.523 20.220 17.324 1.00 49.73 ? 248 MET A CG 1 +ATOM 1986 S SD . MET A 1 248 ? 64.128 19.641 15.735 1.00 50.05 ? 248 MET A SD 1 +ATOM 1987 C CE . MET A 1 248 ? 64.649 18.016 16.103 1.00 45.85 ? 248 MET A CE 1 +ATOM 1988 N N . GLN A 1 249 ? 59.593 19.911 18.574 1.00 53.48 ? 249 GLN A N 1 +ATOM 1989 C CA . GLN A 1 249 ? 58.373 20.588 18.149 1.00 53.63 ? 249 GLN A CA 1 +ATOM 1990 C C . GLN A 1 249 ? 57.999 21.714 19.119 1.00 53.59 ? 249 GLN A C 1 +ATOM 1991 O O . GLN A 1 249 ? 57.757 22.853 18.710 1.00 52.86 ? 249 GLN A O 1 +ATOM 1992 C CB . GLN A 1 249 ? 57.239 19.565 18.069 0.0000 53.72 ? 249 GLN A CB 1 +ATOM 1993 C CG . GLN A 1 249 ? 56.037 19.993 17.251 0.0000 53.94 ? 249 GLN A CG 1 +ATOM 1994 C CD . GLN A 1 249 ? 54.994 18.894 17.148 0.0000 54.06 ? 249 GLN A CD 1 +ATOM 1995 O OE1 . GLN A 1 249 ? 54.006 19.025 16.429 0.0000 54.14 ? 249 GLN A OE1 1 +ATOM 1996 N NE2 . GLN A 1 249 ? 55.212 17.803 17.871 0.0000 54.14 ? 249 GLN A NE2 1 +ATOM 1997 N N . ASP A 1 250 ? 57.958 21.391 20.410 1.00 54.45 ? 250 ASP A N 1 +ATOM 1998 C CA . ASP A 1 250 ? 57.585 22.381 21.429 1.00 54.12 ? 250 ASP A CA 1 +ATOM 1999 C C . ASP A 1 250 ? 58.584 23.531 21.498 1.00 52.40 ? 250 ASP A C 1 +ATOM 2000 O O . ASP A 1 250 ? 58.231 24.683 21.704 1.00 50.60 ? 250 ASP A O 1 +ATOM 2001 C CB . ASP A 1 250 ? 57.472 21.714 22.815 1.00 55.36 ? 250 ASP A CB 1 +ATOM 2002 C CG . ASP A 1 250 ? 56.199 20.881 22.979 1.00 54.91 ? 250 ASP A CG 1 +ATOM 2003 O OD1 . ASP A 1 250 ? 55.104 21.419 22.699 1.00 52.21 ? 250 ASP A OD1 1 +ATOM 2004 O OD2 . ASP A 1 250 ? 56.303 19.702 23.399 1.00 55.39 ? 250 ASP A OD2 1 +ATOM 2005 N N . TYR A 1 251 ? 59.845 23.190 21.321 1.00 52.07 ? 251 TYR A N 1 +ATOM 2006 C CA . TYR A 1 251 ? 60.910 24.163 21.378 1.00 51.49 ? 251 TYR A CA 1 +ATOM 2007 C C . TYR A 1 251 ? 60.675 25.212 20.292 1.00 50.41 ? 251 TYR A C 1 +ATOM 2008 O O . TYR A 1 251 ? 60.347 26.361 20.586 1.00 51.81 ? 251 TYR A O 1 +ATOM 2009 C CB . TYR A 1 251 ? 62.248 23.425 21.205 1.00 52.68 ? 251 TYR A CB 1 +ATOM 2010 C CG . TYR A 1 251 ? 63.475 24.263 21.415 1.00 54.91 ? 251 TYR A CG 1 +ATOM 2011 C CD1 . TYR A 1 251 ? 63.806 24.766 22.674 1.00 55.78 ? 251 TYR A CD1 1 +ATOM 2012 C CD2 . TYR A 1 251 ? 64.309 24.566 20.343 1.00 56.28 ? 251 TYR A CD2 1 +ATOM 2013 C CE1 . TYR A 1 251 ? 64.951 25.562 22.852 1.00 56.94 ? 251 TYR A CE1 1 +ATOM 2014 C CE2 . TYR A 1 251 ? 65.445 25.343 20.508 1.00 57.17 ? 251 TYR A CE2 1 +ATOM 2015 C CZ . TYR A 1 251 ? 65.767 25.838 21.755 1.00 57.26 ? 251 TYR A CZ 1 +ATOM 2016 O OH . TYR A 1 251 ? 66.925 26.570 21.878 1.00 57.14 ? 251 TYR A OH 1 +ATOM 2017 N N . ASN A 1 252 ? 60.800 24.792 19.039 1.00 48.31 ? 252 ASN A N 1 +ATOM 2018 C CA . ASN A 1 252 ? 60.625 25.664 17.891 1.00 45.64 ? 252 ASN A CA 1 +ATOM 2019 C C . ASN A 1 252 ? 59.535 26.681 18.037 1.00 43.81 ? 252 ASN A C 1 +ATOM 2020 O O . ASN A 1 252 ? 59.674 27.801 17.569 1.00 44.21 ? 252 ASN A O 1 +ATOM 2021 C CB . ASN A 1 252 ? 60.331 24.850 16.637 1.00 45.82 ? 252 ASN A CB 1 +ATOM 2022 C CG . ASN A 1 252 ? 61.569 24.240 16.036 1.00 47.60 ? 252 ASN A CG 1 +ATOM 2023 O OD1 . ASN A 1 252 ? 62.109 23.249 16.545 1.00 48.87 ? 252 ASN A OD1 1 +ATOM 2024 N ND2 . ASN A 1 252 ? 62.042 24.837 14.943 1.00 47.68 ? 252 ASN A ND2 1 +ATOM 2025 N N . TYR A 1 253 ? 58.449 26.276 18.676 1.00 42.55 ? 253 TYR A N 1 +ATOM 2026 C CA . TYR A 1 253 ? 57.286 27.121 18.861 1.00 41.37 ? 253 TYR A CA 1 +ATOM 2027 C C . TYR A 1 253 ? 57.339 28.038 20.053 1.00 43.37 ? 253 TYR A C 1 +ATOM 2028 O O . TYR A 1 253 ? 56.720 29.091 20.053 1.00 44.29 ? 253 TYR A O 1 +ATOM 2029 C CB . TYR A 1 253 ? 56.060 26.253 19.013 1.00 37.40 ? 253 TYR A CB 1 +ATOM 2030 C CG . TYR A 1 253 ? 54.795 27.047 19.072 1.00 35.33 ? 253 TYR A CG 1 +ATOM 2031 C CD1 . TYR A 1 253 ? 54.361 27.775 17.970 1.00 35.10 ? 253 TYR A CD1 1 +ATOM 2032 C CD2 . TYR A 1 253 ? 54.002 27.046 20.203 1.00 34.56 ? 253 TYR A CD2 1 +ATOM 2033 C CE1 . TYR A 1 253 ? 53.160 28.479 17.990 1.00 32.77 ? 253 TYR A CE1 1 +ATOM 2034 C CE2 . TYR A 1 253 ? 52.793 27.745 20.231 1.00 33.13 ? 253 TYR A CE2 1 +ATOM 2035 C CZ . TYR A 1 253 ? 52.385 28.456 19.120 1.00 32.38 ? 253 TYR A CZ 1 +ATOM 2036 O OH . TYR A 1 253 ? 51.200 29.155 19.139 1.00 33.42 ? 253 TYR A OH 1 +ATOM 2037 N N . ILE A 1 254 ? 58.057 27.619 21.084 1.00 45.33 ? 254 ILE A N 1 +ATOM 2038 C CA . ILE A 1 254 ? 58.140 28.383 22.312 1.00 46.57 ? 254 ILE A CA 1 +ATOM 2039 C C . ILE A 1 254 ? 59.249 29.383 22.272 1.00 48.78 ? 254 ILE A C 1 +ATOM 2040 O O . ILE A 1 254 ? 59.025 30.572 22.499 1.00 50.98 ? 254 ILE A O 1 +ATOM 2041 C CB . ILE A 1 254 ? 58.384 27.460 23.533 1.00 45.19 ? 254 ILE A CB 1 +ATOM 2042 C CG1 . ILE A 1 254 ? 57.125 26.639 23.829 1.00 44.63 ? 254 ILE A CG1 1 +ATOM 2043 C CG2 . ILE A 1 254 ? 58.782 28.273 24.756 1.00 43.48 ? 254 ILE A CG2 1 +ATOM 2044 C CD1 . ILE A 1 254 ? 56.039 27.367 24.535 1.00 41.35 ? 254 ILE A CD1 1 +ATOM 2045 N N . TRP A 1 255 ? 60.440 28.893 21.965 1.00 49.91 ? 255 TRP A N 1 +ATOM 2046 C CA . TRP A 1 255 ? 61.647 29.712 21.959 1.00 51.43 ? 255 TRP A CA 1 +ATOM 2047 C C . TRP A 1 255 ? 62.256 30.106 20.614 1.00 50.29 ? 255 TRP A C 1 +ATOM 2048 O O . TRP A 1 255 ? 63.128 30.970 20.554 1.00 49.93 ? 255 TRP A O 1 +ATOM 2049 C CB . TRP A 1 255 ? 62.732 28.983 22.774 1.00 54.37 ? 255 TRP A CB 1 +ATOM 2050 C CG . TRP A 1 255 ? 62.458 28.852 24.260 1.00 57.72 ? 255 TRP A CG 1 +ATOM 2051 C CD1 . TRP A 1 255 ? 62.611 29.819 25.210 1.00 58.58 ? 255 TRP A CD1 1 +ATOM 2052 C CD2 . TRP A 1 255 ? 62.030 27.677 24.954 1.00 58.70 ? 255 TRP A CD2 1 +ATOM 2053 N NE1 . TRP A 1 255 ? 62.315 29.319 26.451 1.00 59.31 ? 255 TRP A NE1 1 +ATOM 2054 C CE2 . TRP A 1 255 ? 61.954 28.005 26.324 1.00 59.08 ? 255 TRP A CE2 1 +ATOM 2055 C CE3 . TRP A 1 255 ? 61.707 26.376 24.553 1.00 58.95 ? 255 TRP A CE3 1 +ATOM 2056 C CZ2 . TRP A 1 255 ? 61.567 27.082 27.295 1.00 59.31 ? 255 TRP A CZ2 1 +ATOM 2057 C CZ3 . TRP A 1 255 ? 61.322 25.453 25.522 1.00 59.45 ? 255 TRP A CZ3 1 +ATOM 2058 C CH2 . TRP A 1 255 ? 61.257 25.813 26.877 1.00 59.68 ? 255 TRP A CH2 1 +ATOM 2059 N N . ALA A 1 256 ? 61.823 29.472 19.536 1.00 49.99 ? 256 ALA A N 1 +ATOM 2060 C CA . ALA A 1 256 ? 62.411 29.756 18.238 1.00 48.28 ? 256 ALA A CA 1 +ATOM 2061 C C . ALA A 1 256 ? 61.488 30.496 17.332 1.00 47.15 ? 256 ALA A C 1 +ATOM 2062 O O . ALA A 1 256 ? 61.825 30.754 16.202 1.00 48.68 ? 256 ALA A O 1 +ATOM 2063 C CB . ALA A 1 256 ? 62.850 28.473 17.575 1.00 47.93 ? 256 ALA A CB 1 +ATOM 2064 N N . GLN A 1 257 ? 60.308 30.817 17.818 1.00 47.00 ? 257 GLN A N 1 +ATOM 2065 C CA . GLN A 1 257 ? 59.350 31.560 17.019 1.00 47.01 ? 257 GLN A CA 1 +ATOM 2066 C C . GLN A 1 257 ? 58.802 30.896 15.748 1.00 46.33 ? 257 GLN A C 1 +ATOM 2067 O O . GLN A 1 257 ? 58.124 31.563 14.981 1.00 46.15 ? 257 GLN A O 1 +ATOM 2068 C CB . GLN A 1 257 ? 59.953 32.921 16.667 1.00 48.31 ? 257 GLN A CB 1 +ATOM 2069 C CG . GLN A 1 257 ? 59.145 34.117 17.171 1.00 51.26 ? 257 GLN A CG 1 +ATOM 2070 C CD . GLN A 1 257 ? 60.037 35.277 17.591 1.00 52.08 ? 257 GLN A CD 1 +ATOM 2071 O OE1 . GLN A 1 257 ? 59.616 36.189 18.319 1.00 51.64 ? 257 GLN A OE1 1 +ATOM 2072 N NE2 . GLN A 1 257 ? 61.283 35.240 17.132 1.00 52.58 ? 257 GLN A NE2 1 +ATOM 2073 N N . CYS A 1 258 ? 59.078 29.612 15.504 1.00 45.55 ? 258 CYS A N 1 +ATOM 2074 C CA . CYS A 1 258 ? 58.512 28.969 14.312 1.00 46.40 ? 258 CYS A CA 1 +ATOM 2075 C C . CYS A 1 258 ? 57.606 27.763 14.620 1.00 44.58 ? 258 CYS A C 1 +ATOM 2076 O O . CYS A 1 258 ? 57.745 27.129 15.651 1.00 46.00 ? 258 CYS A O 1 +ATOM 2077 C CB . CYS A 1 258 ? 59.611 28.518 13.370 1.00 49.17 ? 258 CYS A CB 1 +ATOM 2078 S SG . CYS A 1 258 ? 60.181 26.890 13.737 1.00 56.51 ? 258 CYS A SG 1 +ATOM 2079 N N . PHE A 1 259 ? 56.699 27.442 13.703 1.00 41.97 ? 259 PHE A N 1 +ATOM 2080 C CA . PHE A 1 259 ? 55.752 26.346 13.864 1.00 39.89 ? 259 PHE A CA 1 +ATOM 2081 C C . PHE A 1 259 ? 56.258 25.015 13.376 1.00 40.91 ? 259 PHE A C 1 +ATOM 2082 O O . PHE A 1 259 ? 56.438 24.860 12.171 1.00 41.98 ? 259 PHE A O 1 +ATOM 2083 C CB . PHE A 1 259 ? 54.488 26.621 13.070 1.00 37.90 ? 259 PHE A CB 1 +ATOM 2084 C CG . PHE A 1 259 ? 53.640 27.713 13.619 1.00 36.51 ? 259 PHE A CG 1 +ATOM 2085 C CD1 . PHE A 1 259 ? 54.214 28.835 14.206 1.00 34.81 ? 259 PHE A CD1 1 +ATOM 2086 C CD2 . PHE A 1 259 ? 52.249 27.636 13.500 1.00 35.63 ? 259 PHE A CD2 1 +ATOM 2087 C CE1 . PHE A 1 259 ? 53.415 29.867 14.664 1.00 36.26 ? 259 PHE A CE1 1 +ATOM 2088 C CE2 . PHE A 1 259 ? 51.440 28.659 13.951 1.00 35.54 ? 259 PHE A CE2 1 +ATOM 2089 C CZ . PHE A 1 259 ? 52.013 29.782 14.534 1.00 36.18 ? 259 PHE A CZ 1 +ATOM 2090 N N . GLU A 1 260 ? 56.464 24.040 14.269 1.00 41.30 ? 260 GLU A N 1 +ATOM 2091 C CA . GLU A 1 260 ? 56.915 22.715 13.812 1.00 40.29 ? 260 GLU A CA 1 +ATOM 2092 C C . GLU A 1 260 ? 55.806 21.730 14.163 1.00 40.66 ? 260 GLU A C 1 +ATOM 2093 O O . GLU A 1 260 ? 55.118 21.966 15.149 1.00 44.21 ? 260 GLU A O 1 +ATOM 2094 C CB . GLU A 1 260 ? 58.220 22.316 14.509 1.00 37.22 ? 260 GLU A CB 1 +ATOM 2095 C CG . GLU A 1 260 ? 59.207 21.607 13.583 1.00 39.65 ? 260 GLU A CG 1 +ATOM 2096 C CD . GLU A 1 260 ? 60.565 21.263 14.227 1.00 41.06 ? 260 GLU A CD 1 +ATOM 2097 O OE1 . GLU A 1 260 ? 60.556 20.500 15.208 1.00 41.60 ? 260 GLU A OE1 1 +ATOM 2098 O OE2 . GLU A 1 260 ? 61.642 21.738 13.757 1.00 41.57 ? 260 GLU A OE2 1 +ATOM 2099 N N . ILE A 1 261 ? 55.551 20.713 13.332 1.00 38.66 ? 261 ILE A N 1 +ATOM 2100 C CA . ILE A 1 261 ? 54.568 19.670 13.666 1.00 37.66 ? 261 ILE A CA 1 +ATOM 2101 C C . ILE A 1 261 ? 55.375 18.424 13.393 1.00 40.04 ? 261 ILE A C 1 +ATOM 2102 O O . ILE A 1 261 ? 56.438 18.530 12.801 1.00 43.47 ? 261 ILE A O 1 +ATOM 2103 C CB . ILE A 1 261 ? 53.291 19.627 12.797 1.00 36.03 ? 261 ILE A CB 1 +ATOM 2104 C CG1 . ILE A 1 261 ? 53.558 18.966 11.452 1.00 33.58 ? 261 ILE A CG1 1 +ATOM 2105 C CG2 . ILE A 1 261 ? 52.722 21.005 12.654 1.00 36.15 ? 261 ILE A CG2 1 +ATOM 2106 C CD1 . ILE A 1 261 ? 52.284 18.650 10.721 1.00 31.44 ? 261 ILE A CD1 1 +ATOM 2107 N N . THR A 1 262 ? 54.901 17.248 13.805 1.00 41.30 ? 262 THR A N 1 +ATOM 2108 C CA . THR A 1 262 ? 55.669 15.996 13.633 1.00 39.49 ? 262 THR A CA 1 +ATOM 2109 C C . THR A 1 262 ? 55.047 15.085 12.594 1.00 39.93 ? 262 THR A C 1 +ATOM 2110 O O . THR A 1 262 ? 53.879 14.720 12.678 1.00 40.97 ? 262 THR A O 1 +ATOM 2111 C CB . THR A 1 262 ? 55.743 15.196 14.957 1.00 37.11 ? 262 THR A CB 1 +ATOM 2112 O OG1 . THR A 1 262 ? 55.976 16.077 16.053 1.00 35.95 ? 262 THR A OG1 1 +ATOM 2113 C CG2 . THR A 1 262 ? 56.839 14.233 14.917 1.00 35.91 ? 262 THR A CG2 1 +ATOM 2114 N N . LEU A 1 263 ? 55.816 14.694 11.610 1.00 39.30 ? 263 LEU A N 1 +ATOM 2115 C CA . LEU A 1 263 ? 55.213 13.835 10.639 1.00 41.64 ? 263 LEU A CA 1 +ATOM 2116 C C . LEU A 1 263 ? 55.635 12.400 10.900 1.00 43.15 ? 263 LEU A C 1 +ATOM 2117 O O . LEU A 1 263 ? 56.827 12.086 10.864 1.00 45.09 ? 263 LEU A O 1 +ATOM 2118 C CB . LEU A 1 263 ? 55.621 14.290 9.238 1.00 41.95 ? 263 LEU A CB 1 +ATOM 2119 C CG . LEU A 1 263 ? 55.215 15.732 8.882 1.00 41.53 ? 263 LEU A CG 1 +ATOM 2120 C CD1 . LEU A 1 263 ? 55.760 16.092 7.489 1.00 38.33 ? 263 LEU A CD1 1 +ATOM 2121 C CD2 . LEU A 1 263 ? 53.681 15.870 8.942 1.00 38.27 ? 263 LEU A CD2 1 +ATOM 2122 N N . GLU A 1 264 ? 54.667 11.534 11.209 1.00 43.05 ? 264 GLU A N 1 +ATOM 2123 C CA . GLU A 1 264 ? 54.956 10.106 11.437 1.00 41.96 ? 264 GLU A CA 1 +ATOM 2124 C C . GLU A 1 264 ? 54.657 9.456 10.095 1.00 39.91 ? 264 GLU A C 1 +ATOM 2125 O O . GLU A 1 264 ? 53.527 9.094 9.807 1.00 38.69 ? 264 GLU A O 1 +ATOM 2126 C CB . GLU A 1 264 ? 54.070 9.545 12.562 1.00 41.84 ? 264 GLU A CB 1 +ATOM 2127 C CG . GLU A 1 264 ? 54.485 10.047 13.962 1.00 41.32 ? 264 GLU A CG 1 +ATOM 2128 C CD . GLU A 1 264 ? 55.819 9.477 14.463 1.00 40.03 ? 264 GLU A CD 1 +ATOM 2129 O OE1 . GLU A 1 264 ? 56.311 9.937 15.513 1.00 38.91 ? 264 GLU A OE1 1 +ATOM 2130 O OE2 . GLU A 1 264 ? 56.367 8.563 13.821 1.00 39.45 ? 264 GLU A OE2 1 +ATOM 2131 N N . LEU A 1 265 ? 55.696 9.304 9.289 1.00 38.64 ? 265 LEU A N 1 +ATOM 2132 C CA . LEU A 1 265 ? 55.521 8.828 7.937 1.00 39.64 ? 265 LEU A CA 1 +ATOM 2133 C C . LEU A 1 265 ? 55.498 7.374 7.606 1.00 40.38 ? 265 LEU A C 1 +ATOM 2134 O O . LEU A 1 265 ? 55.187 7.015 6.471 1.00 40.66 ? 265 LEU A O 1 +ATOM 2135 C CB . LEU A 1 265 ? 56.535 9.517 7.040 1.00 39.37 ? 265 LEU A CB 1 +ATOM 2136 C CG . LEU A 1 265 ? 56.480 11.031 7.193 1.00 38.93 ? 265 LEU A CG 1 +ATOM 2137 C CD1 . LEU A 1 265 ? 57.473 11.617 6.262 1.00 40.18 ? 265 LEU A CD1 1 +ATOM 2138 C CD2 . LEU A 1 265 ? 55.101 11.560 6.891 1.00 38.48 ? 265 LEU A CD2 1 +ATOM 2139 N N . SER A 1 266 ? 55.827 6.531 8.570 1.00 41.90 ? 266 SER A N 1 +ATOM 2140 C CA . SER A 1 266 ? 55.808 5.095 8.325 1.00 43.20 ? 266 SER A CA 1 +ATOM 2141 C C . SER A 1 266 ? 55.490 4.294 9.577 1.00 44.35 ? 266 SER A C 1 +ATOM 2142 O O . SER A 1 266 ? 55.937 4.638 10.663 1.00 45.16 ? 266 SER A O 1 +ATOM 2143 C CB . SER A 1 266 ? 57.158 4.631 7.789 1.00 41.83 ? 266 SER A CB 1 +ATOM 2144 O OG . SER A 1 266 ? 58.130 4.651 8.816 1.00 42.81 ? 266 SER A OG 1 +ATOM 2145 N N . CYS A 1 267 ? 54.706 3.232 9.428 1.00 46.09 ? 267 CYS A N 1 +ATOM 2146 C CA . CYS A 1 267 ? 54.403 2.365 10.561 1.00 47.04 ? 267 CYS A CA 1 +ATOM 2147 C C . CYS A 1 267 ? 55.726 1.699 10.926 1.00 45.85 ? 267 CYS A C 1 +ATOM 2148 O O . CYS A 1 267 ? 56.209 1.801 12.054 1.00 46.56 ? 267 CYS A O 1 +ATOM 2149 C CB . CYS A 1 267 ? 53.397 1.261 10.190 1.00 48.32 ? 267 CYS A CB 1 +ATOM 2150 S SG . CYS A 1 267 ? 51.737 1.798 9.677 1.00 51.84 ? 267 CYS A SG 1 +ATOM 2151 N N . CYS A 1 268 ? 56.299 1.012 9.946 1.00 44.83 ? 268 CYS A N 1 +ATOM 2152 C CA . CYS A 1 268 ? 57.549 0.302 10.110 1.00 44.85 ? 268 CYS A CA 1 +ATOM 2153 C C . CYS A 1 268 ? 58.718 1.271 10.121 1.00 45.51 ? 268 CYS A C 1 +ATOM 2154 O O . CYS A 1 268 ? 59.085 1.813 9.081 1.00 46.29 ? 268 CYS A O 1 +ATOM 2155 C CB . CYS A 1 268 ? 57.718 -0.686 8.979 1.00 45.41 ? 268 CYS A CB 1 +ATOM 2156 S SG . CYS A 1 268 ? 59.354 -1.422 9.050 1.00 49.44 ? 268 CYS A SG 1 +ATOM 2157 N N . LYS A 1 269 ? 59.312 1.454 11.297 1.00 45.15 ? 269 LYS A N 1 +ATOM 2158 C CA . LYS A 1 269 ? 60.411 2.383 11.505 1.00 45.19 ? 269 LYS A CA 1 +ATOM 2159 C C . LYS A 1 269 ? 61.597 2.310 10.548 1.00 45.83 ? 269 LYS A C 1 +ATOM 2160 O O . LYS A 1 269 ? 62.192 3.344 10.217 1.00 45.73 ? 269 LYS A O 1 +ATOM 2161 C CB . LYS A 1 269 ? 60.889 2.270 12.956 1.00 45.93 ? 269 LYS A CB 1 +ATOM 2162 C CG . LYS A 1 269 ? 59.788 2.579 13.982 1.00 46.96 ? 269 LYS A CG 1 +ATOM 2163 C CD . LYS A 1 269 ? 60.252 2.417 15.426 1.00 47.72 ? 269 LYS A CD 1 +ATOM 2164 C CE . LYS A 1 269 ? 60.689 3.736 16.059 1.00 48.52 ? 269 LYS A CE 1 +ATOM 2165 N NZ . LYS A 1 269 ? 59.516 4.625 16.245 1.00 45.56 ? 269 LYS A NZ 1 +ATOM 2166 N N . TYR A 1 270 ? 61.946 1.107 10.094 1.00 46.20 ? 270 TYR A N 1 +ATOM 2167 C CA . TYR A 1 270 ? 63.069 0.940 9.166 1.00 46.69 ? 270 TYR A CA 1 +ATOM 2168 C C . TYR A 1 270 ? 62.706 -0.087 8.101 1.00 47.19 ? 270 TYR A C 1 +ATOM 2169 O O . TYR A 1 270 ? 63.290 -1.168 8.070 1.00 47.87 ? 270 TYR A O 1 +ATOM 2170 C CB . TYR A 1 270 ? 64.304 0.473 9.931 1.00 45.69 ? 270 TYR A CB 1 +ATOM 2171 C CG . TYR A 1 270 ? 65.630 0.753 9.247 1.00 47.77 ? 270 TYR A CG 1 +ATOM 2172 C CD1 . TYR A 1 270 ? 66.810 0.874 10.003 1.00 47.74 ? 270 TYR A CD1 1 +ATOM 2173 C CD2 . TYR A 1 270 ? 65.724 0.878 7.853 1.00 47.01 ? 270 TYR A CD2 1 +ATOM 2174 C CE1 . TYR A 1 270 ? 68.031 1.109 9.395 1.00 46.45 ? 270 TYR A CE1 1 +ATOM 2175 C CE2 . TYR A 1 270 ? 66.952 1.113 7.242 1.00 46.87 ? 270 TYR A CE2 1 +ATOM 2176 C CZ . TYR A 1 270 ? 68.094 1.225 8.022 1.00 47.38 ? 270 TYR A CZ 1 +ATOM 2177 O OH . TYR A 1 270 ? 69.311 1.445 7.436 1.00 49.20 ? 270 TYR A OH 1 +ATOM 2178 N N . PRO A 1 271 ? 61.763 0.256 7.198 1.00 47.21 ? 271 PRO A N 1 +ATOM 2179 C CA . PRO A 1 271 ? 61.236 -0.562 6.093 1.00 48.61 ? 271 PRO A CA 1 +ATOM 2180 C C . PRO A 1 271 ? 62.260 -1.036 5.069 1.00 50.50 ? 271 PRO A C 1 +ATOM 2181 O O . PRO A 1 271 ? 63.337 -0.466 4.986 1.00 52.67 ? 271 PRO A O 1 +ATOM 2182 C CB . PRO A 1 271 ? 60.173 0.345 5.477 1.00 48.32 ? 271 PRO A CB 1 +ATOM 2183 C CG . PRO A 1 271 ? 60.750 1.699 5.674 1.00 47.47 ? 271 PRO A CG 1 +ATOM 2184 C CD . PRO A 1 271 ? 61.315 1.653 7.066 1.00 46.51 ? 271 PRO A CD 1 +ATOM 2185 N N . ARG A 1 272 ? 61.937 -2.066 4.283 1.00 52.17 ? 272 ARG A N 1 +ATOM 2186 C CA . ARG A 1 272 ? 62.883 -2.564 3.280 1.00 53.35 ? 272 ARG A CA 1 +ATOM 2187 C C . ARG A 1 272 ? 63.029 -1.598 2.090 1.00 53.15 ? 272 ARG A C 1 +ATOM 2188 O O . ARG A 1 272 ? 62.078 -0.919 1.730 1.00 53.43 ? 272 ARG A O 1 +ATOM 2189 C CB . ARG A 1 272 ? 62.449 -3.947 2.812 1.00 55.37 ? 272 ARG A CB 1 +ATOM 2190 C CG . ARG A 1 272 ? 62.461 -4.983 3.922 1.00 60.08 ? 272 ARG A CG 1 +ATOM 2191 C CD . ARG A 1 272 ? 62.120 -6.394 3.417 1.00 64.80 ? 272 ARG A CD 1 +ATOM 2192 N NE . ARG A 1 272 ? 60.936 -6.418 2.542 1.00 69.45 ? 272 ARG A NE 1 +ATOM 2193 C CZ . ARG A 1 272 ? 60.979 -6.334 1.208 1.00 70.40 ? 272 ARG A CZ 1 +ATOM 2194 N NH1 . ARG A 1 272 ? 59.857 -6.357 0.485 1.00 69.21 ? 272 ARG A NH1 1 +ATOM 2195 N NH2 . ARG A 1 272 ? 62.153 -6.241 0.590 1.00 71.56 ? 272 ARG A NH2 1 +ATOM 2196 N N . GLU A 1 273 ? 64.220 -1.542 1.489 1.00 53.13 ? 273 GLU A N 1 +ATOM 2197 C CA . GLU A 1 273 ? 64.518 -0.634 0.372 1.00 53.64 ? 273 GLU A CA 1 +ATOM 2198 C C . GLU A 1 273 ? 63.484 -0.612 -0.734 1.00 54.80 ? 273 GLU A C 1 +ATOM 2199 O O . GLU A 1 273 ? 63.109 0.441 -1.263 1.00 55.42 ? 273 GLU A O 1 +ATOM 2200 C CB . GLU A 1 273 ? 65.868 -0.982 -0.246 1.00 53.56 ? 273 GLU A CB 1 +ATOM 2201 C CG . GLU A 1 273 ? 67.063 -0.598 0.590 1.00 56.13 ? 273 GLU A CG 1 +ATOM 2202 C CD . GLU A 1 273 ? 68.379 -0.831 -0.126 1.00 57.51 ? 273 GLU A CD 1 +ATOM 2203 O OE1 . GLU A 1 273 ? 69.396 -0.231 0.270 1.00 60.09 ? 273 GLU A OE1 1 +ATOM 2204 O OE2 . GLU A 1 273 ? 68.409 -1.619 -1.083 1.00 57.34 ? 273 GLU A OE2 1 +ATOM 2205 N N . GLU A 1 274 ? 63.032 -1.793 -1.098 1.00 55.15 ? 274 GLU A N 1 +ATOM 2206 C CA . GLU A 1 274 ? 62.049 -1.943 -2.148 1.00 55.69 ? 274 GLU A CA 1 +ATOM 2207 C C . GLU A 1 274 ? 60.763 -1.107 -1.945 1.00 54.05 ? 274 GLU A C 1 +ATOM 2208 O O . GLU A 1 274 ? 59.952 -0.957 -2.862 1.00 54.17 ? 274 GLU A O 1 +ATOM 2209 C CB . GLU A 1 274 ? 61.753 -3.436 -2.243 1.00 58.48 ? 274 GLU A CB 1 +ATOM 2210 C CG . GLU A 1 274 ? 62.964 -4.238 -1.756 1.00 64.09 ? 274 GLU A CG 1 +ATOM 2211 C CD . GLU A 1 274 ? 63.035 -5.653 -2.323 1.00 70.13 ? 274 GLU A CD 1 +ATOM 2212 O OE1 . GLU A 1 274 ? 62.982 -5.806 -3.580 1.00 71.48 ? 274 GLU A OE1 1 +ATOM 2213 O OE2 . GLU A 1 274 ? 63.162 -6.615 -1.512 1.00 71.05 ? 274 GLU A OE2 1 +ATOM 2214 N N . LYS A 1 275 ? 60.589 -0.539 -0.755 1.00 52.09 ? 275 LYS A N 1 +ATOM 2215 C CA . LYS A 1 275 ? 59.389 0.240 -0.447 1.00 50.55 ? 275 LYS A CA 1 +ATOM 2216 C C . LYS A 1 275 ? 59.489 1.764 -0.565 1.00 47.59 ? 275 LYS A C 1 +ATOM 2217 O O . LYS A 1 275 ? 58.486 2.471 -0.479 1.00 46.33 ? 275 LYS A O 1 +ATOM 2218 C CB . LYS A 1 275 ? 58.913 -0.093 0.965 1.00 52.58 ? 275 LYS A CB 1 +ATOM 2219 C CG . LYS A 1 275 ? 58.624 -1.555 1.240 1.00 56.79 ? 275 LYS A CG 1 +ATOM 2220 C CD . LYS A 1 275 ? 58.142 -1.711 2.701 1.00 61.65 ? 275 LYS A CD 1 +ATOM 2221 C CE . LYS A 1 275 ? 57.840 -3.167 3.121 1.00 63.34 ? 275 LYS A CE 1 +ATOM 2222 N NZ . LYS A 1 275 ? 56.486 -3.658 2.691 1.00 62.58 ? 275 LYS A NZ 1 +ATOM 2223 N N . LEU A 1 276 ? 60.693 2.268 -0.760 1.00 44.44 ? 276 LEU A N 1 +ATOM 2224 C CA . LEU A 1 276 ? 60.890 3.691 -0.845 1.00 42.55 ? 276 LEU A CA 1 +ATOM 2225 C C . LEU A 1 276 ? 60.102 4.340 -1.995 1.00 43.89 ? 276 LEU A C 1 +ATOM 2226 O O . LEU A 1 276 ? 59.399 5.346 -1.810 1.00 43.31 ? 276 LEU A O 1 +ATOM 2227 C CB . LEU A 1 276 ? 62.392 3.940 -0.924 1.00 39.24 ? 276 LEU A CB 1 +ATOM 2228 C CG . LEU A 1 276 ? 62.956 3.474 0.427 1.00 38.94 ? 276 LEU A CG 1 +ATOM 2229 C CD1 . LEU A 1 276 ? 64.433 3.152 0.361 1.00 35.92 ? 276 LEU A CD1 1 +ATOM 2230 C CD2 . LEU A 1 276 ? 62.662 4.546 1.477 1.00 37.13 ? 276 LEU A CD2 1 +ATOM 2231 N N . PRO A 1 277 ? 60.202 3.779 -3.205 1.00 44.67 ? 277 PRO A N 1 +ATOM 2232 C CA . PRO A 1 277 ? 59.445 4.397 -4.285 1.00 44.01 ? 277 PRO A CA 1 +ATOM 2233 C C . PRO A 1 277 ? 58.053 4.699 -3.805 1.00 44.93 ? 277 PRO A C 1 +ATOM 2234 O O . PRO A 1 277 ? 57.551 5.783 -4.026 1.00 46.38 ? 277 PRO A O 1 +ATOM 2235 C CB . PRO A 1 277 ? 59.468 3.333 -5.348 1.00 43.63 ? 277 PRO A CB 1 +ATOM 2236 C CG . PRO A 1 277 ? 60.873 2.830 -5.214 1.00 44.61 ? 277 PRO A CG 1 +ATOM 2237 C CD . PRO A 1 277 ? 61.059 2.697 -3.719 1.00 45.65 ? 277 PRO A CD 1 +ATOM 2238 N N . SER A 1 278 ? 57.437 3.754 -3.105 1.00 45.57 ? 278 SER A N 1 +ATOM 2239 C CA . SER A 1 278 ? 56.073 3.963 -2.621 1.00 45.66 ? 278 SER A CA 1 +ATOM 2240 C C . SER A 1 278 ? 55.961 5.019 -1.541 1.00 45.47 ? 278 SER A C 1 +ATOM 2241 O O . SER A 1 278 ? 54.953 5.735 -1.425 1.00 44.82 ? 278 SER A O 1 +ATOM 2242 C CB . SER A 1 278 ? 55.504 2.681 -2.073 1.00 46.26 ? 278 SER A CB 1 +ATOM 2243 O OG . SER A 1 278 ? 54.123 2.862 -1.817 1.00 50.18 ? 278 SER A OG 1 +ATOM 2244 N N . PHE A 1 279 ? 56.999 5.083 -0.724 1.00 45.21 ? 279 PHE A N 1 +ATOM 2245 C CA . PHE A 1 279 ? 57.047 6.052 0.345 1.00 43.21 ? 279 PHE A CA 1 +ATOM 2246 C C . PHE A 1 279 ? 57.211 7.403 -0.307 1.00 43.60 ? 279 PHE A C 1 +ATOM 2247 O O . PHE A 1 279 ? 56.507 8.358 0.036 1.00 43.64 ? 279 PHE A O 1 +ATOM 2248 C CB . PHE A 1 279 ? 58.201 5.728 1.292 1.00 40.77 ? 279 PHE A CB 1 +ATOM 2249 C CG . PHE A 1 279 ? 57.848 4.704 2.328 1.00 38.54 ? 279 PHE A CG 1 +ATOM 2250 C CD1 . PHE A 1 279 ? 56.722 4.877 3.130 1.00 37.15 ? 279 PHE A CD1 1 +ATOM 2251 C CD2 . PHE A 1 279 ? 58.635 3.583 2.519 1.00 39.55 ? 279 PHE A CD2 1 +ATOM 2252 C CE1 . PHE A 1 279 ? 56.384 3.967 4.095 1.00 35.62 ? 279 PHE A CE1 1 +ATOM 2253 C CE2 . PHE A 1 279 ? 58.306 2.641 3.503 1.00 38.62 ? 279 PHE A CE2 1 +ATOM 2254 C CZ . PHE A 1 279 ? 57.178 2.839 4.288 1.00 38.17 ? 279 PHE A CZ 1 +ATOM 2255 N N . TRP A 1 280 ? 58.125 7.490 -1.264 1.00 43.26 ? 280 TRP A N 1 +ATOM 2256 C CA . TRP A 1 280 ? 58.279 8.751 -1.933 1.00 44.32 ? 280 TRP A CA 1 +ATOM 2257 C C . TRP A 1 280 ? 56.887 9.068 -2.471 1.00 45.30 ? 280 TRP A C 1 +ATOM 2258 O O . TRP A 1 280 ? 56.323 10.122 -2.202 1.00 44.76 ? 280 TRP A O 1 +ATOM 2259 C CB . TRP A 1 280 ? 59.290 8.658 -3.089 1.00 44.14 ? 280 TRP A CB 1 +ATOM 2260 C CG . TRP A 1 280 ? 59.228 9.877 -4.000 1.00 43.99 ? 280 TRP A CG 1 +ATOM 2261 C CD1 . TRP A 1 280 ? 58.833 9.909 -5.311 1.00 44.84 ? 280 TRP A CD1 1 +ATOM 2262 C CD2 . TRP A 1 280 ? 59.458 11.238 -3.628 1.00 43.75 ? 280 TRP A CD2 1 +ATOM 2263 N NE1 . TRP A 1 280 ? 58.790 11.207 -5.777 1.00 44.06 ? 280 TRP A NE1 1 +ATOM 2264 C CE2 . TRP A 1 280 ? 59.169 12.042 -4.763 1.00 44.14 ? 280 TRP A CE2 1 +ATOM 2265 C CE3 . TRP A 1 280 ? 59.878 11.860 -2.448 1.00 42.60 ? 280 TRP A CE3 1 +ATOM 2266 C CZ2 . TRP A 1 280 ? 59.286 13.421 -4.746 1.00 44.06 ? 280 TRP A CZ2 1 +ATOM 2267 C CZ3 . TRP A 1 280 ? 59.995 13.225 -2.430 1.00 43.03 ? 280 TRP A CZ3 1 +ATOM 2268 C CH2 . TRP A 1 280 ? 59.700 13.996 -3.572 1.00 45.79 ? 280 TRP A CH2 1 +ATOM 2269 N N . ASN A 1 281 ? 56.308 8.108 -3.177 1.00 46.78 ? 281 ASN A N 1 +ATOM 2270 C CA . ASN A 1 281 ? 55.014 8.309 -3.787 1.00 48.87 ? 281 ASN A CA 1 +ATOM 2271 C C . ASN A 1 281 ? 53.882 8.781 -2.879 1.00 48.70 ? 281 ASN A C 1 +ATOM 2272 O O . ASN A 1 281 ? 53.157 9.708 -3.242 1.00 47.81 ? 281 ASN A O 1 +ATOM 2273 C CB . ASN A 1 281 ? 54.586 7.050 -4.542 1.00 52.30 ? 281 ASN A CB 1 +ATOM 2274 C CG . ASN A 1 281 ? 53.434 7.322 -5.524 1.00 56.29 ? 281 ASN A CG 1 +ATOM 2275 O OD1 . ASN A 1 281 ? 53.561 8.163 -6.433 1.00 56.70 ? 281 ASN A OD1 1 +ATOM 2276 N ND2 . ASN A 1 281 ? 52.306 6.611 -5.342 1.00 56.23 ? 281 ASN A ND2 1 +ATOM 2277 N N . ASN A 1 282 ? 53.701 8.160 -1.715 1.00 49.29 ? 282 ASN A N 1 +ATOM 2278 C CA . ASN A 1 282 ? 52.614 8.593 -0.827 1.00 49.17 ? 282 ASN A CA 1 +ATOM 2279 C C . ASN A 1 282 ? 52.938 9.829 -0.018 1.00 49.68 ? 282 ASN A C 1 +ATOM 2280 O O . ASN A 1 282 ? 52.172 10.172 0.880 1.00 50.16 ? 282 ASN A O 1 +ATOM 2281 C CB . ASN A 1 282 ? 52.228 7.513 0.158 1.00 49.95 ? 282 ASN A CB 1 +ATOM 2282 C CG . ASN A 1 282 ? 51.509 6.388 -0.480 1.00 51.49 ? 282 ASN A CG 1 +ATOM 2283 O OD1 . ASN A 1 282 ? 50.298 6.461 -0.723 1.00 52.13 ? 282 ASN A OD1 1 +ATOM 2284 N ND2 . ASN A 1 282 ? 52.246 5.319 -0.775 1.00 51.86 ? 282 ASN A ND2 1 +ATOM 2285 N N . ASN A 1 283 ? 54.062 10.491 -0.312 1.00 48.99 ? 283 ASN A N 1 +ATOM 2286 C CA . ASN A 1 283 ? 54.423 11.697 0.423 1.00 47.23 ? 283 ASN A CA 1 +ATOM 2287 C C . ASN A 1 283 ? 54.718 12.932 -0.416 1.00 46.79 ? 283 ASN A C 1 +ATOM 2288 O O . ASN A 1 283 ? 54.476 14.050 0.014 1.00 47.11 ? 283 ASN A O 1 +ATOM 2289 C CB . ASN A 1 283 ? 55.564 11.378 1.367 1.00 44.87 ? 283 ASN A CB 1 +ATOM 2290 C CG . ASN A 1 283 ? 55.112 10.523 2.509 1.00 43.63 ? 283 ASN A CG 1 +ATOM 2291 O OD1 . ASN A 1 283 ? 54.904 9.320 2.364 1.00 41.34 ? 283 ASN A OD1 1 +ATOM 2292 N ND2 . ASN A 1 283 ? 54.915 11.148 3.654 1.00 43.50 ? 283 ASN A ND2 1 +ATOM 2293 N N . LYS A 1 284 ? 55.226 12.716 -1.616 1.00 46.95 ? 284 LYS A N 1 +ATOM 2294 C CA . LYS A 1 284 ? 55.521 13.777 -2.567 1.00 47.16 ? 284 LYS A CA 1 +ATOM 2295 C C . LYS A 1 284 ? 54.615 14.985 -2.361 1.00 47.01 ? 284 LYS A C 1 +ATOM 2296 O O . LYS A 1 284 ? 54.998 15.983 -1.763 1.00 47.77 ? 284 LYS A O 1 +ATOM 2297 C CB . LYS A 1 284 ? 55.305 13.217 -3.962 1.00 48.72 ? 284 LYS A CB 1 +ATOM 2298 C CG . LYS A 1 284 ? 56.023 13.927 -5.079 1.00 52.36 ? 284 LYS A CG 1 +ATOM 2299 C CD . LYS A 1 284 ? 56.068 13.035 -6.345 1.00 53.92 ? 284 LYS A CD 1 +ATOM 2300 C CE . LYS A 1 284 ? 54.697 12.804 -6.972 1.00 51.87 ? 284 LYS A CE 1 +ATOM 2301 N NZ . LYS A 1 284 ? 54.811 11.885 -8.127 1.00 53.93 ? 284 LYS A NZ 1 +ATOM 2302 N N . ALA A 1 285 ? 53.394 14.883 -2.852 1.00 47.27 ? 285 ALA A N 1 +ATOM 2303 C CA . ALA A 1 285 ? 52.428 15.971 -2.729 1.00 48.06 ? 285 ALA A CA 1 +ATOM 2304 C C . ALA A 1 285 ? 52.272 16.553 -1.319 1.00 47.51 ? 285 ALA A C 1 +ATOM 2305 O O . ALA A 1 285 ? 51.971 17.732 -1.142 1.00 46.79 ? 285 ALA A O 1 +ATOM 2306 C CB . ALA A 1 285 ? 51.076 15.496 -3.242 1.00 48.65 ? 285 ALA A CB 1 +ATOM 2307 N N . SER A 1 286 ? 52.457 15.721 -0.311 1.00 47.91 ? 286 SER A N 1 +ATOM 2308 C CA . SER A 1 286 ? 52.317 16.207 1.049 1.00 48.42 ? 286 SER A CA 1 +ATOM 2309 C C . SER A 1 286 ? 53.461 17.124 1.475 1.00 47.19 ? 286 SER A C 1 +ATOM 2310 O O . SER A 1 286 ? 53.212 18.153 2.101 1.00 45.61 ? 286 SER A O 1 +ATOM 2311 C CB . SER A 1 286 ? 52.164 15.031 2.019 1.00 49.47 ? 286 SER A CB 1 +ATOM 2312 O OG . SER A 1 286 ? 50.838 14.532 1.976 1.00 49.15 ? 286 SER A OG 1 +ATOM 2313 N N . LEU A 1 287 ? 54.704 16.755 1.152 1.00 46.22 ? 287 LEU A N 1 +ATOM 2314 C CA . LEU A 1 287 ? 55.840 17.619 1.489 1.00 44.95 ? 287 LEU A CA 1 +ATOM 2315 C C . LEU A 1 287 ? 55.594 18.956 0.774 1.00 44.50 ? 287 LEU A C 1 +ATOM 2316 O O . LEU A 1 287 ? 55.573 20.010 1.409 1.00 44.82 ? 287 LEU A O 1 +ATOM 2317 C CB . LEU A 1 287 ? 57.196 17.047 1.018 1.00 41.76 ? 287 LEU A CB 1 +ATOM 2318 C CG . LEU A 1 287 ? 57.846 15.784 1.595 1.00 39.51 ? 287 LEU A CG 1 +ATOM 2319 C CD1 . LEU A 1 287 ? 57.964 15.849 3.090 1.00 38.22 ? 287 LEU A CD1 1 +ATOM 2320 C CD2 . LEU A 1 287 ? 57.042 14.611 1.189 1.00 38.62 ? 287 LEU A CD2 1 +ATOM 2321 N N . ILE A 1 288 ? 55.372 18.912 -0.537 1.00 43.37 ? 288 ILE A N 1 +ATOM 2322 C CA . ILE A 1 288 ? 55.158 20.152 -1.278 1.00 43.27 ? 288 ILE A CA 1 +ATOM 2323 C C . ILE A 1 288 ? 54.006 21.024 -0.726 1.00 44.37 ? 288 ILE A C 1 +ATOM 2324 O O . ILE A 1 288 ? 54.198 22.220 -0.468 1.00 44.72 ? 288 ILE A O 1 +ATOM 2325 C CB . ILE A 1 288 ? 54.922 19.889 -2.815 1.00 41.11 ? 288 ILE A CB 1 +ATOM 2326 C CG1 . ILE A 1 288 ? 56.048 19.016 -3.396 1.00 39.62 ? 288 ILE A CG1 1 +ATOM 2327 C CG2 . ILE A 1 288 ? 54.823 21.204 -3.562 1.00 35.37 ? 288 ILE A CG2 1 +ATOM 2328 C CD1 . ILE A 1 288 ? 57.458 19.541 -3.212 1.00 38.44 ? 288 ILE A CD1 1 +ATOM 2329 N N . GLU A 1 289 ? 52.825 20.440 -0.533 1.00 44.75 ? 289 GLU A N 1 +ATOM 2330 C CA . GLU A 1 289 ? 51.692 21.220 -0.043 1.00 44.65 ? 289 GLU A CA 1 +ATOM 2331 C C . GLU A 1 289 ? 51.928 21.852 1.317 1.00 44.26 ? 289 GLU A C 1 +ATOM 2332 O O . GLU A 1 289 ? 51.345 22.899 1.646 1.00 42.99 ? 289 GLU A O 1 +ATOM 2333 C CB . GLU A 1 289 ? 50.434 20.365 0.003 1.00 44.92 ? 289 GLU A CB 1 +ATOM 2334 C CG . GLU A 1 289 ? 49.534 20.565 -1.201 1.00 47.90 ? 289 GLU A CG 1 +ATOM 2335 C CD . GLU A 1 289 ? 48.869 21.959 -1.256 1.00 50.34 ? 289 GLU A CD 1 +ATOM 2336 O OE1 . GLU A 1 289 ? 48.874 22.553 -2.351 1.00 52.03 ? 289 GLU A OE1 1 +ATOM 2337 O OE2 . GLU A 1 289 ? 48.323 22.466 -0.237 1.00 50.96 ? 289 GLU A OE2 1 +ATOM 2338 N N . TYR A 1 290 ? 52.806 21.216 2.090 1.00 44.17 ? 290 TYR A N 1 +ATOM 2339 C CA . TYR A 1 290 ? 53.140 21.655 3.446 1.00 42.59 ? 290 TYR A CA 1 +ATOM 2340 C C . TYR A 1 290 ? 54.060 22.862 3.387 1.00 42.38 ? 290 TYR A C 1 +ATOM 2341 O O . TYR A 1 290 ? 53.772 23.905 3.983 1.00 42.21 ? 290 TYR A O 1 +ATOM 2342 C CB . TYR A 1 290 ? 53.806 20.508 4.210 1.00 41.04 ? 290 TYR A CB 1 +ATOM 2343 C CG . TYR A 1 290 ? 53.965 20.794 5.656 1.00 39.23 ? 290 TYR A CG 1 +ATOM 2344 C CD1 . TYR A 1 290 ? 52.866 20.772 6.510 1.00 39.46 ? 290 TYR A CD1 1 +ATOM 2345 C CD2 . TYR A 1 290 ? 55.198 21.214 6.153 1.00 39.45 ? 290 TYR A CD2 1 +ATOM 2346 C CE1 . TYR A 1 290 ? 52.988 21.183 7.846 1.00 41.65 ? 290 TYR A CE1 1 +ATOM 2347 C CE2 . TYR A 1 290 ? 55.350 21.631 7.472 1.00 40.09 ? 290 TYR A CE2 1 +ATOM 2348 C CZ . TYR A 1 290 ? 54.243 21.621 8.323 1.00 42.27 ? 290 TYR A CZ 1 +ATOM 2349 O OH . TYR A 1 290 ? 54.395 22.079 9.623 1.00 42.67 ? 290 TYR A OH 1 +ATOM 2350 N N . ILE A 1 291 ? 55.172 22.699 2.674 1.00 42.44 ? 291 ILE A N 1 +ATOM 2351 C CA . ILE A 1 291 ? 56.150 23.765 2.474 1.00 41.29 ? 291 ILE A CA 1 +ATOM 2352 C C . ILE A 1 291 ? 55.331 24.981 2.058 1.00 41.43 ? 291 ILE A C 1 +ATOM 2353 O O . ILE A 1 291 ? 55.348 26.031 2.692 1.00 40.84 ? 291 ILE A O 1 +ATOM 2354 C CB . ILE A 1 291 ? 57.172 23.375 1.327 1.00 40.26 ? 291 ILE A CB 1 +ATOM 2355 C CG1 . ILE A 1 291 ? 58.348 22.573 1.915 1.00 40.15 ? 291 ILE A CG1 1 +ATOM 2356 C CG2 . ILE A 1 291 ? 57.668 24.608 0.594 1.00 39.17 ? 291 ILE A CG2 1 +ATOM 2357 C CD1 . ILE A 1 291 ? 59.325 22.009 0.892 1.00 36.33 ? 291 ILE A CD1 1 +ATOM 2358 N N . LYS A 1 292 ? 54.567 24.790 0.998 1.00 42.02 ? 292 LYS A N 1 +ATOM 2359 C CA . LYS A 1 292 ? 53.735 25.828 0.428 1.00 42.48 ? 292 LYS A CA 1 +ATOM 2360 C C . LYS A 1 292 ? 52.948 26.623 1.454 1.00 41.75 ? 292 LYS A C 1 +ATOM 2361 O O . LYS A 1 292 ? 52.519 27.729 1.186 1.00 39.71 ? 292 LYS A O 1 +ATOM 2362 C CB . LYS A 1 292 ? 52.798 25.169 -0.596 1.00 45.01 ? 292 LYS A CB 1 +ATOM 2363 C CG . LYS A 1 292 ? 51.904 26.118 -1.399 1.00 48.28 ? 292 LYS A CG 1 +ATOM 2364 C CD . LYS A 1 292 ? 51.596 25.591 -2.817 1.00 47.86 ? 292 LYS A CD 1 +ATOM 2365 C CE . LYS A 1 292 ? 50.883 24.248 -2.809 1.00 47.50 ? 292 LYS A CE 1 +ATOM 2366 N NZ . LYS A 1 292 ? 50.419 23.826 -4.167 1.00 47.17 ? 292 LYS A NZ 1 +ATOM 2367 N N . GLN A 1 293 ? 52.770 26.063 2.642 1.00 43.31 ? 293 GLN A N 1 +ATOM 2368 C CA . GLN A 1 293 ? 51.972 26.720 3.688 1.00 43.70 ? 293 GLN A CA 1 +ATOM 2369 C C . GLN A 1 293 ? 52.707 27.830 4.423 1.00 44.28 ? 293 GLN A C 1 +ATOM 2370 O O . GLN A 1 293 ? 52.110 28.587 5.218 1.00 44.96 ? 293 GLN A O 1 +ATOM 2371 C CB . GLN A 1 293 ? 51.483 25.671 4.694 1.00 42.45 ? 293 GLN A CB 1 +ATOM 2372 C CG . GLN A 1 293 ? 50.499 24.693 4.122 1.00 42.52 ? 293 GLN A CG 1 +ATOM 2373 C CD . GLN A 1 293 ? 49.350 25.389 3.425 1.00 43.20 ? 293 GLN A CD 1 +ATOM 2374 O OE1 . GLN A 1 293 ? 48.870 26.416 3.890 1.00 43.21 ? 293 GLN A OE1 1 +ATOM 2375 N NE2 . GLN A 1 293 ? 48.904 24.831 2.304 1.00 44.35 ? 293 GLN A NE2 1 +ATOM 2376 N N . VAL A 1 294 ? 54.007 27.913 4.151 1.00 43.19 ? 294 VAL A N 1 +ATOM 2377 C CA . VAL A 1 294 ? 54.874 28.905 4.764 1.00 41.47 ? 294 VAL A CA 1 +ATOM 2378 C C . VAL A 1 294 ? 54.376 30.304 4.367 1.00 41.92 ? 294 VAL A C 1 +ATOM 2379 O O . VAL A 1 294 ? 54.884 31.326 4.843 1.00 43.62 ? 294 VAL A O 1 +ATOM 2380 C CB . VAL A 1 294 ? 56.336 28.678 4.297 1.00 39.88 ? 294 VAL A CB 1 +ATOM 2381 C CG1 . VAL A 1 294 ? 56.615 29.462 3.042 1.00 38.76 ? 294 VAL A CG1 1 +ATOM 2382 C CG2 . VAL A 1 294 ? 57.299 29.009 5.412 1.00 39.17 ? 294 VAL A CG2 1 +ATOM 2383 N N . HIS A 1 295 ? 53.350 30.342 3.519 1.00 40.34 ? 295 HIS A N 1 +ATOM 2384 C CA . HIS A 1 295 ? 52.804 31.596 3.057 1.00 38.08 ? 295 HIS A CA 1 +ATOM 2385 C C . HIS A 1 295 ? 51.420 31.912 3.595 1.00 39.08 ? 295 HIS A C 1 +ATOM 2386 O O . HIS A 1 295 ? 50.660 32.613 2.937 1.00 41.35 ? 295 HIS A O 1 +ATOM 2387 C CB . HIS A 1 295 ? 52.777 31.622 1.526 1.00 35.54 ? 295 HIS A CB 1 +ATOM 2388 C CG . HIS A 1 295 ? 54.125 31.492 0.896 1.00 35.20 ? 295 HIS A CG 1 +ATOM 2389 N ND1 . HIS A 1 295 ? 55.115 32.438 1.057 1.00 37.64 ? 295 HIS A ND1 1 +ATOM 2390 C CD2 . HIS A 1 295 ? 54.685 30.477 0.198 1.00 35.84 ? 295 HIS A CD2 1 +ATOM 2391 C CE1 . HIS A 1 295 ? 56.232 32.002 0.501 1.00 38.49 ? 295 HIS A CE1 1 +ATOM 2392 N NE2 . HIS A 1 295 ? 55.998 30.811 -0.026 1.00 36.92 ? 295 HIS A NE2 1 +ATOM 2393 N N . LEU A 1 296 ? 51.063 31.424 4.776 1.00 39.18 ? 296 LEU A N 1 +ATOM 2394 C CA . LEU A 1 296 ? 49.731 31.747 5.303 1.00 40.05 ? 296 LEU A CA 1 +ATOM 2395 C C . LEU A 1 296 ? 49.812 33.080 6.027 1.00 40.72 ? 296 LEU A C 1 +ATOM 2396 O O . LEU A 1 296 ? 50.871 33.463 6.494 1.00 41.97 ? 296 LEU A O 1 +ATOM 2397 C CB . LEU A 1 296 ? 49.267 30.686 6.312 1.00 40.53 ? 296 LEU A CB 1 +ATOM 2398 C CG . LEU A 1 296 ? 48.892 29.243 5.977 1.00 38.89 ? 296 LEU A CG 1 +ATOM 2399 C CD1 . LEU A 1 296 ? 49.129 28.421 7.199 1.00 38.66 ? 296 LEU A CD1 1 +ATOM 2400 C CD2 . LEU A 1 296 ? 47.434 29.132 5.563 1.00 39.36 ? 296 LEU A CD2 1 +ATOM 2401 N N . GLY A 1 297 ? 48.703 33.792 6.126 1.00 42.92 ? 297 GLY A N 1 +ATOM 2402 C CA . GLY A 1 297 ? 48.696 35.056 6.863 1.00 45.80 ? 297 GLY A CA 1 +ATOM 2403 C C . GLY A 1 297 ? 49.418 36.287 6.330 1.00 47.30 ? 297 GLY A C 1 +ATOM 2404 O O . GLY A 1 297 ? 49.369 36.575 5.139 1.00 46.84 ? 297 GLY A O 1 +ATOM 2405 N N . VAL A 1 298 ? 50.080 37.014 7.235 1.00 49.35 ? 298 VAL A N 1 +ATOM 2406 C CA . VAL A 1 298 ? 50.817 38.236 6.901 1.00 50.46 ? 298 VAL A CA 1 +ATOM 2407 C C . VAL A 1 298 ? 52.267 38.273 7.307 1.00 51.41 ? 298 VAL A C 1 +ATOM 2408 O O . VAL A 1 298 ? 52.717 37.508 8.163 1.00 51.99 ? 298 VAL A O 1 +ATOM 2409 C CB . VAL A 1 298 ? 50.213 39.466 7.549 1.00 50.63 ? 298 VAL A CB 1 +ATOM 2410 C CG1 . VAL A 1 298 ? 48.884 39.779 6.905 1.00 52.06 ? 298 VAL A CG1 1 +ATOM 2411 C CG2 . VAL A 1 298 ? 50.073 39.231 9.043 1.00 48.74 ? 298 VAL A CG2 1 +ATOM 2412 N N . LYS A 1 299 ? 52.981 39.215 6.690 1.00 52.35 ? 299 LYS A N 1 +ATOM 2413 C CA . LYS A 1 299 ? 54.405 39.444 6.937 1.00 52.22 ? 299 LYS A CA 1 +ATOM 2414 C C . LYS A 1 299 ? 54.711 40.898 6.602 1.00 53.02 ? 299 LYS A C 1 +ATOM 2415 O O . LYS A 1 299 ? 53.887 41.591 6.013 1.00 54.51 ? 299 LYS A O 1 +ATOM 2416 C CB . LYS A 1 299 ? 55.250 38.545 6.048 1.00 50.49 ? 299 LYS A CB 1 +ATOM 2417 C CG . LYS A 1 299 ? 54.959 38.731 4.557 1.00 48.92 ? 299 LYS A CG 1 +ATOM 2418 C CD . LYS A 1 299 ? 56.004 37.995 3.713 1.00 47.82 ? 299 LYS A CD 1 +ATOM 2419 C CE . LYS A 1 299 ? 55.541 37.804 2.293 1.00 45.92 ? 299 LYS A CE 1 +ATOM 2420 N NZ . LYS A 1 299 ? 56.448 36.877 1.596 1.00 46.10 ? 299 LYS A NZ 1 +ATOM 2421 N N . GLY A 1 300 ? 55.893 41.355 6.975 1.00 53.04 ? 300 GLY A N 1 +ATOM 2422 C CA . GLY A 1 300 ? 56.273 42.722 6.694 1.00 55.05 ? 300 GLY A CA 1 +ATOM 2423 C C . GLY A 1 300 ? 57.345 43.112 7.685 1.00 57.62 ? 300 GLY A C 1 +ATOM 2424 O O . GLY A 1 300 ? 57.869 42.253 8.416 1.00 57.87 ? 300 GLY A O 1 +ATOM 2425 N N . GLN A 1 301 ? 57.716 44.387 7.703 1.00 57.64 ? 301 GLN A N 1 +ATOM 2426 C CA . GLN A 1 301 ? 58.696 44.822 8.676 1.00 57.99 ? 301 GLN A CA 1 +ATOM 2427 C C . GLN A 1 301 ? 58.145 46.068 9.335 1.00 58.90 ? 301 GLN A C 1 +ATOM 2428 O O . GLN A 1 301 ? 57.163 46.640 8.846 1.00 58.87 ? 301 GLN A O 1 +ATOM 2429 C CB . GLN A 1 301 ? 60.083 45.036 8.052 1.00 57.30 ? 301 GLN A CB 1 +ATOM 2430 C CG . GLN A 1 301 ? 60.133 45.615 6.655 1.00 56.81 ? 301 GLN A CG 1 +ATOM 2431 C CD . GLN A 1 301 ? 61.545 45.600 6.099 1.00 55.10 ? 301 GLN A CD 1 +ATOM 2432 O OE1 . GLN A 1 301 ? 61.807 46.090 5.004 1.00 56.18 ? 301 GLN A OE1 1 +ATOM 2433 N NE2 . GLN A 1 301 ? 62.462 45.032 6.857 1.00 53.92 ? 301 GLN A NE2 1 +ATOM 2434 N N . VAL A 1 302 ? 58.759 46.456 10.453 1.00 59.46 ? 302 VAL A N 1 +ATOM 2435 C CA . VAL A 1 302 ? 58.320 47.589 11.260 1.00 59.54 ? 302 VAL A CA 1 +ATOM 2436 C C . VAL A 1 302 ? 59.336 48.700 11.432 1.00 59.29 ? 302 VAL A C 1 +ATOM 2437 O O . VAL A 1 302 ? 60.425 48.456 11.939 1.00 58.31 ? 302 VAL A O 1 +ATOM 2438 C CB . VAL A 1 302 ? 57.953 47.095 12.679 1.00 60.83 ? 302 VAL A CB 1 +ATOM 2439 C CG1 . VAL A 1 302 ? 57.725 48.280 13.621 1.00 60.37 ? 302 VAL A CG1 1 +ATOM 2440 C CG2 . VAL A 1 302 ? 56.732 46.177 12.612 1.00 60.94 ? 302 VAL A CG2 1 +ATOM 2441 N N . PHE A 1 303 ? 58.981 49.922 11.038 1.00 60.18 ? 303 PHE A N 1 +ATOM 2442 C CA . PHE A 1 303 ? 59.906 51.047 11.237 1.00 61.29 ? 303 PHE A CA 1 +ATOM 2443 C C . PHE A 1 303 ? 59.325 52.197 12.049 1.00 61.38 ? 303 PHE A C 1 +ATOM 2444 O O . PHE A 1 303 ? 58.103 52.396 12.109 1.00 60.75 ? 303 PHE A O 1 +ATOM 2445 C CB . PHE A 1 303 ? 60.401 51.693 9.930 1.00 61.32 ? 303 PHE A CB 1 +ATOM 2446 C CG . PHE A 1 303 ? 60.299 50.838 8.724 1.00 61.50 ? 303 PHE A CG 1 +ATOM 2447 C CD1 . PHE A 1 303 ? 59.085 50.702 8.061 1.00 61.97 ? 303 PHE A CD1 1 +ATOM 2448 C CD2 . PHE A 1 303 ? 61.440 50.243 8.188 1.00 61.77 ? 303 PHE A CD2 1 +ATOM 2449 C CE1 . PHE A 1 303 ? 59.004 49.985 6.863 1.00 63.16 ? 303 PHE A CE1 1 +ATOM 2450 C CE2 . PHE A 1 303 ? 61.375 49.528 6.996 1.00 63.27 ? 303 PHE A CE2 1 +ATOM 2451 C CZ . PHE A 1 303 ? 60.148 49.399 6.326 1.00 63.00 ? 303 PHE A CZ 1 +ATOM 2452 N N . ASP A 1 304 ? 60.233 52.969 12.645 1.00 62.19 ? 304 ASP A N 1 +ATOM 2453 C CA . ASP A 1 304 ? 59.882 54.159 13.412 1.00 63.30 ? 304 ASP A CA 1 +ATOM 2454 C C . ASP A 1 304 ? 59.692 55.250 12.372 1.00 63.74 ? 304 ASP A C 1 +ATOM 2455 O O . ASP A 1 304 ? 59.848 55.005 11.178 1.00 64.20 ? 304 ASP A O 1 +ATOM 2456 C CB . ASP A 1 304 ? 61.009 54.556 14.365 1.00 62.77 ? 304 ASP A CB 1 +ATOM 2457 C CG . ASP A 1 304 ? 62.355 54.642 13.670 1.00 63.91 ? 304 ASP A CG 1 +ATOM 2458 O OD1 . ASP A 1 304 ? 62.372 54.807 12.420 1.00 63.12 ? 304 ASP A OD1 1 +ATOM 2459 O OD2 . ASP A 1 304 ? 63.393 54.550 14.377 1.00 64.52 ? 304 ASP A OD2 1 +ATOM 2460 N N . GLN A 1 305 ? 59.386 56.459 12.818 1.00 64.92 ? 305 GLN A N 1 +ATOM 2461 C CA . GLN A 1 305 ? 59.147 57.562 11.889 1.00 65.59 ? 305 GLN A CA 1 +ATOM 2462 C C . GLN A 1 305 ? 60.327 57.947 10.972 1.00 64.90 ? 305 GLN A C 1 +ATOM 2463 O O . GLN A 1 305 ? 60.127 58.669 9.997 1.00 64.89 ? 305 GLN A O 1 +ATOM 2464 C CB . GLN A 1 305 ? 58.793 58.826 12.665 1.00 99.99 ? 305 GLN A CB 1 +ATOM 2465 C CG . GLN A 1 305 ? 57.422 58.661 13.310 0.0000 99.99 ? 305 GLN A CG 1 +ATOM 2466 C CD . GLN A 1 305 ? 56.315 58.714 12.267 0.0000 99.99 ? 305 GLN A CD 1 +ATOM 2467 O OE1 . GLN A 1 305 ? 56.585 58.872 11.079 0.0000 99.99 ? 305 GLN A OE1 1 +ATOM 2468 N NE2 . GLN A 1 305 ? 55.065 58.580 12.716 0.0000 99.99 ? 305 GLN A NE2 1 +ATOM 2469 N N . ASN A 1 306 ? 61.537 57.470 11.274 1.00 64.36 ? 306 ASN A N 1 +ATOM 2470 C CA . ASN A 1 306 ? 62.716 57.767 10.444 1.00 64.50 ? 306 ASN A CA 1 +ATOM 2471 C C . ASN A 1 306 ? 62.967 56.594 9.512 1.00 64.87 ? 306 ASN A C 1 +ATOM 2472 O O . ASN A 1 306 ? 64.094 56.406 9.031 1.00 64.49 ? 306 ASN A O 1 +ATOM 2473 C CB . ASN A 1 306 ? 63.977 57.958 11.286 1.00 63.28 ? 306 ASN A CB 1 +ATOM 2474 C CG . ASN A 1 306 ? 63.754 58.856 12.453 1.00 62.68 ? 306 ASN A CG 1 +ATOM 2475 O OD1 . ASN A 1 306 ? 64.365 58.677 13.506 1.00 62.11 ? 306 ASN A OD1 1 +ATOM 2476 N ND2 . ASN A 1 306 ? 62.872 59.839 12.286 1.00 63.12 ? 306 ASN A ND2 1 +ATOM 2477 N N . GLY A 1 307 ? 61.914 55.804 9.288 1.00 64.89 ? 307 GLY A N 1 +ATOM 2478 C CA . GLY A 1 307 ? 61.997 54.653 8.408 1.00 63.36 ? 307 GLY A CA 1 +ATOM 2479 C C . GLY A 1 307 ? 63.159 53.763 8.782 1.00 62.78 ? 307 GLY A C 1 +ATOM 2480 O O . GLY A 1 307 ? 64.018 53.422 7.945 1.00 62.96 ? 307 GLY A O 1 +ATOM 2481 N N . ASN A 1 308 ? 63.206 53.386 10.050 1.00 61.28 ? 308 ASN A N 1 +ATOM 2482 C CA . ASN A 1 308 ? 64.285 52.525 10.496 1.00 60.73 ? 308 ASN A CA 1 +ATOM 2483 C C . ASN A 1 308 ? 63.738 51.256 11.101 1.00 58.49 ? 308 ASN A C 1 +ATOM 2484 O O . ASN A 1 308 ? 63.058 51.286 12.107 1.00 59.00 ? 308 ASN A O 1 +ATOM 2485 C CB . ASN A 1 308 ? 65.170 53.281 11.485 1.00 62.75 ? 308 ASN A CB 1 +ATOM 2486 C CG . ASN A 1 308 ? 66.100 54.282 10.788 1.00 64.57 ? 308 ASN A CG 1 +ATOM 2487 O OD1 . ASN A 1 308 ? 66.411 55.348 11.337 1.00 65.09 ? 308 ASN A OD1 1 +ATOM 2488 N ND2 . ASN A 1 308 ? 66.556 53.931 9.578 1.00 64.49 ? 308 ASN A ND2 1 +ATOM 2489 N N . PRO A 1 309 ? 64.009 50.114 10.473 1.00 57.04 ? 309 PRO A N 1 +ATOM 2490 C CA . PRO A 1 309 ? 63.489 48.872 11.039 1.00 56.29 ? 309 PRO A CA 1 +ATOM 2491 C C . PRO A 1 309 ? 63.862 48.735 12.508 1.00 54.47 ? 309 PRO A C 1 +ATOM 2492 O O . PRO A 1 309 ? 65.053 48.706 12.839 1.00 54.86 ? 309 PRO A O 1 +ATOM 2493 C CB . PRO A 1 309 ? 64.163 47.805 10.186 1.00 56.75 ? 309 PRO A CB 1 +ATOM 2494 C CG . PRO A 1 309 ? 65.484 48.452 9.863 1.00 57.07 ? 309 PRO A CG 1 +ATOM 2495 C CD . PRO A 1 309 ? 65.027 49.827 9.454 1.00 57.21 ? 309 PRO A CD 1 +ATOM 2496 N N . LEU A 1 310 ? 62.854 48.669 13.378 1.00 51.09 ? 310 LEU A N 1 +ATOM 2497 C CA . LEU A 1 310 ? 63.107 48.501 14.792 1.00 48.33 ? 310 LEU A CA 1 +ATOM 2498 C C . LEU A 1 310 ? 63.082 47.008 14.969 1.00 47.36 ? 310 LEU A C 1 +ATOM 2499 O O . LEU A 1 310 ? 62.082 46.358 14.704 1.00 45.39 ? 310 LEU A O 1 +ATOM 2500 C CB . LEU A 1 310 ? 61.985 49.070 15.655 1.00 50.59 ? 310 LEU A CB 1 +ATOM 2501 C CG . LEU A 1 310 ? 61.223 50.361 15.337 1.00 52.17 ? 310 LEU A CG 1 +ATOM 2502 C CD1 . LEU A 1 310 ? 59.913 50.419 16.143 1.00 49.09 ? 310 LEU A CD1 1 +ATOM 2503 C CD2 . LEU A 1 310 ? 62.119 51.555 15.637 1.00 53.07 ? 310 LEU A CD2 1 +ATOM 2504 N N . PRO A 1 311 ? 64.192 46.430 15.401 1.00 47.64 ? 311 PRO A N 1 +ATOM 2505 C CA . PRO A 1 311 ? 64.213 44.984 15.599 1.00 48.88 ? 311 PRO A CA 1 +ATOM 2506 C C . PRO A 1 311 ? 63.687 44.682 17.004 1.00 48.70 ? 311 PRO A C 1 +ATOM 2507 O O . PRO A 1 311 ? 63.190 45.561 17.690 1.00 48.37 ? 311 PRO A O 1 +ATOM 2508 C CB . PRO A 1 311 ? 65.692 44.659 15.468 1.00 49.23 ? 311 PRO A CB 1 +ATOM 2509 C CG . PRO A 1 311 ? 66.317 45.829 16.145 1.00 46.47 ? 311 PRO A CG 1 +ATOM 2510 C CD . PRO A 1 311 ? 65.539 46.994 15.565 1.00 47.04 ? 311 PRO A CD 1 +ATOM 2511 N N . ASN A 1 312 ? 63.789 43.435 17.422 1.00 48.81 ? 312 ASN A N 1 +ATOM 2512 C CA . ASN A 1 312 ? 63.359 43.061 18.749 1.00 49.45 ? 312 ASN A CA 1 +ATOM 2513 C C . ASN A 1 312 ? 62.012 43.581 19.277 1.00 48.38 ? 312 ASN A C 1 +ATOM 2514 O O . ASN A 1 312 ? 61.728 43.496 20.461 1.00 46.85 ? 312 ASN A O 1 +ATOM 2515 C CB . ASN A 1 312 ? 64.449 43.450 19.719 1.00 51.68 ? 312 ASN A CB 1 +ATOM 2516 C CG . ASN A 1 312 ? 64.483 42.547 20.890 1.00 54.81 ? 312 ASN A CG 1 +ATOM 2517 O OD1 . ASN A 1 312 ? 63.598 42.582 21.749 1.00 56.88 ? 312 ASN A OD1 1 +ATOM 2518 N ND2 . ASN A 1 312 ? 65.486 41.683 20.924 1.00 57.99 ? 312 ASN A ND2 1 +ATOM 2519 N N . VAL A 1 313 ? 61.181 44.123 18.413 1.00 48.92 ? 313 VAL A N 1 +ATOM 2520 C CA . VAL A 1 313 ? 59.895 44.627 18.860 1.00 50.12 ? 313 VAL A CA 1 +ATOM 2521 C C . VAL A 1 313 ? 58.933 43.453 18.904 1.00 52.07 ? 313 VAL A C 1 +ATOM 2522 O O . VAL A 1 313 ? 59.198 42.427 18.281 1.00 53.69 ? 313 VAL A O 1 +ATOM 2523 C CB . VAL A 1 313 ? 59.373 45.684 17.878 1.00 48.46 ? 313 VAL A CB 1 +ATOM 2524 C CG1 . VAL A 1 313 ? 57.874 45.831 17.993 1.00 47.82 ? 313 VAL A CG1 1 +ATOM 2525 C CG2 . VAL A 1 313 ? 60.049 46.996 18.159 1.00 48.57 ? 313 VAL A CG2 1 +ATOM 2526 N N . ILE A 1 314 ? 57.828 43.593 19.636 1.00 52.46 ? 314 ILE A N 1 +ATOM 2527 C CA . ILE A 1 314 ? 56.828 42.526 19.708 1.00 51.93 ? 314 ILE A CA 1 +ATOM 2528 C C . ILE A 1 314 ? 55.720 42.763 18.696 1.00 52.41 ? 314 ILE A C 1 +ATOM 2529 O O . ILE A 1 314 ? 55.108 43.825 18.664 1.00 53.11 ? 314 ILE A O 1 +ATOM 2530 C CB . ILE A 1 314 ? 56.151 42.430 21.115 1.00 50.87 ? 314 ILE A CB 1 +ATOM 2531 C CG1 . ILE A 1 314 ? 57.082 41.719 22.099 1.00 50.24 ? 314 ILE A CG1 1 +ATOM 2532 C CG2 . ILE A 1 314 ? 54.818 41.690 21.018 1.00 47.87 ? 314 ILE A CG2 1 +ATOM 2533 C CD1 . ILE A 1 314 ? 56.516 41.588 23.484 1.00 47.82 ? 314 ILE A CD1 1 +ATOM 2534 N N . VAL A 1 315 ? 55.460 41.778 17.856 1.00 52.77 ? 315 VAL A N 1 +ATOM 2535 C CA . VAL A 1 315 ? 54.366 41.924 16.918 1.00 53.24 ? 315 VAL A CA 1 +ATOM 2536 C C . VAL A 1 315 ? 53.516 40.665 16.933 1.00 53.42 ? 315 VAL A C 1 +ATOM 2537 O O . VAL A 1 315 ? 53.928 39.640 16.411 1.00 53.10 ? 315 VAL A O 1 +ATOM 2538 C CB . VAL A 1 315 ? 54.857 42.151 15.479 1.00 53.15 ? 315 VAL A CB 1 +ATOM 2539 C CG1 . VAL A 1 315 ? 53.682 42.571 14.592 1.00 51.63 ? 315 VAL A CG1 1 +ATOM 2540 C CG2 . VAL A 1 315 ? 55.960 43.187 15.462 1.00 53.31 ? 315 VAL A CG2 1 +ATOM 2541 N N . GLU A 1 316 ? 52.362 40.710 17.578 1.00 54.20 ? 316 GLU A N 1 +ATOM 2542 C CA . GLU A 1 316 ? 51.503 39.553 17.536 1.00 57.24 ? 316 GLU A CA 1 +ATOM 2543 C C . GLU A 1 316 ? 50.072 39.958 17.512 1.00 58.67 ? 316 GLU A C 1 +ATOM 2544 O O . GLU A 1 316 ? 49.763 41.101 17.802 1.00 58.87 ? 316 GLU A O 1 +ATOM 2545 C CB . GLU A 1 316 ? 51.780 38.543 18.653 1.00 59.07 ? 316 GLU A CB 1 +ATOM 2546 C CG . GLU A 1 316 ? 52.051 39.010 20.062 1.00 60.94 ? 316 GLU A CG 1 +ATOM 2547 C CD . GLU A 1 316 ? 52.878 37.951 20.816 1.00 61.97 ? 316 GLU A CD 1 +ATOM 2548 O OE1 . GLU A 1 316 ? 52.934 37.956 22.069 1.00 64.90 ? 316 GLU A OE1 1 +ATOM 2549 O OE2 . GLU A 1 316 ? 53.489 37.105 20.133 1.00 59.95 ? 316 GLU A OE2 1 +ATOM 2550 N N . VAL A 1 317 ? 49.209 39.031 17.108 1.00 60.42 ? 317 VAL A N 1 +ATOM 2551 C CA . VAL A 1 317 ? 47.788 39.303 17.000 1.00 62.01 ? 317 VAL A CA 1 +ATOM 2552 C C . VAL A 1 317 ? 47.182 39.575 18.362 1.00 64.87 ? 317 VAL A C 1 +ATOM 2553 O O . VAL A 1 317 ? 47.648 39.048 19.364 1.00 66.05 ? 317 VAL A O 1 +ATOM 2554 C CB . VAL A 1 317 ? 47.085 38.148 16.353 1.00 60.43 ? 317 VAL A CB 1 +ATOM 2555 C CG1 . VAL A 1 317 ? 45.667 38.538 16.033 1.00 60.96 ? 317 VAL A CG1 1 +ATOM 2556 C CG2 . VAL A 1 317 ? 47.825 37.758 15.108 1.00 59.84 ? 317 VAL A CG2 1 +ATOM 2557 N N . GLN A 1 318 ? 46.133 40.392 18.397 1.00 67.38 ? 318 GLN A N 1 +ATOM 2558 C CA . GLN A 1 318 ? 45.501 40.790 19.657 1.00 69.14 ? 318 GLN A CA 1 +ATOM 2559 C C . GLN A 1 318 ? 45.343 39.710 20.719 1.00 69.44 ? 318 GLN A C 1 +ATOM 2560 O O . GLN A 1 318 ? 45.864 39.861 21.823 1.00 69.81 ? 318 GLN A O 1 +ATOM 2561 C CB . GLN A 1 318 ? 44.139 41.458 19.386 1.00 70.37 ? 318 GLN A CB 1 +ATOM 2562 C CG . GLN A 1 318 ? 43.529 42.184 20.582 0.0000 70.25 ? 318 GLN A CG 1 +ATOM 2563 C CD . GLN A 1 318 ? 43.102 41.246 21.695 0.0000 70.49 ? 318 GLN A CD 1 +ATOM 2564 O OE1 . GLN A 1 318 ? 42.246 40.382 21.500 0.0000 70.53 ? 318 GLN A OE1 1 +ATOM 2565 N NE2 . GLN A 1 318 ? 43.698 41.410 22.870 0.0000 70.53 ? 318 GLN A NE2 1 +ATOM 2566 N N . ASP A 1 319 ? 44.642 38.627 20.389 1.00 69.99 ? 319 ASP A N 1 +ATOM 2567 C CA . ASP A 1 319 ? 44.377 37.534 21.347 1.00 70.39 ? 319 ASP A CA 1 +ATOM 2568 C C . ASP A 1 319 ? 45.273 36.269 21.280 1.00 68.66 ? 319 ASP A C 1 +ATOM 2569 O O . ASP A 1 319 ? 44.920 35.217 21.839 1.00 67.50 ? 319 ASP A O 1 +ATOM 2570 C CB . ASP A 1 319 ? 42.912 37.112 21.200 1.00 72.65 ? 319 ASP A CB 1 +ATOM 2571 C CG . ASP A 1 319 ? 42.586 36.629 19.786 1.00 74.07 ? 319 ASP A CG 1 +ATOM 2572 O OD1 . ASP A 1 319 ? 41.427 36.223 19.535 1.00 74.96 ? 319 ASP A OD1 1 +ATOM 2573 O OD2 . ASP A 1 319 ? 43.497 36.656 18.925 1.00 75.04 ? 319 ASP A OD2 1 +ATOM 2574 N N . ARG A 1 320 ? 46.421 36.384 20.609 1.00 66.65 ? 320 ARG A N 1 +ATOM 2575 C CA . ARG A 1 320 ? 47.363 35.278 20.439 1.00 64.26 ? 320 ARG A CA 1 +ATOM 2576 C C . ARG A 1 320 ? 48.716 35.553 21.066 1.00 63.27 ? 320 ARG A C 1 +ATOM 2577 O O . ARG A 1 320 ? 49.755 35.402 20.408 1.00 62.39 ? 320 ARG A O 1 +ATOM 2578 C CB . ARG A 1 320 ? 47.593 34.992 18.958 1.00 63.94 ? 320 ARG A CB 1 +ATOM 2579 C CG . ARG A 1 320 ? 46.445 34.334 18.222 1.00 63.21 ? 320 ARG A CG 1 +ATOM 2580 C CD . ARG A 1 320 ? 46.854 34.081 16.781 1.00 62.36 ? 320 ARG A CD 1 +ATOM 2581 N NE . ARG A 1 320 ? 46.211 32.904 16.208 1.00 61.06 ? 320 ARG A NE 1 +ATOM 2582 C CZ . ARG A 1 320 ? 44.912 32.805 15.967 1.00 60.97 ? 320 ARG A CZ 1 +ATOM 2583 N NH1 . ARG A 1 320 ? 44.437 31.684 15.440 1.00 59.46 ? 320 ARG A NH1 1 +ATOM 2584 N NH2 . ARG A 1 320 ? 44.095 33.825 16.249 1.00 59.71 ? 320 ARG A NH2 1 +ATOM 2585 N N . LYS A 1 321 ? 48.721 35.962 22.328 1.00 62.34 ? 321 LYS A N 1 +ATOM 2586 C CA . LYS A 1 321 ? 49.991 36.229 22.986 1.00 61.45 ? 321 LYS A CA 1 +ATOM 2587 C C . LYS A 1 321 ? 50.644 34.888 23.317 1.00 60.51 ? 321 LYS A C 1 +ATOM 2588 O O . LYS A 1 321 ? 50.001 33.958 23.810 1.00 58.29 ? 321 LYS A O 1 +ATOM 2589 C CB . LYS A 1 321 ? 49.775 37.089 24.232 1.00 60.51 ? 321 LYS A CB 1 +ATOM 2590 C CG . LYS A 1 321 ? 48.835 38.258 23.959 1.00 59.39 ? 321 LYS A CG 1 +ATOM 2591 C CD . LYS A 1 321 ? 48.681 39.167 25.159 1.00 59.99 ? 321 LYS A CD 1 +ATOM 2592 C CE . LYS A 1 321 ? 47.651 40.257 24.898 1.00 60.29 ? 321 LYS A CE 1 +ATOM 2593 N NZ . LYS A 1 321 ? 46.260 39.749 24.752 1.00 61.01 ? 321 LYS A NZ 1 +ATOM 2594 N N . HIS A 1 322 ? 51.925 34.798 22.990 1.00 60.90 ? 322 HIS A N 1 +ATOM 2595 C CA . HIS A 1 322 ? 52.710 33.587 23.196 1.00 61.60 ? 322 HIS A CA 1 +ATOM 2596 C C . HIS A 1 322 ? 53.374 33.623 24.564 1.00 62.57 ? 322 HIS A C 1 +ATOM 2597 O O . HIS A 1 322 ? 53.610 34.712 25.095 1.00 63.80 ? 322 HIS A O 1 +ATOM 2598 C CB . HIS A 1 322 ? 53.752 33.480 22.074 1.00 59.18 ? 322 HIS A CB 1 +ATOM 2599 C CG . HIS A 1 322 ? 53.140 33.464 20.712 1.00 56.10 ? 322 HIS A CG 1 +ATOM 2600 N ND1 . HIS A 1 322 ? 52.613 32.326 20.154 1.00 55.27 ? 322 HIS A ND1 1 +ATOM 2601 C CD2 . HIS A 1 322 ? 52.834 34.470 19.863 1.00 56.34 ? 322 HIS A CD2 1 +ATOM 2602 C CE1 . HIS A 1 322 ? 52.003 32.628 19.024 1.00 54.67 ? 322 HIS A CE1 1 +ATOM 2603 N NE2 . HIS A 1 322 ? 52.122 33.926 18.826 1.00 54.93 ? 322 HIS A NE2 1 +ATOM 2604 N N . ILE A 1 323 ? 53.656 32.451 25.143 1.00 62.33 ? 323 ILE A N 1 +ATOM 2605 C CA . ILE A 1 323 ? 54.289 32.428 26.451 1.00 62.47 ? 323 ILE A CA 1 +ATOM 2606 C C . ILE A 1 323 ? 55.546 33.325 26.362 1.00 64.62 ? 323 ILE A C 1 +ATOM 2607 O O . ILE A 1 323 ? 55.693 34.277 27.150 1.00 64.61 ? 323 ILE A O 1 +ATOM 2608 C CB . ILE A 1 323 ? 54.597 30.988 26.879 1.00 59.47 ? 323 ILE A CB 1 +ATOM 2609 C CG1 . ILE A 1 323 ? 55.101 30.975 28.314 1.00 58.60 ? 323 ILE A CG1 1 +ATOM 2610 C CG2 . ILE A 1 323 ? 55.587 30.378 25.977 1.00 59.23 ? 323 ILE A CG2 1 +ATOM 2611 C CD1 . ILE A 1 323 ? 54.109 31.497 29.308 1.00 56.46 ? 323 ILE A CD1 1 +ATOM 2612 N N . CYS A 1 324 ? 56.443 33.034 25.411 1.00 66.12 ? 324 CYS A N 1 +ATOM 2613 C CA . CYS A 1 324 ? 57.605 33.898 25.174 1.00 66.40 ? 324 CYS A CA 1 +ATOM 2614 C C . CYS A 1 324 ? 57.075 34.567 23.932 1.00 65.71 ? 324 CYS A C 1 +ATOM 2615 O O . CYS A 1 324 ? 56.896 33.893 22.905 1.00 64.67 ? 324 CYS A O 1 +ATOM 2616 C CB . CYS A 1 324 ? 58.875 33.125 24.831 1.00 68.08 ? 324 CYS A CB 1 +ATOM 2617 S SG . CYS A 1 324 ? 60.326 34.223 24.623 1.00 69.26 ? 324 CYS A SG 1 +ATOM 2618 N N . PRO A 1 325 ? 56.776 35.887 24.027 1.00 65.24 ? 325 PRO A N 1 +ATOM 2619 C CA . PRO A 1 325 ? 56.229 36.780 22.992 1.00 64.48 ? 325 PRO A CA 1 +ATOM 2620 C C . PRO A 1 325 ? 57.070 36.905 21.736 1.00 64.13 ? 325 PRO A C 1 +ATOM 2621 O O . PRO A 1 325 ? 58.288 37.055 21.820 1.00 64.19 ? 325 PRO A O 1 +ATOM 2622 C CB . PRO A 1 325 ? 56.071 38.106 23.733 1.00 63.88 ? 325 PRO A CB 1 +ATOM 2623 C CG . PRO A 1 325 ? 57.229 38.089 24.661 1.00 64.02 ? 325 PRO A CG 1 +ATOM 2624 C CD . PRO A 1 325 ? 57.193 36.673 25.204 1.00 63.76 ? 325 PRO A CD 1 +ATOM 2625 N N . TYR A 1 326 ? 56.398 36.846 20.580 1.00 63.92 ? 326 TYR A N 1 +ATOM 2626 C CA . TYR A 1 326 ? 57.029 36.928 19.252 1.00 62.54 ? 326 TYR A CA 1 +ATOM 2627 C C . TYR A 1 326 ? 57.516 38.321 18.877 1.00 62.37 ? 326 TYR A C 1 +ATOM 2628 O O . TYR A 1 326 ? 56.746 39.269 18.752 1.00 62.79 ? 326 TYR A O 1 +ATOM 2629 C CB . TYR A 1 326 ? 56.068 36.400 18.171 1.00 60.49 ? 326 TYR A CB 1 +ATOM 2630 C CG . TYR A 1 326 ? 55.962 34.896 18.168 1.00 59.78 ? 326 TYR A CG 1 +ATOM 2631 C CD1 . TYR A 1 326 ? 55.300 34.212 17.153 1.00 60.31 ? 326 TYR A CD1 1 +ATOM 2632 C CD2 . TYR A 1 326 ? 56.568 34.145 19.164 1.00 60.37 ? 326 TYR A CD2 1 +ATOM 2633 C CE1 . TYR A 1 326 ? 55.258 32.805 17.132 1.00 59.56 ? 326 TYR A CE1 1 +ATOM 2634 C CE2 . TYR A 1 326 ? 56.527 32.758 19.153 1.00 59.79 ? 326 TYR A CE2 1 +ATOM 2635 C CZ . TYR A 1 326 ? 55.882 32.095 18.142 1.00 58.95 ? 326 TYR A CZ 1 +ATOM 2636 O OH . TYR A 1 326 ? 55.908 30.725 18.158 1.00 57.55 ? 326 TYR A OH 1 +ATOM 2637 N N . ARG A 1 327 ? 58.815 38.439 18.686 1.00 62.64 ? 327 ARG A N 1 +ATOM 2638 C CA . ARG A 1 327 ? 59.388 39.724 18.347 1.00 63.62 ? 327 ARG A CA 1 +ATOM 2639 C C . ARG A 1 327 ? 59.876 39.770 16.895 1.00 61.78 ? 327 ARG A C 1 +ATOM 2640 O O . ARG A 1 327 ? 59.973 38.732 16.232 1.00 61.96 ? 327 ARG A O 1 +ATOM 2641 C CB . ARG A 1 327 ? 60.549 40.019 19.306 1.00 66.65 ? 327 ARG A CB 1 +ATOM 2642 C CG . ARG A 1 327 ? 60.139 40.083 20.770 1.00 69.79 ? 327 ARG A CG 1 +ATOM 2643 C CD . ARG A 1 327 ? 61.348 40.182 21.680 1.00 72.60 ? 327 ARG A CD 1 +ATOM 2644 N NE . ARG A 1 327 ? 60.937 40.185 23.077 1.00 76.69 ? 327 ARG A NE 1 +ATOM 2645 C CZ . ARG A 1 327 ? 60.295 41.186 23.677 1.00 78.12 ? 327 ARG A CZ 1 +ATOM 2646 N NH1 . ARG A 1 327 ? 59.996 42.281 22.992 1.00 78.77 ? 327 ARG A NH1 1 +ATOM 2647 N NH2 . ARG A 1 327 ? 59.937 41.083 24.960 1.00 78.22 ? 327 ARG A NH2 1 +ATOM 2648 N N . THR A 1 328 ? 60.176 40.969 16.402 1.00 57.85 ? 328 THR A N 1 +ATOM 2649 C CA . THR A 1 328 ? 60.685 41.096 15.053 1.00 55.48 ? 328 THR A CA 1 +ATOM 2650 C C . THR A 1 328 ? 62.145 40.603 14.983 1.00 53.98 ? 328 THR A C 1 +ATOM 2651 O O . THR A 1 328 ? 62.800 40.392 16.000 1.00 52.68 ? 328 THR A O 1 +ATOM 2652 C CB . THR A 1 328 ? 60.610 42.553 14.585 1.00 55.42 ? 328 THR A CB 1 +ATOM 2653 O OG1 . THR A 1 328 ? 61.226 43.400 15.558 1.00 55.08 ? 328 THR A OG1 1 +ATOM 2654 C CG2 . THR A 1 328 ? 59.172 42.973 14.397 1.00 55.83 ? 328 THR A CG2 1 +ATOM 2655 N N . ASN A 1 329 ? 62.655 40.397 13.780 1.00 52.94 ? 329 ASN A N 1 +ATOM 2656 C CA . ASN A 1 329 ? 64.032 39.954 13.649 1.00 52.48 ? 329 ASN A CA 1 +ATOM 2657 C C . ASN A 1 329 ? 65.016 41.141 13.504 1.00 53.05 ? 329 ASN A C 1 +ATOM 2658 O O . ASN A 1 329 ? 64.639 42.316 13.616 1.00 51.51 ? 329 ASN A O 1 +ATOM 2659 C CB . ASN A 1 329 ? 64.160 38.995 12.464 1.00 50.46 ? 329 ASN A CB 1 +ATOM 2660 C CG . ASN A 1 329 ? 63.852 39.658 11.152 1.00 51.14 ? 329 ASN A CG 1 +ATOM 2661 O OD1 . ASN A 1 329 ? 63.337 40.783 11.113 1.00 52.59 ? 329 ASN A OD1 1 +ATOM 2662 N ND2 . ASN A 1 329 ? 64.153 38.966 10.058 1.00 49.21 ? 329 ASN A ND2 1 +ATOM 2663 N N . LYS A 1 330 ? 66.287 40.835 13.268 1.00 53.54 ? 330 LYS A N 1 +ATOM 2664 C CA . LYS A 1 330 ? 67.261 41.898 13.142 1.00 53.14 ? 330 LYS A CA 1 +ATOM 2665 C C . LYS A 1 330 ? 66.864 42.838 12.020 1.00 51.68 ? 330 LYS A C 1 +ATOM 2666 O O . LYS A 1 330 ? 67.221 44.002 12.033 1.00 52.14 ? 330 LYS A O 1 +ATOM 2667 C CB . LYS A 1 330 ? 68.650 41.325 12.898 1.00 53.93 ? 330 LYS A CB 1 +ATOM 2668 C CG . LYS A 1 330 ? 68.814 40.748 11.544 1.00 57.33 ? 330 LYS A CG 1 +ATOM 2669 C CD . LYS A 1 330 ? 70.251 40.384 11.296 1.00 60.82 ? 330 LYS A CD 1 +ATOM 2670 C CE . LYS A 1 330 ? 70.745 39.392 12.307 1.00 62.37 ? 330 LYS A CE 1 +ATOM 2671 N NZ . LYS A 1 330 ? 72.093 38.946 11.876 1.00 65.97 ? 330 LYS A NZ 1 +ATOM 2672 N N . TYR A 1 331 ? 66.112 42.348 11.052 1.00 50.66 ? 331 TYR A N 1 +ATOM 2673 C CA . TYR A 1 331 ? 65.700 43.217 9.962 1.00 50.47 ? 331 TYR A CA 1 +ATOM 2674 C C . TYR A 1 331 ? 64.358 43.845 10.266 1.00 50.12 ? 331 TYR A C 1 +ATOM 2675 O O . TYR A 1 331 ? 63.706 44.411 9.401 1.00 50.72 ? 331 TYR A O 1 +ATOM 2676 C CB . TYR A 1 331 ? 65.677 42.447 8.641 1.00 49.67 ? 331 TYR A CB 1 +ATOM 2677 C CG . TYR A 1 331 ? 67.012 41.809 8.381 1.00 49.85 ? 331 TYR A CG 1 +ATOM 2678 C CD1 . TYR A 1 331 ? 67.189 40.449 8.514 1.00 50.53 ? 331 TYR A CD1 1 +ATOM 2679 C CD2 . TYR A 1 331 ? 68.125 42.581 8.107 1.00 49.92 ? 331 TYR A CD2 1 +ATOM 2680 C CE1 . TYR A 1 331 ? 68.441 39.884 8.390 1.00 50.59 ? 331 TYR A CE1 1 +ATOM 2681 C CE2 . TYR A 1 331 ? 69.373 42.024 7.980 1.00 49.59 ? 331 TYR A CE2 1 +ATOM 2682 C CZ . TYR A 1 331 ? 69.520 40.682 8.128 1.00 50.10 ? 331 TYR A CZ 1 +ATOM 2683 O OH . TYR A 1 331 ? 70.763 40.131 8.062 1.00 53.04 ? 331 TYR A OH 1 +ATOM 2684 N N . GLY A 1 332 ? 63.950 43.747 11.519 1.00 49.41 ? 332 GLY A N 1 +ATOM 2685 C CA . GLY A 1 332 ? 62.697 44.357 11.922 1.00 48.23 ? 332 GLY A CA 1 +ATOM 2686 C C . GLY A 1 332 ? 61.458 43.809 11.263 1.00 45.97 ? 332 GLY A C 1 +ATOM 2687 O O . GLY A 1 332 ? 60.351 44.327 11.463 1.00 44.69 ? 332 GLY A O 1 +ATOM 2688 N N . GLU A 1 333 ? 61.636 42.764 10.473 1.00 45.27 ? 333 GLU A N 1 +ATOM 2689 C CA . GLU A 1 333 ? 60.485 42.158 9.819 1.00 46.20 ? 333 GLU A CA 1 +ATOM 2690 C C . GLU A 1 333 ? 59.777 41.204 10.788 1.00 45.53 ? 333 GLU A C 1 +ATOM 2691 O O . GLU A 1 333 ? 60.357 40.774 11.803 1.00 42.46 ? 333 GLU A O 1 +ATOM 2692 C CB . GLU A 1 333 ? 60.909 41.405 8.554 1.00 46.22 ? 333 GLU A CB 1 +ATOM 2693 C CG . GLU A 1 333 ? 61.920 40.338 8.797 1.00 43.45 ? 333 GLU A CG 1 +ATOM 2694 C CD . GLU A 1 333 ? 62.519 39.826 7.529 1.00 45.47 ? 333 GLU A CD 1 +ATOM 2695 O OE1 . GLU A 1 333 ? 63.513 39.091 7.637 1.00 47.60 ? 333 GLU A OE1 1 +ATOM 2696 O OE2 . GLU A 1 333 ? 62.006 40.139 6.426 1.00 45.58 ? 333 GLU A OE2 1 +ATOM 2697 N N . TYR A 1 334 ? 58.519 40.896 10.473 1.00 44.72 ? 334 TYR A N 1 +ATOM 2698 C CA . TYR A 1 334 ? 57.727 40.006 11.304 1.00 44.95 ? 334 TYR A CA 1 +ATOM 2699 C C . TYR A 1 334 ? 56.943 39.025 10.439 1.00 45.27 ? 334 TYR A C 1 +ATOM 2700 O O . TYR A 1 334 ? 56.493 39.372 9.350 1.00 46.43 ? 334 TYR A O 1 +ATOM 2701 C CB . TYR A 1 334 ? 56.778 40.838 12.183 1.00 43.66 ? 334 TYR A CB 1 +ATOM 2702 C CG . TYR A 1 334 ? 55.611 41.440 11.446 1.00 43.16 ? 334 TYR A CG 1 +ATOM 2703 C CD1 . TYR A 1 334 ? 54.351 40.841 11.505 1.00 43.64 ? 334 TYR A CD1 1 +ATOM 2704 C CD2 . TYR A 1 334 ? 55.771 42.565 10.632 1.00 40.97 ? 334 TYR A CD2 1 +ATOM 2705 C CE1 . TYR A 1 334 ? 53.281 41.346 10.758 1.00 43.51 ? 334 TYR A CE1 1 +ATOM 2706 C CE2 . TYR A 1 334 ? 54.708 43.078 9.880 1.00 39.64 ? 334 TYR A CE2 1 +ATOM 2707 C CZ . TYR A 1 334 ? 53.470 42.460 9.942 1.00 41.97 ? 334 TYR A CZ 1 +ATOM 2708 O OH . TYR A 1 334 ? 52.423 42.886 9.149 1.00 42.28 ? 334 TYR A OH 1 +ATOM 2709 N N . TYR A 1 335 ? 56.811 37.791 10.900 1.00 45.41 ? 335 TYR A N 1 +ATOM 2710 C CA . TYR A 1 335 ? 56.036 36.809 10.155 1.00 47.34 ? 335 TYR A CA 1 +ATOM 2711 C C . TYR A 1 335 ? 55.028 36.154 11.095 1.00 46.29 ? 335 TYR A C 1 +ATOM 2712 O O . TYR A 1 335 ? 55.377 35.710 12.189 1.00 47.32 ? 335 TYR A O 1 +ATOM 2713 C CB . TYR A 1 335 ? 56.931 35.714 9.567 1.00 50.58 ? 335 TYR A CB 1 +ATOM 2714 C CG . TYR A 1 335 ? 57.864 36.117 8.443 1.00 54.95 ? 335 TYR A CG 1 +ATOM 2715 C CD1 . TYR A 1 335 ? 57.471 36.043 7.092 1.00 56.22 ? 335 TYR A CD1 1 +ATOM 2716 C CD2 . TYR A 1 335 ? 59.170 36.489 8.725 1.00 55.19 ? 335 TYR A CD2 1 +ATOM 2717 C CE1 . TYR A 1 335 ? 58.384 36.325 6.065 1.00 56.22 ? 335 TYR A CE1 1 +ATOM 2718 C CE2 . TYR A 1 335 ? 60.070 36.770 7.723 1.00 56.46 ? 335 TYR A CE2 1 +ATOM 2719 C CZ . TYR A 1 335 ? 59.690 36.690 6.401 1.00 57.04 ? 335 TYR A CZ 1 +ATOM 2720 O OH . TYR A 1 335 ? 60.656 36.987 5.454 1.00 58.34 ? 335 TYR A OH 1 +ATOM 2721 N N . LEU A 1 336 ? 53.779 36.081 10.672 1.00 44.74 ? 336 LEU A N 1 +ATOM 2722 C CA . LEU A 1 336 ? 52.766 35.455 11.502 1.00 44.97 ? 336 LEU A CA 1 +ATOM 2723 C C . LEU A 1 336 ? 51.850 34.506 10.710 1.00 46.67 ? 336 LEU A C 1 +ATOM 2724 O O . LEU A 1 336 ? 50.932 34.981 10.011 1.00 47.10 ? 336 LEU A O 1 +ATOM 2725 C CB . LEU A 1 336 ? 51.905 36.526 12.164 1.00 42.05 ? 336 LEU A CB 1 +ATOM 2726 C CG . LEU A 1 336 ? 52.596 37.502 13.114 1.00 40.75 ? 336 LEU A CG 1 +ATOM 2727 C CD1 . LEU A 1 336 ? 51.537 38.403 13.773 1.00 39.57 ? 336 LEU A CD1 1 +ATOM 2728 C CD2 . LEU A 1 336 ? 53.372 36.735 14.160 1.00 37.66 ? 336 LEU A CD2 1 +ATOM 2729 N N . LEU A 1 337 ? 52.078 33.189 10.805 1.00 45.44 ? 337 LEU A N 1 +ATOM 2730 C CA . LEU A 1 337 ? 51.203 32.268 10.092 1.00 45.78 ? 337 LEU A CA 1 +ATOM 2731 C C . LEU A 1 337 ? 49.788 32.349 10.714 1.00 47.24 ? 337 LEU A C 1 +ATOM 2732 O O . LEU A 1 337 ? 49.599 32.110 11.911 1.00 46.20 ? 337 LEU A O 1 +ATOM 2733 C CB . LEU A 1 337 ? 51.719 30.841 10.183 1.00 44.74 ? 337 LEU A CB 1 +ATOM 2734 C CG . LEU A 1 337 ? 53.159 30.593 9.765 1.00 46.14 ? 337 LEU A CG 1 +ATOM 2735 C CD1 . LEU A 1 337 ? 53.513 29.131 10.028 1.00 46.67 ? 337 LEU A CD1 1 +ATOM 2736 C CD2 . LEU A 1 337 ? 53.351 30.924 8.319 1.00 46.75 ? 337 LEU A CD2 1 +ATOM 2737 N N . LEU A 1 338 ? 48.807 32.711 9.887 1.00 48.74 ? 338 LEU A N 1 +ATOM 2738 C CA . LEU A 1 338 ? 47.409 32.842 10.306 1.00 49.72 ? 338 LEU A CA 1 +ATOM 2739 C C . LEU A 1 338 ? 46.425 32.294 9.256 1.00 51.54 ? 338 LEU A C 1 +ATOM 2740 O O . LEU A 1 338 ? 46.756 32.179 8.063 1.00 51.18 ? 338 LEU A O 1 +ATOM 2741 C CB . LEU A 1 338 ? 47.072 34.309 10.562 1.00 46.38 ? 338 LEU A CB 1 +ATOM 2742 C CG . LEU A 1 338 ? 47.786 35.039 11.693 1.00 45.37 ? 338 LEU A CG 1 +ATOM 2743 C CD1 . LEU A 1 338 ? 47.233 36.443 11.699 1.00 44.70 ? 338 LEU A CD1 1 +ATOM 2744 C CD2 . LEU A 1 338 ? 47.583 34.374 13.056 1.00 41.98 ? 338 LEU A CD2 1 +ATOM 2745 N N . LEU A 1 339 ? 45.214 31.951 9.698 1.00 52.73 ? 339 LEU A N 1 +ATOM 2746 C CA . LEU A 1 339 ? 44.218 31.460 8.753 1.00 53.86 ? 339 LEU A CA 1 +ATOM 2747 C C . LEU A 1 339 ? 43.360 32.597 8.188 1.00 54.81 ? 339 LEU A C 1 +ATOM 2748 O O . LEU A 1 339 ? 43.287 33.692 8.742 1.00 56.76 ? 339 LEU A O 1 +ATOM 2749 C CB . LEU A 1 339 ? 43.322 30.414 9.408 1.00 52.22 ? 339 LEU A CB 1 +ATOM 2750 C CG . LEU A 1 339 ? 44.032 29.108 9.763 1.00 51.24 ? 339 LEU A CG 1 +ATOM 2751 C CD1 . LEU A 1 339 ? 43.003 28.072 10.133 1.00 48.08 ? 339 LEU A CD1 1 +ATOM 2752 C CD2 . LEU A 1 339 ? 44.858 28.628 8.585 1.00 50.03 ? 339 LEU A CD2 1 +ATOM 2753 N N . PRO A 1 340 ? 42.712 32.360 7.058 1.00 54.33 ? 340 PRO A N 1 +ATOM 2754 C CA . PRO A 1 340 ? 41.882 33.417 6.489 1.00 54.49 ? 340 PRO A CA 1 +ATOM 2755 C C . PRO A 1 340 ? 40.926 34.053 7.513 1.00 55.72 ? 340 PRO A C 1 +ATOM 2756 O O . PRO A 1 340 ? 40.041 33.387 8.075 1.00 55.54 ? 340 PRO A O 1 +ATOM 2757 C CB . PRO A 1 340 ? 41.141 32.692 5.382 1.00 54.21 ? 340 PRO A CB 1 +ATOM 2758 C CG . PRO A 1 340 ? 42.160 31.680 4.921 1.00 54.63 ? 340 PRO A CG 1 +ATOM 2759 C CD . PRO A 1 340 ? 42.729 31.162 6.208 1.00 54.23 ? 340 PRO A CD 1 +ATOM 2760 N N . GLY A 1 341 ? 41.104 35.346 7.748 1.00 56.38 ? 341 GLY A N 1 +ATOM 2761 C CA . GLY A 1 341 ? 40.243 36.038 8.679 1.00 58.57 ? 341 GLY A CA 1 +ATOM 2762 C C . GLY A 1 341 ? 40.757 37.428 8.967 1.00 60.70 ? 341 GLY A C 1 +ATOM 2763 O O . GLY A 1 341 ? 41.897 37.755 8.634 1.00 61.67 ? 341 GLY A O 1 +ATOM 2764 N N . SER A 1 342 ? 39.923 38.251 9.597 1.00 61.69 ? 342 SER A N 1 +ATOM 2765 C CA . SER A 1 342 ? 40.312 39.617 9.931 1.00 61.78 ? 342 SER A CA 1 +ATOM 2766 C C . SER A 1 342 ? 40.986 39.695 11.296 1.00 61.90 ? 342 SER A C 1 +ATOM 2767 O O . SER A 1 342 ? 40.436 39.273 12.318 1.00 60.65 ? 342 SER A O 1 +ATOM 2768 C CB . SER A 1 342 ? 39.085 40.530 9.913 1.00 62.63 ? 342 SER A CB 1 +ATOM 2769 O OG . SER A 1 342 ? 38.495 40.556 8.625 1.00 63.59 ? 342 SER A OG 1 +ATOM 2770 N N . TYR A 1 343 ? 42.187 40.253 11.306 1.00 62.86 ? 343 TYR A N 1 +ATOM 2771 C CA . TYR A 1 343 ? 42.935 40.384 12.545 1.00 63.62 ? 343 TYR A CA 1 +ATOM 2772 C C . TYR A 1 343 ? 43.273 41.816 12.963 1.00 63.32 ? 343 TYR A C 1 +ATOM 2773 O O . TYR A 1 343 ? 42.973 42.790 12.267 1.00 63.82 ? 343 TYR A O 1 +ATOM 2774 C CB . TYR A 1 343 ? 44.217 39.569 12.456 1.00 64.26 ? 343 TYR A CB 1 +ATOM 2775 C CG . TYR A 1 343 ? 43.965 38.130 12.126 1.00 65.24 ? 343 TYR A CG 1 +ATOM 2776 C CD1 . TYR A 1 343 ? 43.693 37.731 10.816 1.00 65.34 ? 343 TYR A CD1 1 +ATOM 2777 C CD2 . TYR A 1 343 ? 43.994 37.165 13.121 1.00 65.58 ? 343 TYR A CD2 1 +ATOM 2778 C CE1 . TYR A 1 343 ? 43.463 36.403 10.507 1.00 66.14 ? 343 TYR A CE1 1 +ATOM 2779 C CE2 . TYR A 1 343 ? 43.769 35.841 12.830 1.00 67.14 ? 343 TYR A CE2 1 +ATOM 2780 C CZ . TYR A 1 343 ? 43.507 35.459 11.520 1.00 67.82 ? 343 TYR A CZ 1 +ATOM 2781 O OH . TYR A 1 343 ? 43.332 34.119 11.239 1.00 70.60 ? 343 TYR A OH 1 +ATOM 2782 N N . ILE A 1 344 ? 43.910 41.913 14.121 1.00 61.88 ? 344 ILE A N 1 +ATOM 2783 C CA . ILE A 1 344 ? 44.318 43.169 14.711 1.00 60.76 ? 344 ILE A CA 1 +ATOM 2784 C C . ILE A 1 344 ? 45.652 42.822 15.313 1.00 60.47 ? 344 ILE A C 1 +ATOM 2785 O O . ILE A 1 344 ? 45.740 41.945 16.175 1.00 60.43 ? 344 ILE A O 1 +ATOM 2786 C CB . ILE A 1 344 ? 43.368 43.567 15.842 1.00 60.99 ? 344 ILE A CB 1 +ATOM 2787 C CG1 . ILE A 1 344 ? 42.035 44.030 15.270 1.00 60.44 ? 344 ILE A CG1 1 +ATOM 2788 C CG2 . ILE A 1 344 ? 43.998 44.632 16.702 1.00 62.52 ? 344 ILE A CG2 1 +ATOM 2789 C CD1 . ILE A 1 344 ? 41.000 44.241 16.330 1.00 60.14 ? 344 ILE A CD1 1 +ATOM 2790 N N . ILE A 1 345 ? 46.701 43.489 14.867 1.00 59.63 ? 345 ILE A N 1 +ATOM 2791 C CA . ILE A 1 345 ? 48.009 43.172 15.404 1.00 59.46 ? 345 ILE A CA 1 +ATOM 2792 C C . ILE A 1 345 ? 48.397 44.260 16.398 1.00 59.14 ? 345 ILE A C 1 +ATOM 2793 O O . ILE A 1 345 ? 48.112 45.421 16.171 1.00 59.36 ? 345 ILE A O 1 +ATOM 2794 C CB . ILE A 1 345 ? 49.029 43.023 14.229 1.00 59.00 ? 345 ILE A CB 1 +ATOM 2795 C CG1 . ILE A 1 345 ? 48.466 42.010 13.221 1.00 57.27 ? 345 ILE A CG1 1 +ATOM 2796 C CG2 . ILE A 1 345 ? 50.387 42.562 14.736 1.00 58.34 ? 345 ILE A CG2 1 +ATOM 2797 C CD1 . ILE A 1 345 ? 49.440 41.502 12.214 1.00 57.60 ? 345 ILE A CD1 1 +ATOM 2798 N N . ASN A 1 346 ? 48.992 43.880 17.523 1.00 59.28 ? 346 ASN A N 1 +ATOM 2799 C CA . ASN A 1 346 ? 49.407 44.854 18.527 1.00 60.15 ? 346 ASN A CA 1 +ATOM 2800 C C . ASN A 1 346 ? 50.909 44.981 18.461 1.00 61.67 ? 346 ASN A C 1 +ATOM 2801 O O . ASN A 1 346 ? 51.651 44.081 18.910 1.00 61.81 ? 346 ASN A O 1 +ATOM 2802 C CB . ASN A 1 346 ? 49.015 44.414 19.942 1.00 60.17 ? 346 ASN A CB 1 +ATOM 2803 C CG . ASN A 1 346 ? 47.524 44.474 20.182 1.00 60.45 ? 346 ASN A CG 1 +ATOM 2804 O OD1 . ASN A 1 346 ? 46.908 45.534 20.072 0.0000 60.37 ? 346 ASN A OD1 1 +ATOM 2805 N ND2 . ASN A 1 346 ? 46.932 43.333 20.515 0.0000 60.37 ? 346 ASN A ND2 1 +ATOM 2806 N N . VAL A 1 347 ? 51.356 46.093 17.886 1.00 62.21 ? 347 VAL A N 1 +ATOM 2807 C CA . VAL A 1 347 ? 52.780 46.355 17.763 1.00 62.77 ? 347 VAL A CA 1 +ATOM 2808 C C . VAL A 1 347 ? 53.205 47.074 19.031 1.00 63.51 ? 347 VAL A C 1 +ATOM 2809 O O . VAL A 1 347 ? 52.873 48.233 19.271 1.00 63.60 ? 347 VAL A O 1 +ATOM 2810 C CB . VAL A 1 347 ? 53.088 47.227 16.551 1.00 62.38 ? 347 VAL A CB 1 +ATOM 2811 C CG1 . VAL A 1 347 ? 54.589 47.204 16.280 1.00 61.58 ? 347 VAL A CG1 1 +ATOM 2812 C CG2 . VAL A 1 347 ? 52.274 46.748 15.348 1.00 61.00 ? 347 VAL A CG2 1 +ATOM 2813 N N . THR A 1 348 ? 53.940 46.358 19.859 1.00 65.16 ? 348 THR A N 1 +ATOM 2814 C CA . THR A 1 348 ? 54.373 46.911 21.117 1.00 66.39 ? 348 THR A CA 1 +ATOM 2815 C C . THR A 1 348 ? 55.880 47.026 21.146 1.00 66.36 ? 348 THR A C 1 +ATOM 2816 O O . THR A 1 348 ? 56.594 46.025 21.306 1.00 63.96 ? 348 THR A O 1 +ATOM 2817 C CB . THR A 1 348 ? 53.864 46.033 22.288 1.00 67.59 ? 348 THR A CB 1 +ATOM 2818 O OG1 . THR A 1 348 ? 52.433 45.881 22.187 1.00 68.32 ? 348 THR A OG1 1 +ATOM 2819 C CG2 . THR A 1 348 ? 54.199 46.678 23.626 1.00 67.89 ? 348 THR A CG2 1 +ATOM 2820 N N . VAL A 1 349 ? 56.342 48.265 20.952 1.00 67.43 ? 349 VAL A N 1 +ATOM 2821 C CA . VAL A 1 349 ? 57.766 48.583 20.961 1.00 68.44 ? 349 VAL A CA 1 +ATOM 2822 C C . VAL A 1 349 ? 58.113 48.954 22.382 1.00 68.89 ? 349 VAL A C 1 +ATOM 2823 O O . VAL A 1 349 ? 57.431 49.774 23.002 1.00 68.53 ? 349 VAL A O 1 +ATOM 2824 C CB . VAL A 1 349 ? 58.094 49.757 20.037 1.00 67.96 ? 349 VAL A CB 1 +ATOM 2825 C CG1 . VAL A 1 349 ? 56.963 50.735 20.051 1.00 67.82 ? 349 VAL A CG1 1 +ATOM 2826 C CG2 . VAL A 1 349 ? 59.389 50.430 20.494 1.00 68.03 ? 349 VAL A CG2 1 +ATOM 2827 N N . PRO A 1 350 ? 59.190 48.362 22.916 1.00 69.77 ? 350 PRO A N 1 +ATOM 2828 C CA . PRO A 1 350 ? 59.607 48.634 24.287 1.00 70.66 ? 350 PRO A CA 1 +ATOM 2829 C C . PRO A 1 350 ? 59.355 50.033 24.804 1.00 71.70 ? 350 PRO A C 1 +ATOM 2830 O O . PRO A 1 350 ? 59.706 51.033 24.173 1.00 71.93 ? 350 PRO A O 1 +ATOM 2831 C CB . PRO A 1 350 ? 61.070 48.234 24.281 1.00 69.35 ? 350 PRO A CB 1 +ATOM 2832 C CG . PRO A 1 350 ? 61.017 47.006 23.446 1.00 70.27 ? 350 PRO A CG 1 +ATOM 2833 C CD . PRO A 1 350 ? 60.151 47.460 22.261 1.00 69.85 ? 350 PRO A CD 1 +ATOM 2834 N N . GLY A 1 351 ? 58.703 50.068 25.961 1.00 72.76 ? 351 GLY A N 1 +ATOM 2835 C CA . GLY A 1 351 ? 58.396 51.315 26.614 1.00 74.28 ? 351 GLY A CA 1 +ATOM 2836 C C . GLY A 1 351 ? 57.443 52.134 25.795 1.00 75.49 ? 351 GLY A C 1 +ATOM 2837 O O . GLY A 1 351 ? 57.624 53.342 25.649 1.00 76.59 ? 351 GLY A O 1 +ATOM 2838 N N . HIS A 1 352 ? 56.426 51.479 25.255 1.00 76.23 ? 352 HIS A N 1 +ATOM 2839 C CA . HIS A 1 352 ? 55.438 52.186 24.458 1.00 77.30 ? 352 HIS A CA 1 +ATOM 2840 C C . HIS A 1 352 ? 54.053 51.576 24.546 1.00 77.82 ? 352 HIS A C 1 +ATOM 2841 O O . HIS A 1 352 ? 53.888 50.415 24.941 1.00 77.69 ? 352 HIS A O 1 +ATOM 2842 C CB . HIS A 1 352 ? 55.876 52.228 23.003 1.00 76.75 ? 352 HIS A CB 1 +ATOM 2843 C CG . HIS A 1 352 ? 56.882 53.286 22.718 1.00 77.01 ? 352 HIS A CG 1 +ATOM 2844 N ND1 . HIS A 1 352 ? 56.525 54.568 22.365 1.00 77.26 ? 352 HIS A ND1 1 +ATOM 2845 C CD2 . HIS A 1 352 ? 58.236 53.266 22.768 1.00 78.27 ? 352 HIS A CD2 1 +ATOM 2846 C CE1 . HIS A 1 352 ? 57.619 55.294 22.206 1.00 79.18 ? 352 HIS A CE1 1 +ATOM 2847 N NE2 . HIS A 1 352 ? 58.671 54.528 22.446 1.00 78.98 ? 352 HIS A NE2 1 +ATOM 2848 N N . ASP A 1 353 ? 53.055 52.378 24.195 1.00 77.73 ? 353 ASP A N 1 +ATOM 2849 C CA . ASP A 1 353 ? 51.695 51.897 24.193 1.00 77.89 ? 353 ASP A CA 1 +ATOM 2850 C C . ASP A 1 353 ? 51.649 50.979 22.997 1.00 77.75 ? 353 ASP A C 1 +ATOM 2851 O O . ASP A 1 353 ? 52.206 51.284 21.938 1.00 77.62 ? 353 ASP A O 1 +ATOM 2852 C CB . ASP A 1 353 ? 50.704 53.047 24.011 1.00 79.65 ? 353 ASP A CB 1 +ATOM 2853 C CG . ASP A 1 353 ? 50.069 53.492 25.325 1.00 81.58 ? 353 ASP A CG 1 +ATOM 2854 O OD1 . ASP A 1 353 ? 50.657 53.202 26.403 1.00 81.86 ? 353 ASP A OD1 1 +ATOM 2855 O OD2 . ASP A 1 353 ? 48.987 54.136 25.271 1.00 80.84 ? 353 ASP A OD2 1 +ATOM 2856 N N . PRO A 1 354 ? 51.029 49.809 23.159 1.00 77.88 ? 354 PRO A N 1 +ATOM 2857 C CA . PRO A 1 354 ? 50.978 48.921 22.002 1.00 77.50 ? 354 PRO A CA 1 +ATOM 2858 C C . PRO A 1 354 ? 50.295 49.635 20.837 1.00 76.82 ? 354 PRO A C 1 +ATOM 2859 O O . PRO A 1 354 ? 49.275 50.308 21.004 1.00 76.42 ? 354 PRO A O 1 +ATOM 2860 C CB . PRO A 1 354 ? 50.192 47.719 22.528 1.00 77.02 ? 354 PRO A CB 1 +ATOM 2861 C CG . PRO A 1 354 ? 49.349 48.318 23.633 1.00 77.24 ? 354 PRO A CG 1 +ATOM 2862 C CD . PRO A 1 354 ? 50.327 49.224 24.311 1.00 77.73 ? 354 PRO A CD 1 +ATOM 2863 N N . HIS A 1 355 ? 50.877 49.504 19.658 1.00 75.94 ? 355 HIS A N 1 +ATOM 2864 C CA . HIS A 1 355 ? 50.315 50.134 18.492 1.00 75.71 ? 355 HIS A CA 1 +ATOM 2865 C C . HIS A 1 355 ? 49.375 49.203 17.761 1.00 75.02 ? 355 HIS A C 1 +ATOM 2866 O O . HIS A 1 355 ? 49.753 48.101 17.382 1.00 74.73 ? 355 HIS A O 1 +ATOM 2867 C CB . HIS A 1 355 ? 51.420 50.545 17.534 1.00 78.15 ? 355 HIS A CB 1 +ATOM 2868 C CG . HIS A 1 355 ? 50.924 51.284 16.334 1.00 80.64 ? 355 HIS A CG 1 +ATOM 2869 N ND1 . HIS A 1 355 ? 50.530 52.604 16.384 1.00 81.40 ? 355 HIS A ND1 1 +ATOM 2870 C CD2 . HIS A 1 355 ? 50.694 50.870 15.066 1.00 82.45 ? 355 HIS A CD2 1 +ATOM 2871 C CE1 . HIS A 1 355 ? 50.074 52.970 15.200 1.00 82.68 ? 355 HIS A CE1 1 +ATOM 2872 N NE2 . HIS A 1 355 ? 50.161 51.936 14.382 1.00 83.40 ? 355 HIS A NE2 1 +ATOM 2873 N N . ILE A 1 356 ? 48.142 49.646 17.573 1.00 74.52 ? 356 ILE A N 1 +ATOM 2874 C CA . ILE A 1 356 ? 47.177 48.858 16.832 1.00 74.40 ? 356 ILE A CA 1 +ATOM 2875 C C . ILE A 1 356 ? 47.450 49.064 15.336 1.00 75.31 ? 356 ILE A C 1 +ATOM 2876 O O . ILE A 1 356 ? 47.861 50.147 14.897 1.00 76.17 ? 356 ILE A O 1 +ATOM 2877 C CB . ILE A 1 356 ? 45.718 49.314 17.090 1.00 73.74 ? 356 ILE A CB 1 +ATOM 2878 C CG1 . ILE A 1 356 ? 45.235 48.867 18.462 1.00 73.76 ? 356 ILE A CG1 1 +ATOM 2879 C CG2 . ILE A 1 356 ? 44.801 48.735 16.039 1.00 72.84 ? 356 ILE A CG2 1 +ATOM 2880 C CD1 . ILE A 1 356 ? 43.724 49.103 18.663 1.00 72.78 ? 356 ILE A CD1 1 +ATOM 2881 N N . THR A 1 357 ? 47.214 48.010 14.566 1.00 75.53 ? 357 THR A N 1 +ATOM 2882 C CA . THR A 1 357 ? 47.362 48.015 13.116 1.00 75.55 ? 357 THR A CA 1 +ATOM 2883 C C . THR A 1 357 ? 46.533 46.816 12.669 1.00 75.14 ? 357 THR A C 1 +ATOM 2884 O O . THR A 1 357 ? 46.855 45.665 12.992 1.00 75.16 ? 357 THR A O 1 +ATOM 2885 C CB . THR A 1 357 ? 48.847 47.898 12.693 1.00 76.83 ? 357 THR A CB 1 +ATOM 2886 O OG1 . THR A 1 357 ? 49.331 49.197 12.302 1.00 76.89 ? 357 THR A OG1 1 +ATOM 2887 C CG2 . THR A 1 357 ? 49.008 46.925 11.536 1.00 77.13 ? 357 THR A CG2 1 +ATOM 2888 N N . LYS A 1 358 ? 45.438 47.105 11.965 1.00 74.51 ? 358 LYS A N 1 +ATOM 2889 C CA . LYS A 1 358 ? 44.508 46.072 11.516 1.00 73.68 ? 358 LYS A CA 1 +ATOM 2890 C C . LYS A 1 358 ? 44.785 45.501 10.129 1.00 73.43 ? 358 LYS A C 1 +ATOM 2891 O O . LYS A 1 358 ? 45.235 46.212 9.216 1.00 73.79 ? 358 LYS A O 1 +ATOM 2892 C CB . LYS A 1 358 ? 43.071 46.600 11.574 1.00 72.60 ? 358 LYS A CB 1 +ATOM 2893 C CG . LYS A 1 358 ? 42.021 45.528 11.325 1.00 72.79 ? 358 LYS A CG 1 +ATOM 2894 C CD . LYS A 1 358 ? 40.611 46.088 11.335 1.00 73.48 ? 358 LYS A CD 1 +ATOM 2895 C CE . LYS A 1 358 ? 40.264 46.722 12.677 1.00 73.97 ? 358 LYS A CE 1 +ATOM 2896 N NZ . LYS A 1 358 ? 38.879 47.289 12.680 1.00 74.35 ? 358 LYS A NZ 1 +ATOM 2897 N N . VAL A 1 359 ? 44.499 44.206 9.987 1.00 72.09 ? 359 VAL A N 1 +ATOM 2898 C CA . VAL A 1 359 ? 44.704 43.498 8.737 1.00 70.15 ? 359 VAL A CA 1 +ATOM 2899 C C . VAL A 1 359 ? 43.678 42.392 8.450 1.00 69.20 ? 359 VAL A C 1 +ATOM 2900 O O . VAL A 1 359 ? 43.378 41.569 9.309 1.00 69.13 ? 359 VAL A O 1 +ATOM 2901 C CB . VAL A 1 359 ? 46.113 42.881 8.707 1.00 69.81 ? 359 VAL A CB 1 +ATOM 2902 C CG1 . VAL A 1 359 ? 46.223 41.912 7.541 1.00 70.76 ? 359 VAL A CG1 1 +ATOM 2903 C CG2 . VAL A 1 359 ? 47.163 43.981 8.582 1.00 68.05 ? 359 VAL A CG2 1 +ATOM 2904 N N . ILE A 1 360 ? 43.137 42.399 7.234 1.00 68.11 ? 360 ILE A N 1 +ATOM 2905 C CA . ILE A 1 360 ? 42.191 41.385 6.778 1.00 67.40 ? 360 ILE A CA 1 +ATOM 2906 C C . ILE A 1 360 ? 43.037 40.393 5.982 1.00 68.48 ? 360 ILE A C 1 +ATOM 2907 O O . ILE A 1 360 ? 43.610 40.753 4.964 1.00 69.42 ? 360 ILE A O 1 +ATOM 2908 C CB . ILE A 1 360 ? 41.135 41.972 5.812 1.00 66.08 ? 360 ILE A CB 1 +ATOM 2909 C CG1 . ILE A 1 360 ? 40.004 42.627 6.602 1.00 66.95 ? 360 ILE A CG1 1 +ATOM 2910 C CG2 . ILE A 1 360 ? 40.596 40.888 4.909 1.00 64.93 ? 360 ILE A CG2 1 +ATOM 2911 C CD1 . ILE A 1 360 ? 38.785 43.063 5.764 1.00 66.48 ? 360 ILE A CD1 1 +ATOM 2912 N N . ILE A 1 361 ? 43.141 39.153 6.439 1.00 69.27 ? 361 ILE A N 1 +ATOM 2913 C CA . ILE A 1 361 ? 43.932 38.179 5.703 1.00 69.83 ? 361 ILE A CA 1 +ATOM 2914 C C . ILE A 1 361 ? 43.054 37.479 4.686 1.00 71.51 ? 361 ILE A C 1 +ATOM 2915 O O . ILE A 1 361 ? 42.250 36.627 5.041 1.00 71.66 ? 361 ILE A O 1 +ATOM 2916 C CB . ILE A 1 361 ? 44.541 37.139 6.624 1.00 68.71 ? 361 ILE A CB 1 +ATOM 2917 C CG1 . ILE A 1 361 ? 45.479 37.820 7.607 1.00 67.50 ? 361 ILE A CG1 1 +ATOM 2918 C CG2 . ILE A 1 361 ? 45.297 36.114 5.807 1.00 67.62 ? 361 ILE A CG2 1 +ATOM 2919 C CD1 . ILE A 1 361 ? 46.222 36.848 8.463 1.00 69.79 ? 361 ILE A CD1 1 +ATOM 2920 N N . PRO A 1 362 ? 43.241 37.805 3.397 1.00 73.69 ? 362 PRO A N 1 +ATOM 2921 C CA . PRO A 1 362 ? 42.540 37.307 2.206 1.00 75.01 ? 362 PRO A CA 1 +ATOM 2922 C C . PRO A 1 362 ? 41.563 36.158 2.392 1.00 76.19 ? 362 PRO A C 1 +ATOM 2923 O O . PRO A 1 362 ? 40.719 36.173 3.281 1.00 77.26 ? 362 PRO A O 1 +ATOM 2924 C CB . PRO A 1 362 ? 43.681 36.946 1.273 1.00 75.27 ? 362 PRO A CB 1 +ATOM 2925 C CG . PRO A 1 362 ? 44.607 38.096 1.499 1.00 76.23 ? 362 PRO A CG 1 +ATOM 2926 C CD . PRO A 1 362 ? 44.584 38.288 3.021 1.00 74.51 ? 362 PRO A CD 1 +ATOM 2927 N N . GLU A 1 363 ? 41.669 35.166 1.528 1.00 77.21 ? 363 GLU A N 1 +ATOM 2928 C CA . GLU A 1 363 ? 40.789 34.021 1.592 1.00 78.75 ? 363 GLU A CA 1 +ATOM 2929 C C . GLU A 1 363 ? 41.053 33.209 0.362 1.00 79.40 ? 363 GLU A C 1 +ATOM 2930 O O . GLU A 1 363 ? 40.148 32.583 -0.172 1.00 80.68 ? 363 GLU A O 1 +ATOM 2931 C CB . GLU A 1 363 ? 39.326 34.458 1.606 1.00 79.08 ? 363 GLU A CB 1 +ATOM 2932 C CG . GLU A 1 363 ? 38.600 34.129 2.905 1.00 81.74 ? 363 GLU A CG 1 +ATOM 2933 C CD . GLU A 1 363 ? 38.553 32.627 3.212 1.00 83.41 ? 363 GLU A CD 1 +ATOM 2934 O OE1 . GLU A 1 363 ? 38.060 32.254 4.304 1.00 84.22 ? 363 GLU A OE1 1 +ATOM 2935 O OE2 . GLU A 1 363 ? 39.002 31.817 2.368 1.00 83.51 ? 363 GLU A OE2 1 +ATOM 2936 N N . LYS A 1 364 ? 42.305 33.244 -0.077 1.00 80.09 ? 364 LYS A N 1 +ATOM 2937 C CA . LYS A 1 364 ? 42.778 32.541 -1.265 1.00 80.78 ? 364 LYS A CA 1 +ATOM 2938 C C . LYS A 1 364 ? 43.801 33.446 -1.928 1.00 81.17 ? 364 LYS A C 1 +ATOM 2939 O O . LYS A 1 364 ? 43.462 34.545 -2.356 1.00 80.67 ? 364 LYS A O 1 +ATOM 2940 C CB . LYS A 1 364 ? 41.637 32.275 -2.253 0.0000 80.87 ? 364 LYS A CB 1 +ATOM 2941 C CG . LYS A 1 364 ? 42.057 31.540 -3.518 0.0000 81.08 ? 364 LYS A CG 1 +ATOM 2942 C CD . LYS A 1 364 ? 42.483 30.107 -3.226 0.0000 81.22 ? 364 LYS A CD 1 +ATOM 2943 C CE . LYS A 1 364 ? 41.320 29.277 -2.704 0.0000 81.30 ? 364 LYS A CE 1 +ATOM 2944 N NZ . LYS A 1 364 ? 41.714 27.864 -2.446 0.0000 81.40 ? 364 LYS A NZ 1 +ATOM 2945 N N . SER A 1 365 ? 45.050 32.985 -1.993 1.00 82.20 ? 365 SER A N 1 +ATOM 2946 C CA . SER A 1 365 ? 46.132 33.748 -2.617 1.00 82.25 ? 365 SER A CA 1 +ATOM 2947 C C . SER A 1 365 ? 46.517 33.176 -3.991 1.00 82.25 ? 365 SER A C 1 +ATOM 2948 O O . SER A 1 365 ? 46.620 31.950 -4.173 1.00 82.44 ? 365 SER A O 1 +ATOM 2949 C CB . SER A 1 365 ? 47.368 33.780 -1.711 1.00 82.16 ? 365 SER A CB 1 +ATOM 2950 O OG . SER A 1 365 ? 48.330 34.694 -2.219 1.00 81.80 ? 365 SER A OG 1 +ATOM 2951 N N . GLN A 1 366 ? 46.739 34.089 -4.940 1.00 81.29 ? 366 GLN A N 1 +ATOM 2952 C CA . GLN A 1 366 ? 47.097 33.756 -6.317 1.00 79.37 ? 366 GLN A CA 1 +ATOM 2953 C C . GLN A 1 366 ? 48.599 33.624 -6.497 1.00 77.40 ? 366 GLN A C 1 +ATOM 2954 O O . GLN A 1 366 ? 49.067 33.177 -7.545 1.00 77.39 ? 366 GLN A O 1 +ATOM 2955 C CB . GLN A 1 366 ? 46.554 34.834 -7.252 1.00 80.49 ? 366 GLN A CB 1 +ATOM 2956 C CG . GLN A 1 366 ? 45.269 35.472 -6.726 1.00 83.33 ? 366 GLN A CG 1 +ATOM 2957 C CD . GLN A 1 366 ? 44.240 34.449 -6.216 1.00 84.58 ? 366 GLN A CD 1 +ATOM 2958 O OE1 . GLN A 1 366 ? 43.314 34.804 -5.485 1.00 84.67 ? 366 GLN A OE1 1 +ATOM 2959 N NE2 . GLN A 1 366 ? 44.397 33.181 -6.610 1.00 85.74 ? 366 GLN A NE2 1 +ATOM 2960 N N . ASN A 1 367 ? 49.343 34.022 -5.466 1.00 74.56 ? 367 ASN A N 1 +ATOM 2961 C CA . ASN A 1 367 ? 50.797 33.948 -5.466 1.00 71.26 ? 367 ASN A CA 1 +ATOM 2962 C C . ASN A 1 367 ? 51.228 33.073 -4.286 1.00 68.92 ? 367 ASN A C 1 +ATOM 2963 O O . ASN A 1 367 ? 50.380 32.570 -3.534 1.00 67.29 ? 367 ASN A O 1 +ATOM 2964 C CB . ASN A 1 367 ? 51.406 35.351 -5.332 1.00 70.73 ? 367 ASN A CB 1 +ATOM 2965 C CG . ASN A 1 367 ? 52.874 35.392 -5.716 0.0000 70.98 ? 367 ASN A CG 1 +ATOM 2966 O OD1 . ASN A 1 367 ? 53.531 36.425 -5.591 0.0000 70.95 ? 367 ASN A OD1 1 +ATOM 2967 N ND2 . ASN A 1 367 ? 53.395 34.267 -6.194 0.0000 70.95 ? 367 ASN A ND2 1 +ATOM 2968 N N . PHE A 1 368 ? 52.544 32.887 -4.158 1.00 66.64 ? 368 PHE A N 1 +ATOM 2969 C CA . PHE A 1 368 ? 53.155 32.100 -3.087 1.00 64.05 ? 368 PHE A CA 1 +ATOM 2970 C C . PHE A 1 368 ? 53.878 33.022 -2.110 1.00 62.18 ? 368 PHE A C 1 +ATOM 2971 O O . PHE A 1 368 ? 55.089 32.947 -1.941 1.00 62.73 ? 368 PHE A O 1 +ATOM 2972 C CB . PHE A 1 368 ? 54.169 31.089 -3.643 1.00 64.92 ? 368 PHE A CB 1 +ATOM 2973 C CG . PHE A 1 368 ? 53.555 29.953 -4.420 1.00 66.78 ? 368 PHE A CG 1 +ATOM 2974 C CD1 . PHE A 1 368 ? 52.318 29.416 -4.053 1.00 67.27 ? 368 PHE A CD1 1 +ATOM 2975 C CD2 . PHE A 1 368 ? 54.228 29.396 -5.506 1.00 67.69 ? 368 PHE A CD2 1 +ATOM 2976 C CE1 . PHE A 1 368 ? 51.761 28.346 -4.760 1.00 67.94 ? 368 PHE A CE1 1 +ATOM 2977 C CE2 . PHE A 1 368 ? 53.678 28.321 -6.223 1.00 67.84 ? 368 PHE A CE2 1 +ATOM 2978 C CZ . PHE A 1 368 ? 52.443 27.797 -5.850 1.00 67.57 ? 368 PHE A CZ 1 +ATOM 2979 N N . SER A 1 369 ? 53.132 33.920 -1.488 1.00 59.30 ? 369 SER A N 1 +ATOM 2980 C CA . SER A 1 369 ? 53.693 34.835 -0.515 1.00 56.16 ? 369 SER A CA 1 +ATOM 2981 C C . SER A 1 369 ? 52.565 35.200 0.412 1.00 55.52 ? 369 SER A C 1 +ATOM 2982 O O . SER A 1 369 ? 51.422 35.290 -0.014 1.00 54.74 ? 369 SER A O 1 +ATOM 2983 C CB . SER A 1 369 ? 54.213 36.093 -1.185 1.00 54.78 ? 369 SER A CB 1 +ATOM 2984 O OG . SER A 1 369 ? 54.246 37.177 -0.267 1.00 52.09 ? 369 SER A OG 1 +ATOM 2985 N N . ALA A 1 370 ? 52.871 35.392 1.686 1.00 55.25 ? 370 ALA A N 1 +ATOM 2986 C CA . ALA A 1 370 ? 51.826 35.758 2.624 1.00 55.70 ? 370 ALA A CA 1 +ATOM 2987 C C . ALA A 1 370 ? 51.343 37.169 2.269 1.00 55.30 ? 370 ALA A C 1 +ATOM 2988 O O . ALA A 1 370 ? 51.729 37.710 1.244 1.00 54.65 ? 370 ALA A O 1 +ATOM 2989 C CB . ALA A 1 370 ? 52.371 35.714 4.042 1.00 56.33 ? 370 ALA A CB 1 +ATOM 2990 N N . LEU A 1 371 ? 50.484 37.752 3.098 1.00 54.97 ? 371 LEU A N 1 +ATOM 2991 C CA . LEU A 1 371 ? 50.011 39.099 2.853 1.00 54.56 ? 371 LEU A CA 1 +ATOM 2992 C C . LEU A 1 371 ? 51.105 40.022 3.372 1.00 56.38 ? 371 LEU A C 1 +ATOM 2993 O O . LEU A 1 371 ? 51.633 39.810 4.483 1.00 57.20 ? 371 LEU A O 1 +ATOM 2994 C CB . LEU A 1 371 ? 48.704 39.364 3.612 1.00 53.98 ? 371 LEU A CB 1 +ATOM 2995 C CG . LEU A 1 371 ? 48.011 40.711 3.341 1.00 54.55 ? 371 LEU A CG 1 +ATOM 2996 C CD1 . LEU A 1 371 ? 46.513 40.614 3.593 1.00 53.28 ? 371 LEU A CD1 1 +ATOM 2997 C CD2 . LEU A 1 371 ? 48.627 41.784 4.217 1.00 55.11 ? 371 LEU A CD2 1 +ATOM 2998 N N . LYS A 1 372 ? 51.476 41.028 2.576 1.00 56.01 ? 372 LYS A N 1 +ATOM 2999 C CA . LYS A 1 372 ? 52.498 41.960 3.027 1.00 55.74 ? 372 LYS A CA 1 +ATOM 3000 C C . LYS A 1 372 ? 51.839 43.171 3.675 1.00 56.46 ? 372 LYS A C 1 +ATOM 3001 O O . LYS A 1 372 ? 50.846 43.704 3.172 1.00 55.78 ? 372 LYS A O 1 +ATOM 3002 C CB . LYS A 1 372 ? 53.400 42.375 1.871 1.00 54.65 ? 372 LYS A CB 1 +ATOM 3003 C CG . LYS A 1 372 ? 54.563 41.429 1.630 1.00 53.91 ? 372 LYS A CG 1 +ATOM 3004 C CD . LYS A 1 372 ? 55.241 41.691 0.295 0.0000 54.25 ? 372 LYS A CD 1 +ATOM 3005 C CE . LYS A 1 372 ? 54.314 41.360 -0.865 0.0000 54.22 ? 372 LYS A CE 1 +ATOM 3006 N NZ . LYS A 1 372 ? 54.974 41.549 -2.185 0.0000 54.27 ? 372 LYS A NZ 1 +ATOM 3007 N N . LYS A 1 373 ? 52.374 43.568 4.827 1.00 58.04 ? 373 LYS A N 1 +ATOM 3008 C CA . LYS A 1 373 ? 51.859 44.714 5.573 1.00 59.53 ? 373 LYS A CA 1 +ATOM 3009 C C . LYS A 1 373 ? 52.973 45.272 6.414 1.00 59.56 ? 373 LYS A C 1 +ATOM 3010 O O . LYS A 1 373 ? 53.389 44.662 7.402 1.00 59.43 ? 373 LYS A O 1 +ATOM 3011 C CB . LYS A 1 373 ? 50.706 44.322 6.505 1.00 61.49 ? 373 LYS A CB 1 +ATOM 3012 C CG . LYS A 1 373 ? 49.596 45.355 6.595 1.00 61.57 ? 373 LYS A CG 1 +ATOM 3013 C CD . LYS A 1 373 ? 50.173 46.733 6.813 1.00 64.10 ? 373 LYS A CD 1 +ATOM 3014 C CE . LYS A 1 373 ? 49.128 47.807 6.527 1.00 66.56 ? 373 LYS A CE 1 +ATOM 3015 N NZ . LYS A 1 373 ? 49.704 49.181 6.551 1.00 67.25 ? 373 LYS A NZ 1 +ATOM 3016 N N . ASP A 1 374 ? 53.470 46.427 5.990 1.00 60.00 ? 374 ASP A N 1 +ATOM 3017 C CA . ASP A 1 374 ? 54.531 47.117 6.698 1.00 59.42 ? 374 ASP A CA 1 +ATOM 3018 C C . ASP A 1 374 ? 53.896 48.034 7.734 1.00 58.44 ? 374 ASP A C 1 +ATOM 3019 O O . ASP A 1 374 ? 52.776 48.534 7.566 1.00 57.22 ? 374 ASP A O 1 +ATOM 3020 C CB . ASP A 1 374 ? 55.382 47.915 5.714 1.00 60.10 ? 374 ASP A CB 1 +ATOM 3021 C CG . ASP A 1 374 ? 56.509 47.097 5.128 1.00 60.96 ? 374 ASP A CG 1 +ATOM 3022 O OD1 . ASP A 1 374 ? 57.019 47.472 4.044 1.00 60.02 ? 374 ASP A OD1 1 +ATOM 3023 O OD2 . ASP A 1 374 ? 56.888 46.089 5.771 1.00 62.19 ? 374 ASP A OD2 1 +ATOM 3024 N N . ILE A 1 375 ? 54.627 48.257 8.808 1.00 57.96 ? 375 ILE A N 1 +ATOM 3025 C CA . ILE A 1 375 ? 54.124 49.081 9.877 1.00 58.17 ? 375 ILE A CA 1 +ATOM 3026 C C . ILE A 1 375 ? 54.996 50.300 10.188 1.00 57.92 ? 375 ILE A C 1 +ATOM 3027 O O . ILE A 1 375 ? 56.197 50.195 10.494 1.00 57.83 ? 375 ILE A O 1 +ATOM 3028 C CB . ILE A 1 375 ? 53.934 48.198 11.119 1.00 58.68 ? 375 ILE A CB 1 +ATOM 3029 C CG1 . ILE A 1 375 ? 52.907 47.121 10.783 1.00 58.19 ? 375 ILE A CG1 1 +ATOM 3030 C CG2 . ILE A 1 375 ? 53.494 49.024 12.313 1.00 59.38 ? 375 ILE A CG2 1 +ATOM 3031 C CD1 . ILE A 1 375 ? 52.738 46.092 11.837 1.00 58.96 ? 375 ILE A CD1 1 +ATOM 3032 N N . LEU A 1 376 ? 54.379 51.468 10.086 1.00 56.93 ? 376 LEU A N 1 +ATOM 3033 C CA . LEU A 1 376 ? 55.080 52.699 10.376 1.00 57.71 ? 376 LEU A CA 1 +ATOM 3034 C C . LEU A 1 376 ? 54.590 53.211 11.724 1.00 58.77 ? 376 LEU A C 1 +ATOM 3035 O O . LEU A 1 376 ? 53.497 53.780 11.833 1.00 59.16 ? 376 LEU A O 1 +ATOM 3036 C CB . LEU A 1 376 ? 54.784 53.741 9.309 1.00 57.21 ? 376 LEU A CB 1 +ATOM 3037 C CG . LEU A 1 376 ? 55.952 54.375 8.560 1.00 56.59 ? 376 LEU A CG 1 +ATOM 3038 C CD1 . LEU A 1 376 ? 55.382 55.592 7.862 1.00 57.17 ? 376 LEU A CD1 1 +ATOM 3039 C CD2 . LEU A 1 376 ? 57.110 54.770 9.478 1.00 54.98 ? 376 LEU A CD2 1 +ATOM 3040 N N . LEU A 1 377 ? 55.374 52.998 12.766 1.00 58.94 ? 377 LEU A N 1 +ATOM 3041 C CA . LEU A 1 377 ? 54.930 53.488 14.047 1.00 59.76 ? 377 LEU A CA 1 +ATOM 3042 C C . LEU A 1 377 ? 54.982 54.980 13.925 1.00 60.75 ? 377 LEU A C 1 +ATOM 3043 O O . LEU A 1 377 ? 55.834 55.513 13.209 1.00 61.00 ? 377 LEU A O 1 +ATOM 3044 C CB . LEU A 1 377 ? 55.846 53.016 15.156 1.00 58.16 ? 377 LEU A CB 1 +ATOM 3045 C CG . LEU A 1 377 ? 55.745 51.510 15.227 1.00 57.52 ? 377 LEU A CG 1 +ATOM 3046 C CD1 . LEU A 1 377 ? 56.613 51.027 16.368 1.00 57.47 ? 377 LEU A CD1 1 +ATOM 3047 C CD2 . LEU A 1 377 ? 54.264 51.100 15.369 1.00 55.49 ? 377 LEU A CD2 1 +ATOM 3048 N N . PRO A 1 378 ? 54.056 55.678 14.600 1.00 61.56 ? 378 PRO A N 1 +ATOM 3049 C CA . PRO A 1 378 ? 53.988 57.138 14.570 1.00 61.74 ? 378 PRO A CA 1 +ATOM 3050 C C . PRO A 1 378 ? 54.958 57.814 15.548 1.00 62.53 ? 378 PRO A C 1 +ATOM 3051 O O . PRO A 1 378 ? 54.672 58.895 16.056 1.00 62.94 ? 378 PRO A O 1 +ATOM 3052 C CB . PRO A 1 378 ? 52.536 57.403 14.898 1.00 60.92 ? 378 PRO A CB 1 +ATOM 3053 C CG . PRO A 1 378 ? 52.274 56.340 15.912 1.00 62.09 ? 378 PRO A CG 1 +ATOM 3054 C CD . PRO A 1 378 ? 52.896 55.115 15.312 1.00 61.12 ? 378 PRO A CD 1 +ATOM 3055 N N . PHE A 1 379 ? 56.096 57.171 15.807 1.00 63.31 ? 379 PHE A N 1 +ATOM 3056 C CA . PHE A 1 379 ? 57.114 57.715 16.696 1.00 65.13 ? 379 PHE A CA 1 +ATOM 3057 C C . PHE A 1 379 ? 58.466 57.096 16.429 1.00 67.48 ? 379 PHE A C 1 +ATOM 3058 O O . PHE A 1 379 ? 58.715 56.616 15.333 1.00 68.38 ? 379 PHE A O 1 +ATOM 3059 C CB . PHE A 1 379 ? 56.738 57.526 18.167 1.00 64.03 ? 379 PHE A CB 1 +ATOM 3060 C CG . PHE A 1 379 ? 56.398 56.124 18.534 1.00 62.86 ? 379 PHE A CG 1 +ATOM 3061 C CD1 . PHE A 1 379 ? 57.361 55.130 18.507 1.00 62.71 ? 379 PHE A CD1 1 +ATOM 3062 C CD2 . PHE A 1 379 ? 55.097 55.791 18.886 1.00 63.04 ? 379 PHE A CD2 1 +ATOM 3063 C CE1 . PHE A 1 379 ? 57.032 53.817 18.821 1.00 61.72 ? 379 PHE A CE1 1 +ATOM 3064 C CE2 . PHE A 1 379 ? 54.761 54.492 19.199 1.00 62.44 ? 379 PHE A CE2 1 +ATOM 3065 C CZ . PHE A 1 379 ? 55.731 53.502 19.166 1.00 62.14 ? 379 PHE A CZ 1 +ATOM 3066 N N . GLN A 1 380 ? 59.337 57.103 17.431 1.00 70.21 ? 380 GLN A N 1 +ATOM 3067 C CA . GLN A 1 380 ? 60.683 56.562 17.281 1.00 73.60 ? 380 GLN A CA 1 +ATOM 3068 C C . GLN A 1 380 ? 61.080 55.584 18.374 1.00 74.86 ? 380 GLN A C 1 +ATOM 3069 O O . GLN A 1 380 ? 60.524 55.618 19.472 1.00 75.90 ? 380 GLN A O 1 +ATOM 3070 C CB . GLN A 1 380 ? 61.705 57.700 17.272 1.00 74.82 ? 380 GLN A CB 1 +ATOM 3071 C CG . GLN A 1 380 ? 63.138 57.220 17.483 1.00 78.08 ? 380 GLN A CG 1 +ATOM 3072 C CD . GLN A 1 380 ? 64.097 58.332 17.890 1.00 80.84 ? 380 GLN A CD 1 +ATOM 3073 O OE1 . GLN A 1 380 ? 64.513 59.158 17.059 1.00 81.99 ? 380 GLN A OE1 1 +ATOM 3074 N NE2 . GLN A 1 380 ? 64.452 58.362 19.181 1.00 80.86 ? 380 GLN A NE2 1 +ATOM 3075 N N . GLY A 1 381 ? 62.058 54.726 18.082 1.00 75.76 ? 381 GLY A N 1 +ATOM 3076 C CA . GLY A 1 381 ? 62.535 53.773 19.077 1.00 76.87 ? 381 GLY A CA 1 +ATOM 3077 C C . GLY A 1 381 ? 64.015 53.993 19.385 1.00 77.71 ? 381 GLY A C 1 +ATOM 3078 O O . GLY A 1 381 ? 64.401 54.085 20.548 1.00 99.99 ? 381 GLY A O 1 +ATOM 3079 O OXT . GLY A 1 381 ? 64.521 55.076 19.009 1.00 77.68 ? 381 GLY A OXT 1 +ATOM 3080 N N . PRO A 1 391 ? 68.265 37.617 23.247 1.00 83.53 ? 391 PRO A N 1 +ATOM 3081 C CA . PRO A 1 391 ? 67.769 37.609 24.666 1.00 83.84 ? 391 PRO A CA 1 +ATOM 3082 C C . PRO A 1 391 ? 66.512 36.718 24.928 1.00 83.70 ? 391 PRO A C 1 +ATOM 3083 O O . PRO A 1 391 ? 66.259 36.309 26.074 1.00 83.83 ? 391 PRO A O 1 +ATOM 3084 C CB . PRO A 1 391 ? 67.444 39.056 24.786 1.00 99.99 ? 391 PRO A CB 1 +ATOM 3085 C CG . PRO A 1 391 ? 68.305 39.763 23.766 0.0000 99.99 ? 391 PRO A CG 1 +ATOM 3086 C CD . PRO A 1 391 ? 68.552 39.060 22.730 0.0000 99.99 ? 391 PRO A CD 1 +ATOM 3087 N N . SER A 1 392 ? 65.762 36.408 23.859 1.00 83.25 ? 392 SER A N 1 +ATOM 3088 C CA . SER A 1 392 ? 64.518 35.604 23.887 1.00 81.60 ? 392 SER A CA 1 +ATOM 3089 C C . SER A 1 392 ? 63.834 35.428 25.257 1.00 80.54 ? 392 SER A C 1 +ATOM 3090 O O . SER A 1 392 ? 63.121 36.325 25.703 1.00 80.82 ? 392 SER A O 1 +ATOM 3091 C CB . SER A 1 392 ? 64.720 34.229 23.185 1.00 81.23 ? 392 SER A CB 1 +ATOM 3092 O OG . SER A 1 392 ? 66.039 33.695 23.310 1.00 80.17 ? 392 SER A OG 1 +ATOM 3093 N N . CYS A 1 393 ? 64.036 34.288 25.914 1.00 78.06 ? 393 CYS A N 1 +ATOM 3094 C CA . CYS A 1 393 ? 63.428 34.027 27.214 1.00 75.65 ? 393 CYS A CA 1 +ATOM 3095 C C . CYS A 1 393 ? 64.205 32.962 27.919 1.00 75.77 ? 393 CYS A C 1 +ATOM 3096 O O . CYS A 1 393 ? 64.715 32.047 27.288 1.00 76.09 ? 393 CYS A O 1 +ATOM 3097 C CB . CYS A 1 393 ? 62.010 33.512 27.068 1.00 73.92 ? 393 CYS A CB 1 +ATOM 3098 S SG . CYS A 1 393 ? 60.830 34.756 26.518 1.00 72.73 ? 393 CYS A SG 1 +ATOM 3099 N N . PRO A 1 394 ? 64.281 33.038 29.250 1.00 75.92 ? 394 PRO A N 1 +ATOM 3100 C CA . PRO A 1 394 ? 65.039 31.997 29.951 1.00 75.55 ? 394 PRO A CA 1 +ATOM 3101 C C . PRO A 1 394 ? 64.477 30.640 29.551 1.00 74.64 ? 394 PRO A C 1 +ATOM 3102 O O . PRO A 1 394 ? 63.274 30.411 29.638 1.00 75.57 ? 394 PRO A O 1 +ATOM 3103 C CB . PRO A 1 394 ? 64.791 32.324 31.419 1.00 76.15 ? 394 PRO A CB 1 +ATOM 3104 C CG . PRO A 1 394 ? 63.394 32.907 31.392 1.00 76.45 ? 394 PRO A CG 1 +ATOM 3105 C CD . PRO A 1 394 ? 63.442 33.811 30.181 1.00 76.02 ? 394 PRO A CD 1 +ATOM 3106 N N . MET A 1 395 ? 65.334 29.748 29.084 1.00 73.44 ? 395 MET A N 1 +ATOM 3107 C CA . MET A 1 395 ? 64.859 28.435 28.689 1.00 72.77 ? 395 MET A CA 1 +ATOM 3108 C C . MET A 1 395 ? 64.536 27.595 29.925 1.00 71.12 ? 395 MET A C 1 +ATOM 3109 O O . MET A 1 395 ? 65.197 26.598 30.229 1.00 70.73 ? 395 MET A O 1 +ATOM 3110 C CB . MET A 1 395 ? 65.900 27.760 27.799 1.00 73.72 ? 395 MET A CB 1 +ATOM 3111 C CG . MET A 1 395 ? 65.894 28.298 26.374 1.00 73.67 ? 395 MET A CG 1 +ATOM 3112 S SD . MET A 1 395 ? 67.251 27.571 25.461 1.00 75.42 ? 395 MET A SD 1 +ATOM 3113 C CE . MET A 1 395 ? 67.385 28.685 24.018 1.00 74.41 ? 395 MET A CE 1 +ATOM 3114 N N . ILE A 1 396 ? 63.486 28.026 30.613 1.00 69.43 ? 396 ILE A N 1 +ATOM 3115 C CA . ILE A 1 396 ? 63.001 27.415 31.839 1.00 68.89 ? 396 ILE A CA 1 +ATOM 3116 C C . ILE A 1 396 ? 61.482 27.298 31.753 1.00 68.85 ? 396 ILE A C 1 +ATOM 3117 O O . ILE A 1 396 ? 60.817 28.209 31.288 1.00 68.62 ? 396 ILE A O 1 +ATOM 3118 C CB . ILE A 1 396 ? 63.334 28.307 33.013 1.00 68.38 ? 396 ILE A CB 1 +ATOM 3119 C CG1 . ILE A 1 396 ? 62.705 29.684 32.766 1.00 67.74 ? 396 ILE A CG1 1 +ATOM 3120 C CG2 . ILE A 1 396 ? 64.843 28.405 33.171 1.00 67.00 ? 396 ILE A CG2 1 +ATOM 3121 C CD1 . ILE A 1 396 ? 62.896 30.671 33.852 1.00 66.96 ? 396 ILE A CD1 1 +ATOM 3122 N N . PRO A 1 397 ? 60.916 26.191 32.247 1.00 69.36 ? 397 PRO A N 1 +ATOM 3123 C CA . PRO A 1 397 ? 59.465 25.934 32.225 1.00 69.86 ? 397 PRO A CA 1 +ATOM 3124 C C . PRO A 1 397 ? 58.576 27.150 32.461 1.00 70.25 ? 397 PRO A C 1 +ATOM 3125 O O . PRO A 1 397 ? 58.084 27.355 33.567 1.00 71.97 ? 397 PRO A O 1 +ATOM 3126 C CB . PRO A 1 397 ? 59.284 24.848 33.296 1.00 69.52 ? 397 PRO A CB 1 +ATOM 3127 C CG . PRO A 1 397 ? 60.533 24.954 34.144 1.00 69.31 ? 397 PRO A CG 1 +ATOM 3128 C CD . PRO A 1 397 ? 61.604 25.253 33.149 1.00 69.27 ? 397 PRO A CD 1 +ATOM 3129 N N . LEU A 1 398 ? 58.342 27.934 31.413 1.00 69.96 ? 398 LEU A N 1 +ATOM 3130 C CA . LEU A 1 398 ? 57.543 29.146 31.535 1.00 69.69 ? 398 LEU A CA 1 +ATOM 3131 C C . LEU A 1 398 ? 56.088 28.888 31.885 1.00 70.78 ? 398 LEU A C 1 +ATOM 3132 O O . LEU A 1 398 ? 55.547 29.473 32.826 1.00 71.25 ? 398 LEU A O 1 +ATOM 3133 C CB . LEU A 1 398 ? 57.637 29.961 30.248 1.00 67.62 ? 398 LEU A CB 1 +ATOM 3134 C CG . LEU A 1 398 ? 59.059 30.198 29.727 1.00 67.53 ? 398 LEU A CG 1 +ATOM 3135 C CD1 . LEU A 1 398 ? 59.018 31.160 28.558 1.00 68.51 ? 398 LEU A CD1 1 +ATOM 3136 C CD2 . LEU A 1 398 ? 59.940 30.765 30.817 1.00 67.27 ? 398 LEU A CD2 1 +ATOM 3137 N N . TYR A 1 399 ? 55.456 28.005 31.126 1.00 72.16 ? 399 TYR A N 1 +ATOM 3138 C CA . TYR A 1 399 ? 54.053 27.667 31.342 1.00 72.97 ? 399 TYR A CA 1 +ATOM 3139 C C . TYR A 1 399 ? 53.790 27.115 32.745 1.00 76.08 ? 399 TYR A C 1 +ATOM 3140 O O . TYR A 1 399 ? 52.737 27.362 33.325 1.00 76.42 ? 399 TYR A O 1 +ATOM 3141 C CB . TYR A 1 399 ? 53.601 26.651 30.290 1.00 68.61 ? 399 TYR A CB 1 +ATOM 3142 C CG . TYR A 1 399 ? 52.978 27.256 29.055 1.00 63.31 ? 399 TYR A CG 1 +ATOM 3143 C CD1 . TYR A 1 399 ? 51.809 27.982 29.144 1.00 61.87 ? 399 TYR A CD1 1 +ATOM 3144 C CD2 . TYR A 1 399 ? 53.515 27.043 27.796 1.00 61.33 ? 399 TYR A CD2 1 +ATOM 3145 C CE1 . TYR A 1 399 ? 51.169 28.477 28.010 1.00 60.49 ? 399 TYR A CE1 1 +ATOM 3146 C CE2 . TYR A 1 399 ? 52.881 27.538 26.654 1.00 59.99 ? 399 TYR A CE2 1 +ATOM 3147 C CZ . TYR A 1 399 ? 51.703 28.251 26.772 1.00 59.21 ? 399 TYR A CZ 1 +ATOM 3148 O OH . TYR A 1 399 ? 51.029 28.723 25.670 1.00 57.67 ? 399 TYR A OH 1 +ATOM 3149 N N . ARG A 1 400 ? 54.744 26.356 33.281 1.00 80.04 ? 400 ARG A N 1 +ATOM 3150 C CA . ARG A 1 400 ? 54.602 25.774 34.620 1.00 83.19 ? 400 ARG A CA 1 +ATOM 3151 C C . ARG A 1 400 ? 54.032 26.842 35.542 1.00 85.03 ? 400 ARG A C 1 +ATOM 3152 O O . ARG A 1 400 ? 52.837 26.806 35.888 1.00 85.80 ? 400 ARG A O 1 +ATOM 3153 C CB . ARG A 1 400 ? 55.963 25.314 35.133 1.00 99.99 ? 400 ARG A CB 1 +ATOM 3154 C CG . ARG A 1 400 ? 55.798 24.667 36.502 0.0000 99.99 ? 400 ARG A CG 1 +ATOM 3155 C CD . ARG A 1 400 ? 57.142 24.119 36.971 0.0000 99.99 ? 400 ARG A CD 1 +ATOM 3156 N NE . ARG A 1 400 ? 57.912 25.152 37.698 0.0000 99.99 ? 400 ARG A NE 1 +ATOM 3157 C CZ . ARG A 1 400 ? 57.685 25.463 38.971 0.0000 99.99 ? 400 ARG A CZ 1 +ATOM 3158 N NH1 . ARG A 1 400 ? 56.738 24.860 39.686 0.0000 99.99 ? 400 ARG A NH1 1 +ATOM 3159 N NH2 . ARG A 1 400 ? 58.436 26.408 39.528 0.0000 99.99 ? 400 ARG A NH2 1 +ATOM 3160 N N . ASN A 1 401 ? 54.896 27.785 35.925 1.00 86.21 ? 401 ASN A N 1 +ATOM 3161 C CA . ASN A 1 401 ? 54.514 28.892 36.792 1.00 87.61 ? 401 ASN A CA 1 +ATOM 3162 C C . ASN A 1 401 ? 53.779 29.941 35.957 1.00 88.81 ? 401 ASN A C 1 +ATOM 3163 O O . ASN A 1 401 ? 54.160 31.118 35.949 1.00 88.79 ? 401 ASN A O 1 +ATOM 3164 C CB . ASN A 1 401 ? 55.758 29.514 37.418 1.00 99.99 ? 401 ASN A CB 1 +ATOM 3165 C CG . ASN A 1 401 ? 55.384 30.542 38.476 0.0000 99.99 ? 401 ASN A CG 1 +ATOM 3166 O OD1 . ASN A 1 401 ? 55.739 31.713 38.362 0.0000 99.99 ? 401 ASN A OD1 1 +ATOM 3167 N ND2 . ASN A 1 401 ? 54.667 30.099 39.511 0.0000 99.99 ? 401 ASN A ND2 1 +ATOM 3168 N N . LEU A 1 402 ? 52.729 29.487 35.259 1.00 89.87 ? 402 LEU A N 1 +ATOM 3169 C CA . LEU A 1 402 ? 51.880 30.326 34.392 1.00 90.16 ? 402 LEU A CA 1 +ATOM 3170 C C . LEU A 1 402 ? 50.412 29.835 34.352 1.00 89.91 ? 402 LEU A C 1 +ATOM 3171 O O . LEU A 1 402 ? 49.488 30.622 34.544 1.00 99.99 ? 402 LEU A O 1 +ATOM 3172 C CB . LEU A 1 402 ? 52.418 30.308 32.965 1.00 99.99 ? 402 LEU A CB 1 +ATOM 3173 C CG . LEU A 1 402 ? 51.889 31.518 32.205 0.0000 99.99 ? 402 LEU A CG 1 +ATOM 3174 C CD1 . LEU A 1 402 ? 52.328 32.795 32.916 0.0000 99.99 ? 402 LEU A CD1 1 +ATOM 3175 C CD2 . LEU A 1 402 ? 52.443 31.511 30.785 0.0000 99.99 ? 402 LEU A CD2 1 +ATOM 3176 N N . PRO A 1 403 ? 49.638 31.600 33.018 1.00 89.84 ? 403 PRO A N 1 +HETATM 3177 C C1 . NAG B 2 . ? 62.117 32.333 -10.851 1.00 86.48 ? 1 NAG B C1 1 +HETATM 3178 C C2 . NAG B 2 . ? 61.640 33.306 -11.943 1.00 88.39 ? 1 NAG B C2 1 +HETATM 3179 C C3 . NAG B 2 . ? 62.455 33.072 -13.216 1.00 89.93 ? 1 NAG B C3 1 +HETATM 3180 C C4 . NAG B 2 . ? 63.973 33.100 -12.963 1.00 91.46 ? 1 NAG B C4 1 +HETATM 3181 C C5 . NAG B 2 . ? 64.333 32.202 -11.769 1.00 90.89 ? 1 NAG B C5 1 +HETATM 3182 C C6 . NAG B 2 . ? 65.794 32.332 -11.347 1.00 91.57 ? 1 NAG B C6 1 +HETATM 3183 C C7 . NAG B 2 . ? 59.292 33.666 -11.460 1.00 91.93 ? 1 NAG B C7 1 +HETATM 3184 C C8 . NAG B 2 . ? 59.572 35.021 -10.803 1.00 91.98 ? 1 NAG B C8 1 +HETATM 3185 N N2 . NAG B 2 . ? 60.230 33.123 -12.238 1.00 89.59 ? 1 NAG B N2 1 +HETATM 3186 O O3 . NAG B 2 . ? 62.125 34.045 -14.197 1.00 90.20 ? 1 NAG B O3 1 +HETATM 3187 O O4 . NAG B 2 . ? 64.620 32.592 -14.148 1.00 94.81 ? 1 NAG B O4 1 +HETATM 3188 O O5 . NAG B 2 . ? 63.520 32.542 -10.618 1.00 89.48 ? 1 NAG B O5 1 +HETATM 3189 O O6 . NAG B 2 . ? 66.588 31.264 -11.855 1.00 92.26 ? 1 NAG B O6 1 +HETATM 3190 O O7 . NAG B 2 . ? 58.201 33.121 -11.271 1.00 93.62 ? 1 NAG B O7 1 +HETATM 3191 C C1 . NAG B 2 . ? 65.884 33.027 -14.514 1.00 95.43 ? 2 NAG B C1 1 +HETATM 3192 C C2 . NAG B 2 . ? 66.169 32.456 -15.910 1.00 96.55 ? 2 NAG B C2 1 +HETATM 3193 C C3 . NAG B 2 . ? 67.347 33.147 -16.631 1.00 98.14 ? 2 NAG B C3 1 +HETATM 3194 C C4 . NAG B 2 . ? 67.286 34.672 -16.474 1.00 98.34 ? 2 NAG B C4 1 +HETATM 3195 C C5 . NAG B 2 . ? 67.119 35.014 -14.998 1.00 97.94 ? 2 NAG B C5 1 +HETATM 3196 C C6 . NAG B 2 . ? 67.113 36.512 -14.712 1.00 98.10 ? 2 NAG B C6 1 +HETATM 3197 C C7 . NAG B 2 . ? 65.555 30.159 -16.315 1.00 93.56 ? 2 NAG B C7 1 +HETATM 3198 C C8 . NAG B 2 . ? 65.804 29.681 -17.737 0.0000 94.03 ? 2 NAG B C8 1 +HETATM 3199 N N2 . NAG B 2 . ? 66.422 31.029 -15.806 1.00 94.72 ? 2 NAG B N2 1 +HETATM 3200 O O3 . NAG B 2 . ? 67.293 32.824 -18.020 1.00 100.07 ? 2 NAG B O3 1 +HETATM 3201 O O4 . NAG B 2 . ? 68.470 35.271 -16.987 1.00 99.03 ? 2 NAG B O4 1 +HETATM 3202 O O5 . NAG B 2 . ? 65.870 34.462 -14.534 1.00 96.53 ? 2 NAG B O5 1 +HETATM 3203 O O6 . NAG B 2 . ? 68.344 36.930 -14.140 0.0000 98.05 ? 2 NAG B O6 1 +HETATM 3204 O O7 . NAG B 2 . ? 64.583 29.739 -15.688 0.0000 94.03 ? 2 NAG B O7 1 +HETATM 3205 ZN ZN . ZN C 3 . ? 60.286 8.974 16.065 1.00 54.07 ? 1405 ZN A ZN 1 +HETATM 3206 O O . HOH D 4 . ? 78.132 27.878 -4.180 1.00 45.05 ? 2001 HOH A O 1 +HETATM 3207 O O . HOH D 4 . ? 82.330 6.013 0.636 1.00 64.86 ? 2002 HOH A O 1 +HETATM 3208 O O . HOH D 4 . ? 81.835 16.713 -6.124 1.00 59.84 ? 2003 HOH A O 1 +HETATM 3209 O O . HOH D 4 . ? 75.514 29.636 -3.926 1.00 41.20 ? 2004 HOH A O 1 +HETATM 3210 O O . HOH D 4 . ? 80.196 25.633 12.190 1.00 57.41 ? 2005 HOH A O 1 +HETATM 3211 O O . HOH D 4 . ? 62.684 12.475 -8.452 1.00 13.19 ? 2006 HOH A O 1 +HETATM 3212 O O . HOH D 4 . ? 52.879 18.275 -6.726 1.00 39.30 ? 2007 HOH A O 1 +HETATM 3213 O O . HOH D 4 . ? 72.319 -2.856 5.537 1.00 42.24 ? 2008 HOH A O 1 +HETATM 3214 O O . HOH D 4 . ? 67.653 37.005 13.102 1.00 25.37 ? 2009 HOH A O 1 +HETATM 3215 O O . HOH D 4 . ? 41.088 20.285 19.349 1.00 54.42 ? 2010 HOH A O 1 +HETATM 3216 O O . HOH D 4 . ? 38.875 16.995 9.527 1.00 56.21 ? 2011 HOH A O 1 +HETATM 3217 O O . HOH D 4 . ? 47.976 13.079 -3.204 1.00 32.64 ? 2012 HOH A O 1 +HETATM 3218 O O . HOH D 4 . ? 50.367 1.553 -0.172 1.00 32.17 ? 2013 HOH A O 1 +HETATM 3219 O O . HOH D 4 . ? 64.677 32.680 17.442 1.00 33.13 ? 2014 HOH A O 1 +HETATM 3220 O O . HOH D 4 . ? 55.922 11.228 19.777 1.00 32.14 ? 2015 HOH A O 1 +HETATM 3221 O O . HOH D 4 . ? 62.771 -4.388 6.952 1.00 32.97 ? 2016 HOH A O 1 +HETATM 3222 O O . HOH D 4 . ? 55.391 -5.228 5.992 1.00 26.00 ? 2017 HOH A O 1 +HETATM 3223 O O . HOH D 4 . ? 51.337 3.270 -2.361 1.00 45.64 ? 2018 HOH A O 1 +HETATM 3224 O O . HOH D 4 . ? 52.499 35.911 28.860 1.00 46.53 ? 2019 HOH A O 1 +HETATM 3225 O O . HOH D 4 . ? 61.821 56.186 24.783 1.00 49.46 ? 2020 HOH A O 1 +HETATM 3226 O O . HOH D 4 . ? 49.263 55.398 13.697 1.00 33.87 ? 2021 HOH A O 1 +HETATM 3227 O O . HOH D 4 . ? 47.187 44.309 1.811 1.00 66.55 ? 2022 HOH A O 1 +HETATM 3228 O O . HOH D 4 . ? 58.981 60.180 15.029 1.00 38.43 ? 2023 HOH A O 1 +HETATM 3229 O O . HOH D 4 . ? 69.184 33.070 -13.978 1.00 71.63 ? 2024 HOH A O 1 +HETATM 3230 O O . HOH D 4 . ? 69.863 34.623 -19.663 1.00 50.39 ? 2025 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 LEU 1 1 1 LEU LEU A . n +A 1 2 ASP 2 2 2 ASP ASP A . n +A 1 3 PHE 3 3 3 PHE PHE A . n +A 1 4 ASN 4 4 4 ASN ASN A . n +A 1 5 TYR 5 5 5 TYR TYR A . n +A 1 6 HIS 6 6 6 HIS HIS A . n +A 1 7 ARG 7 7 7 ARG ARG A . n +A 1 8 GLN 8 8 8 GLN GLN A . n +A 1 9 GLU 9 9 9 GLU GLU A . n +A 1 10 GLY 10 10 10 GLY GLY A . n +A 1 11 MET 11 11 11 MET MET A . n +A 1 12 GLU 12 12 12 GLU GLU A . n +A 1 13 ALA 13 13 13 ALA ALA A . n +A 1 14 PHE 14 14 14 PHE PHE A . n +A 1 15 LEU 15 15 15 LEU LEU A . n +A 1 16 LYS 16 16 16 LYS LYS A . n +A 1 17 THR 17 17 17 THR THR A . n +A 1 18 VAL 18 18 18 VAL VAL A . n +A 1 19 ALA 19 19 19 ALA ALA A . n +A 1 20 GLN 20 20 20 GLN GLN A . n +A 1 21 ASN 21 21 21 ASN ASN A . n +A 1 22 TYR 22 22 22 TYR TYR A . n +A 1 23 SER 23 23 23 SER SER A . n +A 1 24 SER 24 24 24 SER SER A . n +A 1 25 VAL 25 25 25 VAL VAL A . n +A 1 26 THR 26 26 26 THR THR A . n +A 1 27 HIS 27 27 27 HIS HIS A . n +A 1 28 LEU 28 28 28 LEU LEU A . n +A 1 29 HIS 29 29 29 HIS HIS A . n +A 1 30 SER 30 30 30 SER SER A . n +A 1 31 ILE 31 31 31 ILE ILE A . n +A 1 32 GLY 32 32 32 GLY GLY A . n +A 1 33 LYS 33 33 33 LYS LYS A . n +A 1 34 SER 34 34 34 SER SER A . n +A 1 35 VAL 35 35 35 VAL VAL A . n +A 1 36 LYS 36 36 36 LYS LYS A . n +A 1 37 GLY 37 37 37 GLY GLY A . n +A 1 38 ARG 38 38 38 ARG ARG A . n +A 1 39 ASN 39 39 39 ASN ASN A . n +A 1 40 LEU 40 40 40 LEU LEU A . n +A 1 41 TRP 41 41 41 TRP TRP A . n +A 1 42 VAL 42 42 42 VAL VAL A . n +A 1 43 LEU 43 43 43 LEU LEU A . n +A 1 44 VAL 44 44 44 VAL VAL A . n +A 1 45 VAL 45 45 45 VAL VAL A . n +A 1 46 GLY 46 46 46 GLY GLY A . n +A 1 47 ARG 47 47 47 ARG ARG A . n +A 1 48 PHE 48 48 48 PHE PHE A . n +A 1 49 PRO 49 49 49 PRO PRO A . n +A 1 50 LYS 50 50 50 LYS LYS A . n +A 1 51 GLU 51 51 51 GLU GLU A . n +A 1 52 HIS 52 52 52 HIS HIS A . n +A 1 53 ARG 53 53 53 ARG ARG A . n +A 1 54 ILE 54 54 54 ILE ILE A . n +A 1 55 GLY 55 55 55 GLY GLY A . n +A 1 56 ILE 56 56 56 ILE ILE A . n +A 1 57 PRO 57 57 57 PRO PRO A . n +A 1 58 GLU 58 58 58 GLU GLU A . n +A 1 59 PHE 59 59 59 PHE PHE A . n +A 1 60 LYS 60 60 60 LYS LYS A . n +A 1 61 TYR 61 61 61 TYR TYR A . n +A 1 62 VAL 62 62 62 VAL VAL A . n +A 1 63 ALA 63 63 63 ALA ALA A . n +A 1 64 ASN 64 64 64 ASN ASN A . n +A 1 65 MET 65 65 65 MET MET A . n +A 1 66 HIS 66 66 66 HIS HIS A . n +A 1 67 GLY 67 67 67 GLY GLY A . n +A 1 68 ASP 68 68 68 ASP ASP A . n +A 1 69 GLU 69 69 69 GLU GLU A . n +A 1 70 THR 70 70 70 THR THR A . n +A 1 71 VAL 71 71 71 VAL VAL A . n +A 1 72 GLY 72 72 72 GLY GLY A . n +A 1 73 ARG 73 73 73 ARG ARG A . n +A 1 74 GLU 74 74 74 GLU GLU A . n +A 1 75 LEU 75 75 75 LEU LEU A . n +A 1 76 LEU 76 76 76 LEU LEU A . n +A 1 77 LEU 77 77 77 LEU LEU A . n +A 1 78 HIS 78 78 78 HIS HIS A . n +A 1 79 LEU 79 79 79 LEU LEU A . n +A 1 80 ILE 80 80 80 ILE ILE A . n +A 1 81 ASP 81 81 81 ASP ASP A . n +A 1 82 TYR 82 82 82 TYR TYR A . n +A 1 83 LEU 83 83 83 LEU LEU A . n +A 1 84 VAL 84 84 84 VAL VAL A . n +A 1 85 THR 85 85 85 THR THR A . n +A 1 86 SER 86 86 86 SER SER A . n +A 1 87 ASP 87 87 87 ASP ASP A . n +A 1 88 GLY 88 88 88 GLY GLY A . n +A 1 89 LYS 89 89 89 LYS LYS A . n +A 1 90 ASP 90 90 90 ASP ASP A . n +A 1 91 PRO 91 91 91 PRO PRO A . n +A 1 92 GLU 92 92 92 GLU GLU A . n +A 1 93 ILE 93 93 93 ILE ILE A . n +A 1 94 THR 94 94 94 THR THR A . n +A 1 95 ASN 95 95 95 ASN ASN A . n +A 1 96 LEU 96 96 96 LEU LEU A . n +A 1 97 ILE 97 97 97 ILE ILE A . n +A 1 98 ASN 98 98 98 ASN ASN A . n +A 1 99 SER 99 99 99 SER SER A . n +A 1 100 THR 100 100 100 THR THR A . n +A 1 101 ARG 101 101 101 ARG ARG A . n +A 1 102 ILE 102 102 102 ILE ILE A . n +A 1 103 HIS 103 103 103 HIS HIS A . n +A 1 104 ILE 104 104 104 ILE ILE A . n +A 1 105 MET 105 105 105 MET MET A . n +A 1 106 PRO 106 106 106 PRO PRO A . n +A 1 107 SER 107 107 107 SER SER A . n +A 1 108 MET 108 108 108 MET MET A . n +A 1 109 ASN 109 109 109 ASN ASN A . n +A 1 110 PRO 110 110 110 PRO PRO A . n +A 1 111 ASP 111 111 111 ASP ASP A . n +A 1 112 GLY 112 112 112 GLY GLY A . n +A 1 113 PHE 113 113 113 PHE PHE A . n +A 1 114 GLU 114 114 114 GLU GLU A . n +A 1 115 ALA 115 115 115 ALA ALA A . n +A 1 116 VAL 116 116 116 VAL VAL A . n +A 1 117 LYS 117 117 117 LYS LYS A . n +A 1 118 LYS 118 118 118 LYS LYS A . n +A 1 119 PRO 119 119 119 PRO PRO A . n +A 1 120 ASP 120 120 120 ASP ASP A . n +A 1 121 CYS 121 121 121 CYS CYS A . n +A 1 122 TYR 122 122 122 TYR TYR A . n +A 1 123 TYR 123 123 123 TYR TYR A . n +A 1 124 SER 124 124 124 SER SER A . n +A 1 125 ILE 125 125 125 ILE ILE A . n +A 1 126 GLY 126 126 126 GLY GLY A . n +A 1 127 ARG 127 127 127 ARG ARG A . n +A 1 128 GLU 128 128 128 GLU GLU A . n +A 1 129 ASN 129 129 129 ASN ASN A . n +A 1 130 TYR 130 130 130 TYR TYR A . n +A 1 131 ASN 131 131 131 ASN ASN A . n +A 1 132 GLN 132 132 132 GLN GLN A . n +A 1 133 TYR 133 133 133 TYR TYR A . n +A 1 134 ASP 134 134 134 ASP ASP A . n +A 1 135 LEU 135 135 135 LEU LEU A . n +A 1 136 ASN 136 136 136 ASN ASN A . n +A 1 137 ARG 137 137 137 ARG ARG A . n +A 1 138 ASN 138 138 138 ASN ASN A . n +A 1 139 PHE 139 139 139 PHE PHE A . n +A 1 140 PRO 140 140 140 PRO PRO A . n +A 1 141 ASP 141 141 141 ASP ASP A . n +A 1 142 ALA 142 142 142 ALA ALA A . n +A 1 143 PHE 143 143 143 PHE PHE A . n +A 1 144 GLU 144 144 144 GLU GLU A . n +A 1 145 TYR 145 145 145 TYR TYR A . n +A 1 146 ASN 146 146 146 ASN ASN A . n +A 1 147 ASN 147 147 147 ASN ASN A . n +A 1 148 VAL 148 148 148 VAL VAL A . n +A 1 149 SER 149 149 149 SER SER A . n +A 1 150 ARG 150 150 150 ARG ARG A . n +A 1 151 GLN 151 151 151 GLN GLN A . n +A 1 152 PRO 152 152 152 PRO PRO A . n +A 1 153 GLU 153 153 153 GLU GLU A . n +A 1 154 THR 154 154 154 THR THR A . n +A 1 155 VAL 155 155 155 VAL VAL 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 MET 158 158 158 MET MET A . n +A 1 159 LYS 159 159 159 LYS LYS A . n +A 1 160 TRP 160 160 160 TRP TRP A . n +A 1 161 LEU 161 161 161 LEU LEU A . n +A 1 162 LYS 162 162 162 LYS LYS A . n +A 1 163 THR 163 163 163 THR THR A . n +A 1 164 GLU 164 164 164 GLU GLU A . n +A 1 165 THR 165 165 165 THR THR A . n +A 1 166 PHE 166 166 166 PHE PHE A . n +A 1 167 VAL 167 167 167 VAL VAL A . n +A 1 168 LEU 168 168 168 LEU LEU A . n +A 1 169 SER 169 169 169 SER SER A . n +A 1 170 ALA 170 170 170 ALA ALA A . n +A 1 171 ASN 171 171 171 ASN ASN A . n +A 1 172 LEU 172 172 172 LEU LEU A . n +A 1 173 HIS 173 173 173 HIS HIS A . n +A 1 174 GLY 174 174 174 GLY GLY A . n +A 1 175 GLY 175 175 175 GLY GLY A . n +A 1 176 ALA 176 176 176 ALA ALA A . n +A 1 177 LEU 177 177 177 LEU LEU A . n +A 1 178 VAL 178 178 178 VAL VAL A . n +A 1 179 ALA 179 179 179 ALA ALA A . n +A 1 180 SER 180 180 180 SER SER A . n +A 1 181 TYR 181 181 181 TYR TYR A . n +A 1 182 PRO 182 182 182 PRO PRO A . n +A 1 183 PHE 183 183 183 PHE PHE A . n +A 1 184 ASP 184 184 184 ASP ASP A . n +A 1 185 ASN 185 185 185 ASN ASN A . n +A 1 186 GLY 186 186 186 GLY GLY A . n +A 1 187 VAL 187 187 187 VAL VAL A . n +A 1 188 GLN 188 188 188 GLN GLN A . n +A 1 189 ALA 189 189 189 ALA ALA A . n +A 1 190 THR 190 190 190 THR THR A . n +A 1 191 GLY 191 191 191 GLY GLY A . n +A 1 192 ALA 192 192 192 ALA ALA A . n +A 1 193 LEU 193 193 193 LEU LEU A . n +A 1 194 TYR 194 194 194 TYR TYR A . n +A 1 195 SER 195 195 195 SER SER A . n +A 1 196 ARG 196 196 196 ARG ARG A . n +A 1 197 SER 197 197 197 SER SER A . n +A 1 198 LEU 198 198 198 LEU LEU A . n +A 1 199 THR 199 199 199 THR THR A . n +A 1 200 PRO 200 200 200 PRO PRO A . n +A 1 201 ASP 201 201 201 ASP ASP A . n +A 1 202 ASP 202 202 202 ASP ASP A . n +A 1 203 ASP 203 203 203 ASP ASP A . n +A 1 204 VAL 204 204 204 VAL VAL A . n +A 1 205 PHE 205 205 205 PHE PHE A . n +A 1 206 GLN 206 206 206 GLN GLN A . n +A 1 207 TYR 207 207 207 TYR TYR A . n +A 1 208 LEU 208 208 208 LEU LEU A . n +A 1 209 ALA 209 209 209 ALA ALA A . n +A 1 210 HIS 210 210 210 HIS HIS A . n +A 1 211 THR 211 211 211 THR THR A . n +A 1 212 TYR 212 212 212 TYR TYR A . n +A 1 213 ALA 213 213 213 ALA ALA A . n +A 1 214 SER 214 214 214 SER SER A . n +A 1 215 ARG 215 215 215 ARG ARG A . n +A 1 216 ASN 216 216 216 ASN ASN A . n +A 1 217 PRO 217 217 217 PRO PRO A . n +A 1 218 ASN 218 218 218 ASN ASN A . n +A 1 219 MET 219 219 219 MET MET A . n +A 1 220 LYS 220 220 220 LYS LYS A . n +A 1 221 LYS 221 221 221 LYS LYS A . n +A 1 222 GLY 222 222 222 GLY GLY A . n +A 1 223 ASP 223 223 223 ASP ASP A . n +A 1 224 GLU 224 224 224 GLU GLU A . n +A 1 225 CYS 225 225 225 CYS CYS A . n +A 1 226 LYS 226 226 226 LYS LYS A . n +A 1 227 ASN 227 227 227 ASN ASN A . n +A 1 228 LYS 228 228 228 LYS LYS A . n +A 1 229 MET 229 229 229 MET MET A . n +A 1 230 ASN 230 230 230 ASN ASN A . n +A 1 231 PHE 231 231 231 PHE PHE A . n +A 1 232 PRO 232 232 232 PRO PRO A . n +A 1 233 ASN 233 233 233 ASN ASN A . n +A 1 234 GLY 234 234 234 GLY GLY A . n +A 1 235 VAL 235 235 235 VAL VAL A . n +A 1 236 THR 236 236 236 THR THR A . n +A 1 237 ASN 237 237 237 ASN ASN A . n +A 1 238 GLY 238 238 238 GLY GLY A . n +A 1 239 TYR 239 239 239 TYR TYR A . n +A 1 240 SER 240 240 240 SER SER A . n +A 1 241 TRP 241 241 241 TRP TRP A . n +A 1 242 TYR 242 242 242 TYR TYR A . n +A 1 243 PRO 243 243 243 PRO PRO A . n +A 1 244 LEU 244 244 244 LEU LEU A . n +A 1 245 GLN 245 245 245 GLN GLN A . n +A 1 246 GLY 246 246 246 GLY GLY A . n +A 1 247 GLY 247 247 247 GLY GLY A . n +A 1 248 MET 248 248 248 MET MET A . n +A 1 249 GLN 249 249 249 GLN GLN A . n +A 1 250 ASP 250 250 250 ASP ASP A . n +A 1 251 TYR 251 251 251 TYR TYR A . n +A 1 252 ASN 252 252 252 ASN ASN A . n +A 1 253 TYR 253 253 253 TYR TYR A . n +A 1 254 ILE 254 254 254 ILE ILE A . n +A 1 255 TRP 255 255 255 TRP TRP A . n +A 1 256 ALA 256 256 256 ALA ALA A . n +A 1 257 GLN 257 257 257 GLN GLN A . n +A 1 258 CYS 258 258 258 CYS CYS A . n +A 1 259 PHE 259 259 259 PHE PHE A . n +A 1 260 GLU 260 260 260 GLU GLU A . n +A 1 261 ILE 261 261 261 ILE ILE A . n +A 1 262 THR 262 262 262 THR THR A . n +A 1 263 LEU 263 263 263 LEU LEU A . n +A 1 264 GLU 264 264 264 GLU GLU A . n +A 1 265 LEU 265 265 265 LEU LEU A . n +A 1 266 SER 266 266 266 SER SER A . n +A 1 267 CYS 267 267 267 CYS CYS A . n +A 1 268 CYS 268 268 268 CYS CYS A . n +A 1 269 LYS 269 269 269 LYS LYS A . n +A 1 270 TYR 270 270 270 TYR TYR A . n +A 1 271 PRO 271 271 271 PRO PRO A . n +A 1 272 ARG 272 272 272 ARG ARG A . n +A 1 273 GLU 273 273 273 GLU GLU A . n +A 1 274 GLU 274 274 274 GLU GLU A . n +A 1 275 LYS 275 275 275 LYS LYS A . n +A 1 276 LEU 276 276 276 LEU LEU A . n +A 1 277 PRO 277 277 277 PRO PRO A . n +A 1 278 SER 278 278 278 SER SER A . n +A 1 279 PHE 279 279 279 PHE PHE A . n +A 1 280 TRP 280 280 280 TRP TRP A . n +A 1 281 ASN 281 281 281 ASN ASN A . n +A 1 282 ASN 282 282 282 ASN ASN A . n +A 1 283 ASN 283 283 283 ASN ASN A . n +A 1 284 LYS 284 284 284 LYS LYS A . n +A 1 285 ALA 285 285 285 ALA ALA A . n +A 1 286 SER 286 286 286 SER SER A . n +A 1 287 LEU 287 287 287 LEU LEU A . n +A 1 288 ILE 288 288 288 ILE ILE A . n +A 1 289 GLU 289 289 289 GLU GLU A . n +A 1 290 TYR 290 290 290 TYR TYR A . n +A 1 291 ILE 291 291 291 ILE ILE A . n +A 1 292 LYS 292 292 292 LYS LYS A . n +A 1 293 GLN 293 293 293 GLN GLN A . n +A 1 294 VAL 294 294 294 VAL VAL A . n +A 1 295 HIS 295 295 295 HIS HIS A . n +A 1 296 LEU 296 296 296 LEU LEU A . n +A 1 297 GLY 297 297 297 GLY GLY A . n +A 1 298 VAL 298 298 298 VAL VAL A . n +A 1 299 LYS 299 299 299 LYS LYS A . n +A 1 300 GLY 300 300 300 GLY GLY A . n +A 1 301 GLN 301 301 301 GLN GLN A . n +A 1 302 VAL 302 302 302 VAL VAL A . n +A 1 303 PHE 303 303 303 PHE PHE A . n +A 1 304 ASP 304 304 304 ASP ASP A . n +A 1 305 GLN 305 305 305 GLN GLN A . n +A 1 306 ASN 306 306 306 ASN ASN A . n +A 1 307 GLY 307 307 307 GLY GLY A . n +A 1 308 ASN 308 308 308 ASN ASN A . n +A 1 309 PRO 309 309 309 PRO PRO A . n +A 1 310 LEU 310 310 310 LEU LEU A . n +A 1 311 PRO 311 311 311 PRO PRO A . n +A 1 312 ASN 312 312 312 ASN ASN A . n +A 1 313 VAL 313 313 313 VAL VAL A . n +A 1 314 ILE 314 314 314 ILE ILE A . n +A 1 315 VAL 315 315 315 VAL VAL A . n +A 1 316 GLU 316 316 316 GLU GLU A . n +A 1 317 VAL 317 317 317 VAL VAL A . n +A 1 318 GLN 318 318 318 GLN GLN A . n +A 1 319 ASP 319 319 319 ASP ASP A . n +A 1 320 ARG 320 320 320 ARG ARG A . n +A 1 321 LYS 321 321 321 LYS LYS A . n +A 1 322 HIS 322 322 322 HIS HIS A . n +A 1 323 ILE 323 323 323 ILE ILE A . n +A 1 324 CYS 324 324 324 CYS CYS A . n +A 1 325 PRO 325 325 325 PRO PRO A . n +A 1 326 TYR 326 326 326 TYR TYR A . n +A 1 327 ARG 327 327 327 ARG ARG A . n +A 1 328 THR 328 328 328 THR THR A . n +A 1 329 ASN 329 329 329 ASN ASN A . n +A 1 330 LYS 330 330 330 LYS LYS A . n +A 1 331 TYR 331 331 331 TYR TYR A . n +A 1 332 GLY 332 332 332 GLY GLY A . n +A 1 333 GLU 333 333 333 GLU GLU A . n +A 1 334 TYR 334 334 334 TYR TYR A . n +A 1 335 TYR 335 335 335 TYR TYR A . n +A 1 336 LEU 336 336 336 LEU LEU A . n +A 1 337 LEU 337 337 337 LEU LEU A . n +A 1 338 LEU 338 338 338 LEU LEU A . n +A 1 339 LEU 339 339 339 LEU LEU A . n +A 1 340 PRO 340 340 340 PRO PRO A . n +A 1 341 GLY 341 341 341 GLY GLY A . n +A 1 342 SER 342 342 342 SER SER A . n +A 1 343 TYR 343 343 343 TYR TYR A . n +A 1 344 ILE 344 344 344 ILE ILE A . n +A 1 345 ILE 345 345 345 ILE ILE A . n +A 1 346 ASN 346 346 346 ASN ASN A . n +A 1 347 VAL 347 347 347 VAL VAL A . n +A 1 348 THR 348 348 348 THR THR A . n +A 1 349 VAL 349 349 349 VAL VAL A . n +A 1 350 PRO 350 350 350 PRO PRO A . n +A 1 351 GLY 351 351 351 GLY GLY A . n +A 1 352 HIS 352 352 352 HIS HIS A . n +A 1 353 ASP 353 353 353 ASP ASP A . n +A 1 354 PRO 354 354 354 PRO PRO A . n +A 1 355 HIS 355 355 355 HIS HIS A . n +A 1 356 ILE 356 356 356 ILE ILE A . n +A 1 357 THR 357 357 357 THR THR A . n +A 1 358 LYS 358 358 358 LYS LYS A . n +A 1 359 VAL 359 359 359 VAL VAL A . n +A 1 360 ILE 360 360 360 ILE ILE A . n +A 1 361 ILE 361 361 361 ILE ILE A . n +A 1 362 PRO 362 362 362 PRO PRO A . n +A 1 363 GLU 363 363 363 GLU GLU A . n +A 1 364 LYS 364 364 364 LYS LYS 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 ASN 367 367 367 ASN ASN A . n +A 1 368 PHE 368 368 368 PHE PHE A . n +A 1 369 SER 369 369 369 SER SER A . n +A 1 370 ALA 370 370 370 ALA ALA A . n +A 1 371 LEU 371 371 371 LEU LEU A . n +A 1 372 LYS 372 372 372 LYS LYS A . n +A 1 373 LYS 373 373 373 LYS LYS A . n +A 1 374 ASP 374 374 374 ASP ASP A . n +A 1 375 ILE 375 375 375 ILE ILE A . n +A 1 376 LEU 376 376 376 LEU LEU A . n +A 1 377 LEU 377 377 377 LEU LEU A . n +A 1 378 PRO 378 378 378 PRO PRO A . n +A 1 379 PHE 379 379 379 PHE PHE A . n +A 1 380 GLN 380 380 380 GLN GLN A . n +A 1 381 GLY 381 381 381 GLY GLY A . n +A 1 382 GLN 382 382 ? ? ? A . n +A 1 383 LEU 383 383 ? ? ? A . n +A 1 384 ASP 384 384 ? ? ? A . n +A 1 385 SER 385 385 ? ? ? A . n +A 1 386 ILE 386 386 ? ? ? A . n +A 1 387 PRO 387 387 ? ? ? A . n +A 1 388 VAL 388 388 ? ? ? A . n +A 1 389 SER 389 389 ? ? ? A . n +A 1 390 ASN 390 390 ? ? ? A . n +A 1 391 PRO 391 391 391 PRO PRO A . n +A 1 392 SER 392 392 392 SER SER A . n +A 1 393 CYS 393 393 393 CYS CYS A . n +A 1 394 PRO 394 394 394 PRO PRO A . n +A 1 395 MET 395 395 395 MET MET A . n +A 1 396 ILE 396 396 396 ILE ILE A . n +A 1 397 PRO 397 397 397 PRO PRO A . n +A 1 398 LEU 398 398 398 LEU LEU A . n +A 1 399 TYR 399 399 399 TYR TYR A . n +A 1 400 ARG 400 400 400 ARG ARG A . n +A 1 401 ASN 401 401 401 ASN ASN A . n +A 1 402 LEU 402 402 402 LEU LEU A . n +A 1 403 PRO 403 403 403 PRO PRO A . n +A 1 404 ASP 404 404 ? ? ? A . n +A 1 405 HIS 405 405 ? ? ? A . n +A 1 406 SER 406 406 ? ? ? A . n +A 1 407 ALA 407 407 ? ? ? A . n +A 1 408 ALA 408 408 ? ? ? A . n +A 1 409 THR 409 409 ? ? ? A . n +A 1 410 LYS 410 410 ? ? ? A . n +A 1 411 PRO 411 411 ? ? ? A . n +A 1 412 SER 412 412 ? ? ? A . n +A 1 413 LEU 413 413 ? ? ? A . n +A 1 414 PHE 414 414 ? ? ? A . n +A 1 415 LEU 415 415 ? ? ? A . n +A 1 416 PHE 416 416 ? ? ? A . n +A 1 417 LEU 417 417 ? ? ? A . n +A 1 418 VAL 418 418 ? ? ? A . n +A 1 419 SER 419 419 ? ? ? A . n +A 1 420 LEU 420 420 ? ? ? A . n +A 1 421 LEU 421 421 ? ? ? A . n +A 1 422 HIS 422 422 ? ? ? A . n +A 1 423 ILE 423 423 ? ? ? A . n +A 1 424 PHE 424 424 ? ? ? A . n +A 1 425 PHE 425 425 ? ? ? A . n +A 1 426 LYS 426 426 ? ? ? 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 +C 3 ZN 1 1405 1405 ZN ZN A . +D 4 HOH 1 2001 2001 HOH HOH A . +D 4 HOH 2 2002 2002 HOH HOH A . +D 4 HOH 3 2003 2003 HOH HOH A . +D 4 HOH 4 2004 2004 HOH HOH A . +D 4 HOH 5 2005 2005 HOH HOH A . +D 4 HOH 6 2006 2006 HOH HOH A . +D 4 HOH 7 2007 2007 HOH HOH A . +D 4 HOH 8 2008 2008 HOH HOH A . +D 4 HOH 9 2009 2009 HOH HOH A . +D 4 HOH 10 2010 2010 HOH HOH A . +D 4 HOH 11 2011 2011 HOH HOH A . +D 4 HOH 12 2012 2012 HOH HOH A . +D 4 HOH 13 2013 2013 HOH HOH A . +D 4 HOH 14 2014 2014 HOH HOH A . +D 4 HOH 15 2015 2015 HOH HOH A . +D 4 HOH 16 2016 2016 HOH HOH A . +D 4 HOH 17 2017 2017 HOH HOH A . +D 4 HOH 18 2018 2018 HOH HOH A . +D 4 HOH 19 2019 2019 HOH HOH A . +D 4 HOH 20 2020 2020 HOH HOH A . +D 4 HOH 21 2021 2021 HOH HOH A . +D 4 HOH 22 2022 2022 HOH HOH A . +D 4 HOH 23 2023 2023 HOH HOH A . +D 4 HOH 24 2024 2024 HOH HOH A . +D 4 HOH 25 2025 2025 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 98 +_pdbx_struct_mod_residue.auth_asym_id A +_pdbx_struct_mod_residue.auth_comp_id ASN +_pdbx_struct_mod_residue.auth_seq_id 98 +_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_and_software_defined_assembly +_pdbx_struct_assembly.method_details PQS +_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 +# +_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_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 ND1 ? A HIS 66 ? A HIS 66 ? 1_555 ZN ? C ZN . ? A ZN 1405 ? 1_555 OE1 ? A GLU 69 ? A GLU 69 ? 1_555 70.8 ? +2 ND1 ? A HIS 66 ? A HIS 66 ? 1_555 ZN ? C ZN . ? A ZN 1405 ? 1_555 OE2 ? A GLU 69 ? A GLU 69 ? 1_555 97.0 ? +3 OE1 ? A GLU 69 ? A GLU 69 ? 1_555 ZN ? C ZN . ? A ZN 1405 ? 1_555 OE2 ? A GLU 69 ? A GLU 69 ? 1_555 59.7 ? +4 ND1 ? A HIS 66 ? A HIS 66 ? 1_555 ZN ? C ZN . ? A ZN 1405 ? 1_555 ND1 ? A HIS 173 ? A HIS 173 ? 1_555 90.7 ? +5 OE1 ? A GLU 69 ? A GLU 69 ? 1_555 ZN ? C ZN . ? A ZN 1405 ? 1_555 ND1 ? A HIS 173 ? A HIS 173 ? 1_555 130.2 ? +6 OE2 ? A GLU 69 ? A GLU 69 ? 1_555 ZN ? C ZN . ? A ZN 1405 ? 1_555 ND1 ? A HIS 173 ? A HIS 173 ? 1_555 78.3 ? +# +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 2004-04-08 +2 'Structure model' 1 1 2011-05-08 +3 'Structure model' 1 2 2011-07-13 +4 'Structure model' 2 0 2020-07-29 +5 'Structure model' 2 1 2023-12-13 +# +loop_ +_pdbx_audit_revision_details.ordinal +_pdbx_audit_revision_details.revision_ordinal +_pdbx_audit_revision_details.data_content_type +_pdbx_audit_revision_details.provider +_pdbx_audit_revision_details.type +_pdbx_audit_revision_details.description +_pdbx_audit_revision_details.details +1 1 'Structure model' repository 'Initial release' ? ? +2 4 'Structure model' repository Remediation 'Carbohydrate remediation' ? +# +loop_ +_pdbx_audit_revision_group.ordinal +_pdbx_audit_revision_group.revision_ordinal +_pdbx_audit_revision_group.data_content_type +_pdbx_audit_revision_group.group +1 2 'Structure model' 'Version format compliance' +2 3 'Structure model' 'Version format compliance' +3 4 'Structure model' Advisory +4 4 'Structure model' 'Atomic model' +5 4 'Structure model' 'Data collection' +6 4 'Structure model' 'Derived calculations' +7 4 'Structure model' 'Structure summary' +8 5 'Structure model' Advisory +9 5 'Structure model' 'Data collection' +10 5 'Structure model' 'Database references' +11 5 'Structure model' 'Refinement description' +12 5 'Structure model' 'Structure summary' +# +loop_ +_pdbx_audit_revision_category.ordinal +_pdbx_audit_revision_category.revision_ordinal +_pdbx_audit_revision_category.data_content_type +_pdbx_audit_revision_category.category +1 4 'Structure model' atom_site +2 4 'Structure model' chem_comp +3 4 'Structure model' entity +4 4 'Structure model' pdbx_branch_scheme +5 4 'Structure model' pdbx_chem_comp_identifier +6 4 'Structure model' pdbx_entity_branch +7 4 'Structure model' pdbx_entity_branch_descriptor +8 4 'Structure model' pdbx_entity_branch_link +9 4 'Structure model' pdbx_entity_branch_list +10 4 'Structure model' pdbx_entity_nonpoly +11 4 'Structure model' pdbx_nonpoly_scheme +12 4 'Structure model' pdbx_struct_assembly_gen +13 4 'Structure model' pdbx_struct_conn_angle +14 4 'Structure model' pdbx_unobs_or_zero_occ_atoms +15 4 'Structure model' struct_asym +16 4 'Structure model' struct_conn +17 4 'Structure model' struct_site +18 4 'Structure model' struct_site_gen +19 5 'Structure model' chem_comp +20 5 'Structure model' chem_comp_atom +21 5 'Structure model' chem_comp_bond +22 5 'Structure model' database_2 +23 5 'Structure model' pdbx_initial_refinement_model +24 5 'Structure model' pdbx_unobs_or_zero_occ_atoms +# +loop_ +_pdbx_audit_revision_item.ordinal +_pdbx_audit_revision_item.revision_ordinal +_pdbx_audit_revision_item.data_content_type +_pdbx_audit_revision_item.item +1 4 'Structure model' '_atom_site.auth_asym_id' +2 4 'Structure model' '_atom_site.auth_seq_id' +3 4 'Structure model' '_atom_site.label_asym_id' +4 4 'Structure model' '_chem_comp.name' +5 4 'Structure model' '_chem_comp.type' +6 4 'Structure model' '_entity.formula_weight' +7 4 'Structure model' '_entity.pdbx_description' +8 4 'Structure model' '_entity.pdbx_number_of_molecules' +9 4 'Structure model' '_entity.type' +10 4 'Structure model' '_pdbx_struct_assembly_gen.asym_id_list' +11 4 'Structure model' '_pdbx_struct_conn_angle.ptnr2_label_asym_id' +12 4 'Structure model' '_struct_conn.pdbx_leaving_atom_flag' +13 4 'Structure model' '_struct_conn.pdbx_role' +14 4 'Structure model' '_struct_conn.ptnr1_auth_asym_id' +15 4 'Structure model' '_struct_conn.ptnr1_auth_comp_id' +16 4 'Structure model' '_struct_conn.ptnr1_auth_seq_id' +17 4 'Structure model' '_struct_conn.ptnr1_label_asym_id' +18 4 'Structure model' '_struct_conn.ptnr1_label_atom_id' +19 4 'Structure model' '_struct_conn.ptnr1_label_comp_id' +20 4 'Structure model' '_struct_conn.ptnr1_label_seq_id' +21 4 'Structure model' '_struct_conn.ptnr2_auth_asym_id' +22 4 'Structure model' '_struct_conn.ptnr2_auth_comp_id' +23 4 'Structure model' '_struct_conn.ptnr2_auth_seq_id' +24 4 'Structure model' '_struct_conn.ptnr2_label_asym_id' +25 4 'Structure model' '_struct_conn.ptnr2_label_atom_id' +26 4 'Structure model' '_struct_conn.ptnr2_label_comp_id' +27 4 'Structure model' '_struct_conn.ptnr2_label_seq_id' +28 5 'Structure model' '_chem_comp.pdbx_synonyms' +29 5 'Structure model' '_database_2.pdbx_DOI' +30 5 'Structure model' '_database_2.pdbx_database_accession' +# +loop_ +_software.name +_software.classification +_software.version +_software.citation_id +_software.pdbx_ordinal +CNS refinement . ? 1 +MOSFLM 'data reduction' . ? 2 +SCALA 'data scaling' . ? 3 +AMoRE phasing . ? 4 +# +_pdbx_database_remark.id 700 +_pdbx_database_remark.text +; +SHEET +THE SHEET STRUCTURE OF THIS MOLECULE IS BIFURCATED. IN +ORDER TO REPRESENT THIS FEATURE IN THE SHEET RECORDS BELOW, +TWO SHEETS ARE DEFINED. +; +# +_pdbx_validate_close_contact.id 1 +_pdbx_validate_close_contact.PDB_model_num 1 +_pdbx_validate_close_contact.auth_atom_id_1 OE2 +_pdbx_validate_close_contact.auth_asym_id_1 A +_pdbx_validate_close_contact.auth_comp_id_1 GLU +_pdbx_validate_close_contact.auth_seq_id_1 9 +_pdbx_validate_close_contact.PDB_ins_code_1 ? +_pdbx_validate_close_contact.label_alt_id_1 ? +_pdbx_validate_close_contact.auth_atom_id_2 O +_pdbx_validate_close_contact.auth_asym_id_2 A +_pdbx_validate_close_contact.auth_comp_id_2 HOH +_pdbx_validate_close_contact.auth_seq_id_2 2002 +_pdbx_validate_close_contact.PDB_ins_code_2 ? +_pdbx_validate_close_contact.label_alt_id_2 ? +_pdbx_validate_close_contact.dist 2.15 +# +loop_ +_pdbx_validate_symm_contact.id +_pdbx_validate_symm_contact.PDB_model_num +_pdbx_validate_symm_contact.auth_atom_id_1 +_pdbx_validate_symm_contact.auth_asym_id_1 +_pdbx_validate_symm_contact.auth_comp_id_1 +_pdbx_validate_symm_contact.auth_seq_id_1 +_pdbx_validate_symm_contact.PDB_ins_code_1 +_pdbx_validate_symm_contact.label_alt_id_1 +_pdbx_validate_symm_contact.site_symmetry_1 +_pdbx_validate_symm_contact.auth_atom_id_2 +_pdbx_validate_symm_contact.auth_asym_id_2 +_pdbx_validate_symm_contact.auth_comp_id_2 +_pdbx_validate_symm_contact.auth_seq_id_2 +_pdbx_validate_symm_contact.PDB_ins_code_2 +_pdbx_validate_symm_contact.label_alt_id_2 +_pdbx_validate_symm_contact.site_symmetry_2 +_pdbx_validate_symm_contact.dist +1 1 NZ A LYS 118 ? ? 1_555 CE2 A TYR 133 ? ? 5_555 1.65 +2 1 NZ A LYS 118 ? ? 1_555 CD2 A TYR 133 ? ? 5_555 1.94 +3 1 NZ A LYS 118 ? ? 1_555 CZ A TYR 133 ? ? 5_555 2.18 +# +loop_ +_pdbx_validate_rmsd_bond.id +_pdbx_validate_rmsd_bond.PDB_model_num +_pdbx_validate_rmsd_bond.auth_atom_id_1 +_pdbx_validate_rmsd_bond.auth_asym_id_1 +_pdbx_validate_rmsd_bond.auth_comp_id_1 +_pdbx_validate_rmsd_bond.auth_seq_id_1 +_pdbx_validate_rmsd_bond.PDB_ins_code_1 +_pdbx_validate_rmsd_bond.label_alt_id_1 +_pdbx_validate_rmsd_bond.auth_atom_id_2 +_pdbx_validate_rmsd_bond.auth_asym_id_2 +_pdbx_validate_rmsd_bond.auth_comp_id_2 +_pdbx_validate_rmsd_bond.auth_seq_id_2 +_pdbx_validate_rmsd_bond.PDB_ins_code_2 +_pdbx_validate_rmsd_bond.label_alt_id_2 +_pdbx_validate_rmsd_bond.bond_value +_pdbx_validate_rmsd_bond.bond_target_value +_pdbx_validate_rmsd_bond.bond_deviation +_pdbx_validate_rmsd_bond.bond_standard_deviation +_pdbx_validate_rmsd_bond.linker_flag +1 1 CG A PRO 391 ? ? CD A PRO 391 ? ? 1.276 1.502 -0.226 0.033 N +2 1 CD A PRO 391 ? ? N A PRO 391 ? ? 1.559 1.474 0.085 0.014 N +# +loop_ +_pdbx_validate_rmsd_angle.id +_pdbx_validate_rmsd_angle.PDB_model_num +_pdbx_validate_rmsd_angle.auth_atom_id_1 +_pdbx_validate_rmsd_angle.auth_asym_id_1 +_pdbx_validate_rmsd_angle.auth_comp_id_1 +_pdbx_validate_rmsd_angle.auth_seq_id_1 +_pdbx_validate_rmsd_angle.PDB_ins_code_1 +_pdbx_validate_rmsd_angle.label_alt_id_1 +_pdbx_validate_rmsd_angle.auth_atom_id_2 +_pdbx_validate_rmsd_angle.auth_asym_id_2 +_pdbx_validate_rmsd_angle.auth_comp_id_2 +_pdbx_validate_rmsd_angle.auth_seq_id_2 +_pdbx_validate_rmsd_angle.PDB_ins_code_2 +_pdbx_validate_rmsd_angle.label_alt_id_2 +_pdbx_validate_rmsd_angle.auth_atom_id_3 +_pdbx_validate_rmsd_angle.auth_asym_id_3 +_pdbx_validate_rmsd_angle.auth_comp_id_3 +_pdbx_validate_rmsd_angle.auth_seq_id_3 +_pdbx_validate_rmsd_angle.PDB_ins_code_3 +_pdbx_validate_rmsd_angle.label_alt_id_3 +_pdbx_validate_rmsd_angle.angle_value +_pdbx_validate_rmsd_angle.angle_target_value +_pdbx_validate_rmsd_angle.angle_deviation +_pdbx_validate_rmsd_angle.angle_standard_deviation +_pdbx_validate_rmsd_angle.linker_flag +1 1 C A CYS 324 ? ? N A PRO 325 ? ? CA A PRO 325 ? ? 128.51 119.30 9.21 1.50 Y +2 1 C A ILE 361 ? ? N A PRO 362 ? ? CA A PRO 362 ? ? 129.02 119.30 9.72 1.50 Y +# +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 PHE A 3 ? ? -101.10 50.73 +2 1 ARG A 7 ? ? -57.76 -175.23 +3 1 GLU A 9 ? ? -49.15 -75.47 +4 1 ALA A 13 ? ? -41.01 -73.05 +5 1 LEU A 15 ? ? -47.04 -71.04 +6 1 ASN A 21 ? ? -48.37 -18.02 +7 1 SER A 23 ? ? -39.60 -26.61 +8 1 VAL A 25 ? ? -145.45 23.71 +9 1 SER A 34 ? ? -63.17 -172.93 +10 1 PHE A 48 ? ? -116.38 78.09 +11 1 LYS A 50 ? ? 89.09 -22.43 +12 1 PRO A 91 ? ? -61.06 -71.09 +13 1 ASN A 98 ? ? -68.32 -79.92 +14 1 SER A 99 ? ? -44.06 -7.49 +15 1 PRO A 119 ? ? -47.86 150.64 +16 1 ARG A 127 ? ? 108.99 -72.27 +17 1 ALA A 142 ? ? -66.12 5.41 +18 1 GLU A 144 ? ? -160.69 113.42 +19 1 TYR A 145 ? ? -21.64 115.93 +20 1 ASN A 147 ? ? -43.15 106.57 +21 1 SER A 149 ? ? -67.41 99.93 +22 1 ALA A 170 ? ? 170.03 116.09 +23 1 ASP A 201 ? ? -112.85 55.04 +24 1 GLU A 224 ? ? -133.21 -45.18 +25 1 LYS A 226 ? ? -64.66 -86.00 +26 1 ASN A 227 ? ? -59.81 5.37 +27 1 ASN A 233 ? ? 75.09 -0.18 +28 1 TYR A 242 ? ? -175.36 108.51 +29 1 ASN A 252 ? ? -37.62 -37.42 +30 1 LYS A 284 ? ? -27.84 -78.78 +31 1 ASN A 312 ? ? 45.01 13.35 +32 1 ARG A 320 ? ? -118.02 50.94 +33 1 PRO A 350 ? ? -33.15 127.91 +34 1 THR A 357 ? ? -160.56 112.93 +35 1 PRO A 362 ? ? -7.31 -133.12 +36 1 GLU A 363 ? ? 171.82 32.64 +37 1 LYS A 364 ? ? 143.23 116.47 +38 1 PHE A 368 ? ? -108.99 61.00 +39 1 ALA A 370 ? ? -67.69 -172.90 +40 1 PRO A 378 ? ? -82.43 30.58 +41 1 PHE A 379 ? ? -158.64 -155.54 +42 1 SER A 392 ? ? 17.06 -99.86 +43 1 PRO A 397 ? ? -37.31 81.94 +44 1 ARG A 400 ? ? -43.47 -75.59 +# +_pdbx_validate_planes.id 1 +_pdbx_validate_planes.PDB_model_num 1 +_pdbx_validate_planes.auth_comp_id TYR +_pdbx_validate_planes.auth_asym_id A +_pdbx_validate_planes.auth_seq_id 133 +_pdbx_validate_planes.PDB_ins_code ? +_pdbx_validate_planes.label_alt_id ? +_pdbx_validate_planes.rmsd 0.084 +_pdbx_validate_planes.type 'SIDE CHAIN' +# +_pdbx_validate_polymer_linkage.id 1 +_pdbx_validate_polymer_linkage.PDB_model_num 1 +_pdbx_validate_polymer_linkage.auth_atom_id_1 C +_pdbx_validate_polymer_linkage.auth_asym_id_1 A +_pdbx_validate_polymer_linkage.auth_comp_id_1 LEU +_pdbx_validate_polymer_linkage.auth_seq_id_1 402 +_pdbx_validate_polymer_linkage.PDB_ins_code_1 ? +_pdbx_validate_polymer_linkage.label_alt_id_1 ? +_pdbx_validate_polymer_linkage.auth_atom_id_2 N +_pdbx_validate_polymer_linkage.auth_asym_id_2 A +_pdbx_validate_polymer_linkage.auth_comp_id_2 PRO +_pdbx_validate_polymer_linkage.auth_seq_id_2 403 +_pdbx_validate_polymer_linkage.PDB_ins_code_2 ? +_pdbx_validate_polymer_linkage.label_alt_id_2 ? +_pdbx_validate_polymer_linkage.dist 2.34 +# +loop_ +_pdbx_unobs_or_zero_occ_atoms.id +_pdbx_unobs_or_zero_occ_atoms.PDB_model_num +_pdbx_unobs_or_zero_occ_atoms.polymer_flag +_pdbx_unobs_or_zero_occ_atoms.occupancy_flag +_pdbx_unobs_or_zero_occ_atoms.auth_asym_id +_pdbx_unobs_or_zero_occ_atoms.auth_comp_id +_pdbx_unobs_or_zero_occ_atoms.auth_seq_id +_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code +_pdbx_unobs_or_zero_occ_atoms.auth_atom_id +_pdbx_unobs_or_zero_occ_atoms.label_alt_id +_pdbx_unobs_or_zero_occ_atoms.label_asym_id +_pdbx_unobs_or_zero_occ_atoms.label_comp_id +_pdbx_unobs_or_zero_occ_atoms.label_seq_id +_pdbx_unobs_or_zero_occ_atoms.label_atom_id +1 1 Y 0 A GLU 9 ? CG ? A GLU 9 CG +2 1 Y 0 A GLU 9 ? CD ? A GLU 9 CD +3 1 Y 0 A GLU 9 ? OE1 ? A GLU 9 OE1 +4 1 Y 0 A GLU 9 ? OE2 ? A GLU 9 OE2 +5 1 Y 0 A LYS 33 ? CG ? A LYS 33 CG +6 1 Y 0 A LYS 33 ? CD ? A LYS 33 CD +7 1 Y 0 A LYS 33 ? CE ? A LYS 33 CE +8 1 Y 0 A LYS 33 ? NZ ? A LYS 33 NZ +9 1 Y 0 A LYS 36 ? CG ? A LYS 36 CG +10 1 Y 0 A LYS 36 ? CD ? A LYS 36 CD +11 1 Y 0 A LYS 36 ? CE ? A LYS 36 CE +12 1 Y 0 A LYS 36 ? NZ ? A LYS 36 NZ +13 1 Y 0 A LYS 50 ? CD ? A LYS 50 CD +14 1 Y 0 A LYS 50 ? CE ? A LYS 50 CE +15 1 Y 0 A LYS 50 ? NZ ? A LYS 50 NZ +16 1 Y 0 A ARG 53 ? CG ? A ARG 53 CG +17 1 Y 0 A ARG 53 ? CD ? A ARG 53 CD +18 1 Y 0 A ARG 53 ? NE ? A ARG 53 NE +19 1 Y 0 A ARG 53 ? CZ ? A ARG 53 CZ +20 1 Y 0 A ARG 53 ? NH1 ? A ARG 53 NH1 +21 1 Y 0 A ARG 53 ? NH2 ? A ARG 53 NH2 +22 1 Y 0 A ASN 98 ? CG ? A ASN 98 CG +23 1 Y 0 A ASN 98 ? OD1 ? A ASN 98 OD1 +24 1 Y 0 A LYS 118 ? CG ? A LYS 118 CG +25 1 Y 0 A LYS 118 ? CD ? A LYS 118 CD +26 1 Y 0 A LYS 118 ? CE ? A LYS 118 CE +27 1 Y 0 A LYS 118 ? NZ ? A LYS 118 NZ +28 1 Y 0 A LYS 159 ? CG ? A LYS 159 CG +29 1 Y 0 A LYS 159 ? CD ? A LYS 159 CD +30 1 Y 0 A LYS 159 ? CE ? A LYS 159 CE +31 1 Y 0 A LYS 159 ? NZ ? A LYS 159 NZ +32 1 Y 0 A GLN 188 ? CG ? A GLN 188 CG +33 1 Y 0 A GLN 188 ? CD ? A GLN 188 CD +34 1 Y 0 A GLN 188 ? OE1 ? A GLN 188 OE1 +35 1 Y 0 A GLN 188 ? NE2 ? A GLN 188 NE2 +36 1 Y 0 A ARG 196 ? CZ ? A ARG 196 CZ +37 1 Y 0 A ARG 196 ? NH1 ? A ARG 196 NH1 +38 1 Y 0 A ARG 196 ? NH2 ? A ARG 196 NH2 +39 1 Y 0 A ASP 223 ? CG ? A ASP 223 CG +40 1 Y 0 A ASP 223 ? OD1 ? A ASP 223 OD1 +41 1 Y 0 A ASP 223 ? OD2 ? A ASP 223 OD2 +42 1 Y 0 A GLU 224 ? CG ? A GLU 224 CG +43 1 Y 0 A GLU 224 ? CD ? A GLU 224 CD +44 1 Y 0 A GLU 224 ? OE1 ? A GLU 224 OE1 +45 1 Y 0 A GLU 224 ? OE2 ? A GLU 224 OE2 +46 1 Y 0 A LYS 226 ? CE ? A LYS 226 CE +47 1 Y 0 A LYS 226 ? NZ ? A LYS 226 NZ +48 1 Y 0 A ASN 227 ? CG ? A ASN 227 CG +49 1 Y 0 A ASN 227 ? OD1 ? A ASN 227 OD1 +50 1 Y 0 A ASN 227 ? ND2 ? A ASN 227 ND2 +51 1 Y 0 A GLN 249 ? CB ? A GLN 249 CB +52 1 Y 0 A GLN 249 ? CG ? A GLN 249 CG +53 1 Y 0 A GLN 249 ? CD ? A GLN 249 CD +54 1 Y 0 A GLN 249 ? OE1 ? A GLN 249 OE1 +55 1 Y 0 A GLN 249 ? NE2 ? A GLN 249 NE2 +56 1 Y 0 A GLN 305 ? CG ? A GLN 305 CG +57 1 Y 0 A GLN 305 ? CD ? A GLN 305 CD +58 1 Y 0 A GLN 305 ? OE1 ? A GLN 305 OE1 +59 1 Y 0 A GLN 305 ? NE2 ? A GLN 305 NE2 +60 1 Y 0 A GLN 318 ? CG ? A GLN 318 CG +61 1 Y 0 A GLN 318 ? CD ? A GLN 318 CD +62 1 Y 0 A GLN 318 ? OE1 ? A GLN 318 OE1 +63 1 Y 0 A GLN 318 ? NE2 ? A GLN 318 NE2 +64 1 Y 0 A ASN 346 ? OD1 ? A ASN 346 OD1 +65 1 Y 0 A ASN 346 ? ND2 ? A ASN 346 ND2 +66 1 Y 0 A LYS 364 ? CB ? A LYS 364 CB +67 1 Y 0 A LYS 364 ? CG ? A LYS 364 CG +68 1 Y 0 A LYS 364 ? CD ? A LYS 364 CD +69 1 Y 0 A LYS 364 ? CE ? A LYS 364 CE +70 1 Y 0 A LYS 364 ? NZ ? A LYS 364 NZ +71 1 Y 0 A ASN 367 ? CG ? A ASN 367 CG +72 1 Y 0 A ASN 367 ? OD1 ? A ASN 367 OD1 +73 1 Y 0 A ASN 367 ? ND2 ? A ASN 367 ND2 +74 1 Y 0 A LYS 372 ? CD ? A LYS 372 CD +75 1 Y 0 A LYS 372 ? CE ? A LYS 372 CE +76 1 Y 0 A LYS 372 ? NZ ? A LYS 372 NZ +77 1 Y 0 A PRO 391 ? CG ? A PRO 391 CG +78 1 Y 0 A PRO 391 ? CD ? A PRO 391 CD +79 1 Y 0 A ARG 400 ? CG ? A ARG 400 CG +80 1 Y 0 A ARG 400 ? CD ? A ARG 400 CD +81 1 Y 0 A ARG 400 ? NE ? A ARG 400 NE +82 1 Y 0 A ARG 400 ? CZ ? A ARG 400 CZ +83 1 Y 0 A ARG 400 ? NH1 ? A ARG 400 NH1 +84 1 Y 0 A ARG 400 ? NH2 ? A ARG 400 NH2 +85 1 Y 0 A ASN 401 ? CG ? A ASN 401 CG +86 1 Y 0 A ASN 401 ? OD1 ? A ASN 401 OD1 +87 1 Y 0 A ASN 401 ? ND2 ? A ASN 401 ND2 +88 1 Y 0 A LEU 402 ? CG ? A LEU 402 CG +89 1 Y 0 A LEU 402 ? CD1 ? A LEU 402 CD1 +90 1 Y 0 A LEU 402 ? CD2 ? A LEU 402 CD2 +91 1 Y 1 A PRO 403 ? CA ? A PRO 403 CA +92 1 Y 1 A PRO 403 ? C ? A PRO 403 C +93 1 Y 1 A PRO 403 ? O ? A PRO 403 O +94 1 Y 1 A PRO 403 ? CB ? A PRO 403 CB +95 1 Y 1 A PRO 403 ? CG ? A PRO 403 CG +96 1 Y 1 A PRO 403 ? CD ? A PRO 403 CD +97 1 N 0 B NAG 2 ? C8 ? B NAG ? C8 +98 1 N 0 B NAG 2 ? O6 ? B NAG ? O6 +99 1 N 0 B NAG 2 ? O7 ? B NAG ? O7 +# +loop_ +_pdbx_unobs_or_zero_occ_residues.id +_pdbx_unobs_or_zero_occ_residues.PDB_model_num +_pdbx_unobs_or_zero_occ_residues.polymer_flag +_pdbx_unobs_or_zero_occ_residues.occupancy_flag +_pdbx_unobs_or_zero_occ_residues.auth_asym_id +_pdbx_unobs_or_zero_occ_residues.auth_comp_id +_pdbx_unobs_or_zero_occ_residues.auth_seq_id +_pdbx_unobs_or_zero_occ_residues.PDB_ins_code +_pdbx_unobs_or_zero_occ_residues.label_asym_id +_pdbx_unobs_or_zero_occ_residues.label_comp_id +_pdbx_unobs_or_zero_occ_residues.label_seq_id +1 1 Y 1 A GLN 382 ? A GLN 382 +2 1 Y 1 A LEU 383 ? A LEU 383 +3 1 Y 1 A ASP 384 ? A ASP 384 +4 1 Y 1 A SER 385 ? A SER 385 +5 1 Y 1 A ILE 386 ? A ILE 386 +6 1 Y 1 A PRO 387 ? A PRO 387 +7 1 Y 1 A VAL 388 ? A VAL 388 +8 1 Y 1 A SER 389 ? A SER 389 +9 1 Y 1 A ASN 390 ? A ASN 390 +10 1 Y 1 A ASP 404 ? A ASP 404 +11 1 Y 1 A HIS 405 ? A HIS 405 +12 1 Y 1 A SER 406 ? A SER 406 +13 1 Y 1 A ALA 407 ? A ALA 407 +14 1 Y 1 A ALA 408 ? A ALA 408 +15 1 Y 1 A THR 409 ? A THR 409 +16 1 Y 1 A LYS 410 ? A LYS 410 +17 1 Y 1 A PRO 411 ? A PRO 411 +18 1 Y 1 A SER 412 ? A SER 412 +19 1 Y 1 A LEU 413 ? A LEU 413 +20 1 Y 1 A PHE 414 ? A PHE 414 +21 1 Y 1 A LEU 415 ? A LEU 415 +22 1 Y 1 A PHE 416 ? A PHE 416 +23 1 Y 1 A LEU 417 ? A LEU 417 +24 1 Y 1 A VAL 418 ? A VAL 418 +25 1 Y 1 A SER 419 ? A SER 419 +26 1 Y 1 A LEU 420 ? A LEU 420 +27 1 Y 1 A LEU 421 ? A LEU 421 +28 1 Y 1 A HIS 422 ? A HIS 422 +29 1 Y 1 A ILE 423 ? A ILE 423 +30 1 Y 1 A PHE 424 ? A PHE 424 +31 1 Y 1 A PHE 425 ? A PHE 425 +32 1 Y 1 A LYS 426 ? A LYS 426 +# +loop_ +_chem_comp_atom.comp_id +_chem_comp_atom.atom_id +_chem_comp_atom.type_symbol +_chem_comp_atom.pdbx_aromatic_flag +_chem_comp_atom.pdbx_stereo_config +_chem_comp_atom.pdbx_ordinal +ALA N N N N 1 +ALA CA C N S 2 +ALA C C N N 3 +ALA O O N N 4 +ALA CB C N N 5 +ALA OXT O N N 6 +ALA H H N N 7 +ALA H2 H N N 8 +ALA HA H N N 9 +ALA HB1 H N N 10 +ALA HB2 H N N 11 +ALA HB3 H N N 12 +ALA HXT H N N 13 +ARG N N N N 14 +ARG CA C N S 15 +ARG C C N N 16 +ARG O O N N 17 +ARG CB C N N 18 +ARG CG C N N 19 +ARG CD C N N 20 +ARG NE N N N 21 +ARG CZ C N N 22 +ARG NH1 N N N 23 +ARG NH2 N N N 24 +ARG OXT O N N 25 +ARG H H N N 26 +ARG H2 H N N 27 +ARG HA H N N 28 +ARG HB2 H N N 29 +ARG HB3 H N N 30 +ARG HG2 H N N 31 +ARG HG3 H N N 32 +ARG HD2 H N N 33 +ARG HD3 H N N 34 +ARG HE H N N 35 +ARG HH11 H N N 36 +ARG HH12 H N N 37 +ARG HH21 H N N 38 +ARG HH22 H N N 39 +ARG HXT H N N 40 +ASN N N N N 41 +ASN CA C N S 42 +ASN C C N N 43 +ASN O O N N 44 +ASN CB C N N 45 +ASN CG C N N 46 +ASN OD1 O N N 47 +ASN ND2 N N N 48 +ASN OXT O N N 49 +ASN H H N N 50 +ASN H2 H N N 51 +ASN HA H N N 52 +ASN HB2 H N N 53 +ASN HB3 H N N 54 +ASN HD21 H N N 55 +ASN HD22 H N N 56 +ASN HXT H N N 57 +ASP N N N N 58 +ASP CA C N S 59 +ASP C C N N 60 +ASP O O N N 61 +ASP CB C N N 62 +ASP CG C N N 63 +ASP OD1 O N N 64 +ASP OD2 O N N 65 +ASP OXT O N N 66 +ASP H H N N 67 +ASP H2 H N N 68 +ASP HA H N N 69 +ASP HB2 H N N 70 +ASP HB3 H N N 71 +ASP HD2 H N N 72 +ASP HXT H N N 73 +CYS N N N N 74 +CYS CA C N R 75 +CYS C C N N 76 +CYS O O N N 77 +CYS CB C N N 78 +CYS SG S N N 79 +CYS OXT O N N 80 +CYS H H N N 81 +CYS H2 H N N 82 +CYS HA H N N 83 +CYS HB2 H N N 84 +CYS HB3 H N N 85 +CYS HG H N N 86 +CYS HXT H N N 87 +GLN N N N N 88 +GLN CA C N S 89 +GLN C C N N 90 +GLN O O N N 91 +GLN CB C N N 92 +GLN CG C N N 93 +GLN CD C N N 94 +GLN OE1 O N N 95 +GLN NE2 N N N 96 +GLN OXT O N N 97 +GLN H H N N 98 +GLN H2 H N N 99 +GLN HA H N N 100 +GLN HB2 H N N 101 +GLN HB3 H N N 102 +GLN HG2 H N N 103 +GLN HG3 H N N 104 +GLN HE21 H N N 105 +GLN HE22 H N N 106 +GLN HXT H N N 107 +GLU N N N N 108 +GLU CA C N S 109 +GLU C C N N 110 +GLU O O N N 111 +GLU CB C N N 112 +GLU CG C N N 113 +GLU CD C N N 114 +GLU OE1 O N N 115 +GLU OE2 O N N 116 +GLU OXT O N N 117 +GLU H H N N 118 +GLU H2 H N N 119 +GLU HA H N N 120 +GLU HB2 H N N 121 +GLU HB3 H N N 122 +GLU HG2 H N N 123 +GLU HG3 H N N 124 +GLU HE2 H N N 125 +GLU HXT H N N 126 +GLY N N N N 127 +GLY CA C N N 128 +GLY C C N N 129 +GLY O O N N 130 +GLY OXT O N N 131 +GLY H H N N 132 +GLY H2 H N N 133 +GLY HA2 H N N 134 +GLY HA3 H N N 135 +GLY HXT H N N 136 +HIS N N N N 137 +HIS CA C N S 138 +HIS C C N N 139 +HIS O O N N 140 +HIS CB C N N 141 +HIS CG C Y N 142 +HIS ND1 N Y N 143 +HIS CD2 C Y N 144 +HIS CE1 C Y N 145 +HIS NE2 N Y N 146 +HIS OXT O N N 147 +HIS H H N N 148 +HIS H2 H N N 149 +HIS HA H N N 150 +HIS HB2 H N N 151 +HIS HB3 H N N 152 +HIS HD1 H N N 153 +HIS HD2 H N N 154 +HIS HE1 H N N 155 +HIS HE2 H N N 156 +HIS HXT H N N 157 +HOH O O N N 158 +HOH H1 H N N 159 +HOH H2 H N N 160 +ILE N N N N 161 +ILE CA C N S 162 +ILE C C N N 163 +ILE O O N N 164 +ILE CB C N S 165 +ILE CG1 C N N 166 +ILE CG2 C N N 167 +ILE CD1 C N N 168 +ILE OXT O N N 169 +ILE H H N N 170 +ILE H2 H N N 171 +ILE HA H N N 172 +ILE HB H N N 173 +ILE HG12 H N N 174 +ILE HG13 H N N 175 +ILE HG21 H N N 176 +ILE HG22 H N N 177 +ILE HG23 H N N 178 +ILE HD11 H N N 179 +ILE HD12 H N N 180 +ILE HD13 H N N 181 +ILE HXT H N N 182 +LEU N N N N 183 +LEU CA C N S 184 +LEU C C N N 185 +LEU O O N N 186 +LEU CB C N N 187 +LEU CG C N N 188 +LEU CD1 C N N 189 +LEU CD2 C N N 190 +LEU OXT O N N 191 +LEU H H N N 192 +LEU H2 H N N 193 +LEU HA H N N 194 +LEU HB2 H N N 195 +LEU HB3 H N N 196 +LEU HG H N N 197 +LEU HD11 H N N 198 +LEU HD12 H N N 199 +LEU HD13 H N N 200 +LEU HD21 H N N 201 +LEU HD22 H N N 202 +LEU HD23 H N N 203 +LEU HXT H N N 204 +LYS N N N N 205 +LYS CA C N S 206 +LYS C C N N 207 +LYS O O N N 208 +LYS CB C N N 209 +LYS CG C N N 210 +LYS CD C N N 211 +LYS CE C N N 212 +LYS NZ N N N 213 +LYS OXT O N N 214 +LYS H H N N 215 +LYS H2 H N N 216 +LYS HA H N N 217 +LYS HB2 H N N 218 +LYS HB3 H N N 219 +LYS HG2 H N N 220 +LYS HG3 H N N 221 +LYS HD2 H N N 222 +LYS HD3 H N N 223 +LYS HE2 H N N 224 +LYS HE3 H N N 225 +LYS HZ1 H N N 226 +LYS HZ2 H N N 227 +LYS HZ3 H N N 228 +LYS HXT H N N 229 +MET N N N N 230 +MET CA C N S 231 +MET C C N N 232 +MET O O N N 233 +MET CB C N N 234 +MET CG C N N 235 +MET SD S N N 236 +MET CE C N N 237 +MET OXT O N N 238 +MET H H N N 239 +MET H2 H N N 240 +MET HA H N N 241 +MET HB2 H N N 242 +MET HB3 H N N 243 +MET HG2 H N N 244 +MET HG3 H N N 245 +MET HE1 H N N 246 +MET HE2 H N N 247 +MET HE3 H N N 248 +MET HXT H N N 249 +NAG C1 C N R 250 +NAG C2 C N R 251 +NAG C3 C N R 252 +NAG C4 C N S 253 +NAG C5 C N R 254 +NAG C6 C N N 255 +NAG C7 C N N 256 +NAG C8 C N N 257 +NAG N2 N N N 258 +NAG O1 O N N 259 +NAG O3 O N N 260 +NAG O4 O N N 261 +NAG O5 O N N 262 +NAG O6 O N N 263 +NAG O7 O N N 264 +NAG H1 H N N 265 +NAG H2 H N N 266 +NAG H3 H N N 267 +NAG H4 H N N 268 +NAG H5 H N N 269 +NAG H61 H N N 270 +NAG H62 H N N 271 +NAG H81 H N N 272 +NAG H82 H N N 273 +NAG H83 H N N 274 +NAG HN2 H N N 275 +NAG HO1 H N N 276 +NAG HO3 H N N 277 +NAG HO4 H N N 278 +NAG HO6 H N N 279 +PHE N N N N 280 +PHE CA C N S 281 +PHE C C N N 282 +PHE O O N N 283 +PHE CB C N N 284 +PHE CG C Y N 285 +PHE CD1 C Y N 286 +PHE CD2 C Y N 287 +PHE CE1 C Y N 288 +PHE CE2 C Y N 289 +PHE CZ C Y N 290 +PHE OXT O N N 291 +PHE H H N N 292 +PHE H2 H N N 293 +PHE HA H N N 294 +PHE HB2 H N N 295 +PHE HB3 H N N 296 +PHE HD1 H N N 297 +PHE HD2 H N N 298 +PHE HE1 H N N 299 +PHE HE2 H N N 300 +PHE HZ H N N 301 +PHE HXT H N N 302 +PRO N N N N 303 +PRO CA C N S 304 +PRO C C N N 305 +PRO O O N N 306 +PRO CB C N N 307 +PRO CG C N N 308 +PRO CD C N N 309 +PRO OXT O N N 310 +PRO H H N N 311 +PRO HA H N N 312 +PRO HB2 H N N 313 +PRO HB3 H N N 314 +PRO HG2 H N N 315 +PRO HG3 H N N 316 +PRO HD2 H N N 317 +PRO HD3 H N N 318 +PRO HXT H N N 319 +SER N N N N 320 +SER CA C N S 321 +SER C C N N 322 +SER O O N N 323 +SER CB C N N 324 +SER OG O N N 325 +SER OXT O N N 326 +SER H H N N 327 +SER H2 H N N 328 +SER HA H N N 329 +SER HB2 H N N 330 +SER HB3 H N N 331 +SER HG H N N 332 +SER HXT H N N 333 +THR N N N N 334 +THR CA C N S 335 +THR C C N N 336 +THR O O N N 337 +THR CB C N R 338 +THR OG1 O N N 339 +THR CG2 C N N 340 +THR OXT O N N 341 +THR H H N N 342 +THR H2 H N N 343 +THR HA H N N 344 +THR HB H N N 345 +THR HG1 H N N 346 +THR HG21 H N N 347 +THR HG22 H N N 348 +THR HG23 H N N 349 +THR HXT H N N 350 +TRP N N N N 351 +TRP CA C N S 352 +TRP C C N N 353 +TRP O O N N 354 +TRP CB C N N 355 +TRP CG C Y N 356 +TRP CD1 C Y N 357 +TRP CD2 C Y N 358 +TRP NE1 N Y N 359 +TRP CE2 C Y N 360 +TRP CE3 C Y N 361 +TRP CZ2 C Y N 362 +TRP CZ3 C Y N 363 +TRP CH2 C Y N 364 +TRP OXT O N N 365 +TRP H H N N 366 +TRP H2 H N N 367 +TRP HA H N N 368 +TRP HB2 H N N 369 +TRP HB3 H N N 370 +TRP HD1 H N N 371 +TRP HE1 H N N 372 +TRP HE3 H N N 373 +TRP HZ2 H N N 374 +TRP HZ3 H N N 375 +TRP HH2 H N N 376 +TRP HXT H N N 377 +TYR N N N N 378 +TYR CA C N S 379 +TYR C C N N 380 +TYR O O N N 381 +TYR CB C N N 382 +TYR CG C Y N 383 +TYR CD1 C Y N 384 +TYR CD2 C Y N 385 +TYR CE1 C Y N 386 +TYR CE2 C Y N 387 +TYR CZ C Y N 388 +TYR OH O N N 389 +TYR OXT O N N 390 +TYR H H N N 391 +TYR H2 H N N 392 +TYR HA H N N 393 +TYR HB2 H N N 394 +TYR HB3 H N N 395 +TYR HD1 H N N 396 +TYR HD2 H N N 397 +TYR HE1 H N N 398 +TYR HE2 H N N 399 +TYR HH H N N 400 +TYR HXT H N N 401 +VAL N N N N 402 +VAL CA C N S 403 +VAL C C N N 404 +VAL O O N N 405 +VAL CB C N N 406 +VAL CG1 C N N 407 +VAL CG2 C N N 408 +VAL OXT O N N 409 +VAL H H N N 410 +VAL H2 H N N 411 +VAL HA H N N 412 +VAL HB H N N 413 +VAL HG11 H N N 414 +VAL HG12 H N N 415 +VAL HG13 H N N 416 +VAL HG21 H N N 417 +VAL HG22 H N N 418 +VAL HG23 H N N 419 +VAL HXT H N N 420 +ZN ZN ZN N N 421 +# +loop_ +_chem_comp_bond.comp_id +_chem_comp_bond.atom_id_1 +_chem_comp_bond.atom_id_2 +_chem_comp_bond.value_order +_chem_comp_bond.pdbx_aromatic_flag +_chem_comp_bond.pdbx_stereo_config +_chem_comp_bond.pdbx_ordinal +ALA N CA sing N N 1 +ALA N H sing N N 2 +ALA N H2 sing N N 3 +ALA CA C sing N N 4 +ALA CA CB sing N N 5 +ALA CA HA sing N N 6 +ALA C O doub N N 7 +ALA C OXT sing N N 8 +ALA CB HB1 sing N N 9 +ALA CB HB2 sing N N 10 +ALA CB HB3 sing N N 11 +ALA OXT HXT sing N N 12 +ARG N CA sing N N 13 +ARG N H sing N N 14 +ARG N H2 sing N N 15 +ARG CA C sing N N 16 +ARG CA CB sing N N 17 +ARG CA HA sing N N 18 +ARG C O doub N N 19 +ARG C OXT sing N N 20 +ARG CB CG sing N N 21 +ARG CB HB2 sing N N 22 +ARG CB HB3 sing N N 23 +ARG CG CD sing N N 24 +ARG CG HG2 sing N N 25 +ARG CG HG3 sing N N 26 +ARG CD NE sing N N 27 +ARG CD HD2 sing N N 28 +ARG CD HD3 sing N N 29 +ARG NE CZ sing N N 30 +ARG NE HE sing N N 31 +ARG CZ NH1 sing N N 32 +ARG CZ NH2 doub N N 33 +ARG NH1 HH11 sing N N 34 +ARG NH1 HH12 sing N N 35 +ARG NH2 HH21 sing N N 36 +ARG NH2 HH22 sing N N 37 +ARG OXT HXT sing N N 38 +ASN N CA sing N N 39 +ASN N H sing N N 40 +ASN N H2 sing N N 41 +ASN CA C sing N N 42 +ASN CA CB sing N N 43 +ASN CA HA sing N N 44 +ASN C O doub N N 45 +ASN C OXT sing N N 46 +ASN CB CG sing N N 47 +ASN CB HB2 sing N N 48 +ASN CB HB3 sing N N 49 +ASN CG OD1 doub N N 50 +ASN CG ND2 sing N N 51 +ASN ND2 HD21 sing N N 52 +ASN ND2 HD22 sing N N 53 +ASN OXT HXT sing N N 54 +ASP N CA sing N N 55 +ASP N H sing N N 56 +ASP N H2 sing N N 57 +ASP CA C sing N N 58 +ASP CA CB sing N N 59 +ASP CA HA sing N N 60 +ASP C O doub N N 61 +ASP C OXT sing N N 62 +ASP CB CG sing N N 63 +ASP CB HB2 sing N N 64 +ASP CB HB3 sing N N 65 +ASP CG OD1 doub N N 66 +ASP CG OD2 sing N N 67 +ASP OD2 HD2 sing N N 68 +ASP OXT HXT sing N N 69 +CYS N CA sing N N 70 +CYS N H sing N N 71 +CYS N H2 sing N N 72 +CYS CA C sing N N 73 +CYS CA CB sing N N 74 +CYS CA HA sing N N 75 +CYS C O doub N N 76 +CYS C OXT sing N N 77 +CYS CB SG sing N N 78 +CYS CB HB2 sing N N 79 +CYS CB HB3 sing N N 80 +CYS SG HG sing N N 81 +CYS OXT HXT sing N N 82 +GLN N CA sing N N 83 +GLN N H sing N N 84 +GLN N H2 sing N N 85 +GLN CA C sing N N 86 +GLN CA CB sing N N 87 +GLN CA HA sing N N 88 +GLN C O doub N N 89 +GLN C OXT sing N N 90 +GLN CB CG sing N N 91 +GLN CB HB2 sing N N 92 +GLN CB HB3 sing N N 93 +GLN CG CD sing N N 94 +GLN CG HG2 sing N N 95 +GLN CG HG3 sing N N 96 +GLN CD OE1 doub N N 97 +GLN CD NE2 sing N N 98 +GLN NE2 HE21 sing N N 99 +GLN NE2 HE22 sing N N 100 +GLN OXT HXT sing N N 101 +GLU N CA sing N N 102 +GLU N H sing N N 103 +GLU N H2 sing N N 104 +GLU CA C sing N N 105 +GLU CA CB sing N N 106 +GLU CA HA sing N N 107 +GLU C O doub N N 108 +GLU C OXT sing N N 109 +GLU CB CG sing N N 110 +GLU CB HB2 sing N N 111 +GLU CB HB3 sing N N 112 +GLU CG CD sing N N 113 +GLU CG HG2 sing N N 114 +GLU CG HG3 sing N N 115 +GLU CD OE1 doub N N 116 +GLU CD OE2 sing N N 117 +GLU OE2 HE2 sing N N 118 +GLU OXT HXT sing N N 119 +GLY N CA sing N N 120 +GLY N H sing N N 121 +GLY N H2 sing N N 122 +GLY CA C sing N N 123 +GLY CA HA2 sing N N 124 +GLY CA HA3 sing N N 125 +GLY C O doub N N 126 +GLY C OXT sing N N 127 +GLY OXT HXT sing N N 128 +HIS N CA sing N N 129 +HIS N H sing N N 130 +HIS N H2 sing N N 131 +HIS CA C sing N N 132 +HIS CA CB sing N N 133 +HIS CA HA sing N N 134 +HIS C O doub N N 135 +HIS C OXT sing N N 136 +HIS CB CG sing N N 137 +HIS CB HB2 sing N N 138 +HIS CB HB3 sing N N 139 +HIS CG ND1 sing Y N 140 +HIS CG CD2 doub Y N 141 +HIS ND1 CE1 doub Y N 142 +HIS ND1 HD1 sing N N 143 +HIS CD2 NE2 sing Y N 144 +HIS CD2 HD2 sing N N 145 +HIS CE1 NE2 sing Y N 146 +HIS CE1 HE1 sing N N 147 +HIS NE2 HE2 sing N N 148 +HIS OXT HXT sing N N 149 +HOH O H1 sing N N 150 +HOH O H2 sing N N 151 +ILE N CA sing N N 152 +ILE N H sing N N 153 +ILE N H2 sing N N 154 +ILE CA C sing N N 155 +ILE CA CB sing N N 156 +ILE CA HA sing N N 157 +ILE C O doub N N 158 +ILE C OXT sing N N 159 +ILE CB CG1 sing N N 160 +ILE CB CG2 sing N N 161 +ILE CB HB sing N N 162 +ILE CG1 CD1 sing N N 163 +ILE CG1 HG12 sing N N 164 +ILE CG1 HG13 sing N N 165 +ILE CG2 HG21 sing N N 166 +ILE CG2 HG22 sing N N 167 +ILE CG2 HG23 sing N N 168 +ILE CD1 HD11 sing N N 169 +ILE CD1 HD12 sing N N 170 +ILE CD1 HD13 sing N N 171 +ILE OXT HXT sing N N 172 +LEU N CA sing N N 173 +LEU N H sing N N 174 +LEU N H2 sing N N 175 +LEU CA C sing N N 176 +LEU CA CB sing N N 177 +LEU CA HA sing N N 178 +LEU C O doub N N 179 +LEU C OXT sing N N 180 +LEU CB CG sing N N 181 +LEU CB HB2 sing N N 182 +LEU CB HB3 sing N N 183 +LEU CG CD1 sing N N 184 +LEU CG CD2 sing N N 185 +LEU CG HG sing N N 186 +LEU CD1 HD11 sing N N 187 +LEU CD1 HD12 sing N N 188 +LEU CD1 HD13 sing N N 189 +LEU CD2 HD21 sing N N 190 +LEU CD2 HD22 sing N N 191 +LEU CD2 HD23 sing N N 192 +LEU OXT HXT sing N N 193 +LYS N CA sing N N 194 +LYS N H sing N N 195 +LYS N H2 sing N N 196 +LYS CA C sing N N 197 +LYS CA CB sing N N 198 +LYS CA HA sing N N 199 +LYS C O doub N N 200 +LYS C OXT sing N N 201 +LYS CB CG sing N N 202 +LYS CB HB2 sing N N 203 +LYS CB HB3 sing N N 204 +LYS CG CD sing N N 205 +LYS CG HG2 sing N N 206 +LYS CG HG3 sing N N 207 +LYS CD CE sing N N 208 +LYS CD HD2 sing N N 209 +LYS CD HD3 sing N N 210 +LYS CE NZ sing N N 211 +LYS CE HE2 sing N N 212 +LYS CE HE3 sing N N 213 +LYS NZ HZ1 sing N N 214 +LYS NZ HZ2 sing N N 215 +LYS NZ HZ3 sing N N 216 +LYS OXT HXT sing N N 217 +MET N CA sing N N 218 +MET N H sing N N 219 +MET N H2 sing N N 220 +MET CA C sing N N 221 +MET CA CB sing N N 222 +MET CA HA sing N N 223 +MET C O doub N N 224 +MET C OXT sing N N 225 +MET CB CG sing N N 226 +MET CB HB2 sing N N 227 +MET CB HB3 sing N N 228 +MET CG SD sing N N 229 +MET CG HG2 sing N N 230 +MET CG HG3 sing N N 231 +MET SD CE sing N N 232 +MET CE HE1 sing N N 233 +MET CE HE2 sing N N 234 +MET CE HE3 sing N N 235 +MET OXT HXT sing N N 236 +NAG C1 C2 sing N N 237 +NAG C1 O1 sing N N 238 +NAG C1 O5 sing N N 239 +NAG C1 H1 sing N N 240 +NAG C2 C3 sing N N 241 +NAG C2 N2 sing N N 242 +NAG C2 H2 sing N N 243 +NAG C3 C4 sing N N 244 +NAG C3 O3 sing N N 245 +NAG C3 H3 sing N N 246 +NAG C4 C5 sing N N 247 +NAG C4 O4 sing N N 248 +NAG C4 H4 sing N N 249 +NAG C5 C6 sing N N 250 +NAG C5 O5 sing N N 251 +NAG C5 H5 sing N N 252 +NAG C6 O6 sing N N 253 +NAG C6 H61 sing N N 254 +NAG C6 H62 sing N N 255 +NAG C7 C8 sing N N 256 +NAG C7 N2 sing N N 257 +NAG C7 O7 doub N N 258 +NAG C8 H81 sing N N 259 +NAG C8 H82 sing N N 260 +NAG C8 H83 sing N N 261 +NAG N2 HN2 sing N N 262 +NAG O1 HO1 sing N N 263 +NAG O3 HO3 sing N N 264 +NAG O4 HO4 sing N N 265 +NAG O6 HO6 sing N N 266 +PHE N CA sing N N 267 +PHE N H sing N N 268 +PHE N H2 sing N N 269 +PHE CA C sing N N 270 +PHE CA CB sing N N 271 +PHE CA HA sing N N 272 +PHE C O doub N N 273 +PHE C OXT sing N N 274 +PHE CB CG sing N N 275 +PHE CB HB2 sing N N 276 +PHE CB HB3 sing N N 277 +PHE CG CD1 doub Y N 278 +PHE CG CD2 sing Y N 279 +PHE CD1 CE1 sing Y N 280 +PHE CD1 HD1 sing N N 281 +PHE CD2 CE2 doub Y N 282 +PHE CD2 HD2 sing N N 283 +PHE CE1 CZ doub Y N 284 +PHE CE1 HE1 sing N N 285 +PHE CE2 CZ sing Y N 286 +PHE CE2 HE2 sing N N 287 +PHE CZ HZ sing N N 288 +PHE OXT HXT sing N N 289 +PRO N CA sing N N 290 +PRO N CD sing N N 291 +PRO N H sing N N 292 +PRO CA C sing N N 293 +PRO CA CB sing N N 294 +PRO CA HA sing N N 295 +PRO C O doub N N 296 +PRO C OXT sing N N 297 +PRO CB CG sing N N 298 +PRO CB HB2 sing N N 299 +PRO CB HB3 sing N N 300 +PRO CG CD sing N N 301 +PRO CG HG2 sing N N 302 +PRO CG HG3 sing N N 303 +PRO CD HD2 sing N N 304 +PRO CD HD3 sing N N 305 +PRO OXT HXT sing N N 306 +SER N CA sing N N 307 +SER N H sing N N 308 +SER N H2 sing N N 309 +SER CA C sing N N 310 +SER CA CB sing N N 311 +SER CA HA sing N N 312 +SER C O doub N N 313 +SER C OXT sing N N 314 +SER CB OG sing N N 315 +SER CB HB2 sing N N 316 +SER CB HB3 sing N N 317 +SER OG HG sing N N 318 +SER OXT HXT sing N N 319 +THR N CA sing N N 320 +THR N H sing N N 321 +THR N H2 sing N N 322 +THR CA C sing N N 323 +THR CA CB sing N N 324 +THR CA HA sing N N 325 +THR C O doub N N 326 +THR C OXT sing N N 327 +THR CB OG1 sing N N 328 +THR CB CG2 sing N N 329 +THR CB HB sing N N 330 +THR OG1 HG1 sing N N 331 +THR CG2 HG21 sing N N 332 +THR CG2 HG22 sing N N 333 +THR CG2 HG23 sing N N 334 +THR OXT HXT sing N N 335 +TRP N CA sing N N 336 +TRP N H sing N N 337 +TRP N H2 sing N N 338 +TRP CA C sing N N 339 +TRP CA CB sing N N 340 +TRP CA HA sing N N 341 +TRP C O doub N N 342 +TRP C OXT sing N N 343 +TRP CB CG sing N N 344 +TRP CB HB2 sing N N 345 +TRP CB HB3 sing N N 346 +TRP CG CD1 doub Y N 347 +TRP CG CD2 sing Y N 348 +TRP CD1 NE1 sing Y N 349 +TRP CD1 HD1 sing N N 350 +TRP CD2 CE2 doub Y N 351 +TRP CD2 CE3 sing Y N 352 +TRP NE1 CE2 sing Y N 353 +TRP NE1 HE1 sing N N 354 +TRP CE2 CZ2 sing Y N 355 +TRP CE3 CZ3 doub Y N 356 +TRP CE3 HE3 sing N N 357 +TRP CZ2 CH2 doub Y N 358 +TRP CZ2 HZ2 sing N N 359 +TRP CZ3 CH2 sing Y N 360 +TRP CZ3 HZ3 sing N N 361 +TRP CH2 HH2 sing N N 362 +TRP OXT HXT sing N N 363 +TYR N CA sing N N 364 +TYR N H sing N N 365 +TYR N H2 sing N N 366 +TYR CA C sing N N 367 +TYR CA CB sing N N 368 +TYR CA HA sing N N 369 +TYR C O doub N N 370 +TYR C OXT sing N N 371 +TYR CB CG sing N N 372 +TYR CB HB2 sing N N 373 +TYR CB HB3 sing N N 374 +TYR CG CD1 doub Y N 375 +TYR CG CD2 sing Y N 376 +TYR CD1 CE1 sing Y N 377 +TYR CD1 HD1 sing N N 378 +TYR CD2 CE2 doub Y N 379 +TYR CD2 HD2 sing N N 380 +TYR CE1 CZ doub Y N 381 +TYR CE1 HE1 sing N N 382 +TYR CE2 CZ sing Y N 383 +TYR CE2 HE2 sing N N 384 +TYR CZ OH sing N N 385 +TYR OH HH sing N N 386 +TYR OXT HXT sing N N 387 +VAL N CA sing N N 388 +VAL N H sing N N 389 +VAL N H2 sing N N 390 +VAL CA C sing N N 391 +VAL CA CB sing N N 392 +VAL CA HA sing N N 393 +VAL C O doub N N 394 +VAL C OXT sing N N 395 +VAL CB CG1 sing N N 396 +VAL CB CG2 sing N N 397 +VAL CB HB sing N N 398 +VAL CG1 HG11 sing N N 399 +VAL CG1 HG12 sing N N 400 +VAL CG1 HG13 sing N N 401 +VAL CG2 HG21 sing N N 402 +VAL CG2 HG22 sing N N 403 +VAL CG2 HG23 sing N N 404 +VAL OXT HXT sing N N 405 +# +loop_ +_pdbx_branch_scheme.asym_id +_pdbx_branch_scheme.entity_id +_pdbx_branch_scheme.mon_id +_pdbx_branch_scheme.num +_pdbx_branch_scheme.pdb_asym_id +_pdbx_branch_scheme.pdb_mon_id +_pdbx_branch_scheme.pdb_seq_num +_pdbx_branch_scheme.auth_asym_id +_pdbx_branch_scheme.auth_mon_id +_pdbx_branch_scheme.auth_seq_num +_pdbx_branch_scheme.hetero +B 2 NAG 1 B NAG 1 A NAG 1403 n +B 2 NAG 2 B NAG 2 A NAG 1404 n +# +loop_ +_pdbx_chem_comp_identifier.comp_id +_pdbx_chem_comp_identifier.type +_pdbx_chem_comp_identifier.program +_pdbx_chem_comp_identifier.program_version +_pdbx_chem_comp_identifier.identifier +NAG 'CONDENSED IUPAC CARBOHYDRATE SYMBOL' GMML 1.0 DGlcpNAcb +NAG 'COMMON NAME' GMML 1.0 N-acetyl-b-D-glucopyranosamine +NAG 'IUPAC CARBOHYDRATE SYMBOL' PDB-CARE 1.0 b-D-GlcpNAc +NAG 'SNFG CARBOHYDRATE SYMBOL' GMML 1.0 GlcNAc +# +_pdbx_entity_branch.entity_id 2 +_pdbx_entity_branch.type oligosaccharide +# +loop_ +_pdbx_entity_branch_descriptor.ordinal +_pdbx_entity_branch_descriptor.entity_id +_pdbx_entity_branch_descriptor.descriptor +_pdbx_entity_branch_descriptor.type +_pdbx_entity_branch_descriptor.program +_pdbx_entity_branch_descriptor.program_version +1 2 DGlcpNAcb1-4DGlcpNAcb1- 'Glycam Condensed Sequence' GMML 1.0 +2 2 'WURCS=2.0/1,2,1/[a2122h-1b_1-5_2*NCC/3=O]/1-1/a4-b1' WURCS PDB2Glycan 1.1.0 +3 2 '[]{[(4+1)][b-D-GlcpNAc]{[(4+1)][b-D-GlcpNAc]{}}}' LINUCS PDB-CARE ? +# +_pdbx_entity_branch_link.link_id 1 +_pdbx_entity_branch_link.entity_id 2 +_pdbx_entity_branch_link.entity_branch_list_num_1 2 +_pdbx_entity_branch_link.comp_id_1 NAG +_pdbx_entity_branch_link.atom_id_1 C1 +_pdbx_entity_branch_link.leaving_atom_id_1 O1 +_pdbx_entity_branch_link.entity_branch_list_num_2 1 +_pdbx_entity_branch_link.comp_id_2 NAG +_pdbx_entity_branch_link.atom_id_2 O4 +_pdbx_entity_branch_link.leaving_atom_id_2 HO4 +_pdbx_entity_branch_link.value_order sing +_pdbx_entity_branch_link.details ? +# +loop_ +_pdbx_entity_branch_list.entity_id +_pdbx_entity_branch_list.comp_id +_pdbx_entity_branch_list.num +_pdbx_entity_branch_list.hetero +2 NAG 1 n +2 NAG 2 n +# +loop_ +_pdbx_entity_nonpoly.entity_id +_pdbx_entity_nonpoly.name +_pdbx_entity_nonpoly.comp_id +3 'ZINC ION' ZN +4 water HOH +# +_pdbx_initial_refinement_model.id 1 +_pdbx_initial_refinement_model.entity_id_list ? +_pdbx_initial_refinement_model.type 'experimental model' +_pdbx_initial_refinement_model.source_name PDB +_pdbx_initial_refinement_model.accession_code 1QMU +_pdbx_initial_refinement_model.details 'PDB ENTRY 1QMU' +# diff --git a/src/test/resources/data/tricky_cases/1uwy.pdb b/src/test/resources/data/tricky_cases/1uwy.pdb new file mode 100644 index 00000000..d71004d0 --- /dev/null +++ b/src/test/resources/data/tricky_cases/1uwy.pdb @@ -0,0 +1,3877 @@ +HEADER HYDROLASE 17-FEB-04 1UWY +TITLE CRYSTAL STRUCTURE OF HUMAN CARBOXYPEPTIDASE M +COMPND MOL_ID: 1; +COMPND 2 MOLECULE: CARBOXYPEPTIDASE M; +COMPND 3 CHAIN: A; +COMPND 4 EC: 3.4.17.12; +COMPND 5 ENGINEERED: YES +SOURCE MOL_ID: 1; +SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; +SOURCE 3 ORGANISM_COMMON: HUMAN; +SOURCE 4 ORGANISM_TAXID: 9606; +SOURCE 5 EXPRESSION_SYSTEM: SPODOPTERA FRUGIPERDA; +SOURCE 6 EXPRESSION_SYSTEM_TAXID: 7108; +SOURCE 7 EXPRESSION_SYSTEM_STRAIN: SF9; +SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: BACULOVIRUS; +SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PVL1393 +KEYWDS METALLOPEPTIDASE, CARBOXYPEPTIDASE, GPI-ANCHOR, METALLOPROTEASE, +KEYWDS 2 ZINC, LIPOPROTEIN, HYDROLASE, STRUCTURAL PROTEOMICS IN EUROPE, +KEYWDS 3 SPINE, STRUCTURAL GENOMICS +EXPDTA X-RAY DIFFRACTION +AUTHOR K.MASKOS,D.REVERTER,W.BODE +REVDAT 5 13-DEC-23 1UWY 1 REMARK HETSYN +REVDAT 4 29-JUL-20 1UWY 1 COMPND REMARK HETNAM LINK +REVDAT 4 2 1 SITE ATOM +REVDAT 3 24-FEB-09 1UWY 1 VERSN +REVDAT 2 28-MAY-04 1UWY 1 REMARK +REVDAT 1 08-APR-04 1UWY 0 +JRNL AUTH D.REVERTER,K.MASKOS,F.TAN,R.SKIDGEL,W.BODE +JRNL TITL CRYSTAL STRUCTURE OF HUMAN CARBOXYPEPTIDASE M, A +JRNL TITL 2 MEMBRANE-BOUND ENZYME THAT REGULATES PEPTIDE HORMONE +JRNL TITL 3 ACTIVITY +JRNL REF J.MOL.BIOL. V. 338 257 2004 +JRNL REFN ISSN 0022-2836 +JRNL PMID 15066430 +JRNL DOI 10.1016/J.JMB.2004.02.058 +REMARK 2 +REMARK 2 RESOLUTION. 3.00 ANGSTROMS. +REMARK 3 +REMARK 3 REFINEMENT. +REMARK 3 PROGRAM : CNS +REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- +REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES,PANNU, +REMARK 3 : READ,RICE,SIMONSON,WARREN +REMARK 3 +REMARK 3 REFINEMENT TARGET : NULL +REMARK 3 +REMARK 3 DATA USED IN REFINEMENT. +REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 3.00 +REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 30.00 +REMARK 3 DATA CUTOFF (SIGMA(F)) : 2.000 +REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL +REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL +REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 97.8 +REMARK 3 NUMBER OF REFLECTIONS : 18185 +REMARK 3 +REMARK 3 FIT TO DATA USED IN REFINEMENT. +REMARK 3 CROSS-VALIDATION METHOD : NULL +REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM +REMARK 3 R VALUE (WORKING SET) : 0.206 +REMARK 3 FREE R VALUE : 0.286 +REMARK 3 FREE R VALUE TEST SET SIZE (%) : 7.000 +REMARK 3 FREE R VALUE TEST SET COUNT : 1413 +REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL +REMARK 3 +REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. +REMARK 3 TOTAL NUMBER OF BINS USED : 10 +REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 3.00 +REMARK 3 BIN RESOLUTION RANGE LOW (A) : 3.16 +REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.10 +REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 1580 +REMARK 3 BIN R VALUE (WORKING SET) : NULL +REMARK 3 BIN FREE R VALUE : NULL +REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL +REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL +REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL +REMARK 3 +REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. +REMARK 3 PROTEIN ATOMS : 3176 +REMARK 3 NUCLEIC ACID ATOMS : 0 +REMARK 3 HETEROGEN ATOMS : 29 +REMARK 3 SOLVENT ATOMS : 25 +REMARK 3 +REMARK 3 B VALUES. +REMARK 3 FROM WILSON PLOT (A**2) : NULL +REMARK 3 MEAN B VALUE (OVERALL, A**2) : 54.20 +REMARK 3 OVERALL ANISOTROPIC B VALUE. +REMARK 3 B11 (A**2) : NULL +REMARK 3 B22 (A**2) : NULL +REMARK 3 B33 (A**2) : NULL +REMARK 3 B12 (A**2) : NULL +REMARK 3 B13 (A**2) : NULL +REMARK 3 B23 (A**2) : NULL +REMARK 3 +REMARK 3 ESTIMATED COORDINATE ERROR. +REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL +REMARK 3 ESD FROM SIGMAA (A) : NULL +REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL +REMARK 3 +REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. +REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL +REMARK 3 ESD FROM C-V SIGMAA (A) : NULL +REMARK 3 +REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. +REMARK 3 BOND LENGTHS (A) : 0.012 +REMARK 3 BOND ANGLES (DEGREES) : 1.780 +REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL +REMARK 3 IMPROPER ANGLES (DEGREES) : NULL +REMARK 3 +REMARK 3 ISOTROPIC THERMAL MODEL : NULL +REMARK 3 +REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA +REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL +REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL +REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL +REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL +REMARK 3 +REMARK 3 BULK SOLVENT MODELING. +REMARK 3 METHOD USED : NULL +REMARK 3 KSOL : NULL +REMARK 3 BSOL : NULL +REMARK 3 +REMARK 3 NCS MODEL : NULL +REMARK 3 +REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT +REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL +REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL +REMARK 3 +REMARK 3 PARAMETER FILE 1 : NULL +REMARK 3 TOPOLOGY FILE 1 : NULL +REMARK 3 +REMARK 3 OTHER REFINEMENT REMARKS: THIS ENTRY HAS SOME RESIDUES MODELED +REMARK 3 WITH AN OCCUPANCY OF 0.00 +REMARK 4 +REMARK 4 1UWY COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 +REMARK 100 +REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 17-FEB-04. +REMARK 100 THE DEPOSITION ID IS D_1290014571. +REMARK 200 +REMARK 200 EXPERIMENTAL DETAILS +REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION +REMARK 200 DATE OF DATA COLLECTION : 15-NOV-01 +REMARK 200 TEMPERATURE (KELVIN) : 100.0 +REMARK 200 PH : 6.50 +REMARK 200 NUMBER OF CRYSTALS USED : 1 +REMARK 200 +REMARK 200 SYNCHROTRON (Y/N) : N +REMARK 200 RADIATION SOURCE : ROTATING ANODE +REMARK 200 BEAMLINE : NULL +REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RUH3R +REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M +REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 +REMARK 200 MONOCHROMATOR : NULL +REMARK 200 OPTICS : MIRRORS +REMARK 200 +REMARK 200 DETECTOR TYPE : IMAGE PLATE +REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH +REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM +REMARK 200 DATA SCALING SOFTWARE : SCALA +REMARK 200 +REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 19598 +REMARK 200 RESOLUTION RANGE HIGH (A) : 2.900 +REMARK 200 RESOLUTION RANGE LOW (A) : 30.000 +REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 +REMARK 200 +REMARK 200 OVERALL. +REMARK 200 COMPLETENESS FOR RANGE (%) : 97.8 +REMARK 200 DATA REDUNDANCY : 4.200 +REMARK 200 R MERGE (I) : 0.06100 +REMARK 200 R SYM (I) : NULL +REMARK 200 FOR THE DATA SET : NULL +REMARK 200 +REMARK 200 IN THE HIGHEST RESOLUTION SHELL. +REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 3.00 +REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 3.16 +REMARK 200 COMPLETENESS FOR SHELL (%) : 99.1 +REMARK 200 DATA REDUNDANCY IN SHELL : 3.90 +REMARK 200 R MERGE FOR SHELL (I) : 0.27100 +REMARK 200 R SYM FOR SHELL (I) : NULL +REMARK 200 FOR SHELL : NULL +REMARK 200 +REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH +REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT +REMARK 200 SOFTWARE USED: AMORE +REMARK 200 STARTING MODEL: PDB ENTRY 1QMU +REMARK 200 +REMARK 200 REMARK: NULL +REMARK 280 +REMARK 280 CRYSTAL +REMARK 280 SOLVENT CONTENT, VS (%): 54.75 +REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.37 +REMARK 280 +REMARK 280 CRYSTALLIZATION CONDITIONS: PH 6.50 +REMARK 290 +REMARK 290 CRYSTALLOGRAPHIC SYMMETRY +REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 32 2 1 +REMARK 290 +REMARK 290 SYMOP SYMMETRY +REMARK 290 NNNMMM OPERATOR +REMARK 290 1555 X,Y,Z +REMARK 290 2555 -Y,X-Y,Z+2/3 +REMARK 290 3555 -X+Y,-X,Z+1/3 +REMARK 290 4555 Y,X,-Z +REMARK 290 5555 X-Y,-Y,-Z+1/3 +REMARK 290 6555 -X,-X+Y,-Z+2/3 +REMARK 290 +REMARK 290 WHERE NNN -> OPERATOR NUMBER +REMARK 290 MMM -> TRANSLATION VECTOR +REMARK 290 +REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS +REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM +REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY +REMARK 290 RELATED MOLECULES. +REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 +REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 +REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 +REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 +REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 +REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 83.02667 +REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 +REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 +REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 41.51333 +REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 +REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 +REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 +REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 +REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 +REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 41.51333 +REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 +REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 +REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 83.02667 +REMARK 290 +REMARK 290 REMARK: NULL +REMARK 300 +REMARK 300 BIOMOLECULE: 1 +REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM +REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN +REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON +REMARK 300 BURIED SURFACE AREA. +REMARK 350 +REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN +REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE +REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS +REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND +REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. +REMARK 350 +REMARK 350 BIOMOLECULE: 1 +REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC +REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC +REMARK 350 SOFTWARE USED: PQS +REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B +REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 +REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 +REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 +REMARK 465 +REMARK 465 MISSING RESIDUES +REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE +REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN +REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) +REMARK 465 +REMARK 465 M RES C SSSEQI +REMARK 465 GLN A 382 +REMARK 465 LEU A 383 +REMARK 465 ASP A 384 +REMARK 465 SER A 385 +REMARK 465 ILE A 386 +REMARK 465 PRO A 387 +REMARK 465 VAL A 388 +REMARK 465 SER A 389 +REMARK 465 ASN A 390 +REMARK 465 ASP A 404 +REMARK 465 HIS A 405 +REMARK 465 SER A 406 +REMARK 465 ALA A 407 +REMARK 465 ALA A 408 +REMARK 465 THR A 409 +REMARK 465 LYS A 410 +REMARK 465 PRO A 411 +REMARK 465 SER A 412 +REMARK 465 LEU A 413 +REMARK 465 PHE A 414 +REMARK 465 LEU A 415 +REMARK 465 PHE A 416 +REMARK 465 LEU A 417 +REMARK 465 VAL A 418 +REMARK 465 SER A 419 +REMARK 465 LEU A 420 +REMARK 465 LEU A 421 +REMARK 465 HIS A 422 +REMARK 465 ILE A 423 +REMARK 465 PHE A 424 +REMARK 465 PHE A 425 +REMARK 465 LYS A 426 +REMARK 470 +REMARK 470 MISSING ATOM +REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; +REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; +REMARK 470 I=INSERTION CODE): +REMARK 470 M RES CSSEQI ATOMS +REMARK 470 PRO A 403 CA C O CB CG CD +REMARK 480 +REMARK 480 ZERO OCCUPANCY ATOM +REMARK 480 THE FOLLOWING RESIDUES HAVE ATOMS MODELED WITH ZERO +REMARK 480 OCCUPANCY. THE LOCATION AND PROPERTIES OF THESE ATOMS +REMARK 480 MAY NOT BE RELIABLE. (M=MODEL NUMBER; RES=RESIDUE NAME; +REMARK 480 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): +REMARK 480 M RES C SSEQI ATOMS +REMARK 480 GLU A 9 CG CD OE1 OE2 +REMARK 480 LYS A 33 CG CD CE NZ +REMARK 480 LYS A 36 CG CD CE NZ +REMARK 480 LYS A 50 CD CE NZ +REMARK 480 ARG A 53 CG CD NE CZ NH1 NH2 +REMARK 480 ASN A 98 CG OD1 +REMARK 480 LYS A 118 CG CD CE NZ +REMARK 480 LYS A 159 CG CD CE NZ +REMARK 480 GLN A 188 CG CD OE1 NE2 +REMARK 480 ARG A 196 CZ NH1 NH2 +REMARK 480 ASP A 223 CG OD1 OD2 +REMARK 480 GLU A 224 CG CD OE1 OE2 +REMARK 480 LYS A 226 CE NZ +REMARK 480 ASN A 227 CG OD1 ND2 +REMARK 480 GLN A 249 CB CG CD OE1 NE2 +REMARK 480 GLN A 305 CG CD OE1 NE2 +REMARK 480 GLN A 318 CG CD OE1 NE2 +REMARK 480 ASN A 346 OD1 ND2 +REMARK 480 LYS A 364 CB CG CD CE NZ +REMARK 480 ASN A 367 CG OD1 ND2 +REMARK 480 LYS A 372 CD CE NZ +REMARK 480 PRO A 391 CG CD +REMARK 480 ARG A 400 CG CD NE CZ NH1 NH2 +REMARK 480 ASN A 401 CG OD1 ND2 +REMARK 480 LEU A 402 CG CD1 CD2 +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT +REMARK 500 +REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. +REMARK 500 +REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE +REMARK 500 OE2 GLU A 9 O HOH A 2002 2.15 +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: CLOSE CONTACTS +REMARK 500 +REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC +REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 +REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A +REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 +REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE +REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. +REMARK 500 +REMARK 500 DISTANCE CUTOFF: +REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS +REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS +REMARK 500 +REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE +REMARK 500 NZ LYS A 118 CE2 TYR A 133 5555 1.65 +REMARK 500 NZ LYS A 118 CD2 TYR A 133 5555 1.94 +REMARK 500 NZ LYS A 118 CZ TYR A 133 5555 2.18 +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS +REMARK 500 +REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES +REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE +REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN +REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). +REMARK 500 +REMARK 500 STANDARD TABLE: +REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) +REMARK 500 +REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 +REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 +REMARK 500 +REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION +REMARK 500 PRO A 391 CG PRO A 391 CD -0.226 +REMARK 500 PRO A 391 CD PRO A 391 N 0.085 +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: COVALENT BOND ANGLES +REMARK 500 +REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES +REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE +REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN +REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). +REMARK 500 +REMARK 500 STANDARD TABLE: +REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) +REMARK 500 +REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 +REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 +REMARK 500 +REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 +REMARK 500 PRO A 325 C - N - CA ANGL. DEV. = 9.2 DEGREES +REMARK 500 PRO A 362 C - N - CA ANGL. DEV. = 9.7 DEGREES +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: TORSION ANGLES +REMARK 500 +REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: +REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; +REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). +REMARK 500 +REMARK 500 STANDARD TABLE: +REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) +REMARK 500 +REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- +REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 +REMARK 500 +REMARK 500 M RES CSSEQI PSI PHI +REMARK 500 PHE A 3 50.73 -101.10 +REMARK 500 ARG A 7 -175.23 -57.76 +REMARK 500 GLU A 9 -75.47 -49.15 +REMARK 500 ALA A 13 -73.05 -41.01 +REMARK 500 LEU A 15 -71.04 -47.04 +REMARK 500 ASN A 21 -18.02 -48.37 +REMARK 500 SER A 23 -26.61 -39.60 +REMARK 500 VAL A 25 23.71 -145.45 +REMARK 500 SER A 34 -172.93 -63.17 +REMARK 500 PHE A 48 78.09 -116.38 +REMARK 500 LYS A 50 -22.43 89.09 +REMARK 500 PRO A 91 -71.09 -61.06 +REMARK 500 ASN A 98 -79.92 -68.32 +REMARK 500 SER A 99 -7.49 -44.06 +REMARK 500 PRO A 119 150.64 -47.86 +REMARK 500 ARG A 127 -72.27 108.99 +REMARK 500 ALA A 142 5.41 -66.12 +REMARK 500 GLU A 144 113.42 -160.69 +REMARK 500 TYR A 145 115.93 -21.64 +REMARK 500 ASN A 147 106.57 -43.15 +REMARK 500 SER A 149 99.93 -67.41 +REMARK 500 ALA A 170 116.09 170.03 +REMARK 500 ASP A 201 55.04 -112.85 +REMARK 500 GLU A 224 -45.18 -133.21 +REMARK 500 LYS A 226 -86.00 -64.66 +REMARK 500 ASN A 227 5.37 -59.81 +REMARK 500 ASN A 233 -0.18 75.09 +REMARK 500 TYR A 242 108.51 -175.36 +REMARK 500 ASN A 252 -37.42 -37.62 +REMARK 500 LYS A 284 -78.78 -27.84 +REMARK 500 ASN A 312 13.35 45.01 +REMARK 500 ARG A 320 50.94 -118.02 +REMARK 500 PRO A 350 127.91 -33.15 +REMARK 500 THR A 357 112.93 -160.56 +REMARK 500 PRO A 362 -133.12 -7.31 +REMARK 500 GLU A 363 32.64 171.82 +REMARK 500 LYS A 364 116.47 143.23 +REMARK 500 PHE A 368 61.00 -108.99 +REMARK 500 ALA A 370 -172.90 -67.69 +REMARK 500 PRO A 378 30.58 -82.43 +REMARK 500 PHE A 379 -155.54 -158.64 +REMARK 500 SER A 392 -99.86 17.06 +REMARK 500 PRO A 397 81.94 -37.31 +REMARK 500 ARG A 400 -75.59 -43.47 +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 500 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY +REMARK 500 SUBTOPIC: PLANAR GROUPS +REMARK 500 +REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL +REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE +REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN +REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS +REMARK 500 AN RMSD GREATER THAN THIS VALUE +REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; +REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). +REMARK 500 +REMARK 500 M RES CSSEQI RMS TYPE +REMARK 500 TYR A 133 0.08 SIDE CHAIN +REMARK 500 +REMARK 500 REMARK: NULL +REMARK 615 +REMARK 615 ZERO OCCUPANCY ATOM +REMARK 615 THE FOLLOWING RESIDUES HAVE ATOMS MODELED WITH ZERO +REMARK 615 OCCUPANCY. THE LOCATION AND PROPERTIES OF THESE ATOMS +REMARK 615 MAY NOT BE RELIABLE. (M=MODEL NUMBER; RES=RESIDUE NAME; +REMARK 615 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): +REMARK 615 M RES C SSEQI +REMARK 615 NAG B 2 +REMARK 620 +REMARK 620 METAL COORDINATION +REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; +REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): +REMARK 620 +REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL +REMARK 620 ZN A1405 ZN +REMARK 620 N RES CSSEQI ATOM +REMARK 620 1 HIS A 66 ND1 +REMARK 620 2 GLU A 69 OE1 70.8 +REMARK 620 3 GLU A 69 OE2 97.0 59.7 +REMARK 620 4 HIS A 173 ND1 90.7 130.2 78.3 +REMARK 620 N 1 2 3 +REMARK 700 +REMARK 700 SHEET +REMARK 700 THE SHEET STRUCTURE OF THIS MOLECULE IS BIFURCATED. IN +REMARK 700 ORDER TO REPRESENT THIS FEATURE IN THE SHEET RECORDS BELOW, +REMARK 700 TWO SHEETS ARE DEFINED. +DBREF 1UWY A 1 426 UNP P14384 CBPM_HUMAN 18 443 +SEQRES 1 A 426 LEU ASP PHE ASN TYR HIS ARG GLN GLU GLY MET GLU ALA +SEQRES 2 A 426 PHE LEU LYS THR VAL ALA GLN ASN TYR SER SER VAL THR +SEQRES 3 A 426 HIS LEU HIS SER ILE GLY LYS SER VAL LYS GLY ARG ASN +SEQRES 4 A 426 LEU TRP VAL LEU VAL VAL GLY ARG PHE PRO LYS GLU HIS +SEQRES 5 A 426 ARG ILE GLY ILE PRO GLU PHE LYS TYR VAL ALA ASN MET +SEQRES 6 A 426 HIS GLY ASP GLU THR VAL GLY ARG GLU LEU LEU LEU HIS +SEQRES 7 A 426 LEU ILE ASP TYR LEU VAL THR SER ASP GLY LYS ASP PRO +SEQRES 8 A 426 GLU ILE THR ASN LEU ILE ASN SER THR ARG ILE HIS ILE +SEQRES 9 A 426 MET PRO SER MET ASN PRO ASP GLY PHE GLU ALA VAL LYS +SEQRES 10 A 426 LYS PRO ASP CYS TYR TYR SER ILE GLY ARG GLU ASN TYR +SEQRES 11 A 426 ASN GLN TYR ASP LEU ASN ARG ASN PHE PRO ASP ALA PHE +SEQRES 12 A 426 GLU TYR ASN ASN VAL SER ARG GLN PRO GLU THR VAL ALA +SEQRES 13 A 426 VAL MET LYS TRP LEU LYS THR GLU THR PHE VAL LEU SER +SEQRES 14 A 426 ALA ASN LEU HIS GLY GLY ALA LEU VAL ALA SER TYR PRO +SEQRES 15 A 426 PHE ASP ASN GLY VAL GLN ALA THR GLY ALA LEU TYR SER +SEQRES 16 A 426 ARG SER LEU THR PRO ASP ASP ASP VAL PHE GLN TYR LEU +SEQRES 17 A 426 ALA HIS THR TYR ALA SER ARG ASN PRO ASN MET LYS LYS +SEQRES 18 A 426 GLY ASP GLU CYS LYS ASN LYS MET ASN PHE PRO ASN GLY +SEQRES 19 A 426 VAL THR ASN GLY TYR SER TRP TYR PRO LEU GLN GLY GLY +SEQRES 20 A 426 MET GLN ASP TYR ASN TYR ILE TRP ALA GLN CYS PHE GLU +SEQRES 21 A 426 ILE THR LEU GLU LEU SER CYS CYS LYS TYR PRO ARG GLU +SEQRES 22 A 426 GLU LYS LEU PRO SER PHE TRP ASN ASN ASN LYS ALA SER +SEQRES 23 A 426 LEU ILE GLU TYR ILE LYS GLN VAL HIS LEU GLY VAL LYS +SEQRES 24 A 426 GLY GLN VAL PHE ASP GLN ASN GLY ASN PRO LEU PRO ASN +SEQRES 25 A 426 VAL ILE VAL GLU VAL GLN ASP ARG LYS HIS ILE CYS PRO +SEQRES 26 A 426 TYR ARG THR ASN LYS TYR GLY GLU TYR TYR LEU LEU LEU +SEQRES 27 A 426 LEU PRO GLY SER TYR ILE ILE ASN VAL THR VAL PRO GLY +SEQRES 28 A 426 HIS ASP PRO HIS ILE THR LYS VAL ILE ILE PRO GLU LYS +SEQRES 29 A 426 SER GLN ASN PHE SER ALA LEU LYS LYS ASP ILE LEU LEU +SEQRES 30 A 426 PRO PHE GLN GLY GLN LEU ASP SER ILE PRO VAL SER ASN +SEQRES 31 A 426 PRO SER CYS PRO MET ILE PRO LEU TYR ARG ASN LEU PRO +SEQRES 32 A 426 ASP HIS SER ALA ALA THR LYS PRO SER LEU PHE LEU PHE +SEQRES 33 A 426 LEU VAL SER LEU LEU HIS ILE PHE PHE LYS +MODRES 1UWY ASN A 98 ASN GLYCOSYLATION SITE +HET NAG B 1 14 +HET NAG B 2 14 +HET ZN A1405 1 +HETNAM NAG 2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSE +HETNAM ZN ZINC ION +HETSYN NAG N-ACETYL-BETA-D-GLUCOSAMINE; 2-ACETAMIDO-2-DEOXY-BETA- +HETSYN 2 NAG D-GLUCOSE; 2-ACETAMIDO-2-DEOXY-D-GLUCOSE; 2-ACETAMIDO- +HETSYN 3 NAG 2-DEOXY-GLUCOSE; N-ACETYL-D-GLUCOSAMINE +FORMUL 2 NAG 2(C8 H15 N O6) +FORMUL 3 ZN ZN 2+ +FORMUL 4 HOH *25(H2 O) +HELIX 1 1 ARG A 7 TYR A 22 1 16 +HELIX 2 2 THR A 70 ASP A 87 1 18 +HELIX 3 3 ASP A 90 THR A 100 1 11 +HELIX 4 4 ASN A 109 VAL A 116 1 8 +HELIX 5 5 GLN A 151 GLU A 164 1 14 +HELIX 6 6 VAL A 187 GLY A 191 5 5 +HELIX 7 7 GLY A 191 SER A 195 5 5 +HELIX 8 8 ASP A 201 ARG A 215 1 15 +HELIX 9 9 GLY A 247 TRP A 255 1 9 +HELIX 10 10 ARG A 272 GLU A 274 5 3 +HELIX 11 11 LYS A 275 ASN A 282 1 8 +HELIX 12 12 ASN A 283 LYS A 292 1 10 +HELIX 13 13 GLN A 293 LEU A 296 5 4 +SHEET 1 AA 5 THR A 26 LYS A 33 0 +SHEET 2 AA 5 ASN A 39 VAL A 45 -1 O LEU A 40 N ILE A 31 +SHEET 3 AA 5 ARG A 101 MET A 105 -1 O ILE A 102 N VAL A 45 +SHEET 4 AA 5 GLU A 58 ALA A 63 1 O PHE A 59 N HIS A 103 +SHEET 5 AA 5 PHE A 166 LEU A 168 1 N VAL A 167 O GLU A 58 +SHEET 1 AB 8 THR A 26 LYS A 33 0 +SHEET 2 AB 8 ASN A 39 VAL A 45 -1 O LEU A 40 N ILE A 31 +SHEET 3 AB 8 ARG A 101 MET A 105 -1 O ILE A 102 N VAL A 45 +SHEET 4 AB 8 GLU A 58 ALA A 63 1 O PHE A 59 N HIS A 103 +SHEET 5 AB 8 ASN A 171 HIS A 173 1 N LEU A 172 O VAL A 62 +SHEET 6 AB 8 THR A 262 SER A 266 1 O LEU A 263 N HIS A 173 +SHEET 7 AB 8 ALA A 176 TYR A 181 -1 O ALA A 176 N SER A 266 +SHEET 8 AB 8 VAL A 235 ASN A 237 1 O THR A 236 N TYR A 181 +SHEET 1 AC 3 GLU A 333 LEU A 336 0 +SHEET 2 AC 3 VAL A 298 PHE A 303 -1 O VAL A 298 N LEU A 336 +SHEET 3 AC 3 LEU A 371 LYS A 372 1 O LEU A 371 N LYS A 299 +SHEET 1 AD 3 GLU A 333 LEU A 336 0 +SHEET 2 AD 3 VAL A 298 PHE A 303 -1 O VAL A 298 N LEU A 336 +SHEET 3 AD 3 ILE A 375 LEU A 376 1 O ILE A 375 N PHE A 303 +SHEET 1 AE 3 ILE A 314 VAL A 317 0 +SHEET 2 AE 3 GLY A 341 THR A 348 -1 O ASN A 346 N GLU A 316 +SHEET 3 AE 3 HIS A 355 ILE A 361 -1 O HIS A 355 N VAL A 347 +SSBOND 1 CYS A 121 CYS A 268 1555 1555 2.04 +SSBOND 2 CYS A 225 CYS A 267 1555 1555 2.02 +SSBOND 3 CYS A 324 CYS A 393 1555 1555 2.03 +LINK ND2 ASN A 98 C1 NAG B 1 1555 1555 1.46 +LINK OD1 ASP A 223 O6 NAG B 2 4655 1555 1.94 +LINK O4 NAG B 1 C1 NAG B 2 1555 1555 1.39 +LINK ND1 HIS A 66 ZN ZN A1405 1555 1555 2.24 +LINK OE1 GLU A 69 ZN ZN A1405 1555 1555 2.26 +LINK OE2 GLU A 69 ZN ZN A1405 1555 1555 2.12 +LINK ND1 HIS A 173 ZN ZN A1405 1555 1555 2.13 +CISPEP 1 PRO A 182 PHE A 183 0 0.19 +CRYST1 85.830 85.830 124.540 90.00 90.00 120.00 P 32 2 1 6 +ORIGX1 1.000000 0.000000 0.000000 0.00000 +ORIGX2 0.000000 1.000000 0.000000 0.00000 +ORIGX3 0.000000 0.000000 1.000000 0.00000 +SCALE1 0.011651 0.006727 0.000000 0.00000 +SCALE2 0.000000 0.013453 0.000000 0.00000 +SCALE3 0.000000 0.000000 0.008029 0.00000 +ATOM 1 N LEU A 1 67.900 10.791 -7.918 1.00 52.69 N +ATOM 2 CA LEU A 1 68.597 9.815 -7.040 1.00 52.26 C +ATOM 3 C LEU A 1 67.982 8.431 -7.156 1.00 54.73 C +ATOM 4 O LEU A 1 66.843 8.263 -7.623 1.00 54.55 O +ATOM 5 CB LEU A 1 68.512 10.249 -5.578 1.00 49.24 C +ATOM 6 CG LEU A 1 69.775 10.012 -4.765 1.00 46.18 C +ATOM 7 CD1 LEU A 1 69.418 9.981 -3.323 1.00 43.53 C +ATOM 8 CD2 LEU A 1 70.444 8.726 -5.192 1.00 46.38 C +ATOM 9 N ASP A 2 68.748 7.442 -6.714 1.00 56.52 N +ATOM 10 CA ASP A 2 68.308 6.065 -6.736 1.00 58.44 C +ATOM 11 C ASP A 2 67.476 5.841 -5.482 1.00 58.79 C +ATOM 12 O ASP A 2 67.573 6.604 -4.518 1.00 58.33 O +ATOM 13 CB ASP A 2 69.511 5.157 -6.712 1.00 60.67 C +ATOM 14 CG ASP A 2 70.169 5.147 -5.375 1.00 62.81 C +ATOM 15 OD1 ASP A 2 69.660 4.413 -4.501 1.00 64.06 O +ATOM 16 OD2 ASP A 2 71.169 5.887 -5.193 1.00 63.89 O +ATOM 17 N PHE A 3 66.678 4.778 -5.490 1.00 59.54 N +ATOM 18 CA PHE A 3 65.806 4.473 -4.367 1.00 59.39 C +ATOM 19 C PHE A 3 66.254 3.400 -3.409 1.00 59.81 C +ATOM 20 O PHE A 3 65.503 2.496 -3.117 1.00 61.69 O +ATOM 21 CB PHE A 3 64.411 4.134 -4.872 1.00 57.48 C +ATOM 22 CG PHE A 3 63.569 5.332 -5.094 1.00 57.25 C +ATOM 23 CD1 PHE A 3 63.049 6.032 -4.008 1.00 58.21 C +ATOM 24 CD2 PHE A 3 63.304 5.781 -6.373 1.00 56.24 C +ATOM 25 CE1 PHE A 3 62.270 7.170 -4.192 1.00 57.45 C +ATOM 26 CE2 PHE A 3 62.533 6.908 -6.577 1.00 56.39 C +ATOM 27 CZ PHE A 3 62.012 7.607 -5.483 1.00 58.18 C +ATOM 28 N ASN A 4 67.475 3.488 -2.920 1.00 60.15 N +ATOM 29 CA ASN A 4 67.945 2.527 -1.952 1.00 61.03 C +ATOM 30 C ASN A 4 68.375 3.374 -0.793 1.00 61.96 C +ATOM 31 O ASN A 4 68.232 4.597 -0.834 1.00 61.86 O +ATOM 32 CB ASN A 4 69.116 1.750 -2.497 1.00 63.63 C +ATOM 33 CG ASN A 4 68.726 0.911 -3.668 1.00 67.05 C +ATOM 34 OD1 ASN A 4 67.965 -0.044 -3.523 1.00 69.19 O +ATOM 35 ND2 ASN A 4 69.217 1.271 -4.853 1.00 68.65 N +ATOM 36 N TYR A 5 68.889 2.751 0.255 1.00 62.16 N +ATOM 37 CA TYR A 5 69.303 3.545 1.377 1.00 62.26 C +ATOM 38 C TYR A 5 70.569 4.263 1.046 1.00 62.34 C +ATOM 39 O TYR A 5 71.304 3.868 0.149 1.00 62.54 O +ATOM 40 CB TYR A 5 69.449 2.680 2.605 1.00 63.28 C +ATOM 41 CG TYR A 5 68.121 2.507 3.257 1.00 65.06 C +ATOM 42 CD1 TYR A 5 67.621 1.243 3.550 1.00 66.34 C +ATOM 43 CD2 TYR A 5 67.323 3.617 3.528 1.00 66.06 C +ATOM 44 CE1 TYR A 5 66.347 1.083 4.097 1.00 67.22 C +ATOM 45 CE2 TYR A 5 66.052 3.476 4.070 1.00 67.28 C +ATOM 46 CZ TYR A 5 65.571 2.207 4.355 1.00 67.89 C +ATOM 47 OH TYR A 5 64.331 2.066 4.929 1.00 69.36 O +ATOM 48 N HIS A 6 70.799 5.354 1.753 1.00 62.66 N +ATOM 49 CA HIS A 6 71.978 6.154 1.522 1.00 63.20 C +ATOM 50 C HIS A 6 72.693 6.440 2.819 1.00 63.63 C +ATOM 51 O HIS A 6 72.472 7.491 3.429 1.00 64.14 O +ATOM 52 CB HIS A 6 71.604 7.482 0.859 1.00 63.39 C +ATOM 53 CG HIS A 6 71.120 7.346 -0.552 1.00 63.64 C +ATOM 54 ND1 HIS A 6 69.819 7.020 -0.868 1.00 64.31 N +ATOM 55 CD2 HIS A 6 71.765 7.496 -1.732 1.00 63.61 C +ATOM 56 CE1 HIS A 6 69.682 6.976 -2.179 1.00 63.58 C +ATOM 57 NE2 HIS A 6 70.848 7.262 -2.726 1.00 64.68 N +ATOM 58 N ARG A 7 73.547 5.518 3.246 1.00 63.03 N +ATOM 59 CA ARG A 7 74.294 5.740 4.471 1.00 63.71 C +ATOM 60 C ARG A 7 75.104 7.051 4.317 1.00 64.91 C +ATOM 61 O ARG A 7 74.981 7.748 3.305 1.00 64.72 O +ATOM 62 CB ARG A 7 75.200 4.542 4.747 1.00 62.88 C +ATOM 63 CG ARG A 7 74.702 3.224 4.133 1.00 61.23 C +ATOM 64 CD ARG A 7 75.039 2.068 5.034 1.00 59.70 C +ATOM 65 NE ARG A 7 74.221 2.191 6.227 1.00 62.82 N +ATOM 66 CZ ARG A 7 74.621 1.969 7.477 1.00 63.86 C +ATOM 67 NH1 ARG A 7 73.745 2.132 8.462 1.00 65.89 N +ATOM 68 NH2 ARG A 7 75.865 1.587 7.752 1.00 62.30 N +ATOM 69 N GLN A 8 75.936 7.383 5.302 1.00 66.46 N +ATOM 70 CA GLN A 8 76.697 8.645 5.281 1.00 67.21 C +ATOM 71 C GLN A 8 77.484 8.982 4.036 1.00 67.05 C +ATOM 72 O GLN A 8 77.367 10.087 3.493 1.00 67.20 O +ATOM 73 CB GLN A 8 77.651 8.723 6.464 1.00 68.51 C +ATOM 74 CG GLN A 8 78.489 9.991 6.484 1.00 70.93 C +ATOM 75 CD GLN A 8 79.689 9.872 7.417 1.00 73.53 C +ATOM 76 OE1 GLN A 8 79.547 9.891 8.647 1.00 74.05 O +ATOM 77 NE2 GLN A 8 80.882 9.728 6.831 1.00 73.98 N +ATOM 78 N GLU A 9 78.316 8.049 3.607 1.00 66.68 N +ATOM 79 CA GLU A 9 79.110 8.280 2.426 1.00 66.88 C +ATOM 80 C GLU A 9 78.213 8.797 1.287 1.00 67.16 C +ATOM 81 O GLU A 9 78.204 9.995 0.980 1.00 67.32 O +ATOM 82 CB GLU A 9 79.777 6.981 1.987 1.00 99.99 C +ATOM 83 CG GLU A 9 80.724 6.512 3.064 0.00 99.99 C +ATOM 84 CD GLU A 9 81.941 7.433 3.109 0.00 99.99 C +ATOM 85 OE1 GLU A 9 81.877 8.434 3.870 0.00 99.99 O +ATOM 86 OE2 GLU A 9 82.923 7.127 2.381 0.00 99.99 O +ATOM 87 N GLY A 10 77.441 7.894 0.692 1.00 66.58 N +ATOM 88 CA GLY A 10 76.575 8.243 -0.422 1.00 67.17 C +ATOM 89 C GLY A 10 75.585 9.393 -0.300 1.00 68.11 C +ATOM 90 O GLY A 10 75.325 10.100 -1.290 1.00 68.82 O +ATOM 91 N MET A 11 75.003 9.580 0.881 1.00 67.12 N +ATOM 92 CA MET A 11 74.049 10.663 1.057 1.00 66.47 C +ATOM 93 C MET A 11 74.853 11.949 1.007 1.00 66.87 C +ATOM 94 O MET A 11 74.520 12.886 0.264 1.00 66.47 O +ATOM 95 CB MET A 11 73.339 10.518 2.398 1.00 66.20 C +ATOM 96 CG MET A 11 72.285 11.567 2.659 1.00 64.64 C +ATOM 97 SD MET A 11 72.708 12.523 4.120 1.00 63.50 S +ATOM 98 CE MET A 11 72.913 11.246 5.353 1.00 62.92 C +ATOM 99 N GLU A 12 75.925 11.971 1.801 1.00 66.93 N +ATOM 100 CA GLU A 12 76.838 13.111 1.856 1.00 66.68 C +ATOM 101 C GLU A 12 77.184 13.424 0.408 1.00 64.85 C +ATOM 102 O GLU A 12 76.985 14.536 -0.091 1.00 63.43 O +ATOM 103 CB GLU A 12 78.102 12.721 2.611 1.00 67.18 C +ATOM 104 CG GLU A 12 78.563 13.770 3.583 1.00 71.32 C +ATOM 105 CD GLU A 12 79.454 13.177 4.649 1.00 75.16 C +ATOM 106 OE1 GLU A 12 79.644 13.818 5.724 1.00 74.86 O +ATOM 107 OE2 GLU A 12 79.964 12.054 4.393 1.00 77.21 O +ATOM 108 N ALA A 13 77.703 12.399 -0.254 1.00 63.04 N +ATOM 109 CA ALA A 13 78.062 12.483 -1.648 1.00 61.06 C +ATOM 110 C ALA A 13 76.974 13.265 -2.375 1.00 59.69 C +ATOM 111 O ALA A 13 77.189 14.425 -2.734 1.00 59.41 O +ATOM 112 CB ALA A 13 78.183 11.084 -2.218 1.00 60.89 C +ATOM 113 N PHE A 14 75.815 12.620 -2.556 1.00 57.64 N +ATOM 114 CA PHE A 14 74.647 13.195 -3.227 1.00 55.64 C +ATOM 115 C PHE A 14 74.577 14.686 -3.017 1.00 55.42 C +ATOM 116 O PHE A 14 74.603 15.493 -3.954 1.00 53.37 O +ATOM 117 CB PHE A 14 73.355 12.576 -2.676 1.00 54.65 C +ATOM 118 CG PHE A 14 72.103 13.250 -3.178 1.00 53.71 C +ATOM 119 CD1 PHE A 14 71.390 14.110 -2.366 1.00 54.21 C +ATOM 120 CD2 PHE A 14 71.673 13.065 -4.497 1.00 54.32 C +ATOM 121 CE1 PHE A 14 70.266 14.783 -2.855 1.00 55.08 C +ATOM 122 CE2 PHE A 14 70.546 13.734 -5.007 1.00 53.17 C +ATOM 123 CZ PHE A 14 69.845 14.592 -4.187 1.00 54.49 C +ATOM 124 N LEU A 15 74.465 15.030 -1.746 1.00 55.88 N +ATOM 125 CA LEU A 15 74.391 16.407 -1.320 1.00 56.29 C +ATOM 126 C LEU A 15 75.479 17.241 -2.011 1.00 56.34 C +ATOM 127 O LEU A 15 75.188 18.054 -2.885 1.00 55.45 O +ATOM 128 CB LEU A 15 74.527 16.438 0.208 1.00 55.28 C +ATOM 129 CG LEU A 15 73.389 15.719 0.935 1.00 52.91 C +ATOM 130 CD1 LEU A 15 73.891 15.174 2.232 1.00 51.77 C +ATOM 131 CD2 LEU A 15 72.231 16.678 1.140 1.00 51.12 C +ATOM 132 N LYS A 16 76.729 17.021 -1.616 1.00 57.64 N +ATOM 133 CA LYS A 16 77.867 17.732 -2.183 1.00 58.44 C +ATOM 134 C LYS A 16 77.728 17.883 -3.700 1.00 59.64 C +ATOM 135 O LYS A 16 78.025 18.939 -4.281 1.00 59.23 O +ATOM 136 CB LYS A 16 79.138 16.956 -1.882 1.00 57.69 C +ATOM 137 CG LYS A 16 79.538 16.913 -0.448 1.00 55.54 C +ATOM 138 CD LYS A 16 80.745 16.003 -0.313 1.00 55.21 C +ATOM 139 CE LYS A 16 81.348 16.136 1.060 1.00 55.93 C +ATOM 140 NZ LYS A 16 81.448 17.583 1.388 1.00 56.98 N +ATOM 141 N THR A 17 77.293 16.805 -4.340 1.00 60.50 N +ATOM 142 CA THR A 17 77.124 16.825 -5.774 1.00 60.87 C +ATOM 143 C THR A 17 75.986 17.762 -6.114 1.00 61.99 C +ATOM 144 O THR A 17 76.147 18.582 -7.006 1.00 64.63 O +ATOM 145 CB THR A 17 76.835 15.427 -6.346 1.00 60.60 C +ATOM 146 OG1 THR A 17 77.843 14.511 -5.907 1.00 61.27 O +ATOM 147 CG2 THR A 17 76.867 15.464 -7.858 1.00 60.29 C +ATOM 148 N VAL A 18 74.842 17.673 -5.423 1.00 61.88 N +ATOM 149 CA VAL A 18 73.724 18.589 -5.726 1.00 60.71 C +ATOM 150 C VAL A 18 74.250 19.999 -5.560 1.00 60.84 C +ATOM 151 O VAL A 18 73.787 20.925 -6.225 1.00 59.96 O +ATOM 152 CB VAL A 18 72.522 18.408 -4.769 1.00 60.09 C +ATOM 153 CG1 VAL A 18 71.392 19.381 -5.127 1.00 57.71 C +ATOM 154 CG2 VAL A 18 72.028 16.988 -4.844 1.00 59.81 C +ATOM 155 N ALA A 19 75.241 20.119 -4.673 1.00 61.59 N +ATOM 156 CA ALA A 19 75.911 21.371 -4.345 1.00 62.90 C +ATOM 157 C ALA A 19 76.560 21.969 -5.578 1.00 64.31 C +ATOM 158 O ALA A 19 76.372 23.151 -5.885 1.00 64.61 O +ATOM 159 CB ALA A 19 76.953 21.120 -3.290 1.00 62.60 C +ATOM 160 N GLN A 20 77.326 21.137 -6.275 1.00 66.21 N +ATOM 161 CA GLN A 20 78.018 21.516 -7.510 1.00 68.25 C +ATOM 162 C GLN A 20 77.056 21.719 -8.677 1.00 67.77 C +ATOM 163 O GLN A 20 76.846 22.850 -9.131 1.00 68.40 O +ATOM 164 CB GLN A 20 79.028 20.435 -7.872 1.00 71.14 C +ATOM 165 CG GLN A 20 79.984 20.164 -6.724 1.00 76.12 C +ATOM 166 CD GLN A 20 80.724 21.432 -6.307 1.00 78.57 C +ATOM 167 OE1 GLN A 20 81.222 21.541 -5.173 1.00 80.02 O +ATOM 168 NE2 GLN A 20 80.809 22.400 -7.234 1.00 78.33 N +ATOM 169 N ASN A 21 76.476 20.620 -9.155 1.00 66.20 N +ATOM 170 CA ASN A 21 75.537 20.660 -10.265 1.00 65.74 C +ATOM 171 C ASN A 21 74.416 21.686 -10.209 1.00 65.33 C +ATOM 172 O ASN A 21 73.807 21.961 -11.241 1.00 64.89 O +ATOM 173 CB ASN A 21 74.906 19.296 -10.471 1.00 67.24 C +ATOM 174 CG ASN A 21 75.705 18.419 -11.397 1.00 69.32 C +ATOM 175 OD1 ASN A 21 76.876 18.114 -11.126 1.00 70.51 O +ATOM 176 ND2 ASN A 21 75.078 17.997 -12.505 1.00 69.45 N +ATOM 177 N TYR A 22 74.116 22.237 -9.030 1.00 65.05 N +ATOM 178 CA TYR A 22 73.039 23.235 -8.923 1.00 64.77 C +ATOM 179 C TYR A 22 73.322 24.471 -8.060 1.00 65.82 C +ATOM 180 O TYR A 22 72.380 25.144 -7.633 1.00 66.89 O +ATOM 181 CB TYR A 22 71.742 22.588 -8.408 1.00 62.53 C +ATOM 182 CG TYR A 22 71.162 21.540 -9.325 1.00 59.48 C +ATOM 183 CD1 TYR A 22 71.632 20.236 -9.294 1.00 57.49 C +ATOM 184 CD2 TYR A 22 70.190 21.873 -10.272 1.00 58.14 C +ATOM 185 CE1 TYR A 22 71.162 19.292 -10.183 1.00 56.42 C +ATOM 186 CE2 TYR A 22 69.710 20.938 -11.163 1.00 56.65 C +ATOM 187 CZ TYR A 22 70.207 19.645 -11.115 1.00 56.78 C +ATOM 188 OH TYR A 22 69.775 18.697 -12.011 1.00 55.85 O +ATOM 189 N SER A 23 74.598 24.778 -7.812 1.00 66.03 N +ATOM 190 CA SER A 23 74.984 25.934 -6.989 1.00 65.63 C +ATOM 191 C SER A 23 74.145 27.212 -7.194 1.00 64.63 C +ATOM 192 O SER A 23 74.020 28.034 -6.285 1.00 65.31 O +ATOM 193 CB SER A 23 76.457 26.243 -7.216 1.00 65.45 C +ATOM 194 OG SER A 23 76.747 26.159 -8.597 1.00 65.89 O +ATOM 195 N SER A 24 73.566 27.370 -8.377 1.00 62.46 N +ATOM 196 CA SER A 24 72.743 28.534 -8.679 1.00 60.82 C +ATOM 197 C SER A 24 71.533 28.684 -7.766 1.00 60.86 C +ATOM 198 O SER A 24 70.986 29.782 -7.619 1.00 60.72 O +ATOM 199 CB SER A 24 72.245 28.453 -10.121 1.00 60.06 C +ATOM 200 OG SER A 24 70.917 28.933 -10.219 1.00 57.76 O +ATOM 201 N VAL A 25 71.095 27.582 -7.168 1.00 60.88 N +ATOM 202 CA VAL A 25 69.915 27.627 -6.312 1.00 61.08 C +ATOM 203 C VAL A 25 69.962 26.679 -5.109 1.00 61.03 C +ATOM 204 O VAL A 25 68.929 26.304 -4.551 1.00 60.00 O +ATOM 205 CB VAL A 25 68.613 27.378 -7.148 1.00 60.87 C +ATOM 206 CG1 VAL A 25 68.319 28.594 -8.046 1.00 59.99 C +ATOM 207 CG2 VAL A 25 68.761 26.117 -7.996 1.00 60.65 C +ATOM 208 N THR A 26 71.172 26.318 -4.702 1.00 61.03 N +ATOM 209 CA THR A 26 71.361 25.451 -3.551 1.00 61.43 C +ATOM 210 C THR A 26 72.594 25.895 -2.766 1.00 62.52 C +ATOM 211 O THR A 26 73.434 26.635 -3.282 1.00 62.78 O +ATOM 212 CB THR A 26 71.575 23.991 -3.971 1.00 60.96 C +ATOM 213 OG1 THR A 26 72.900 23.829 -4.502 1.00 59.75 O +ATOM 214 CG2 THR A 26 70.567 23.598 -5.021 1.00 61.35 C +ATOM 215 N HIS A 27 72.682 25.439 -1.514 1.00 63.16 N +ATOM 216 CA HIS A 27 73.809 25.719 -0.620 1.00 62.58 C +ATOM 217 C HIS A 27 73.784 24.652 0.464 1.00 61.32 C +ATOM 218 O HIS A 27 72.743 24.416 1.073 1.00 60.56 O +ATOM 219 CB HIS A 27 73.698 27.125 0.011 1.00 64.79 C +ATOM 220 CG HIS A 27 74.756 27.417 1.041 1.00 65.93 C +ATOM 221 ND1 HIS A 27 75.965 26.753 1.084 1.00 66.61 N +ATOM 222 CD2 HIS A 27 74.796 28.324 2.047 1.00 65.83 C +ATOM 223 CE1 HIS A 27 76.702 27.239 2.067 1.00 65.10 C +ATOM 224 NE2 HIS A 27 76.017 28.193 2.666 1.00 65.15 N +ATOM 225 N LEU A 28 74.924 23.999 0.675 1.00 60.16 N +ATOM 226 CA LEU A 28 75.056 22.952 1.679 1.00 60.33 C +ATOM 227 C LEU A 28 76.053 23.379 2.744 1.00 61.28 C +ATOM 228 O LEU A 28 77.121 23.879 2.415 1.00 61.78 O +ATOM 229 CB LEU A 28 75.563 21.654 1.041 1.00 59.62 C +ATOM 230 CG LEU A 28 76.384 20.733 1.972 1.00 60.46 C +ATOM 231 CD1 LEU A 28 75.465 20.133 3.005 1.00 61.60 C +ATOM 232 CD2 LEU A 28 77.092 19.616 1.203 1.00 60.01 C +ATOM 233 N HIS A 29 75.705 23.195 4.017 1.00 61.78 N +ATOM 234 CA HIS A 29 76.618 23.516 5.107 1.00 61.64 C +ATOM 235 C HIS A 29 76.385 22.572 6.265 1.00 61.58 C +ATOM 236 O HIS A 29 75.659 21.587 6.118 1.00 62.06 O +ATOM 237 CB HIS A 29 76.499 24.993 5.543 1.00 63.72 C +ATOM 238 CG HIS A 29 75.213 25.374 6.223 1.00 65.36 C +ATOM 239 ND1 HIS A 29 73.971 25.194 5.648 1.00 67.11 N +ATOM 240 CD2 HIS A 29 74.993 26.053 7.377 1.00 65.58 C +ATOM 241 CE1 HIS A 29 73.045 25.751 6.412 1.00 66.81 C +ATOM 242 NE2 HIS A 29 73.640 26.281 7.466 1.00 66.19 N +ATOM 243 N SER A 30 77.008 22.839 7.406 1.00 60.59 N +ATOM 244 CA SER A 30 76.821 21.971 8.564 1.00 60.50 C +ATOM 245 C SER A 30 76.674 22.760 9.863 1.00 60.25 C +ATOM 246 O SER A 30 77.565 23.508 10.247 1.00 60.89 O +ATOM 247 CB SER A 30 77.980 20.980 8.675 1.00 59.44 C +ATOM 248 OG SER A 30 77.781 20.107 9.776 1.00 60.86 O +ATOM 249 N ILE A 31 75.551 22.591 10.546 1.00 59.65 N +ATOM 250 CA ILE A 31 75.354 23.331 11.762 1.00 60.08 C +ATOM 251 C ILE A 31 76.105 22.722 12.942 1.00 60.79 C +ATOM 252 O ILE A 31 76.057 23.231 14.066 1.00 60.52 O +ATOM 253 CB ILE A 31 73.863 23.470 12.091 1.00 60.37 C +ATOM 254 CG1 ILE A 31 73.712 24.141 13.471 1.00 62.56 C +ATOM 255 CG2 ILE A 31 73.192 22.102 12.088 1.00 59.67 C +ATOM 256 CD1 ILE A 31 74.437 25.525 13.656 1.00 59.23 C +ATOM 257 N GLY A 32 76.820 21.634 12.702 1.00 61.07 N +ATOM 258 CA GLY A 32 77.568 21.048 13.800 1.00 61.92 C +ATOM 259 C GLY A 32 77.971 19.628 13.506 1.00 62.76 C +ATOM 260 O GLY A 32 77.895 19.202 12.348 1.00 63.49 O +ATOM 261 N LYS A 33 78.413 18.902 14.535 1.00 63.33 N +ATOM 262 CA LYS A 33 78.796 17.496 14.368 1.00 64.58 C +ATOM 263 C LYS A 33 78.265 16.622 15.505 1.00 64.28 C +ATOM 264 O LYS A 33 78.116 17.074 16.639 1.00 62.43 O +ATOM 265 CB LYS A 33 80.316 17.372 14.345 1.00 99.99 C +ATOM 266 CG LYS A 33 80.859 17.995 13.065 0.00 99.99 C +ATOM 267 CD LYS A 33 82.370 17.804 13.007 0.00 99.99 C +ATOM 268 CE LYS A 33 82.923 18.493 11.764 0.00 99.99 C +ATOM 269 NZ LYS A 33 84.373 18.269 11.682 0.00 99.99 N +ATOM 270 N SER A 34 77.962 15.369 15.188 1.00 65.31 N +ATOM 271 CA SER A 34 77.441 14.457 16.198 1.00 67.32 C +ATOM 272 C SER A 34 78.497 14.263 17.266 1.00 67.73 C +ATOM 273 O SER A 34 79.524 14.939 17.258 1.00 68.29 O +ATOM 274 CB SER A 34 77.124 13.095 15.596 1.00 67.23 C +ATOM 275 OG SER A 34 78.303 12.319 15.525 1.00 67.15 O +ATOM 276 N VAL A 35 78.245 13.347 18.192 1.00 67.72 N +ATOM 277 CA VAL A 35 79.232 13.090 19.218 1.00 68.51 C +ATOM 278 C VAL A 35 80.216 12.130 18.588 1.00 69.86 C +ATOM 279 O VAL A 35 81.068 11.575 19.283 1.00 71.81 O +ATOM 280 CB VAL A 35 78.653 12.408 20.485 1.00 67.58 C +ATOM 281 CG1 VAL A 35 77.703 13.321 21.183 1.00 67.82 C +ATOM 282 CG2 VAL A 35 77.973 11.130 20.123 1.00 66.99 C +ATOM 283 N LYS A 36 80.097 11.919 17.277 1.00 69.65 N +ATOM 284 CA LYS A 36 81.009 11.006 16.591 1.00 69.56 C +ATOM 285 C LYS A 36 81.719 11.699 15.436 1.00 69.12 C +ATOM 286 O LYS A 36 82.393 11.065 14.636 1.00 69.48 O +ATOM 287 CB LYS A 36 80.232 9.818 16.035 1.00 99.99 C +ATOM 288 CG LYS A 36 81.208 8.755 15.542 0.00 99.99 C +ATOM 289 CD LYS A 36 81.741 7.965 16.732 0.00 99.99 C +ATOM 290 CE LYS A 36 82.792 6.969 16.251 0.00 99.99 C +ATOM 291 NZ LYS A 36 83.203 6.109 17.370 0.00 99.99 N +ATOM 292 N GLY A 37 81.569 13.007 15.345 1.00 68.88 N +ATOM 293 CA GLY A 37 82.237 13.713 14.276 1.00 70.62 C +ATOM 294 C GLY A 37 81.507 13.639 12.952 1.00 72.08 C +ATOM 295 O GLY A 37 82.040 14.049 11.914 1.00 73.03 O +ATOM 296 N ARG A 38 80.287 13.109 12.979 1.00 72.46 N +ATOM 297 CA ARG A 38 79.473 13.009 11.766 1.00 70.57 C +ATOM 298 C ARG A 38 78.909 14.392 11.483 1.00 69.49 C +ATOM 299 O ARG A 38 78.676 15.191 12.403 1.00 68.88 O +ATOM 300 CB ARG A 38 78.340 12.008 11.967 1.00 70.42 C +ATOM 301 CG ARG A 38 78.817 10.609 12.280 1.00 69.19 C +ATOM 302 CD ARG A 38 78.512 9.656 11.146 1.00 68.64 C +ATOM 303 NE ARG A 38 78.954 8.300 11.441 1.00 68.98 N +ATOM 304 CZ ARG A 38 78.794 7.703 12.619 1.00 69.96 C +ATOM 305 NH1 ARG A 38 78.210 8.351 13.620 1.00 70.32 N +ATOM 306 NH2 ARG A 38 79.186 6.442 12.791 1.00 70.58 N +ATOM 307 N ASN A 39 78.671 14.675 10.214 1.00 68.24 N +ATOM 308 CA ASN A 39 78.179 15.992 9.857 1.00 67.43 C +ATOM 309 C ASN A 39 76.672 16.221 9.787 1.00 66.55 C +ATOM 310 O ASN A 39 75.885 15.385 9.303 1.00 67.82 O +ATOM 311 CB ASN A 39 78.848 16.443 8.571 1.00 66.51 C +ATOM 312 CG ASN A 39 79.888 17.471 8.826 1.00 66.73 C +ATOM 313 OD1 ASN A 39 79.595 18.655 8.847 1.00 67.09 O +ATOM 314 ND2 ASN A 39 81.111 17.030 9.075 1.00 67.77 N +ATOM 315 N LEU A 40 76.276 17.378 10.289 1.00 63.03 N +ATOM 316 CA LEU A 40 74.886 17.724 10.305 1.00 59.95 C +ATOM 317 C LEU A 40 74.595 18.598 9.109 1.00 58.81 C +ATOM 318 O LEU A 40 74.316 19.782 9.238 1.00 58.97 O +ATOM 319 CB LEU A 40 74.582 18.427 11.623 1.00 59.58 C +ATOM 320 CG LEU A 40 74.878 17.559 12.855 1.00 57.47 C +ATOM 321 CD1 LEU A 40 73.898 17.913 13.952 1.00 56.65 C +ATOM 322 CD2 LEU A 40 74.741 16.083 12.528 1.00 57.48 C +ATOM 323 N TRP A 41 74.646 17.989 7.934 1.00 58.24 N +ATOM 324 CA TRP A 41 74.433 18.710 6.687 1.00 57.62 C +ATOM 325 C TRP A 41 73.040 19.237 6.517 1.00 55.96 C +ATOM 326 O TRP A 41 72.073 18.580 6.860 1.00 57.05 O +ATOM 327 CB TRP A 41 74.732 17.814 5.481 1.00 60.23 C +ATOM 328 CG TRP A 41 76.010 17.061 5.578 1.00 63.50 C +ATOM 329 CD1 TRP A 41 76.177 15.781 6.022 1.00 64.25 C +ATOM 330 CD2 TRP A 41 77.316 17.557 5.285 1.00 66.09 C +ATOM 331 NE1 TRP A 41 77.508 15.444 6.029 1.00 65.95 N +ATOM 332 CE2 TRP A 41 78.234 16.516 5.581 1.00 67.37 C +ATOM 333 CE3 TRP A 41 77.805 18.781 4.805 1.00 66.47 C +ATOM 334 CZ2 TRP A 41 79.619 16.662 5.414 1.00 68.02 C +ATOM 335 CZ3 TRP A 41 79.172 18.927 4.642 1.00 67.49 C +ATOM 336 CH2 TRP A 41 80.068 17.869 4.947 1.00 67.97 C +ATOM 337 N VAL A 42 72.943 20.427 5.961 1.00 54.05 N +ATOM 338 CA VAL A 42 71.655 21.026 5.673 1.00 52.49 C +ATOM 339 C VAL A 42 71.809 21.457 4.232 1.00 52.91 C +ATOM 340 O VAL A 42 72.904 21.822 3.795 1.00 52.33 O +ATOM 341 CB VAL A 42 71.412 22.278 6.508 1.00 51.78 C +ATOM 342 CG1 VAL A 42 70.073 22.867 6.185 1.00 49.83 C +ATOM 343 CG2 VAL A 42 71.530 21.943 7.956 1.00 51.54 C +ATOM 344 N LEU A 43 70.730 21.393 3.476 1.00 53.11 N +ATOM 345 CA LEU A 43 70.793 21.837 2.096 1.00 53.44 C +ATOM 346 C LEU A 43 69.670 22.840 1.926 1.00 53.50 C +ATOM 347 O LEU A 43 68.507 22.538 2.209 1.00 53.77 O +ATOM 348 CB LEU A 43 70.620 20.670 1.138 1.00 53.59 C +ATOM 349 CG LEU A 43 70.928 20.951 -0.334 1.00 54.78 C +ATOM 350 CD1 LEU A 43 71.263 19.617 -1.025 1.00 55.52 C +ATOM 351 CD2 LEU A 43 69.745 21.662 -1.012 1.00 54.07 C +ATOM 352 N VAL A 44 70.010 24.051 1.504 1.00 52.97 N +ATOM 353 CA VAL A 44 68.976 25.041 1.335 1.00 51.81 C +ATOM 354 C VAL A 44 68.705 25.156 -0.119 1.00 50.96 C +ATOM 355 O VAL A 44 69.605 25.025 -0.923 1.00 51.26 O +ATOM 356 CB VAL A 44 69.383 26.396 1.886 1.00 51.75 C +ATOM 357 CG1 VAL A 44 68.169 27.320 1.905 1.00 51.75 C +ATOM 358 CG2 VAL A 44 69.949 26.232 3.283 1.00 52.08 C +ATOM 359 N VAL A 45 67.452 25.381 -0.451 1.00 51.08 N +ATOM 360 CA VAL A 45 67.050 25.497 -1.829 1.00 54.08 C +ATOM 361 C VAL A 45 66.267 26.771 -1.962 1.00 57.54 C +ATOM 362 O VAL A 45 65.210 26.917 -1.360 1.00 59.03 O +ATOM 363 CB VAL A 45 66.135 24.339 -2.258 1.00 52.48 C +ATOM 364 CG1 VAL A 45 65.652 24.575 -3.671 1.00 51.55 C +ATOM 365 CG2 VAL A 45 66.873 23.009 -2.152 1.00 51.89 C +ATOM 366 N GLY A 46 66.769 27.701 -2.758 1.00 60.54 N +ATOM 367 CA GLY A 46 66.047 28.943 -2.910 1.00 63.32 C +ATOM 368 C GLY A 46 66.573 29.698 -4.089 1.00 65.81 C +ATOM 369 O GLY A 46 67.611 29.326 -4.650 1.00 64.91 O +ATOM 370 N ARG A 47 65.859 30.760 -4.456 1.00 68.89 N +ATOM 371 CA ARG A 47 66.255 31.585 -5.587 1.00 71.79 C +ATOM 372 C ARG A 47 67.636 32.157 -5.278 1.00 72.60 C +ATOM 373 O ARG A 47 68.563 32.036 -6.085 1.00 74.17 O +ATOM 374 CB ARG A 47 65.223 32.691 -5.826 1.00 73.27 C +ATOM 375 CG ARG A 47 65.258 33.270 -7.229 1.00 75.79 C +ATOM 376 CD ARG A 47 65.607 32.187 -8.249 1.00 78.27 C +ATOM 377 NE ARG A 47 64.582 31.151 -8.378 1.00 79.92 N +ATOM 378 CZ ARG A 47 64.786 29.977 -8.977 1.00 81.50 C +ATOM 379 NH1 ARG A 47 65.981 29.689 -9.493 1.00 81.66 N +ATOM 380 NH2 ARG A 47 63.795 29.094 -9.075 1.00 81.57 N +ATOM 381 N PHE A 48 67.781 32.758 -4.105 1.00 72.13 N +ATOM 382 CA PHE A 48 69.073 33.273 -3.725 1.00 72.31 C +ATOM 383 C PHE A 48 69.494 32.485 -2.506 1.00 71.36 C +ATOM 384 O PHE A 48 69.360 32.964 -1.394 1.00 71.23 O +ATOM 385 CB PHE A 48 69.018 34.757 -3.354 1.00 74.52 C +ATOM 386 CG PHE A 48 67.798 35.496 -3.867 1.00 76.85 C +ATOM 387 CD1 PHE A 48 66.706 35.741 -3.019 1.00 76.92 C +ATOM 388 CD2 PHE A 48 67.763 36.007 -5.175 1.00 77.96 C +ATOM 389 CE1 PHE A 48 65.596 36.486 -3.455 1.00 76.84 C +ATOM 390 CE2 PHE A 48 66.655 36.759 -5.627 1.00 78.65 C +ATOM 391 CZ PHE A 48 65.568 36.997 -4.758 1.00 77.95 C +ATOM 392 N PRO A 49 69.975 31.245 -2.687 1.00 71.79 N +ATOM 393 CA PRO A 49 70.397 30.470 -1.501 1.00 72.06 C +ATOM 394 C PRO A 49 71.590 31.113 -0.799 1.00 71.90 C +ATOM 395 O PRO A 49 72.254 31.987 -1.381 1.00 72.44 O +ATOM 396 CB PRO A 49 70.739 29.087 -2.074 1.00 71.36 C +ATOM 397 CG PRO A 49 71.069 29.377 -3.516 1.00 71.51 C +ATOM 398 CD PRO A 49 70.058 30.432 -3.913 1.00 70.81 C +ATOM 399 N LYS A 50 71.850 30.692 0.440 1.00 70.75 N +ATOM 400 CA LYS A 50 72.978 31.214 1.252 1.00 70.21 C +ATOM 401 C LYS A 50 72.694 32.456 2.123 1.00 68.00 C +ATOM 402 O LYS A 50 73.399 32.700 3.112 1.00 68.24 O +ATOM 403 CB LYS A 50 74.228 31.497 0.368 1.00 70.56 C +ATOM 404 CG LYS A 50 75.464 32.059 1.109 1.00 68.49 C +ATOM 405 CD LYS A 50 76.622 32.286 0.151 0.00 69.31 C +ATOM 406 CE LYS A 50 77.840 32.835 0.875 0.00 69.18 C +ATOM 407 NZ LYS A 50 78.981 33.065 -0.054 0.00 69.31 N +ATOM 408 N GLU A 51 71.676 33.233 1.776 1.00 64.82 N +ATOM 409 CA GLU A 51 71.377 34.420 2.561 1.00 61.77 C +ATOM 410 C GLU A 51 69.893 34.689 2.721 1.00 57.23 C +ATOM 411 O GLU A 51 69.147 34.771 1.751 1.00 54.29 O +ATOM 412 CB GLU A 51 72.068 35.637 1.938 1.00 65.63 C +ATOM 413 CG GLU A 51 71.826 35.798 0.431 1.00 70.14 C +ATOM 414 CD GLU A 51 72.620 36.957 -0.197 1.00 72.96 C +ATOM 415 OE1 GLU A 51 72.352 37.266 -1.391 1.00 73.71 O +ATOM 416 OE2 GLU A 51 73.500 37.548 0.494 1.00 72.92 O +ATOM 417 N HIS A 52 69.453 34.823 3.957 1.00 53.31 N +ATOM 418 CA HIS A 52 68.050 35.093 4.140 1.00 51.68 C +ATOM 419 C HIS A 52 67.796 36.365 3.365 1.00 50.15 C +ATOM 420 O HIS A 52 68.704 37.156 3.177 1.00 51.06 O +ATOM 421 CB HIS A 52 67.693 35.298 5.622 1.00 50.95 C +ATOM 422 CG HIS A 52 66.510 36.187 5.828 1.00 49.59 C +ATOM 423 ND1 HIS A 52 65.262 35.886 5.328 1.00 50.39 N +ATOM 424 CD2 HIS A 52 66.412 37.427 6.361 1.00 48.91 C +ATOM 425 CE1 HIS A 52 64.450 36.908 5.536 1.00 50.73 C +ATOM 426 NE2 HIS A 52 65.124 37.857 6.159 1.00 48.70 N +ATOM 427 N ARG A 53 66.572 36.547 2.894 1.00 48.54 N +ATOM 428 CA ARG A 53 66.222 37.751 2.170 1.00 47.68 C +ATOM 429 C ARG A 53 64.885 38.276 2.685 1.00 47.81 C +ATOM 430 O ARG A 53 63.911 37.544 2.742 1.00 49.29 O +ATOM 431 CB ARG A 53 66.108 37.446 0.680 1.00 99.99 C +ATOM 432 CG ARG A 53 67.400 36.804 0.191 0.00 99.99 C +ATOM 433 CD ARG A 53 68.533 37.822 0.263 0.00 99.99 C +ATOM 434 NE ARG A 53 68.229 39.013 -0.563 0.00 99.99 N +ATOM 435 CZ ARG A 53 69.153 39.898 -0.924 0.00 99.99 C +ATOM 436 NH1 ARG A 53 70.428 39.774 -0.564 0.00 99.99 N +ATOM 437 NH2 ARG A 53 68.771 40.932 -1.669 0.00 99.99 N +ATOM 438 N ILE A 54 64.861 39.539 3.095 1.00 47.48 N +ATOM 439 CA ILE A 54 63.650 40.187 3.574 1.00 47.90 C +ATOM 440 C ILE A 54 62.446 39.793 2.692 1.00 49.03 C +ATOM 441 O ILE A 54 62.499 39.915 1.463 1.00 49.93 O +ATOM 442 CB ILE A 54 63.833 41.749 3.538 1.00 46.86 C +ATOM 443 CG1 ILE A 54 64.520 42.232 4.814 1.00 47.77 C +ATOM 444 CG2 ILE A 54 62.507 42.450 3.372 1.00 44.32 C +ATOM 445 CD1 ILE A 54 65.944 41.751 4.969 1.00 48.87 C +ATOM 446 N GLY A 55 61.365 39.301 3.292 1.00 48.21 N +ATOM 447 CA GLY A 55 60.218 38.968 2.460 1.00 46.30 C +ATOM 448 C GLY A 55 60.036 37.505 2.138 1.00 44.88 C +ATOM 449 O GLY A 55 58.922 37.006 2.207 1.00 44.94 O +ATOM 450 N ILE A 56 61.106 36.819 1.758 1.00 43.87 N +ATOM 451 CA ILE A 56 60.998 35.403 1.474 1.00 43.96 C +ATOM 452 C ILE A 56 61.151 34.674 2.812 1.00 45.62 C +ATOM 453 O ILE A 56 62.161 34.828 3.503 1.00 45.35 O +ATOM 454 CB ILE A 56 62.064 34.935 0.441 1.00 42.34 C +ATOM 455 CG1 ILE A 56 63.486 35.175 0.960 1.00 43.50 C +ATOM 456 CG2 ILE A 56 61.887 35.723 -0.866 1.00 38.45 C +ATOM 457 CD1 ILE A 56 64.003 34.292 2.112 1.00 42.47 C +ATOM 458 N PRO A 57 60.121 33.901 3.213 1.00 46.71 N +ATOM 459 CA PRO A 57 60.108 33.148 4.460 1.00 47.66 C +ATOM 460 C PRO A 57 61.037 31.948 4.449 1.00 48.59 C +ATOM 461 O PRO A 57 61.236 31.319 3.413 1.00 47.89 O +ATOM 462 CB PRO A 57 58.655 32.712 4.574 1.00 47.78 C +ATOM 463 CG PRO A 57 57.920 33.713 3.795 1.00 47.59 C +ATOM 464 CD PRO A 57 58.789 33.829 2.594 1.00 47.49 C +ATOM 465 N GLU A 58 61.584 31.633 5.623 1.00 50.63 N +ATOM 466 CA GLU A 58 62.481 30.490 5.796 1.00 51.80 C +ATOM 467 C GLU A 58 61.664 29.231 6.166 1.00 51.77 C +ATOM 468 O GLU A 58 60.662 29.323 6.899 1.00 52.13 O +ATOM 469 CB GLU A 58 63.512 30.811 6.881 1.00 51.50 C +ATOM 470 CG GLU A 58 64.330 32.043 6.544 1.00 54.17 C +ATOM 471 CD GLU A 58 65.112 31.883 5.237 1.00 55.40 C +ATOM 472 OE1 GLU A 58 65.439 32.907 4.582 1.00 55.14 O +ATOM 473 OE2 GLU A 58 65.406 30.725 4.875 1.00 54.90 O +ATOM 474 N PHE A 59 62.076 28.076 5.632 1.00 50.51 N +ATOM 475 CA PHE A 59 61.389 26.811 5.888 1.00 48.93 C +ATOM 476 C PHE A 59 62.337 25.616 6.064 1.00 48.08 C +ATOM 477 O PHE A 59 63.333 25.484 5.335 1.00 46.36 O +ATOM 478 CB PHE A 59 60.411 26.511 4.755 1.00 49.48 C +ATOM 479 CG PHE A 59 59.669 25.211 4.929 1.00 51.51 C +ATOM 480 CD1 PHE A 59 60.333 23.984 4.820 1.00 51.73 C +ATOM 481 CD2 PHE A 59 58.310 25.207 5.224 1.00 51.79 C +ATOM 482 CE1 PHE A 59 59.669 22.787 5.004 1.00 50.21 C +ATOM 483 CE2 PHE A 59 57.630 24.004 5.408 1.00 51.31 C +ATOM 484 CZ PHE A 59 58.318 22.796 5.298 1.00 51.70 C +ATOM 485 N LYS A 60 62.026 24.738 7.028 1.00 46.31 N +ATOM 486 CA LYS A 60 62.870 23.571 7.240 1.00 43.77 C +ATOM 487 C LYS A 60 62.184 22.241 7.447 1.00 42.68 C +ATOM 488 O LYS A 60 61.001 22.129 7.782 1.00 43.06 O +ATOM 489 CB LYS A 60 63.869 23.804 8.366 1.00 43.24 C +ATOM 490 CG LYS A 60 63.291 24.432 9.589 1.00 45.13 C +ATOM 491 CD LYS A 60 64.383 24.681 10.617 1.00 47.24 C +ATOM 492 CE LYS A 60 63.806 25.352 11.859 1.00 49.33 C +ATOM 493 NZ LYS A 60 62.740 24.523 12.517 1.00 50.51 N +ATOM 494 N TYR A 61 62.974 21.218 7.189 1.00 40.73 N +ATOM 495 CA TYR A 61 62.547 19.858 7.306 1.00 39.29 C +ATOM 496 C TYR A 61 63.702 19.160 7.986 1.00 38.68 C +ATOM 497 O TYR A 61 64.746 18.973 7.403 1.00 38.12 O +ATOM 498 CB TYR A 61 62.318 19.239 5.920 1.00 38.45 C +ATOM 499 CG TYR A 61 60.906 19.342 5.363 1.00 37.61 C +ATOM 500 CD1 TYR A 61 59.795 19.101 6.158 1.00 37.84 C +ATOM 501 CD2 TYR A 61 60.688 19.624 4.019 1.00 39.59 C +ATOM 502 CE1 TYR A 61 58.484 19.142 5.623 1.00 37.78 C +ATOM 503 CE2 TYR A 61 59.379 19.666 3.467 1.00 39.11 C +ATOM 504 CZ TYR A 61 58.282 19.433 4.279 1.00 37.66 C +ATOM 505 OH TYR A 61 57.004 19.590 3.778 1.00 33.21 O +ATOM 506 N VAL A 62 63.535 18.820 9.247 1.00 38.85 N +ATOM 507 CA VAL A 62 64.577 18.101 9.941 1.00 39.23 C +ATOM 508 C VAL A 62 64.008 16.692 9.980 1.00 41.52 C +ATOM 509 O VAL A 62 62.791 16.535 10.061 1.00 43.39 O +ATOM 510 CB VAL A 62 64.792 18.682 11.318 1.00 36.66 C +ATOM 511 CG1 VAL A 62 65.630 17.781 12.153 1.00 36.62 C +ATOM 512 CG2 VAL A 62 65.499 19.985 11.163 1.00 37.00 C +ATOM 513 N ALA A 63 64.865 15.676 9.859 1.00 41.74 N +ATOM 514 CA ALA A 63 64.422 14.291 9.847 1.00 40.56 C +ATOM 515 C ALA A 63 65.549 13.423 10.362 1.00 42.64 C +ATOM 516 O ALA A 63 66.678 13.879 10.481 1.00 44.02 O +ATOM 517 CB ALA A 63 64.076 13.882 8.452 1.00 35.27 C +ATOM 518 N ASN A 64 65.209 12.181 10.695 1.00 44.69 N +ATOM 519 CA ASN A 64 66.128 11.156 11.164 1.00 44.01 C +ATOM 520 C ASN A 64 66.713 11.377 12.531 1.00 44.00 C +ATOM 521 O ASN A 64 67.736 10.788 12.846 1.00 44.27 O +ATOM 522 CB ASN A 64 67.246 10.961 10.134 1.00 45.69 C +ATOM 523 CG ASN A 64 67.914 9.586 10.225 1.00 48.07 C +ATOM 524 OD1 ASN A 64 67.252 8.544 10.329 1.00 48.00 O +ATOM 525 ND2 ASN A 64 69.240 9.582 10.157 1.00 49.18 N +ATOM 526 N MET A 65 66.070 12.197 13.356 1.00 45.06 N +ATOM 527 CA MET A 65 66.570 12.442 14.716 1.00 46.93 C +ATOM 528 C MET A 65 66.550 11.149 15.576 1.00 48.26 C +ATOM 529 O MET A 65 67.213 11.035 16.634 1.00 48.34 O +ATOM 530 CB MET A 65 65.759 13.551 15.385 1.00 47.72 C +ATOM 531 CG MET A 65 64.375 13.168 15.882 1.00 47.20 C +ATOM 532 SD MET A 65 63.891 14.432 17.086 1.00 49.01 S +ATOM 533 CE MET A 65 62.612 15.190 16.209 1.00 49.58 C +ATOM 534 N HIS A 66 65.768 10.178 15.118 1.00 48.92 N +ATOM 535 CA HIS A 66 65.717 8.875 15.759 1.00 49.24 C +ATOM 536 C HIS A 66 66.482 7.969 14.791 1.00 49.88 C +ATOM 537 O HIS A 66 66.005 7.666 13.684 1.00 49.68 O +ATOM 538 CB HIS A 66 64.274 8.411 15.933 1.00 50.01 C +ATOM 539 CG HIS A 66 63.573 9.074 17.080 1.00 51.53 C +ATOM 540 ND1 HIS A 66 62.202 9.086 17.213 1.00 50.27 N +ATOM 541 CD2 HIS A 66 64.062 9.763 18.139 1.00 51.51 C +ATOM 542 CE1 HIS A 66 61.877 9.761 18.302 1.00 50.54 C +ATOM 543 NE2 HIS A 66 62.987 10.182 18.881 1.00 50.46 N +ATOM 544 N GLY A 67 67.690 7.586 15.206 1.00 49.38 N +ATOM 545 CA GLY A 67 68.538 6.746 14.391 1.00 47.83 C +ATOM 546 C GLY A 67 67.769 5.917 13.398 1.00 47.66 C +ATOM 547 O GLY A 67 67.687 6.254 12.216 1.00 47.36 O +ATOM 548 N ASP A 68 67.163 4.852 13.909 1.00 47.90 N +ATOM 549 CA ASP A 68 66.409 3.899 13.106 1.00 48.45 C +ATOM 550 C ASP A 68 65.214 4.350 12.260 1.00 48.18 C +ATOM 551 O ASP A 68 64.759 3.579 11.415 1.00 49.17 O +ATOM 552 CB ASP A 68 65.975 2.733 13.993 1.00 49.61 C +ATOM 553 CG ASP A 68 65.163 3.174 15.199 1.00 53.63 C +ATOM 554 OD1 ASP A 68 64.795 4.371 15.333 1.00 53.58 O +ATOM 555 OD2 ASP A 68 64.872 2.291 16.031 1.00 57.37 O +ATOM 556 N GLU A 69 64.692 5.562 12.457 1.00 46.73 N +ATOM 557 CA GLU A 69 63.543 5.997 11.659 1.00 44.67 C +ATOM 558 C GLU A 69 64.014 6.566 10.334 1.00 45.96 C +ATOM 559 O GLU A 69 64.172 7.783 10.182 1.00 47.22 O +ATOM 560 CB GLU A 69 62.718 7.009 12.432 1.00 42.00 C +ATOM 561 CG GLU A 69 61.967 6.375 13.584 1.00 39.93 C +ATOM 562 CD GLU A 69 61.480 7.381 14.585 1.00 38.97 C +ATOM 563 OE1 GLU A 69 61.438 7.046 15.781 1.00 38.40 O +ATOM 564 OE2 GLU A 69 61.138 8.507 14.182 1.00 39.15 O +ATOM 565 N THR A 70 64.185 5.654 9.371 1.00 45.60 N +ATOM 566 CA THR A 70 64.712 5.921 8.034 1.00 44.17 C +ATOM 567 C THR A 70 63.866 6.465 6.866 1.00 44.94 C +ATOM 568 O THR A 70 64.421 7.030 5.923 1.00 43.83 O +ATOM 569 CB THR A 70 65.375 4.659 7.534 1.00 43.42 C +ATOM 570 OG1 THR A 70 64.376 3.653 7.344 1.00 43.23 O +ATOM 571 CG2 THR A 70 66.370 4.159 8.550 1.00 42.57 C +ATOM 572 N VAL A 71 62.544 6.325 6.894 1.00 46.18 N +ATOM 573 CA VAL A 71 61.770 6.800 5.732 1.00 46.16 C +ATOM 574 C VAL A 71 61.995 8.262 5.393 1.00 46.44 C +ATOM 575 O VAL A 71 62.153 8.626 4.225 1.00 44.06 O +ATOM 576 CB VAL A 71 60.241 6.602 5.906 1.00 45.03 C +ATOM 577 CG1 VAL A 71 59.518 7.012 4.629 1.00 43.27 C +ATOM 578 CG2 VAL A 71 59.935 5.175 6.237 1.00 45.40 C +ATOM 579 N GLY A 72 61.983 9.088 6.439 1.00 48.46 N +ATOM 580 CA GLY A 72 62.143 10.524 6.282 1.00 49.17 C +ATOM 581 C GLY A 72 63.529 10.890 5.796 1.00 49.30 C +ATOM 582 O GLY A 72 63.684 11.876 5.064 1.00 50.81 O +ATOM 583 N ARG A 73 64.530 10.109 6.201 1.00 46.38 N +ATOM 584 CA ARG A 73 65.892 10.371 5.797 1.00 43.98 C +ATOM 585 C ARG A 73 65.831 10.326 4.290 1.00 44.51 C +ATOM 586 O ARG A 73 66.239 11.255 3.596 1.00 43.70 O +ATOM 587 CB ARG A 73 66.807 9.274 6.331 1.00 42.88 C +ATOM 588 CG ARG A 73 68.268 9.498 6.087 1.00 42.74 C +ATOM 589 CD ARG A 73 69.106 8.319 6.585 1.00 44.17 C +ATOM 590 NE ARG A 73 70.345 8.773 7.226 1.00 46.71 N +ATOM 591 CZ ARG A 73 71.572 8.613 6.727 1.00 48.11 C +ATOM 592 NH1 ARG A 73 72.638 9.075 7.395 1.00 48.54 N +ATOM 593 NH2 ARG A 73 71.738 7.988 5.568 1.00 46.85 N +ATOM 594 N GLU A 74 65.243 9.255 3.784 1.00 45.29 N +ATOM 595 CA GLU A 74 65.159 9.073 2.354 1.00 46.96 C +ATOM 596 C GLU A 74 64.178 9.969 1.632 1.00 48.80 C +ATOM 597 O GLU A 74 64.405 10.312 0.473 1.00 51.14 O +ATOM 598 CB GLU A 74 64.858 7.622 2.041 1.00 46.34 C +ATOM 599 CG GLU A 74 65.903 6.659 2.603 1.00 47.37 C +ATOM 600 CD GLU A 74 67.318 6.965 2.132 1.00 45.96 C +ATOM 601 OE1 GLU A 74 67.449 7.644 1.086 1.00 45.46 O +ATOM 602 OE2 GLU A 74 68.281 6.513 2.801 1.00 42.86 O +ATOM 603 N LEU A 75 63.085 10.351 2.285 1.00 49.73 N +ATOM 604 CA LEU A 75 62.118 11.227 1.627 1.00 49.67 C +ATOM 605 C LEU A 75 62.737 12.611 1.418 1.00 50.43 C +ATOM 606 O LEU A 75 62.560 13.228 0.366 1.00 50.25 O +ATOM 607 CB LEU A 75 60.834 11.332 2.453 1.00 48.42 C +ATOM 608 CG LEU A 75 60.113 10.004 2.672 1.00 47.76 C +ATOM 609 CD1 LEU A 75 58.762 10.294 3.252 1.00 48.37 C +ATOM 610 CD2 LEU A 75 59.949 9.257 1.364 1.00 47.10 C +ATOM 611 N LEU A 76 63.491 13.081 2.417 1.00 51.36 N +ATOM 612 CA LEU A 76 64.137 14.398 2.343 1.00 50.32 C +ATOM 613 C LEU A 76 65.211 14.468 1.266 1.00 49.58 C +ATOM 614 O LEU A 76 65.356 15.502 0.625 1.00 50.65 O +ATOM 615 CB LEU A 76 64.723 14.819 3.710 1.00 48.42 C +ATOM 616 CG LEU A 76 63.696 15.171 4.799 1.00 46.07 C +ATOM 617 CD1 LEU A 76 64.359 15.924 5.930 1.00 44.61 C +ATOM 618 CD2 LEU A 76 62.609 16.023 4.200 1.00 44.52 C +ATOM 619 N LEU A 77 65.968 13.394 1.056 1.00 48.55 N +ATOM 620 CA LEU A 77 66.982 13.442 0.005 1.00 47.64 C +ATOM 621 C LEU A 77 66.249 13.537 -1.313 1.00 46.98 C +ATOM 622 O LEU A 77 66.557 14.401 -2.150 1.00 46.71 O +ATOM 623 CB LEU A 77 67.864 12.206 0.039 1.00 45.30 C +ATOM 624 CG LEU A 77 68.749 12.279 1.276 1.00 45.02 C +ATOM 625 CD1 LEU A 77 69.264 10.908 1.633 1.00 46.92 C +ATOM 626 CD2 LEU A 77 69.887 13.221 1.017 1.00 44.30 C +ATOM 627 N HIS A 78 65.252 12.671 -1.463 1.00 45.29 N +ATOM 628 CA HIS A 78 64.452 12.625 -2.666 1.00 46.25 C +ATOM 629 C HIS A 78 63.640 13.907 -2.878 1.00 46.05 C +ATOM 630 O HIS A 78 63.378 14.318 -4.013 1.00 44.86 O +ATOM 631 CB HIS A 78 63.550 11.384 -2.637 1.00 47.91 C +ATOM 632 CG HIS A 78 64.229 10.129 -3.103 1.00 49.06 C +ATOM 633 ND1 HIS A 78 64.439 9.846 -4.437 1.00 49.80 N +ATOM 634 CD2 HIS A 78 64.756 9.088 -2.413 1.00 49.38 C +ATOM 635 CE1 HIS A 78 65.066 8.686 -4.547 1.00 49.89 C +ATOM 636 NE2 HIS A 78 65.270 8.205 -3.334 1.00 48.91 N +ATOM 637 N LEU A 79 63.229 14.545 -1.791 1.00 46.36 N +ATOM 638 CA LEU A 79 62.490 15.793 -1.938 1.00 46.35 C +ATOM 639 C LEU A 79 63.493 16.734 -2.573 1.00 47.88 C +ATOM 640 O LEU A 79 63.217 17.352 -3.593 1.00 49.39 O +ATOM 641 CB LEU A 79 62.078 16.363 -0.591 1.00 43.45 C +ATOM 642 CG LEU A 79 61.481 17.754 -0.717 1.00 40.87 C +ATOM 643 CD1 LEU A 79 60.200 17.701 -1.496 1.00 40.07 C +ATOM 644 CD2 LEU A 79 61.226 18.305 0.637 1.00 41.66 C +ATOM 645 N ILE A 80 64.663 16.817 -1.945 1.00 48.34 N +ATOM 646 CA ILE A 80 65.778 17.641 -2.398 1.00 49.29 C +ATOM 647 C ILE A 80 65.989 17.599 -3.922 1.00 50.33 C +ATOM 648 O ILE A 80 65.964 18.640 -4.611 1.00 48.79 O +ATOM 649 CB ILE A 80 67.083 17.197 -1.677 1.00 48.46 C +ATOM 650 CG1 ILE A 80 67.260 18.019 -0.386 1.00 46.41 C +ATOM 651 CG2 ILE A 80 68.266 17.296 -2.623 1.00 48.01 C +ATOM 652 CD1 ILE A 80 68.519 17.721 0.369 1.00 44.62 C +ATOM 653 N ASP A 81 66.207 16.390 -4.431 1.00 51.29 N +ATOM 654 CA ASP A 81 66.397 16.197 -5.854 1.00 52.15 C +ATOM 655 C ASP A 81 65.194 16.792 -6.575 1.00 50.53 C +ATOM 656 O ASP A 81 65.332 17.708 -7.348 1.00 49.38 O +ATOM 657 CB ASP A 81 66.525 14.702 -6.181 1.00 55.62 C +ATOM 658 CG ASP A 81 66.835 14.451 -7.657 1.00 59.23 C +ATOM 659 OD1 ASP A 81 67.912 13.876 -7.951 1.00 61.09 O +ATOM 660 OD2 ASP A 81 66.006 14.839 -8.520 1.00 59.43 O +ATOM 661 N TYR A 82 64.009 16.265 -6.304 1.00 51.02 N +ATOM 662 CA TYR A 82 62.776 16.758 -6.925 1.00 51.25 C +ATOM 663 C TYR A 82 62.858 18.253 -7.215 1.00 51.72 C +ATOM 664 O TYR A 82 62.786 18.696 -8.363 1.00 52.43 O +ATOM 665 CB TYR A 82 61.596 16.523 -5.989 1.00 49.18 C +ATOM 666 CG TYR A 82 60.243 16.870 -6.566 1.00 47.32 C +ATOM 667 CD1 TYR A 82 59.684 16.108 -7.578 1.00 45.85 C +ATOM 668 CD2 TYR A 82 59.476 17.888 -6.022 1.00 48.08 C +ATOM 669 CE1 TYR A 82 58.401 16.330 -8.026 1.00 44.61 C +ATOM 670 CE2 TYR A 82 58.177 18.120 -6.473 1.00 47.87 C +ATOM 671 CZ TYR A 82 57.653 17.327 -7.476 1.00 46.20 C +ATOM 672 OH TYR A 82 56.368 17.536 -7.915 1.00 48.49 O +ATOM 673 N LEU A 83 62.998 19.023 -6.144 1.00 51.57 N +ATOM 674 CA LEU A 83 63.087 20.466 -6.228 1.00 49.49 C +ATOM 675 C LEU A 83 64.154 20.898 -7.216 1.00 49.06 C +ATOM 676 O LEU A 83 63.821 21.475 -8.239 1.00 49.22 O +ATOM 677 CB LEU A 83 63.359 21.035 -4.842 1.00 48.89 C +ATOM 678 CG LEU A 83 62.214 20.849 -3.847 1.00 46.05 C +ATOM 679 CD1 LEU A 83 62.762 20.680 -2.444 1.00 42.41 C +ATOM 680 CD2 LEU A 83 61.274 22.040 -3.963 1.00 45.93 C +ATOM 681 N VAL A 84 65.430 20.629 -6.963 1.00 48.94 N +ATOM 682 CA VAL A 84 66.399 21.079 -7.963 1.00 50.19 C +ATOM 683 C VAL A 84 66.007 20.744 -9.423 1.00 50.82 C +ATOM 684 O VAL A 84 65.960 21.633 -10.271 1.00 52.18 O +ATOM 685 CB VAL A 84 67.849 20.576 -7.683 1.00 49.21 C +ATOM 686 CG1 VAL A 84 68.369 21.231 -6.433 1.00 49.21 C +ATOM 687 CG2 VAL A 84 67.897 19.085 -7.568 1.00 49.45 C +ATOM 688 N THR A 85 65.683 19.489 -9.717 1.00 51.12 N +ATOM 689 CA THR A 85 65.312 19.108 -11.083 1.00 50.70 C +ATOM 690 C THR A 85 63.933 19.590 -11.600 1.00 50.68 C +ATOM 691 O THR A 85 63.663 19.557 -12.803 1.00 50.62 O +ATOM 692 CB THR A 85 65.440 17.576 -11.263 1.00 50.22 C +ATOM 693 OG1 THR A 85 64.496 16.893 -10.420 1.00 49.11 O +ATOM 694 CG2 THR A 85 66.869 17.139 -10.903 1.00 49.75 C +ATOM 695 N SER A 86 63.062 20.040 -10.710 1.00 50.32 N +ATOM 696 CA SER A 86 61.764 20.522 -11.154 1.00 51.20 C +ATOM 697 C SER A 86 61.905 22.009 -11.438 1.00 52.39 C +ATOM 698 O SER A 86 61.138 22.581 -12.229 1.00 51.57 O +ATOM 699 CB SER A 86 60.706 20.321 -10.070 1.00 50.49 C +ATOM 700 OG SER A 86 60.736 19.019 -9.535 1.00 49.77 O +ATOM 701 N ASP A 87 62.883 22.624 -10.765 1.00 54.09 N +ATOM 702 CA ASP A 87 63.169 24.049 -10.905 1.00 55.09 C +ATOM 703 C ASP A 87 63.395 24.368 -12.380 1.00 55.89 C +ATOM 704 O ASP A 87 64.304 23.808 -13.030 1.00 55.91 O +ATOM 705 CB ASP A 87 64.420 24.443 -10.112 1.00 55.48 C +ATOM 706 CG ASP A 87 64.628 25.957 -10.067 1.00 58.11 C +ATOM 707 OD1 ASP A 87 65.762 26.409 -9.746 1.00 57.21 O +ATOM 708 OD2 ASP A 87 63.638 26.692 -10.345 1.00 58.17 O +ATOM 709 N GLY A 88 62.557 25.257 -12.903 1.00 54.72 N +ATOM 710 CA GLY A 88 62.679 25.631 -14.291 1.00 54.78 C +ATOM 711 C GLY A 88 61.715 24.920 -15.220 1.00 55.05 C +ATOM 712 O GLY A 88 61.176 25.542 -16.138 1.00 56.29 O +ATOM 713 N LYS A 89 61.483 23.630 -15.016 1.00 54.02 N +ATOM 714 CA LYS A 89 60.567 22.937 -15.898 1.00 54.19 C +ATOM 715 C LYS A 89 59.119 22.998 -15.391 1.00 54.59 C +ATOM 716 O LYS A 89 58.213 23.366 -16.144 1.00 55.07 O +ATOM 717 CB LYS A 89 61.012 21.504 -16.062 1.00 55.36 C +ATOM 718 CG LYS A 89 62.480 21.365 -16.348 1.00 58.90 C +ATOM 719 CD LYS A 89 63.025 20.078 -15.729 1.00 62.24 C +ATOM 720 CE LYS A 89 64.424 19.743 -16.235 1.00 64.44 C +ATOM 721 NZ LYS A 89 64.411 19.327 -17.674 1.00 66.02 N +ATOM 722 N ASP A 90 58.880 22.638 -14.130 1.00 53.74 N +ATOM 723 CA ASP A 90 57.523 22.702 -13.625 1.00 52.39 C +ATOM 724 C ASP A 90 57.301 24.103 -13.118 1.00 53.16 C +ATOM 725 O ASP A 90 58.041 24.587 -12.261 1.00 54.12 O +ATOM 726 CB ASP A 90 57.283 21.701 -12.492 1.00 51.71 C +ATOM 727 CG ASP A 90 55.900 21.884 -11.838 1.00 53.67 C +ATOM 728 OD1 ASP A 90 55.040 20.966 -11.892 1.00 52.51 O +ATOM 729 OD2 ASP A 90 55.659 22.972 -11.267 1.00 55.33 O +ATOM 730 N PRO A 91 56.282 24.789 -13.641 1.00 53.70 N +ATOM 731 CA PRO A 91 56.027 26.149 -13.180 1.00 55.17 C +ATOM 732 C PRO A 91 55.706 26.227 -11.686 1.00 55.92 C +ATOM 733 O PRO A 91 56.555 26.696 -10.916 1.00 56.89 O +ATOM 734 CB PRO A 91 54.870 26.616 -14.077 1.00 54.30 C +ATOM 735 CG PRO A 91 54.136 25.389 -14.322 1.00 54.53 C +ATOM 736 CD PRO A 91 55.232 24.360 -14.573 1.00 55.31 C +ATOM 737 N GLU A 92 54.525 25.752 -11.271 1.00 55.46 N +ATOM 738 CA GLU A 92 54.145 25.833 -9.867 1.00 54.58 C +ATOM 739 C GLU A 92 55.314 25.630 -8.928 1.00 54.64 C +ATOM 740 O GLU A 92 55.596 26.515 -8.103 1.00 55.37 O +ATOM 741 CB GLU A 92 53.053 24.845 -9.483 1.00 55.54 C +ATOM 742 CG GLU A 92 52.760 24.925 -7.977 1.00 58.78 C +ATOM 743 CD GLU A 92 51.543 24.136 -7.507 1.00 60.61 C +ATOM 744 OE1 GLU A 92 51.584 22.881 -7.500 1.00 60.16 O +ATOM 745 OE2 GLU A 92 50.543 24.792 -7.130 1.00 61.65 O +ATOM 746 N ILE A 93 56.004 24.492 -9.026 1.00 52.87 N +ATOM 747 CA ILE A 93 57.141 24.287 -8.131 1.00 51.23 C +ATOM 748 C ILE A 93 58.169 25.391 -8.306 1.00 50.98 C +ATOM 749 O ILE A 93 58.687 25.898 -7.322 1.00 49.29 O +ATOM 750 CB ILE A 93 57.842 22.960 -8.336 1.00 49.53 C +ATOM 751 CG1 ILE A 93 59.115 22.945 -7.506 1.00 48.16 C +ATOM 752 CG2 ILE A 93 58.207 22.793 -9.758 1.00 52.25 C +ATOM 753 CD1 ILE A 93 59.828 21.660 -7.521 1.00 47.19 C +ATOM 754 N THR A 94 58.465 25.773 -9.544 1.00 51.69 N +ATOM 755 CA THR A 94 59.420 26.850 -9.732 1.00 54.85 C +ATOM 756 C THR A 94 58.956 28.121 -8.999 1.00 56.50 C +ATOM 757 O THR A 94 59.750 28.731 -8.272 1.00 56.63 O +ATOM 758 CB THR A 94 59.681 27.144 -11.230 1.00 54.76 C +ATOM 759 OG1 THR A 94 60.872 26.458 -11.644 1.00 54.68 O +ATOM 760 CG2 THR A 94 59.887 28.637 -11.464 1.00 54.80 C +ATOM 761 N ASN A 95 57.687 28.514 -9.175 1.00 57.61 N +ATOM 762 CA ASN A 95 57.152 29.699 -8.489 1.00 58.26 C +ATOM 763 C ASN A 95 57.506 29.562 -7.015 1.00 58.59 C +ATOM 764 O ASN A 95 57.967 30.500 -6.394 1.00 59.23 O +ATOM 765 CB ASN A 95 55.623 29.794 -8.587 1.00 59.47 C +ATOM 766 CG ASN A 95 55.115 30.060 -10.004 1.00 61.80 C +ATOM 767 OD1 ASN A 95 55.174 29.190 -10.885 1.00 61.57 O +ATOM 768 ND2 ASN A 95 54.592 31.266 -10.224 1.00 62.33 N +ATOM 769 N LEU A 96 57.282 28.383 -6.453 1.00 58.78 N +ATOM 770 CA LEU A 96 57.593 28.141 -5.051 1.00 59.34 C +ATOM 771 C LEU A 96 59.104 28.318 -4.745 1.00 60.60 C +ATOM 772 O LEU A 96 59.492 29.222 -3.976 1.00 59.72 O +ATOM 773 CB LEU A 96 57.156 26.721 -4.673 1.00 58.59 C +ATOM 774 CG LEU A 96 57.112 26.299 -3.202 1.00 56.91 C +ATOM 775 CD1 LEU A 96 55.712 26.533 -2.685 1.00 56.26 C +ATOM 776 CD2 LEU A 96 57.501 24.835 -3.050 1.00 55.38 C +ATOM 777 N ILE A 97 59.945 27.453 -5.337 1.00 61.49 N +ATOM 778 CA ILE A 97 61.403 27.486 -5.118 1.00 61.97 C +ATOM 779 C ILE A 97 61.913 28.900 -5.249 1.00 62.88 C +ATOM 780 O ILE A 97 62.915 29.250 -4.643 1.00 62.89 O +ATOM 781 CB ILE A 97 62.193 26.625 -6.131 1.00 61.83 C +ATOM 782 CG1 ILE A 97 61.260 25.655 -6.844 1.00 62.37 C +ATOM 783 CG2 ILE A 97 63.281 25.842 -5.410 1.00 60.52 C +ATOM 784 CD1 ILE A 97 61.944 24.778 -7.855 1.00 62.64 C +ATOM 785 N ASN A 98 61.241 29.696 -6.080 1.00 64.19 N +ATOM 786 CA ASN A 98 61.602 31.095 -6.245 1.00 64.68 C +ATOM 787 C ASN A 98 61.228 31.697 -4.886 1.00 62.71 C +ATOM 788 O ASN A 98 62.076 31.855 -4.007 1.00 62.91 O +ATOM 789 CB ASN A 98 60.770 31.764 -7.361 1.00 68.57 C +ATOM 790 CG ASN A 98 61.273 31.441 -8.763 0.00 74.12 C +ATOM 791 OD1 ASN A 98 61.565 30.288 -9.075 0.00 74.01 O +ATOM 792 ND2 ASN A 98 61.351 32.465 -9.614 1.00 79.29 N +ATOM 793 N SER A 99 59.935 31.964 -4.721 1.00 60.21 N +ATOM 794 CA SER A 99 59.332 32.558 -3.521 1.00 57.53 C +ATOM 795 C SER A 99 59.712 32.102 -2.103 1.00 55.15 C +ATOM 796 O SER A 99 59.262 32.720 -1.146 1.00 53.82 O +ATOM 797 CB SER A 99 57.816 32.450 -3.616 1.00 57.45 C +ATOM 798 OG SER A 99 57.416 31.200 -3.080 1.00 59.25 O +ATOM 799 N THR A 100 60.498 31.044 -1.935 1.00 52.97 N +ATOM 800 CA THR A 100 60.851 30.626 -0.571 1.00 51.46 C +ATOM 801 C THR A 100 62.276 30.156 -0.458 1.00 50.82 C +ATOM 802 O THR A 100 62.930 29.942 -1.460 1.00 53.95 O +ATOM 803 CB THR A 100 59.986 29.460 -0.110 1.00 50.66 C +ATOM 804 OG1 THR A 100 58.642 29.665 -0.574 1.00 52.07 O +ATOM 805 CG2 THR A 100 60.017 29.342 1.418 1.00 47.39 C +ATOM 806 N ARG A 101 62.772 30.004 0.759 1.00 48.55 N +ATOM 807 CA ARG A 101 64.117 29.485 0.954 1.00 46.11 C +ATOM 808 C ARG A 101 63.942 28.280 1.869 1.00 46.76 C +ATOM 809 O ARG A 101 63.730 28.404 3.070 1.00 46.72 O +ATOM 810 CB ARG A 101 65.023 30.519 1.582 1.00 44.38 C +ATOM 811 CG ARG A 101 66.369 29.965 1.950 1.00 44.08 C +ATOM 812 CD ARG A 101 67.474 30.758 1.325 1.00 43.72 C +ATOM 813 NE ARG A 101 68.692 30.761 2.130 1.00 42.48 N +ATOM 814 CZ ARG A 101 68.734 31.152 3.398 1.00 41.11 C +ATOM 815 NH1 ARG A 101 69.885 31.136 4.061 1.00 39.54 N +ATOM 816 NH2 ARG A 101 67.615 31.545 4.000 1.00 38.63 N +ATOM 817 N ILE A 102 64.018 27.110 1.254 1.00 47.33 N +ATOM 818 CA ILE A 102 63.810 25.813 1.881 1.00 47.50 C +ATOM 819 C ILE A 102 65.116 25.181 2.402 1.00 48.07 C +ATOM 820 O ILE A 102 66.055 24.974 1.648 1.00 49.06 O +ATOM 821 CB ILE A 102 63.081 24.900 0.816 1.00 46.64 C +ATOM 822 CG1 ILE A 102 61.718 25.506 0.477 1.00 47.42 C +ATOM 823 CG2 ILE A 102 62.864 23.518 1.311 1.00 48.21 C +ATOM 824 CD1 ILE A 102 61.025 24.880 -0.712 1.00 47.88 C +ATOM 825 N HIS A 103 65.186 24.895 3.699 1.00 48.52 N +ATOM 826 CA HIS A 103 66.384 24.277 4.255 1.00 48.79 C +ATOM 827 C HIS A 103 66.032 22.847 4.572 1.00 49.43 C +ATOM 828 O HIS A 103 65.032 22.598 5.233 1.00 50.56 O +ATOM 829 CB HIS A 103 66.817 24.910 5.582 1.00 49.15 C +ATOM 830 CG HIS A 103 67.098 26.381 5.525 1.00 48.90 C +ATOM 831 ND1 HIS A 103 68.267 26.926 6.018 1.00 47.59 N +ATOM 832 CD2 HIS A 103 66.316 27.427 5.162 1.00 48.01 C +ATOM 833 CE1 HIS A 103 68.184 28.243 5.969 1.00 48.21 C +ATOM 834 NE2 HIS A 103 67.011 28.573 5.456 1.00 47.13 N +ATOM 835 N ILE A 104 66.858 21.910 4.135 1.00 49.25 N +ATOM 836 CA ILE A 104 66.604 20.514 4.411 1.00 48.38 C +ATOM 837 C ILE A 104 67.753 19.866 5.170 1.00 50.74 C +ATOM 838 O ILE A 104 68.934 20.077 4.876 1.00 50.20 O +ATOM 839 CB ILE A 104 66.352 19.747 3.125 1.00 46.64 C +ATOM 840 CG1 ILE A 104 65.131 20.330 2.414 1.00 46.28 C +ATOM 841 CG2 ILE A 104 66.140 18.290 3.430 1.00 46.28 C +ATOM 842 CD1 ILE A 104 64.988 19.910 0.963 1.00 44.43 C +ATOM 843 N MET A 105 67.374 19.087 6.179 1.00 53.86 N +ATOM 844 CA MET A 105 68.297 18.350 7.038 1.00 55.47 C +ATOM 845 C MET A 105 67.872 16.888 7.033 1.00 56.17 C +ATOM 846 O MET A 105 67.099 16.467 7.886 1.00 57.69 O +ATOM 847 CB MET A 105 68.244 18.879 8.477 1.00 55.27 C +ATOM 848 CG MET A 105 69.175 18.160 9.441 1.00 56.87 C +ATOM 849 SD MET A 105 69.220 18.899 11.105 1.00 60.01 S +ATOM 850 CE MET A 105 70.889 19.519 11.153 1.00 58.43 C +ATOM 851 N PRO A 106 68.373 16.100 6.068 1.00 56.05 N +ATOM 852 CA PRO A 106 68.065 14.678 5.928 1.00 55.56 C +ATOM 853 C PRO A 106 68.295 13.817 7.186 1.00 55.88 C +ATOM 854 O PRO A 106 67.527 12.887 7.442 1.00 55.81 O +ATOM 855 CB PRO A 106 68.969 14.262 4.776 1.00 55.48 C +ATOM 856 CG PRO A 106 70.149 15.162 4.956 1.00 55.41 C +ATOM 857 CD PRO A 106 69.459 16.473 5.149 1.00 55.44 C +ATOM 858 N SER A 107 69.331 14.115 7.977 1.00 56.00 N +ATOM 859 CA SER A 107 69.588 13.298 9.173 1.00 56.22 C +ATOM 860 C SER A 107 70.272 13.922 10.437 1.00 57.11 C +ATOM 861 O SER A 107 71.506 13.886 10.571 1.00 58.07 O +ATOM 862 CB SER A 107 70.344 12.042 8.733 1.00 53.65 C +ATOM 863 OG SER A 107 70.809 11.324 9.845 1.00 52.91 O +ATOM 864 N MET A 108 69.451 14.450 11.365 1.00 56.19 N +ATOM 865 CA MET A 108 69.891 15.062 12.636 1.00 55.26 C +ATOM 866 C MET A 108 70.641 14.116 13.600 1.00 56.72 C +ATOM 867 O MET A 108 71.322 14.550 14.530 1.00 56.46 O +ATOM 868 CB MET A 108 68.677 15.656 13.363 1.00 52.70 C +ATOM 869 CG MET A 108 68.912 16.124 14.811 1.00 49.16 C +ATOM 870 SD MET A 108 67.452 16.988 15.481 1.00 47.23 S +ATOM 871 CE MET A 108 68.066 17.826 16.944 1.00 42.86 C +ATOM 872 N ASN A 109 70.510 12.820 13.380 1.00 58.44 N +ATOM 873 CA ASN A 109 71.165 11.831 14.225 1.00 60.35 C +ATOM 874 C ASN A 109 71.636 10.750 13.270 1.00 61.37 C +ATOM 875 O ASN A 109 70.948 9.755 13.028 1.00 61.38 O +ATOM 876 CB ASN A 109 70.176 11.247 15.250 1.00 60.36 C +ATOM 877 CG ASN A 109 70.720 10.015 15.982 1.00 61.05 C +ATOM 878 OD1 ASN A 109 69.961 9.313 16.651 1.00 60.44 O +ATOM 879 ND2 ASN A 109 72.029 9.754 15.862 1.00 60.17 N +ATOM 880 N PRO A 110 72.809 10.959 12.679 1.00 61.49 N +ATOM 881 CA PRO A 110 73.342 9.971 11.746 1.00 60.53 C +ATOM 882 C PRO A 110 74.105 8.849 12.443 1.00 60.31 C +ATOM 883 O PRO A 110 74.192 7.749 11.912 1.00 60.16 O +ATOM 884 CB PRO A 110 74.205 10.811 10.830 1.00 60.95 C +ATOM 885 CG PRO A 110 74.717 11.869 11.783 1.00 61.90 C +ATOM 886 CD PRO A 110 73.516 12.247 12.576 1.00 61.00 C +ATOM 887 N ASP A 111 74.655 9.105 13.629 1.00 59.91 N +ATOM 888 CA ASP A 111 75.370 8.033 14.330 1.00 60.16 C +ATOM 889 C ASP A 111 74.346 6.912 14.619 1.00 60.61 C +ATOM 890 O ASP A 111 74.648 5.710 14.538 1.00 60.19 O +ATOM 891 CB ASP A 111 75.937 8.498 15.678 1.00 60.16 C +ATOM 892 CG ASP A 111 76.531 9.871 15.634 1.00 60.41 C +ATOM 893 OD1 ASP A 111 76.152 10.654 14.733 1.00 61.24 O +ATOM 894 OD2 ASP A 111 77.355 10.164 16.528 1.00 58.43 O +ATOM 895 N GLY A 112 73.133 7.323 14.984 1.00 59.63 N +ATOM 896 CA GLY A 112 72.103 6.353 15.273 1.00 57.67 C +ATOM 897 C GLY A 112 71.821 5.524 14.042 1.00 56.20 C +ATOM 898 O GLY A 112 71.828 4.301 14.085 1.00 56.27 O +ATOM 899 N PHE A 113 71.580 6.198 12.931 1.00 55.13 N +ATOM 900 CA PHE A 113 71.293 5.502 11.705 1.00 54.61 C +ATOM 901 C PHE A 113 72.401 4.553 11.339 1.00 54.81 C +ATOM 902 O PHE A 113 72.160 3.370 11.114 1.00 55.96 O +ATOM 903 CB PHE A 113 71.117 6.466 10.560 1.00 55.45 C +ATOM 904 CG PHE A 113 71.109 5.792 9.232 1.00 56.97 C +ATOM 905 CD1 PHE A 113 69.975 5.125 8.785 1.00 56.28 C +ATOM 906 CD2 PHE A 113 72.259 5.764 8.449 1.00 57.73 C +ATOM 907 CE1 PHE A 113 69.983 4.436 7.581 1.00 56.05 C +ATOM 908 CE2 PHE A 113 72.274 5.073 7.238 1.00 58.17 C +ATOM 909 CZ PHE A 113 71.132 4.408 6.807 1.00 57.09 C +ATOM 910 N GLU A 114 73.618 5.068 11.253 1.00 54.08 N +ATOM 911 CA GLU A 114 74.738 4.220 10.889 1.00 54.76 C +ATOM 912 C GLU A 114 74.829 3.020 11.827 1.00 53.65 C +ATOM 913 O GLU A 114 74.998 1.883 11.395 1.00 54.41 O +ATOM 914 CB GLU A 114 76.050 5.003 10.949 1.00 57.69 C +ATOM 915 CG GLU A 114 75.975 6.415 10.395 1.00 62.74 C +ATOM 916 CD GLU A 114 75.707 6.471 8.896 1.00 66.09 C +ATOM 917 OE1 GLU A 114 75.115 7.494 8.453 1.00 66.74 O +ATOM 918 OE2 GLU A 114 76.097 5.512 8.171 1.00 66.91 O +ATOM 919 N ALA A 115 74.705 3.268 13.115 1.00 51.61 N +ATOM 920 CA ALA A 115 74.815 2.202 14.081 1.00 51.48 C +ATOM 921 C ALA A 115 74.123 0.884 13.761 1.00 52.02 C +ATOM 922 O ALA A 115 74.706 -0.184 13.966 1.00 51.85 O +ATOM 923 CB ALA A 115 74.344 2.700 15.412 1.00 53.64 C +ATOM 924 N VAL A 116 72.879 0.936 13.277 1.00 53.33 N +ATOM 925 CA VAL A 116 72.132 -0.306 12.997 1.00 52.90 C +ATOM 926 C VAL A 116 72.585 -0.980 11.725 1.00 52.94 C +ATOM 927 O VAL A 116 72.663 -0.352 10.663 1.00 52.23 O +ATOM 928 CB VAL A 116 70.590 -0.089 12.904 1.00 51.10 C +ATOM 929 CG1 VAL A 116 70.106 0.814 14.023 1.00 48.57 C +ATOM 930 CG2 VAL A 116 70.235 0.479 11.580 1.00 51.95 C +ATOM 931 N LYS A 117 72.895 -2.264 11.852 1.00 53.36 N +ATOM 932 CA LYS A 117 73.347 -3.060 10.726 1.00 53.49 C +ATOM 933 C LYS A 117 72.287 -4.089 10.337 1.00 54.08 C +ATOM 934 O LYS A 117 72.269 -4.570 9.200 1.00 54.63 O +ATOM 935 CB LYS A 117 74.665 -3.752 11.072 1.00 52.28 C +ATOM 936 CG LYS A 117 75.782 -2.805 11.516 1.00 53.75 C +ATOM 937 CD LYS A 117 75.804 -1.509 10.694 1.00 55.78 C +ATOM 938 CE LYS A 117 77.210 -1.083 10.243 1.00 56.41 C +ATOM 939 NZ LYS A 117 77.584 -1.617 8.876 1.00 56.13 N +ATOM 940 N LYS A 118 71.405 -4.409 11.285 1.00 54.60 N +ATOM 941 CA LYS A 118 70.325 -5.372 11.080 1.00 54.61 C +ATOM 942 C LYS A 118 68.996 -4.623 11.201 1.00 55.29 C +ATOM 943 O LYS A 118 68.412 -4.588 12.286 1.00 55.79 O +ATOM 944 CB LYS A 118 70.404 -6.472 12.133 1.00 99.99 C +ATOM 945 CG LYS A 118 71.638 -7.331 11.881 0.00 99.99 C +ATOM 946 CD LYS A 118 71.675 -8.474 12.889 0.00 99.99 C +ATOM 947 CE LYS A 118 72.948 -9.290 12.685 0.00 99.99 C +ATOM 948 NZ LYS A 118 72.962 -10.421 13.624 0.00 99.99 N +ATOM 949 N PRO A 119 68.504 -4.025 10.089 1.00 55.51 N +ATOM 950 CA PRO A 119 67.257 -3.244 9.950 1.00 56.00 C +ATOM 951 C PRO A 119 66.014 -3.901 10.556 1.00 55.71 C +ATOM 952 O PRO A 119 65.924 -5.122 10.593 1.00 56.87 O +ATOM 953 CB PRO A 119 67.147 -3.023 8.431 1.00 56.00 C +ATOM 954 CG PRO A 119 67.876 -4.181 7.855 1.00 56.79 C +ATOM 955 CD PRO A 119 69.083 -4.292 8.763 1.00 56.60 C +ATOM 956 N ASP A 120 65.044 -3.109 11.013 1.00 55.56 N +ATOM 957 CA ASP A 120 63.869 -3.697 11.674 1.00 55.35 C +ATOM 958 C ASP A 120 62.681 -2.734 11.954 1.00 53.59 C +ATOM 959 O ASP A 120 62.874 -1.551 12.173 1.00 55.38 O +ATOM 960 CB ASP A 120 64.374 -4.344 12.970 1.00 57.12 C +ATOM 961 CG ASP A 120 63.278 -4.921 13.796 1.00 59.08 C +ATOM 962 OD1 ASP A 120 62.784 -4.187 14.681 1.00 59.50 O +ATOM 963 OD2 ASP A 120 62.910 -6.098 13.552 1.00 60.51 O +ATOM 964 N CYS A 121 61.454 -3.234 11.982 1.00 50.85 N +ATOM 965 CA CYS A 121 60.319 -2.347 12.178 1.00 49.49 C +ATOM 966 C CYS A 121 60.003 -1.719 13.517 1.00 49.19 C +ATOM 967 O CYS A 121 59.505 -0.593 13.548 1.00 49.34 O +ATOM 968 CB CYS A 121 59.062 -3.012 11.681 1.00 49.61 C +ATOM 969 SG CYS A 121 59.055 -3.256 9.882 1.00 53.70 S +ATOM 970 N TYR A 122 60.252 -2.422 14.623 1.00 48.22 N +ATOM 971 CA TYR A 122 59.957 -1.844 15.929 1.00 46.00 C +ATOM 972 C TYR A 122 61.162 -1.501 16.838 1.00 45.65 C +ATOM 973 O TYR A 122 61.054 -0.563 17.628 1.00 46.95 O +ATOM 974 CB TYR A 122 58.974 -2.727 16.701 1.00 46.60 C +ATOM 975 CG TYR A 122 57.837 -3.344 15.899 1.00 44.83 C +ATOM 976 CD1 TYR A 122 58.053 -4.445 15.096 1.00 45.48 C +ATOM 977 CD2 TYR A 122 56.552 -2.827 15.958 1.00 43.66 C +ATOM 978 CE1 TYR A 122 57.025 -5.015 14.370 1.00 46.28 C +ATOM 979 CE2 TYR A 122 55.510 -3.387 15.234 1.00 43.43 C +ATOM 980 CZ TYR A 122 55.752 -4.477 14.440 1.00 45.90 C +ATOM 981 OH TYR A 122 54.743 -5.041 13.683 1.00 48.27 O +ATOM 982 N TYR A 123 62.297 -2.210 16.753 1.00 44.11 N +ATOM 983 CA TYR A 123 63.454 -1.873 17.621 1.00 43.40 C +ATOM 984 C TYR A 123 64.865 -1.994 17.021 1.00 43.91 C +ATOM 985 O TYR A 123 65.085 -2.738 16.087 1.00 43.78 O +ATOM 986 CB TYR A 123 63.449 -2.709 18.906 1.00 41.49 C +ATOM 987 CG TYR A 123 62.134 -2.792 19.643 1.00 41.32 C +ATOM 988 CD1 TYR A 123 61.263 -3.859 19.422 1.00 41.67 C +ATOM 989 CD2 TYR A 123 61.764 -1.819 20.582 1.00 40.70 C +ATOM 990 CE1 TYR A 123 60.051 -3.961 20.116 1.00 41.87 C +ATOM 991 CE2 TYR A 123 60.558 -1.915 21.289 1.00 40.32 C +ATOM 992 CZ TYR A 123 59.706 -2.992 21.050 1.00 42.11 C +ATOM 993 OH TYR A 123 58.524 -3.138 21.752 1.00 44.79 O +ATOM 994 N SER A 124 65.822 -1.261 17.587 1.00 46.41 N +ATOM 995 CA SER A 124 67.213 -1.300 17.121 1.00 49.83 C +ATOM 996 C SER A 124 68.245 -0.598 18.027 1.00 52.04 C +ATOM 997 O SER A 124 67.918 0.020 19.056 1.00 52.72 O +ATOM 998 CB SER A 124 67.348 -0.681 15.730 1.00 50.41 C +ATOM 999 OG SER A 124 67.436 0.748 15.812 1.00 51.49 O +ATOM 1000 N ILE A 125 69.499 -0.704 17.587 1.00 52.85 N +ATOM 1001 CA ILE A 125 70.662 -0.129 18.240 1.00 53.29 C +ATOM 1002 C ILE A 125 70.666 1.389 18.013 1.00 54.73 C +ATOM 1003 O ILE A 125 71.316 2.133 18.750 1.00 56.03 O +ATOM 1004 CB ILE A 125 71.948 -0.779 17.633 1.00 53.42 C +ATOM 1005 CG1 ILE A 125 72.180 -2.150 18.270 1.00 54.46 C +ATOM 1006 CG2 ILE A 125 73.161 0.142 17.766 1.00 53.19 C +ATOM 1007 CD1 ILE A 125 72.525 -2.133 19.770 1.00 53.95 C +ATOM 1008 N GLY A 126 69.947 1.841 16.982 1.00 55.07 N +ATOM 1009 CA GLY A 126 69.883 3.262 16.663 1.00 54.69 C +ATOM 1010 C GLY A 126 68.705 3.894 17.373 1.00 54.82 C +ATOM 1011 O GLY A 126 68.113 3.222 18.226 1.00 58.34 O +ATOM 1012 N ARG A 127 68.355 5.139 17.031 1.00 51.58 N +ATOM 1013 CA ARG A 127 67.247 5.865 17.663 1.00 48.76 C +ATOM 1014 C ARG A 127 67.831 6.962 18.521 1.00 48.68 C +ATOM 1015 O ARG A 127 67.737 8.148 18.180 1.00 49.66 O +ATOM 1016 CB ARG A 127 66.393 4.939 18.539 1.00 46.84 C +ATOM 1017 CG ARG A 127 65.677 5.598 19.692 1.00 46.43 C +ATOM 1018 CD ARG A 127 64.182 5.770 19.439 1.00 48.12 C +ATOM 1019 NE ARG A 127 63.500 6.444 20.546 1.00 46.78 N +ATOM 1020 CZ ARG A 127 62.289 6.984 20.456 1.00 47.50 C +ATOM 1021 NH1 ARG A 127 61.739 7.575 21.503 1.00 48.41 N +ATOM 1022 NH2 ARG A 127 61.624 6.944 19.313 1.00 47.66 N +ATOM 1023 N GLU A 128 68.425 6.543 19.637 1.00 47.86 N +ATOM 1024 CA GLU A 128 69.076 7.412 20.608 1.00 48.21 C +ATOM 1025 C GLU A 128 70.334 8.020 19.971 1.00 50.37 C +ATOM 1026 O GLU A 128 70.791 7.529 18.945 1.00 52.15 O +ATOM 1027 CB GLU A 128 69.505 6.574 21.806 1.00 48.18 C +ATOM 1028 CG GLU A 128 68.398 6.026 22.681 1.00 48.78 C +ATOM 1029 CD GLU A 128 67.717 4.722 22.205 1.00 50.38 C +ATOM 1030 OE1 GLU A 128 66.665 4.434 22.824 1.00 51.27 O +ATOM 1031 OE2 GLU A 128 68.181 3.985 21.282 1.00 46.69 O +ATOM 1032 N ASN A 129 70.901 9.078 20.549 1.00 51.88 N +ATOM 1033 CA ASN A 129 72.134 9.656 19.993 1.00 54.24 C +ATOM 1034 C ASN A 129 73.217 8.719 20.549 1.00 56.90 C +ATOM 1035 O ASN A 129 72.869 7.778 21.295 1.00 56.96 O +ATOM 1036 CB ASN A 129 72.319 11.119 20.446 1.00 53.62 C +ATOM 1037 CG ASN A 129 73.222 11.272 21.668 1.00 54.46 C +ATOM 1038 OD1 ASN A 129 73.077 10.574 22.681 1.00 55.47 O +ATOM 1039 ND2 ASN A 129 74.144 12.213 21.583 1.00 53.58 N +ATOM 1040 N TYR A 130 74.502 8.935 20.233 1.00 58.16 N +ATOM 1041 CA TYR A 130 75.513 7.975 20.717 1.00 59.33 C +ATOM 1042 C TYR A 130 75.634 7.785 22.228 1.00 59.09 C +ATOM 1043 O TYR A 130 76.172 6.779 22.689 1.00 57.62 O +ATOM 1044 CB TYR A 130 76.891 8.265 20.114 1.00 60.80 C +ATOM 1045 CG TYR A 130 77.977 7.303 20.584 1.00 62.24 C +ATOM 1046 CD1 TYR A 130 78.736 7.569 21.742 1.00 62.57 C +ATOM 1047 CD2 TYR A 130 78.223 6.114 19.892 1.00 63.08 C +ATOM 1048 CE1 TYR A 130 79.716 6.668 22.196 1.00 63.55 C +ATOM 1049 CE2 TYR A 130 79.197 5.197 20.334 1.00 64.78 C +ATOM 1050 CZ TYR A 130 79.942 5.478 21.485 1.00 65.14 C +ATOM 1051 OH TYR A 130 80.901 4.573 21.909 1.00 63.52 O +ATOM 1052 N ASN A 131 75.124 8.740 22.995 1.00 60.11 N +ATOM 1053 CA ASN A 131 75.162 8.642 24.445 1.00 61.19 C +ATOM 1054 C ASN A 131 73.852 8.076 24.975 1.00 61.54 C +ATOM 1055 O ASN A 131 73.488 8.316 26.127 1.00 62.37 O +ATOM 1056 CB ASN A 131 75.407 10.008 25.071 1.00 62.96 C +ATOM 1057 CG ASN A 131 76.636 10.668 24.531 1.00 63.16 C +ATOM 1058 OD1 ASN A 131 77.576 9.992 24.089 1.00 63.35 O +ATOM 1059 ND2 ASN A 131 76.655 11.994 24.569 1.00 63.20 N +ATOM 1060 N GLN A 132 73.143 7.348 24.112 1.00 60.95 N +ATOM 1061 CA GLN A 132 71.890 6.690 24.463 1.00 59.35 C +ATOM 1062 C GLN A 132 70.755 7.666 24.770 1.00 58.92 C +ATOM 1063 O GLN A 132 69.697 7.270 25.247 1.00 58.04 O +ATOM 1064 CB GLN A 132 72.115 5.751 25.664 1.00 57.84 C +ATOM 1065 CG GLN A 132 73.357 4.875 25.557 1.00 57.33 C +ATOM 1066 CD GLN A 132 73.337 3.711 26.531 1.00 59.17 C +ATOM 1067 OE1 GLN A 132 72.583 3.731 27.497 1.00 61.64 O +ATOM 1068 NE2 GLN A 132 74.169 2.695 26.288 1.00 58.83 N +ATOM 1069 N TYR A 133 70.953 8.943 24.496 1.00 58.66 N +ATOM 1070 CA TYR A 133 69.886 9.888 24.781 1.00 60.06 C +ATOM 1071 C TYR A 133 68.819 9.975 23.682 1.00 60.13 C +ATOM 1072 O TYR A 133 69.087 9.706 22.513 1.00 61.04 O +ATOM 1073 CB TYR A 133 70.476 11.259 24.997 1.00 61.17 C +ATOM 1074 CG TYR A 133 71.126 11.487 26.332 1.00 63.78 C +ATOM 1075 CD1 TYR A 133 70.357 11.750 27.457 1.00 64.59 C +ATOM 1076 CD2 TYR A 133 72.507 11.621 26.435 1.00 65.23 C +ATOM 1077 CE1 TYR A 133 70.938 12.171 28.647 1.00 65.10 C +ATOM 1078 CE2 TYR A 133 73.102 12.045 27.619 1.00 66.33 C +ATOM 1079 CZ TYR A 133 72.308 12.330 28.718 1.00 65.95 C +ATOM 1080 OH TYR A 133 72.873 12.869 29.852 1.00 65.31 O +ATOM 1081 N ASP A 134 67.597 10.342 24.051 1.00 59.97 N +ATOM 1082 CA ASP A 134 66.554 10.483 23.042 1.00 58.99 C +ATOM 1083 C ASP A 134 66.582 11.934 22.600 1.00 58.19 C +ATOM 1084 O ASP A 134 66.249 12.858 23.360 1.00 57.21 O +ATOM 1085 CB ASP A 134 65.175 10.161 23.602 1.00 61.07 C +ATOM 1086 CG ASP A 134 64.133 9.977 22.508 1.00 62.64 C +ATOM 1087 OD1 ASP A 134 64.164 10.745 21.509 1.00 62.81 O +ATOM 1088 OD2 ASP A 134 63.283 9.066 22.660 1.00 64.30 O +ATOM 1089 N LEU A 135 66.984 12.144 21.364 1.00 56.82 N +ATOM 1090 CA LEU A 135 67.063 13.496 20.896 1.00 56.29 C +ATOM 1091 C LEU A 135 65.743 14.250 20.902 1.00 55.75 C +ATOM 1092 O LEU A 135 65.747 15.473 20.788 1.00 56.77 O +ATOM 1093 CB LEU A 135 67.689 13.514 19.512 1.00 56.42 C +ATOM 1094 CG LEU A 135 69.203 13.377 19.576 1.00 55.18 C +ATOM 1095 CD1 LEU A 135 69.722 13.169 18.194 1.00 57.18 C +ATOM 1096 CD2 LEU A 135 69.818 14.611 20.186 1.00 54.50 C +ATOM 1097 N ASN A 136 64.610 13.563 21.020 1.00 53.18 N +ATOM 1098 CA ASN A 136 63.372 14.316 21.037 1.00 51.16 C +ATOM 1099 C ASN A 136 62.812 14.407 22.437 1.00 50.50 C +ATOM 1100 O ASN A 136 61.636 14.699 22.639 1.00 50.01 O +ATOM 1101 CB ASN A 136 62.336 13.731 20.085 1.00 51.06 C +ATOM 1102 CG ASN A 136 61.284 14.760 19.670 1.00 50.81 C +ATOM 1103 OD1 ASN A 136 61.568 15.714 18.945 1.00 50.84 O +ATOM 1104 ND2 ASN A 136 60.072 14.578 20.149 1.00 51.07 N +ATOM 1105 N ARG A 137 63.672 14.145 23.408 1.00 51.21 N +ATOM 1106 CA ARG A 137 63.308 14.239 24.817 1.00 53.00 C +ATOM 1107 C ARG A 137 64.400 15.100 25.463 1.00 53.20 C +ATOM 1108 O ARG A 137 64.436 15.266 26.676 1.00 52.57 O +ATOM 1109 CB ARG A 137 63.303 12.854 25.482 1.00 53.51 C +ATOM 1110 CG ARG A 137 62.277 11.873 24.949 1.00 55.90 C +ATOM 1111 CD ARG A 137 61.898 10.795 25.982 1.00 58.99 C +ATOM 1112 NE ARG A 137 63.051 10.108 26.585 1.00 63.30 N +ATOM 1113 CZ ARG A 137 62.993 8.986 27.321 1.00 65.25 C +ATOM 1114 NH1 ARG A 137 64.107 8.457 27.827 1.00 66.57 N +ATOM 1115 NH2 ARG A 137 61.836 8.368 27.547 1.00 66.04 N +ATOM 1116 N ASN A 138 65.249 15.679 24.613 1.00 53.75 N +ATOM 1117 CA ASN A 138 66.417 16.450 25.022 1.00 52.71 C +ATOM 1118 C ASN A 138 66.454 17.974 24.889 1.00 51.56 C +ATOM 1119 O ASN A 138 67.492 18.586 25.071 1.00 51.97 O +ATOM 1120 CB ASN A 138 67.632 15.836 24.312 1.00 54.35 C +ATOM 1121 CG ASN A 138 68.943 16.447 24.752 1.00 55.82 C +ATOM 1122 OD1 ASN A 138 69.053 16.958 25.865 1.00 57.02 O +ATOM 1123 ND2 ASN A 138 69.959 16.374 23.890 1.00 55.25 N +ATOM 1124 N PHE A 139 65.338 18.610 24.591 1.00 51.12 N +ATOM 1125 CA PHE A 139 65.356 20.069 24.482 1.00 50.02 C +ATOM 1126 C PHE A 139 64.750 20.707 25.740 1.00 50.07 C +ATOM 1127 O PHE A 139 64.140 20.042 26.559 1.00 48.46 O +ATOM 1128 CB PHE A 139 64.549 20.522 23.245 1.00 48.29 C +ATOM 1129 CG PHE A 139 65.227 20.249 21.913 1.00 46.51 C +ATOM 1130 CD1 PHE A 139 65.796 21.288 21.175 1.00 46.73 C +ATOM 1131 CD2 PHE A 139 65.280 18.965 21.388 1.00 45.00 C +ATOM 1132 CE1 PHE A 139 66.411 21.047 19.924 1.00 45.83 C +ATOM 1133 CE2 PHE A 139 65.888 18.719 20.146 1.00 45.55 C +ATOM 1134 CZ PHE A 139 66.455 19.762 19.410 1.00 44.30 C +ATOM 1135 N PRO A 140 64.960 22.009 25.931 1.00 51.65 N +ATOM 1136 CA PRO A 140 64.393 22.703 27.095 1.00 53.05 C +ATOM 1137 C PRO A 140 62.873 22.547 27.044 1.00 54.06 C +ATOM 1138 O PRO A 140 62.297 22.505 25.958 1.00 55.13 O +ATOM 1139 CB PRO A 140 64.812 24.145 26.860 1.00 51.10 C +ATOM 1140 CG PRO A 140 66.161 23.966 26.292 1.00 51.20 C +ATOM 1141 CD PRO A 140 66.038 22.807 25.330 1.00 51.17 C +ATOM 1142 N ASP A 141 62.215 22.481 28.193 1.00 55.20 N +ATOM 1143 CA ASP A 141 60.771 22.309 28.177 1.00 56.99 C +ATOM 1144 C ASP A 141 59.983 23.410 28.875 1.00 58.37 C +ATOM 1145 O ASP A 141 60.155 23.623 30.066 1.00 58.92 O +ATOM 1146 CB ASP A 141 60.395 20.972 28.799 1.00 55.63 C +ATOM 1147 CG ASP A 141 59.007 20.573 28.447 1.00 56.36 C +ATOM 1148 OD1 ASP A 141 58.859 20.007 27.351 1.00 58.17 O +ATOM 1149 OD2 ASP A 141 58.065 20.847 29.230 1.00 56.08 O +ATOM 1150 N ALA A 142 59.100 24.081 28.139 1.00 60.03 N +ATOM 1151 CA ALA A 142 58.291 25.168 28.695 1.00 61.97 C +ATOM 1152 C ALA A 142 57.303 24.678 29.750 1.00 63.60 C +ATOM 1153 O ALA A 142 56.488 25.453 30.258 1.00 63.60 O +ATOM 1154 CB ALA A 142 57.520 25.885 27.565 1.00 61.29 C +ATOM 1155 N PHE A 143 57.378 23.399 30.099 1.00 65.24 N +ATOM 1156 CA PHE A 143 56.426 22.863 31.058 1.00 66.78 C +ATOM 1157 C PHE A 143 56.955 22.274 32.377 1.00 68.03 C +ATOM 1158 O PHE A 143 56.322 22.430 33.416 1.00 68.35 O +ATOM 1159 CB PHE A 143 55.556 21.828 30.347 1.00 66.09 C +ATOM 1160 CG PHE A 143 54.819 22.365 29.137 1.00 65.09 C +ATOM 1161 CD1 PHE A 143 55.207 21.991 27.843 1.00 64.85 C +ATOM 1162 CD2 PHE A 143 53.699 23.188 29.290 1.00 63.23 C +ATOM 1163 CE1 PHE A 143 54.481 22.422 26.721 1.00 63.23 C +ATOM 1164 CE2 PHE A 143 52.968 23.624 28.181 1.00 61.44 C +ATOM 1165 CZ PHE A 143 53.357 23.239 26.897 1.00 62.60 C +ATOM 1166 N GLU A 144 58.107 21.618 32.349 1.00 69.91 N +ATOM 1167 CA GLU A 144 58.654 20.997 33.556 1.00 72.39 C +ATOM 1168 C GLU A 144 60.145 20.743 33.379 1.00 72.98 C +ATOM 1169 O GLU A 144 60.532 19.907 32.571 1.00 72.68 O +ATOM 1170 CB GLU A 144 57.954 19.664 33.775 1.00 74.60 C +ATOM 1171 CG GLU A 144 57.944 18.826 32.481 1.00 77.98 C +ATOM 1172 CD GLU A 144 57.398 17.418 32.652 1.00 79.75 C +ATOM 1173 OE1 GLU A 144 58.073 16.571 33.286 1.00 80.61 O +ATOM 1174 OE2 GLU A 144 56.286 17.160 32.143 1.00 81.18 O +ATOM 1175 N TYR A 145 60.983 21.432 34.140 1.00 74.12 N +ATOM 1176 CA TYR A 145 62.422 21.244 33.995 1.00 76.09 C +ATOM 1177 C TYR A 145 62.846 19.932 33.359 1.00 76.52 C +ATOM 1178 O TYR A 145 62.605 18.847 33.905 1.00 76.67 O +ATOM 1179 CB TYR A 145 63.135 21.374 35.332 1.00 76.99 C +ATOM 1180 CG TYR A 145 63.295 22.796 35.768 1.00 80.03 C +ATOM 1181 CD1 TYR A 145 62.350 23.404 36.604 1.00 80.12 C +ATOM 1182 CD2 TYR A 145 64.386 23.552 35.331 1.00 81.38 C +ATOM 1183 CE1 TYR A 145 62.488 24.729 37.001 1.00 80.50 C +ATOM 1184 CE2 TYR A 145 64.534 24.880 35.714 1.00 82.11 C +ATOM 1185 CZ TYR A 145 63.582 25.461 36.552 1.00 82.10 C +ATOM 1186 OH TYR A 145 63.744 26.767 36.951 1.00 82.89 O +ATOM 1187 N ASN A 146 63.471 20.038 32.191 1.00 76.28 N +ATOM 1188 CA ASN A 146 63.958 18.855 31.503 1.00 76.35 C +ATOM 1189 C ASN A 146 65.458 18.800 31.705 1.00 76.31 C +ATOM 1190 O ASN A 146 66.223 18.446 30.805 1.00 76.57 O +ATOM 1191 CB ASN A 146 63.671 18.909 30.009 1.00 76.32 C +ATOM 1192 CG ASN A 146 64.053 17.623 29.312 1.00 74.94 C +ATOM 1193 OD1 ASN A 146 64.451 17.624 28.148 1.00 73.82 O +ATOM 1194 ND2 ASN A 146 63.924 16.511 30.028 1.00 74.79 N +ATOM 1195 N ASN A 147 65.877 19.184 32.896 1.00 75.84 N +ATOM 1196 CA ASN A 147 67.284 19.160 33.230 1.00 74.93 C +ATOM 1197 C ASN A 147 67.866 17.841 32.698 1.00 72.22 C +ATOM 1198 O ASN A 147 67.586 16.763 33.225 1.00 72.97 O +ATOM 1199 CB ASN A 147 67.429 19.253 34.753 1.00 77.04 C +ATOM 1200 CG ASN A 147 66.795 18.073 35.462 1.00 79.45 C +ATOM 1201 OD1 ASN A 147 65.816 17.487 34.964 1.00 81.47 O +ATOM 1202 ND2 ASN A 147 67.340 17.710 36.626 1.00 80.01 N +ATOM 1203 N VAL A 148 68.638 17.920 31.625 1.00 68.12 N +ATOM 1204 CA VAL A 148 69.252 16.727 31.063 1.00 64.92 C +ATOM 1205 C VAL A 148 70.469 17.204 30.312 1.00 62.23 C +ATOM 1206 O VAL A 148 70.575 18.376 29.990 1.00 61.12 O +ATOM 1207 CB VAL A 148 68.305 15.969 30.079 1.00 64.99 C +ATOM 1208 CG1 VAL A 148 67.051 15.497 30.790 1.00 62.08 C +ATOM 1209 CG2 VAL A 148 67.942 16.864 28.925 1.00 65.90 C +ATOM 1210 N SER A 149 71.387 16.298 30.032 1.00 60.41 N +ATOM 1211 CA SER A 149 72.602 16.667 29.328 1.00 60.30 C +ATOM 1212 C SER A 149 72.278 17.080 27.887 1.00 60.48 C +ATOM 1213 O SER A 149 72.078 16.213 27.035 1.00 60.88 O +ATOM 1214 CB SER A 149 73.560 15.473 29.343 1.00 59.69 C +ATOM 1215 OG SER A 149 74.792 15.764 28.718 1.00 58.70 O +ATOM 1216 N ARG A 150 72.208 18.386 27.605 1.00 59.61 N +ATOM 1217 CA ARG A 150 71.906 18.830 26.234 1.00 58.82 C +ATOM 1218 C ARG A 150 72.983 18.218 25.367 1.00 57.76 C +ATOM 1219 O ARG A 150 74.164 18.340 25.675 1.00 59.06 O +ATOM 1220 CB ARG A 150 71.909 20.367 26.117 1.00 58.89 C +ATOM 1221 CG ARG A 150 70.544 21.029 26.344 1.00 59.18 C +ATOM 1222 CD ARG A 150 69.685 20.189 27.286 1.00 61.55 C +ATOM 1223 NE ARG A 150 68.455 20.819 27.756 1.00 63.97 N +ATOM 1224 CZ ARG A 150 68.401 22.012 28.355 1.00 66.80 C +ATOM 1225 NH1 ARG A 150 69.510 22.736 28.538 1.00 66.34 N +ATOM 1226 NH2 ARG A 150 67.245 22.459 28.845 1.00 67.29 N +ATOM 1227 N GLN A 151 72.578 17.547 24.296 1.00 55.81 N +ATOM 1228 CA GLN A 151 73.530 16.865 23.418 1.00 53.84 C +ATOM 1229 C GLN A 151 74.007 17.678 22.216 1.00 52.41 C +ATOM 1230 O GLN A 151 73.330 18.602 21.761 1.00 53.65 O +ATOM 1231 CB GLN A 151 72.910 15.556 22.925 1.00 53.36 C +ATOM 1232 CG GLN A 151 72.354 14.675 24.030 1.00 51.45 C +ATOM 1233 CD GLN A 151 73.422 14.115 24.960 1.00 49.05 C +ATOM 1234 OE1 GLN A 151 74.282 13.328 24.550 1.00 47.90 O +ATOM 1235 NE2 GLN A 151 73.357 14.508 26.221 1.00 46.12 N +ATOM 1236 N PRO A 152 75.169 17.313 21.662 1.00 49.93 N +ATOM 1237 CA PRO A 152 75.762 17.988 20.512 1.00 48.84 C +ATOM 1238 C PRO A 152 74.742 18.347 19.463 1.00 49.80 C +ATOM 1239 O PRO A 152 74.648 19.494 19.023 1.00 50.61 O +ATOM 1240 CB PRO A 152 76.736 16.964 19.981 1.00 47.79 C +ATOM 1241 CG PRO A 152 77.159 16.287 21.176 1.00 49.27 C +ATOM 1242 CD PRO A 152 75.879 16.059 21.928 1.00 49.59 C +ATOM 1243 N GLU A 153 73.968 17.354 19.057 1.00 50.53 N +ATOM 1244 CA GLU A 153 72.974 17.581 18.032 1.00 50.25 C +ATOM 1245 C GLU A 153 71.921 18.542 18.532 1.00 49.69 C +ATOM 1246 O GLU A 153 71.563 19.492 17.839 1.00 48.65 O +ATOM 1247 CB GLU A 153 72.345 16.264 17.613 1.00 49.73 C +ATOM 1248 CG GLU A 153 73.358 15.189 17.266 1.00 50.51 C +ATOM 1249 CD GLU A 153 73.899 14.482 18.502 1.00 51.18 C +ATOM 1250 OE1 GLU A 153 74.629 13.467 18.356 1.00 51.62 O +ATOM 1251 OE2 GLU A 153 73.586 14.948 19.619 1.00 51.10 O +ATOM 1252 N THR A 154 71.443 18.311 19.743 1.00 49.48 N +ATOM 1253 CA THR A 154 70.426 19.174 20.308 1.00 52.20 C +ATOM 1254 C THR A 154 70.896 20.621 20.288 1.00 53.69 C +ATOM 1255 O THR A 154 70.153 21.541 19.868 1.00 52.94 O +ATOM 1256 CB THR A 154 70.130 18.787 21.746 1.00 53.31 C +ATOM 1257 OG1 THR A 154 70.159 17.358 21.851 1.00 55.41 O +ATOM 1258 CG2 THR A 154 68.760 19.332 22.185 1.00 52.43 C +ATOM 1259 N VAL A 155 72.138 20.814 20.740 1.00 54.59 N +ATOM 1260 CA VAL A 155 72.731 22.144 20.794 1.00 55.95 C +ATOM 1261 C VAL A 155 72.935 22.721 19.361 1.00 57.64 C +ATOM 1262 O VAL A 155 72.455 23.827 19.055 1.00 58.07 O +ATOM 1263 CB VAL A 155 74.059 22.113 21.627 1.00 54.25 C +ATOM 1264 CG1 VAL A 155 75.279 21.850 20.735 1.00 54.51 C +ATOM 1265 CG2 VAL A 155 74.205 23.406 22.398 1.00 53.83 C +ATOM 1266 N ALA A 156 73.608 21.968 18.488 1.00 57.44 N +ATOM 1267 CA ALA A 156 73.832 22.404 17.117 1.00 57.53 C +ATOM 1268 C ALA A 156 72.550 23.025 16.606 1.00 58.08 C +ATOM 1269 O ALA A 156 72.524 24.169 16.153 1.00 58.63 O +ATOM 1270 CB ALA A 156 74.191 21.222 16.257 1.00 57.97 C +ATOM 1271 N VAL A 157 71.476 22.253 16.700 1.00 57.77 N +ATOM 1272 CA VAL A 157 70.173 22.709 16.252 1.00 57.05 C +ATOM 1273 C VAL A 157 69.685 23.946 16.985 1.00 55.71 C +ATOM 1274 O VAL A 157 69.193 24.878 16.362 1.00 54.54 O +ATOM 1275 CB VAL A 157 69.131 21.585 16.383 1.00 57.21 C +ATOM 1276 CG1 VAL A 157 67.753 22.062 15.906 1.00 55.50 C +ATOM 1277 CG2 VAL A 157 69.596 20.398 15.573 1.00 56.37 C +ATOM 1278 N MET A 158 69.808 23.980 18.300 1.00 55.33 N +ATOM 1279 CA MET A 158 69.342 25.180 18.989 1.00 57.06 C +ATOM 1280 C MET A 158 69.966 26.451 18.392 1.00 57.41 C +ATOM 1281 O MET A 158 69.245 27.417 18.074 1.00 56.87 O +ATOM 1282 CB MET A 158 69.615 25.071 20.485 1.00 56.13 C +ATOM 1283 CG MET A 158 68.697 24.056 21.133 1.00 56.65 C +ATOM 1284 SD MET A 158 69.148 23.580 22.791 1.00 56.37 S +ATOM 1285 CE MET A 158 68.066 24.588 23.664 1.00 55.98 C +ATOM 1286 N LYS A 159 71.293 26.432 18.217 1.00 57.17 N +ATOM 1287 CA LYS A 159 72.014 27.561 17.632 1.00 56.22 C +ATOM 1288 C LYS A 159 71.498 27.771 16.222 1.00 56.31 C +ATOM 1289 O LYS A 159 71.094 28.880 15.869 1.00 56.98 O +ATOM 1290 CB LYS A 159 73.527 27.302 17.577 1.00 55.26 C +ATOM 1291 CG LYS A 159 74.338 28.462 17.020 0.00 55.89 C +ATOM 1292 CD LYS A 159 75.834 28.180 17.080 0.00 55.99 C +ATOM 1293 CE LYS A 159 76.314 28.014 18.515 0.00 56.16 C +ATOM 1294 NZ LYS A 159 77.777 27.748 18.586 0.00 56.23 N +ATOM 1295 N TRP A 160 71.503 26.699 15.425 1.00 54.75 N +ATOM 1296 CA TRP A 160 71.044 26.771 14.045 1.00 53.02 C +ATOM 1297 C TRP A 160 69.683 27.424 13.993 1.00 52.10 C +ATOM 1298 O TRP A 160 69.400 28.229 13.123 1.00 50.94 O +ATOM 1299 CB TRP A 160 70.985 25.368 13.444 1.00 54.07 C +ATOM 1300 CG TRP A 160 70.387 25.284 12.057 1.00 55.16 C +ATOM 1301 CD1 TRP A 160 70.654 26.092 10.985 1.00 54.97 C +ATOM 1302 CD2 TRP A 160 69.386 24.351 11.616 1.00 55.34 C +ATOM 1303 NE1 TRP A 160 69.874 25.726 9.908 1.00 54.81 N +ATOM 1304 CE2 TRP A 160 69.090 24.658 10.270 1.00 55.74 C +ATOM 1305 CE3 TRP A 160 68.705 23.286 12.231 1.00 53.21 C +ATOM 1306 CZ2 TRP A 160 68.138 23.932 9.529 1.00 54.98 C +ATOM 1307 CZ3 TRP A 160 67.764 22.575 11.496 1.00 52.34 C +ATOM 1308 CH2 TRP A 160 67.490 22.899 10.163 1.00 52.79 C +ATOM 1309 N LEU A 161 68.840 27.085 14.951 1.00 52.30 N +ATOM 1310 CA LEU A 161 67.512 27.644 14.981 1.00 53.00 C +ATOM 1311 C LEU A 161 67.615 29.111 15.250 1.00 53.92 C +ATOM 1312 O LEU A 161 66.650 29.853 15.067 1.00 55.13 O +ATOM 1313 CB LEU A 161 66.672 26.985 16.063 1.00 52.81 C +ATOM 1314 CG LEU A 161 65.405 26.351 15.485 1.00 52.98 C +ATOM 1315 CD1 LEU A 161 65.812 25.213 14.536 1.00 52.61 C +ATOM 1316 CD2 LEU A 161 64.503 25.844 16.605 1.00 51.96 C +ATOM 1317 N LYS A 162 68.794 29.525 15.692 1.00 54.77 N +ATOM 1318 CA LYS A 162 69.052 30.921 16.003 1.00 55.70 C +ATOM 1319 C LYS A 162 69.574 31.630 14.765 1.00 56.11 C +ATOM 1320 O LYS A 162 69.332 32.814 14.563 1.00 56.73 O +ATOM 1321 CB LYS A 162 70.082 31.026 17.123 1.00 56.25 C +ATOM 1322 CG LYS A 162 69.592 30.602 18.496 1.00 57.81 C +ATOM 1323 CD LYS A 162 70.721 30.732 19.537 1.00 59.63 C +ATOM 1324 CE LYS A 162 70.204 30.757 20.985 1.00 61.50 C +ATOM 1325 NZ LYS A 162 69.204 31.866 21.260 1.00 62.60 N +ATOM 1326 N THR A 163 70.280 30.892 13.925 1.00 56.52 N +ATOM 1327 CA THR A 163 70.853 31.451 12.705 1.00 56.62 C +ATOM 1328 C THR A 163 69.846 32.035 11.700 1.00 54.67 C +ATOM 1329 O THR A 163 70.210 32.857 10.877 1.00 54.67 O +ATOM 1330 CB THR A 163 71.700 30.388 11.973 1.00 59.13 C +ATOM 1331 OG1 THR A 163 70.848 29.533 11.188 1.00 60.84 O +ATOM 1332 CG2 THR A 163 72.453 29.535 12.992 1.00 59.90 C +ATOM 1333 N GLU A 164 68.594 31.614 11.734 1.00 52.54 N +ATOM 1334 CA GLU A 164 67.653 32.174 10.785 1.00 52.33 C +ATOM 1335 C GLU A 164 66.261 32.385 11.368 1.00 51.09 C +ATOM 1336 O GLU A 164 65.878 31.794 12.380 1.00 51.45 O +ATOM 1337 CB GLU A 164 67.557 31.287 9.539 1.00 53.84 C +ATOM 1338 CG GLU A 164 67.770 32.025 8.214 1.00 56.74 C +ATOM 1339 CD GLU A 164 69.041 31.546 7.470 1.00 60.08 C +ATOM 1340 OE1 GLU A 164 69.353 32.098 6.388 1.00 60.55 O +ATOM 1341 OE2 GLU A 164 69.737 30.617 7.961 1.00 60.22 O +ATOM 1342 N THR A 165 65.496 33.240 10.723 1.00 48.40 N +ATOM 1343 CA THR A 165 64.169 33.481 11.197 1.00 47.68 C +ATOM 1344 C THR A 165 63.244 32.447 10.577 1.00 48.87 C +ATOM 1345 O THR A 165 62.434 32.754 9.682 1.00 51.24 O +ATOM 1346 CB THR A 165 63.734 34.866 10.820 1.00 47.65 C +ATOM 1347 OG1 THR A 165 64.658 35.793 11.399 1.00 49.49 O +ATOM 1348 CG2 THR A 165 62.300 35.145 11.316 1.00 46.89 C +ATOM 1349 N PHE A 166 63.369 31.210 11.047 1.00 47.09 N +ATOM 1350 CA PHE A 166 62.539 30.142 10.543 1.00 44.97 C +ATOM 1351 C PHE A 166 61.084 30.385 10.861 1.00 44.54 C +ATOM 1352 O PHE A 166 60.726 30.652 12.000 1.00 44.65 O +ATOM 1353 CB PHE A 166 63.005 28.842 11.135 1.00 45.70 C +ATOM 1354 CG PHE A 166 64.359 28.460 10.689 1.00 44.91 C +ATOM 1355 CD1 PHE A 166 65.415 28.458 11.575 1.00 44.68 C +ATOM 1356 CD2 PHE A 166 64.574 28.087 9.367 1.00 44.63 C +ATOM 1357 CE1 PHE A 166 66.673 28.080 11.153 1.00 46.59 C +ATOM 1358 CE2 PHE A 166 65.809 27.711 8.935 1.00 44.98 C +ATOM 1359 CZ PHE A 166 66.872 27.703 9.827 1.00 46.43 C +ATOM 1360 N VAL A 167 60.250 30.301 9.833 1.00 44.85 N +ATOM 1361 CA VAL A 167 58.829 30.545 9.970 1.00 44.27 C +ATOM 1362 C VAL A 167 58.031 29.297 10.128 1.00 44.16 C +ATOM 1363 O VAL A 167 57.185 29.243 11.020 1.00 44.88 O +ATOM 1364 CB VAL A 167 58.248 31.306 8.755 1.00 45.30 C +ATOM 1365 CG1 VAL A 167 56.689 31.211 8.750 1.00 43.95 C +ATOM 1366 CG2 VAL A 167 58.688 32.788 8.810 1.00 45.59 C +ATOM 1367 N LEU A 168 58.268 28.320 9.247 1.00 43.25 N +ATOM 1368 CA LEU A 168 57.536 27.048 9.276 1.00 42.39 C +ATOM 1369 C LEU A 168 58.415 25.837 9.178 1.00 41.73 C +ATOM 1370 O LEU A 168 59.319 25.782 8.336 1.00 41.92 O +ATOM 1371 CB LEU A 168 56.508 26.988 8.161 1.00 43.82 C +ATOM 1372 CG LEU A 168 55.735 25.673 8.017 1.00 45.91 C +ATOM 1373 CD1 LEU A 168 55.206 25.165 9.360 1.00 46.79 C +ATOM 1374 CD2 LEU A 168 54.586 25.918 7.041 1.00 46.71 C +ATOM 1375 N SER A 169 58.126 24.849 10.021 1.00 40.70 N +ATOM 1376 CA SER A 169 58.939 23.637 10.066 1.00 41.49 C +ATOM 1377 C SER A 169 58.159 22.312 10.143 1.00 43.19 C +ATOM 1378 O SER A 169 56.934 22.277 9.954 1.00 44.36 O +ATOM 1379 CB SER A 169 59.915 23.748 11.248 1.00 37.25 C +ATOM 1380 OG SER A 169 60.757 22.622 11.324 1.00 33.30 O +ATOM 1381 N ALA A 170 58.896 21.227 10.397 1.00 43.59 N +ATOM 1382 CA ALA A 170 58.319 19.895 10.555 1.00 43.26 C +ATOM 1383 C ALA A 170 59.429 18.852 10.588 1.00 44.06 C +ATOM 1384 O ALA A 170 60.151 18.694 9.593 1.00 45.50 O +ATOM 1385 CB ALA A 170 57.376 19.608 9.437 1.00 42.36 C +ATOM 1386 N ASN A 171 59.578 18.154 11.722 1.00 43.08 N +ATOM 1387 CA ASN A 171 60.621 17.130 11.865 1.00 43.62 C +ATOM 1388 C ASN A 171 60.026 15.735 11.622 1.00 43.64 C +ATOM 1389 O ASN A 171 59.080 15.326 12.281 1.00 44.62 O +ATOM 1390 CB ASN A 171 61.306 17.237 13.243 1.00 43.80 C +ATOM 1391 CG ASN A 171 60.489 16.623 14.357 1.00 46.25 C +ATOM 1392 OD1 ASN A 171 60.394 15.398 14.468 1.00 46.60 O +ATOM 1393 ND2 ASN A 171 59.886 17.468 15.193 1.00 46.32 N +ATOM 1394 N LEU A 172 60.593 15.013 10.656 1.00 43.79 N +ATOM 1395 CA LEU A 172 60.083 13.711 10.246 1.00 42.24 C +ATOM 1396 C LEU A 172 60.448 12.514 11.107 1.00 43.92 C +ATOM 1397 O LEU A 172 61.589 12.408 11.588 1.00 45.28 O +ATOM 1398 CB LEU A 172 60.476 13.467 8.791 1.00 39.22 C +ATOM 1399 CG LEU A 172 60.186 14.631 7.822 1.00 37.01 C +ATOM 1400 CD1 LEU A 172 60.207 14.096 6.415 1.00 37.55 C +ATOM 1401 CD2 LEU A 172 58.859 15.256 8.069 1.00 35.13 C +ATOM 1402 N HIS A 173 59.459 11.622 11.286 1.00 44.18 N +ATOM 1403 CA HIS A 173 59.567 10.395 12.100 1.00 44.75 C +ATOM 1404 C HIS A 173 58.903 9.175 11.473 1.00 44.54 C +ATOM 1405 O HIS A 173 58.088 9.295 10.560 1.00 45.37 O +ATOM 1406 CB HIS A 173 58.883 10.584 13.463 1.00 45.49 C +ATOM 1407 CG HIS A 173 59.651 11.425 14.432 1.00 45.82 C +ATOM 1408 ND1 HIS A 173 60.629 10.910 15.254 1.00 46.04 N +ATOM 1409 CD2 HIS A 173 59.578 12.748 14.716 1.00 45.40 C +ATOM 1410 CE1 HIS A 173 61.124 11.880 16.004 1.00 47.69 C +ATOM 1411 NE2 HIS A 173 60.502 13.006 15.696 1.00 46.67 N +ATOM 1412 N GLY A 174 59.228 8.007 12.021 1.00 43.71 N +ATOM 1413 CA GLY A 174 58.632 6.756 11.579 1.00 43.90 C +ATOM 1414 C GLY A 174 58.243 5.910 12.794 1.00 44.65 C +ATOM 1415 O GLY A 174 58.843 6.035 13.866 1.00 45.64 O +ATOM 1416 N GLY A 175 57.252 5.040 12.642 1.00 43.91 N +ATOM 1417 CA GLY A 175 56.818 4.205 13.756 1.00 43.96 C +ATOM 1418 C GLY A 175 55.302 4.245 13.936 1.00 43.92 C +ATOM 1419 O GLY A 175 54.685 3.462 14.677 1.00 43.27 O +ATOM 1420 N ALA A 176 54.708 5.198 13.243 1.00 42.87 N +ATOM 1421 CA ALA A 176 53.288 5.389 13.264 1.00 43.05 C +ATOM 1422 C ALA A 176 53.093 6.116 11.960 1.00 43.77 C +ATOM 1423 O ALA A 176 54.060 6.472 11.293 1.00 44.52 O +ATOM 1424 CB ALA A 176 52.881 6.264 14.432 1.00 42.69 C +ATOM 1425 N LEU A 177 51.845 6.343 11.600 1.00 43.33 N +ATOM 1426 CA LEU A 177 51.532 7.011 10.370 1.00 41.87 C +ATOM 1427 C LEU A 177 50.487 8.059 10.741 1.00 43.26 C +ATOM 1428 O LEU A 177 49.284 7.818 10.645 1.00 44.50 O +ATOM 1429 CB LEU A 177 50.979 5.981 9.403 1.00 40.73 C +ATOM 1430 CG LEU A 177 50.816 6.422 7.969 1.00 41.97 C +ATOM 1431 CD1 LEU A 177 52.188 6.679 7.375 1.00 42.56 C +ATOM 1432 CD2 LEU A 177 50.089 5.355 7.196 1.00 41.53 C +ATOM 1433 N VAL A 178 50.953 9.220 11.198 1.00 43.61 N +ATOM 1434 CA VAL A 178 50.066 10.318 11.595 1.00 41.30 C +ATOM 1435 C VAL A 178 50.883 11.610 11.647 1.00 41.21 C +ATOM 1436 O VAL A 178 52.119 11.580 11.697 1.00 41.01 O +ATOM 1437 CB VAL A 178 49.477 10.065 12.986 1.00 40.03 C +ATOM 1438 CG1 VAL A 178 50.610 9.904 13.972 1.00 39.71 C +ATOM 1439 CG2 VAL A 178 48.578 11.212 13.415 1.00 37.48 C +ATOM 1440 N ALA A 179 50.182 12.737 11.638 1.00 39.66 N +ATOM 1441 CA ALA A 179 50.800 14.043 11.693 1.00 38.29 C +ATOM 1442 C ALA A 179 50.436 14.647 13.024 1.00 38.60 C +ATOM 1443 O ALA A 179 49.300 15.068 13.201 1.00 37.98 O +ATOM 1444 CB ALA A 179 50.260 14.900 10.595 1.00 38.53 C +ATOM 1445 N SER A 180 51.401 14.737 13.936 1.00 39.43 N +ATOM 1446 CA SER A 180 51.146 15.263 15.278 1.00 42.52 C +ATOM 1447 C SER A 180 51.470 16.751 15.476 1.00 45.02 C +ATOM 1448 O SER A 180 52.595 17.170 15.205 1.00 46.70 O +ATOM 1449 CB SER A 180 51.947 14.437 16.274 1.00 41.95 C +ATOM 1450 OG SER A 180 51.433 14.569 17.573 1.00 42.67 O +ATOM 1451 N TYR A 181 50.512 17.553 15.955 1.00 45.40 N +ATOM 1452 CA TYR A 181 50.794 18.982 16.161 1.00 46.55 C +ATOM 1453 C TYR A 181 50.931 19.278 17.662 1.00 48.14 C +ATOM 1454 O TYR A 181 50.575 18.433 18.468 1.00 50.22 O +ATOM 1455 CB TYR A 181 49.720 19.857 15.492 1.00 45.66 C +ATOM 1456 CG TYR A 181 48.309 19.700 15.998 1.00 46.35 C +ATOM 1457 CD1 TYR A 181 47.468 18.682 15.527 1.00 47.40 C +ATOM 1458 CD2 TYR A 181 47.785 20.619 16.903 1.00 46.45 C +ATOM 1459 CE1 TYR A 181 46.105 18.601 15.953 1.00 47.51 C +ATOM 1460 CE2 TYR A 181 46.452 20.554 17.333 1.00 47.54 C +ATOM 1461 CZ TYR A 181 45.602 19.554 16.857 1.00 47.66 C +ATOM 1462 OH TYR A 181 44.265 19.580 17.252 1.00 42.99 O +ATOM 1463 N PRO A 182 51.442 20.463 18.058 1.00 64.03 N +ATOM 1464 CA PRO A 182 51.616 20.790 19.476 1.00 64.03 C +ATOM 1465 C PRO A 182 50.432 21.078 20.357 1.00 64.03 C +ATOM 1466 O PRO A 182 49.358 21.339 19.862 1.00 64.03 O +ATOM 1467 CB PRO A 182 52.531 21.987 19.405 1.00 64.03 C +ATOM 1468 CG PRO A 182 53.407 21.630 18.400 1.00 64.03 C +ATOM 1469 CD PRO A 182 52.472 21.182 17.302 1.00 64.03 C +ATOM 1470 N PHE A 183 50.644 21.147 21.671 1.00 64.03 N +ATOM 1471 CA PHE A 183 51.946 20.965 22.296 1.00 64.03 C +ATOM 1472 C PHE A 183 52.114 19.482 22.572 1.00 64.03 C +ATOM 1473 O PHE A 183 51.140 18.747 22.672 1.00 64.03 O +ATOM 1474 CB PHE A 183 52.034 21.746 23.615 1.00 64.03 C +ATOM 1475 CG PHE A 183 52.008 23.252 23.476 1.00 64.03 C +ATOM 1476 CD1 PHE A 183 50.837 23.966 23.669 1.00 64.03 C +ATOM 1477 CD2 PHE A 183 53.169 23.960 23.244 1.00 64.03 C +ATOM 1478 CE1 PHE A 183 50.834 25.334 23.643 1.00 64.03 C +ATOM 1479 CE2 PHE A 183 53.180 25.322 23.215 1.00 64.03 C +ATOM 1480 CZ PHE A 183 52.012 26.017 23.416 1.00 64.03 C +ATOM 1481 N ASP A 184 53.347 19.011 22.648 1.00 65.10 N +ATOM 1482 CA ASP A 184 53.558 17.601 22.913 1.00 64.43 C +ATOM 1483 C ASP A 184 53.536 17.381 24.404 1.00 63.11 C +ATOM 1484 O ASP A 184 53.494 16.253 24.871 1.00 63.46 O +ATOM 1485 CB ASP A 184 54.893 17.150 22.324 1.00 65.82 C +ATOM 1486 CG ASP A 184 54.892 17.171 20.810 1.00 66.08 C +ATOM 1487 OD1 ASP A 184 55.988 16.996 20.228 1.00 67.63 O +ATOM 1488 OD2 ASP A 184 53.802 17.355 20.213 1.00 63.85 O +ATOM 1489 N ASN A 185 53.568 18.476 25.147 1.00 61.96 N +ATOM 1490 CA ASN A 185 53.541 18.419 26.595 1.00 61.74 C +ATOM 1491 C ASN A 185 52.500 19.424 27.038 1.00 61.49 C +ATOM 1492 O ASN A 185 52.137 20.311 26.283 1.00 60.37 O +ATOM 1493 CB ASN A 185 54.912 18.790 27.152 1.00 62.52 C +ATOM 1494 CG ASN A 185 55.055 18.474 28.630 1.00 62.34 C +ATOM 1495 OD1 ASN A 185 56.123 18.672 29.233 1.00 60.71 O +ATOM 1496 ND2 ASN A 185 53.978 17.979 29.225 1.00 63.89 N +ATOM 1497 N GLY A 186 52.013 19.300 28.263 1.00 62.92 N +ATOM 1498 CA GLY A 186 51.002 20.241 28.716 1.00 64.18 C +ATOM 1499 C GLY A 186 50.868 20.494 30.204 1.00 64.13 C +ATOM 1500 O GLY A 186 51.632 19.990 31.025 1.00 64.39 O +ATOM 1501 N VAL A 187 49.864 21.287 30.537 1.00 64.18 N +ATOM 1502 CA VAL A 187 49.591 21.663 31.906 1.00 65.48 C +ATOM 1503 C VAL A 187 48.098 21.894 31.980 1.00 66.11 C +ATOM 1504 O VAL A 187 47.477 22.200 30.959 1.00 65.16 O +ATOM 1505 CB VAL A 187 50.318 22.978 32.262 1.00 65.65 C +ATOM 1506 CG1 VAL A 187 49.768 23.562 33.571 1.00 68.24 C +ATOM 1507 CG2 VAL A 187 51.803 22.714 32.389 1.00 65.52 C +ATOM 1508 N GLN A 188 47.526 21.750 33.181 1.00 66.53 N +ATOM 1509 CA GLN A 188 46.086 21.951 33.386 1.00 66.08 C +ATOM 1510 C GLN A 188 45.575 23.226 32.669 1.00 64.75 C +ATOM 1511 O GLN A 188 44.480 23.219 32.082 1.00 63.14 O +ATOM 1512 CB GLN A 188 45.789 22.093 34.875 1.00 99.99 C +ATOM 1513 CG GLN A 188 44.338 21.709 35.144 0.00 99.99 C +ATOM 1514 CD GLN A 188 43.407 22.890 34.914 0.00 99.99 C +ATOM 1515 OE1 GLN A 188 43.855 23.978 34.557 0.00 99.99 O +ATOM 1516 NE2 GLN A 188 42.105 22.674 35.119 0.00 99.99 N +ATOM 1517 N ALA A 189 46.388 24.291 32.706 1.00 62.38 N +ATOM 1518 CA ALA A 189 46.062 25.571 32.083 1.00 60.25 C +ATOM 1519 C ALA A 189 45.838 25.412 30.598 1.00 59.86 C +ATOM 1520 O ALA A 189 45.108 26.179 29.986 1.00 59.00 O +ATOM 1521 CB ALA A 189 47.171 26.566 32.328 1.00 58.76 C +ATOM 1522 N THR A 190 46.484 24.407 30.023 1.00 60.89 N +ATOM 1523 CA THR A 190 46.368 24.115 28.599 1.00 61.41 C +ATOM 1524 C THR A 190 45.354 22.988 28.421 1.00 62.68 C +ATOM 1525 O THR A 190 44.965 22.665 27.296 1.00 62.55 O +ATOM 1526 CB THR A 190 47.718 23.643 28.003 1.00 61.15 C +ATOM 1527 OG1 THR A 190 48.725 24.647 28.179 1.00 59.59 O +ATOM 1528 CG2 THR A 190 47.569 23.387 26.542 1.00 62.16 C +ATOM 1529 N GLY A 191 44.957 22.379 29.545 1.00 64.33 N +ATOM 1530 CA GLY A 191 43.977 21.294 29.541 1.00 64.30 C +ATOM 1531 C GLY A 191 44.518 19.876 29.520 1.00 63.31 C +ATOM 1532 O GLY A 191 44.037 19.035 28.757 1.00 61.36 O +ATOM 1533 N ALA A 192 45.504 19.601 30.368 1.00 63.55 N +ATOM 1534 CA ALA A 192 46.100 18.274 30.412 1.00 64.87 C +ATOM 1535 C ALA A 192 45.096 17.265 30.900 1.00 66.11 C +ATOM 1536 O ALA A 192 45.204 16.077 30.593 1.00 66.84 O +ATOM 1537 CB ALA A 192 47.301 18.261 31.309 1.00 64.49 C +ATOM 1538 N LEU A 193 44.110 17.745 31.654 1.00 67.05 N +ATOM 1539 CA LEU A 193 43.075 16.874 32.202 1.00 67.38 C +ATOM 1540 C LEU A 193 42.042 16.418 31.157 1.00 68.06 C +ATOM 1541 O LEU A 193 41.210 15.540 31.421 1.00 68.11 O +ATOM 1542 CB LEU A 193 42.388 17.558 33.398 1.00 66.75 C +ATOM 1543 CG LEU A 193 43.217 17.713 34.685 1.00 65.53 C +ATOM 1544 CD1 LEU A 193 43.973 16.414 34.985 1.00 64.99 C +ATOM 1545 CD2 LEU A 193 44.198 18.860 34.538 1.00 65.61 C +ATOM 1546 N TYR A 194 42.088 17.019 29.971 1.00 68.56 N +ATOM 1547 CA TYR A 194 41.182 16.614 28.906 1.00 67.93 C +ATOM 1548 C TYR A 194 41.994 15.812 27.930 1.00 67.42 C +ATOM 1549 O TYR A 194 41.508 15.356 26.888 1.00 66.77 O +ATOM 1550 CB TYR A 194 40.569 17.822 28.233 1.00 68.16 C +ATOM 1551 CG TYR A 194 39.515 18.426 29.101 1.00 68.96 C +ATOM 1552 CD1 TYR A 194 39.842 19.410 30.038 1.00 69.09 C +ATOM 1553 CD2 TYR A 194 38.196 17.955 29.050 1.00 68.42 C +ATOM 1554 CE1 TYR A 194 38.882 19.916 30.914 1.00 69.79 C +ATOM 1555 CE2 TYR A 194 37.229 18.446 29.917 1.00 70.26 C +ATOM 1556 CZ TYR A 194 37.580 19.429 30.857 1.00 70.23 C +ATOM 1557 OH TYR A 194 36.645 19.884 31.768 1.00 70.41 O +ATOM 1558 N SER A 195 43.252 15.630 28.310 1.00 67.00 N +ATOM 1559 CA SER A 195 44.170 14.878 27.503 1.00 66.73 C +ATOM 1560 C SER A 195 44.333 15.676 26.219 1.00 66.27 C +ATOM 1561 O SER A 195 44.244 15.149 25.113 1.00 66.59 O +ATOM 1562 CB SER A 195 43.588 13.486 27.241 1.00 66.66 C +ATOM 1563 OG SER A 195 43.341 12.823 28.473 1.00 66.56 O +ATOM 1564 N ARG A 196 44.555 16.970 26.386 1.00 64.81 N +ATOM 1565 CA ARG A 196 44.746 17.841 25.252 1.00 63.85 C +ATOM 1566 C ARG A 196 45.527 19.045 25.735 1.00 63.75 C +ATOM 1567 O ARG A 196 45.241 19.595 26.805 1.00 63.74 O +ATOM 1568 CB ARG A 196 43.396 18.285 24.679 1.00 63.75 C +ATOM 1569 CG ARG A 196 42.884 19.615 25.205 1.00 63.92 C +ATOM 1570 CD ARG A 196 41.523 19.985 24.614 1.00 66.01 C +ATOM 1571 NE ARG A 196 40.403 19.249 25.209 1.00 66.69 N +ATOM 1572 CZ ARG A 196 39.130 19.434 24.877 0.00 66.65 C +ATOM 1573 NH1 ARG A 196 38.807 20.330 23.954 0.00 66.75 N +ATOM 1574 NH2 ARG A 196 38.178 18.725 25.468 0.00 66.75 N +ATOM 1575 N SER A 197 46.534 19.428 24.954 1.00 62.57 N +ATOM 1576 CA SER A 197 47.364 20.589 25.257 1.00 60.01 C +ATOM 1577 C SER A 197 47.299 21.482 24.029 1.00 57.74 C +ATOM 1578 O SER A 197 47.930 21.217 23.016 1.00 56.15 O +ATOM 1579 CB SER A 197 48.816 20.169 25.545 1.00 60.87 C +ATOM 1580 OG SER A 197 49.596 21.255 26.046 1.00 59.52 O +ATOM 1581 N LEU A 198 46.525 22.548 24.128 1.00 56.57 N +ATOM 1582 CA LEU A 198 46.373 23.442 23.000 1.00 56.17 C +ATOM 1583 C LEU A 198 47.247 24.714 22.975 1.00 55.68 C +ATOM 1584 O LEU A 198 47.616 25.261 24.021 1.00 53.69 O +ATOM 1585 CB LEU A 198 44.881 23.772 22.847 1.00 53.85 C +ATOM 1586 CG LEU A 198 44.077 22.484 22.621 1.00 51.85 C +ATOM 1587 CD1 LEU A 198 42.690 22.792 22.116 1.00 50.04 C +ATOM 1588 CD2 LEU A 198 44.799 21.616 21.613 1.00 50.72 C +ATOM 1589 N THR A 199 47.596 25.138 21.751 1.00 55.34 N +ATOM 1590 CA THR A 199 48.415 26.335 21.507 1.00 54.18 C +ATOM 1591 C THR A 199 47.529 27.526 21.209 1.00 53.26 C +ATOM 1592 O THR A 199 46.332 27.365 20.967 1.00 52.52 O +ATOM 1593 CB THR A 199 49.333 26.190 20.285 1.00 52.71 C +ATOM 1594 OG1 THR A 199 48.601 25.609 19.205 1.00 53.71 O +ATOM 1595 CG2 THR A 199 50.484 25.338 20.592 1.00 52.29 C +ATOM 1596 N PRO A 200 48.108 28.740 21.246 1.00 52.60 N +ATOM 1597 CA PRO A 200 47.355 29.955 20.965 1.00 51.68 C +ATOM 1598 C PRO A 200 46.821 29.848 19.552 1.00 50.91 C +ATOM 1599 O PRO A 200 45.738 30.372 19.233 1.00 50.05 O +ATOM 1600 CB PRO A 200 48.408 31.041 21.122 1.00 51.54 C +ATOM 1601 CG PRO A 200 49.211 30.524 22.266 1.00 50.36 C +ATOM 1602 CD PRO A 200 49.405 29.082 21.862 1.00 52.81 C +ATOM 1603 N ASP A 201 47.577 29.127 18.724 1.00 49.67 N +ATOM 1604 CA ASP A 201 47.217 28.925 17.319 1.00 50.45 C +ATOM 1605 C ASP A 201 46.860 27.457 17.025 1.00 50.30 C +ATOM 1606 O ASP A 201 47.422 26.835 16.130 1.00 51.96 O +ATOM 1607 CB ASP A 201 48.388 29.365 16.442 1.00 49.48 C +ATOM 1608 CG ASP A 201 49.014 30.632 16.936 1.00 49.98 C +ATOM 1609 OD1 ASP A 201 48.294 31.637 16.949 1.00 50.80 O +ATOM 1610 OD2 ASP A 201 50.201 30.632 17.325 1.00 49.28 O +ATOM 1611 N ASP A 202 45.914 26.898 17.760 1.00 49.09 N +ATOM 1612 CA ASP A 202 45.561 25.503 17.549 1.00 48.05 C +ATOM 1613 C ASP A 202 44.904 25.323 16.179 1.00 47.27 C +ATOM 1614 O ASP A 202 44.965 24.245 15.570 1.00 46.68 O +ATOM 1615 CB ASP A 202 44.631 25.039 18.677 1.00 48.09 C +ATOM 1616 CG ASP A 202 44.423 23.548 18.685 1.00 47.90 C +ATOM 1617 OD1 ASP A 202 43.298 23.094 18.364 1.00 46.69 O +ATOM 1618 OD2 ASP A 202 45.396 22.840 19.015 1.00 47.73 O +ATOM 1619 N ASP A 203 44.284 26.386 15.690 1.00 45.19 N +ATOM 1620 CA ASP A 203 43.631 26.311 14.404 1.00 44.38 C +ATOM 1621 C ASP A 203 44.635 26.213 13.257 1.00 43.46 C +ATOM 1622 O ASP A 203 44.480 25.377 12.344 1.00 42.50 O +ATOM 1623 CB ASP A 203 42.741 27.526 14.199 1.00 46.72 C +ATOM 1624 CG ASP A 203 43.497 28.818 14.307 1.00 48.13 C +ATOM 1625 OD1 ASP A 203 42.983 29.847 13.815 1.00 48.16 O +ATOM 1626 OD2 ASP A 203 44.596 28.801 14.900 1.00 50.44 O +ATOM 1627 N VAL A 204 45.654 27.068 13.271 1.00 40.99 N +ATOM 1628 CA VAL A 204 46.618 26.979 12.210 1.00 39.93 C +ATOM 1629 C VAL A 204 47.324 25.642 12.364 1.00 40.23 C +ATOM 1630 O VAL A 204 47.507 24.950 11.372 1.00 42.37 O +ATOM 1631 CB VAL A 204 47.635 28.106 12.215 1.00 38.10 C +ATOM 1632 CG1 VAL A 204 48.380 28.095 13.480 1.00 41.56 C +ATOM 1633 CG2 VAL A 204 48.623 27.898 11.102 1.00 37.76 C +ATOM 1634 N PHE A 205 47.696 25.232 13.575 1.00 39.37 N +ATOM 1635 CA PHE A 205 48.368 23.922 13.693 1.00 40.77 C +ATOM 1636 C PHE A 205 47.466 22.792 13.187 1.00 41.64 C +ATOM 1637 O PHE A 205 47.919 21.885 12.484 1.00 41.27 O +ATOM 1638 CB PHE A 205 48.825 23.621 15.128 1.00 39.08 C +ATOM 1639 CG PHE A 205 50.171 24.212 15.479 1.00 38.58 C +ATOM 1640 CD1 PHE A 205 51.337 23.746 14.864 1.00 38.67 C +ATOM 1641 CD2 PHE A 205 50.278 25.242 16.436 1.00 37.71 C +ATOM 1642 CE1 PHE A 205 52.602 24.295 15.201 1.00 38.05 C +ATOM 1643 CE2 PHE A 205 51.528 25.794 16.775 1.00 35.78 C +ATOM 1644 CZ PHE A 205 52.684 25.319 16.160 1.00 36.68 C +ATOM 1645 N GLN A 206 46.188 22.832 13.534 1.00 42.39 N +ATOM 1646 CA GLN A 206 45.306 21.804 13.024 1.00 43.78 C +ATOM 1647 C GLN A 206 45.275 21.875 11.491 1.00 44.53 C +ATOM 1648 O GLN A 206 45.489 20.871 10.813 1.00 45.19 O +ATOM 1649 CB GLN A 206 43.898 21.972 13.564 1.00 44.03 C +ATOM 1650 CG GLN A 206 43.705 21.520 14.975 1.00 45.23 C +ATOM 1651 CD GLN A 206 42.250 21.262 15.263 1.00 46.45 C +ATOM 1652 OE1 GLN A 206 41.593 20.537 14.518 1.00 47.52 O +ATOM 1653 NE2 GLN A 206 41.732 21.852 16.338 1.00 46.38 N +ATOM 1654 N TYR A 207 45.014 23.053 10.934 1.00 44.31 N +ATOM 1655 CA TYR A 207 44.988 23.164 9.481 1.00 45.01 C +ATOM 1656 C TYR A 207 46.288 22.606 8.868 1.00 44.50 C +ATOM 1657 O TYR A 207 46.262 21.922 7.854 1.00 43.03 O +ATOM 1658 CB TYR A 207 44.754 24.629 9.086 1.00 45.85 C +ATOM 1659 CG TYR A 207 45.097 24.981 7.651 1.00 46.53 C +ATOM 1660 CD1 TYR A 207 46.441 25.099 7.244 1.00 48.27 C +ATOM 1661 CD2 TYR A 207 44.103 25.202 6.707 1.00 44.09 C +ATOM 1662 CE1 TYR A 207 46.783 25.420 5.946 1.00 47.34 C +ATOM 1663 CE2 TYR A 207 44.433 25.532 5.396 1.00 46.29 C +ATOM 1664 CZ TYR A 207 45.778 25.634 5.021 1.00 48.70 C +ATOM 1665 OH TYR A 207 46.135 25.918 3.711 1.00 52.41 O +ATOM 1666 N LEU A 208 47.417 22.887 9.509 1.00 45.25 N +ATOM 1667 CA LEU A 208 48.716 22.418 9.042 1.00 47.20 C +ATOM 1668 C LEU A 208 48.886 20.884 9.052 1.00 48.20 C +ATOM 1669 O LEU A 208 49.489 20.314 8.140 1.00 48.37 O +ATOM 1670 CB LEU A 208 49.841 23.043 9.885 1.00 47.66 C +ATOM 1671 CG LEU A 208 50.139 24.539 9.776 1.00 47.85 C +ATOM 1672 CD1 LEU A 208 51.491 24.852 10.400 1.00 46.72 C +ATOM 1673 CD2 LEU A 208 50.153 24.928 8.316 1.00 48.63 C +ATOM 1674 N ALA A 209 48.386 20.221 10.091 1.00 48.07 N +ATOM 1675 CA ALA A 209 48.507 18.775 10.176 1.00 48.47 C +ATOM 1676 C ALA A 209 47.657 18.175 9.072 1.00 49.33 C +ATOM 1677 O ALA A 209 48.077 17.272 8.344 1.00 48.85 O +ATOM 1678 CB ALA A 209 48.013 18.300 11.519 1.00 48.86 C +ATOM 1679 N HIS A 210 46.444 18.695 8.959 1.00 50.32 N +ATOM 1680 CA HIS A 210 45.517 18.226 7.960 1.00 50.91 C +ATOM 1681 C HIS A 210 46.059 18.492 6.588 1.00 49.67 C +ATOM 1682 O HIS A 210 45.854 17.700 5.684 1.00 50.47 O +ATOM 1683 CB HIS A 210 44.168 18.911 8.116 1.00 54.47 C +ATOM 1684 CG HIS A 210 43.284 18.266 9.137 1.00 59.69 C +ATOM 1685 ND1 HIS A 210 42.770 16.996 8.978 1.00 62.06 N +ATOM 1686 CD2 HIS A 210 42.829 18.710 10.335 1.00 61.87 C +ATOM 1687 CE1 HIS A 210 42.035 16.687 10.034 1.00 63.88 C +ATOM 1688 NE2 HIS A 210 42.055 17.710 10.873 1.00 63.32 N +ATOM 1689 N THR A 211 46.755 19.601 6.413 1.00 47.66 N +ATOM 1690 CA THR A 211 47.275 19.878 5.091 1.00 47.20 C +ATOM 1691 C THR A 211 48.084 18.695 4.622 1.00 45.81 C +ATOM 1692 O THR A 211 47.804 18.107 3.572 1.00 44.26 O +ATOM 1693 CB THR A 211 48.177 21.137 5.066 1.00 48.84 C +ATOM 1694 OG1 THR A 211 47.367 22.309 5.229 1.00 51.52 O +ATOM 1695 CG2 THR A 211 48.937 21.245 3.737 1.00 48.02 C +ATOM 1696 N TYR A 212 49.071 18.331 5.432 1.00 44.89 N +ATOM 1697 CA TYR A 212 49.964 17.249 5.087 1.00 44.47 C +ATOM 1698 C TYR A 212 49.313 15.905 4.950 1.00 45.77 C +ATOM 1699 O TYR A 212 49.488 15.239 3.930 1.00 46.20 O +ATOM 1700 CB TYR A 212 51.103 17.147 6.087 1.00 42.61 C +ATOM 1701 CG TYR A 212 52.161 16.180 5.638 1.00 41.68 C +ATOM 1702 CD1 TYR A 212 51.939 14.818 5.686 1.00 40.97 C +ATOM 1703 CD2 TYR A 212 53.366 16.631 5.111 1.00 41.94 C +ATOM 1704 CE1 TYR A 212 52.875 13.932 5.224 1.00 40.88 C +ATOM 1705 CE2 TYR A 212 54.315 15.741 4.640 1.00 41.37 C +ATOM 1706 CZ TYR A 212 54.056 14.393 4.702 1.00 40.57 C +ATOM 1707 OH TYR A 212 54.960 13.488 4.222 1.00 39.95 O +ATOM 1708 N ALA A 213 48.570 15.498 5.972 1.00 46.93 N +ATOM 1709 CA ALA A 213 47.916 14.192 5.949 1.00 47.85 C +ATOM 1710 C ALA A 213 46.836 14.050 4.886 1.00 48.10 C +ATOM 1711 O ALA A 213 46.723 13.004 4.261 1.00 48.98 O +ATOM 1712 CB ALA A 213 47.336 13.876 7.312 1.00 47.97 C +ATOM 1713 N SER A 214 46.041 15.091 4.672 1.00 48.41 N +ATOM 1714 CA SER A 214 44.978 15.015 3.676 1.00 48.51 C +ATOM 1715 C SER A 214 45.557 14.518 2.361 1.00 47.17 C +ATOM 1716 O SER A 214 44.877 13.836 1.607 1.00 46.65 O +ATOM 1717 CB SER A 214 44.325 16.387 3.467 1.00 49.45 C +ATOM 1718 OG SER A 214 45.120 17.225 2.651 1.00 52.55 O +ATOM 1719 N ARG A 215 46.821 14.854 2.117 1.00 46.00 N +ATOM 1720 CA ARG A 215 47.530 14.459 0.912 1.00 45.97 C +ATOM 1721 C ARG A 215 48.290 13.146 0.966 1.00 45.92 C +ATOM 1722 O ARG A 215 48.985 12.794 0.009 1.00 45.89 O +ATOM 1723 CB ARG A 215 48.525 15.520 0.523 1.00 48.56 C +ATOM 1724 CG ARG A 215 47.993 16.517 -0.446 1.00 51.28 C +ATOM 1725 CD ARG A 215 47.222 17.602 0.228 1.00 49.97 C +ATOM 1726 NE ARG A 215 46.980 18.624 -0.760 1.00 50.51 N +ATOM 1727 CZ ARG A 215 46.419 19.790 -0.500 1.00 53.78 C +ATOM 1728 NH1 ARG A 215 46.041 20.081 0.748 1.00 55.17 N +ATOM 1729 NH2 ARG A 215 46.239 20.660 -1.494 1.00 53.62 N +ATOM 1730 N ASN A 216 48.201 12.435 2.082 1.00 44.79 N +ATOM 1731 CA ASN A 216 48.877 11.162 2.196 1.00 43.66 C +ATOM 1732 C ASN A 216 47.784 10.113 2.238 1.00 44.88 C +ATOM 1733 O ASN A 216 47.093 9.943 3.239 1.00 43.69 O +ATOM 1734 CB ASN A 216 49.724 11.108 3.464 1.00 43.02 C +ATOM 1735 CG ASN A 216 50.653 9.911 3.486 1.00 42.08 C +ATOM 1736 OD1 ASN A 216 50.280 8.820 2.999 1.00 42.77 O +ATOM 1737 ND2 ASN A 216 51.858 10.088 4.052 1.00 36.57 N +ATOM 1738 N PRO A 217 47.609 9.394 1.127 1.00 47.12 N +ATOM 1739 CA PRO A 217 46.599 8.348 0.979 1.00 47.97 C +ATOM 1740 C PRO A 217 46.488 7.440 2.183 1.00 48.43 C +ATOM 1741 O PRO A 217 45.390 7.134 2.636 1.00 47.04 O +ATOM 1742 CB PRO A 217 47.067 7.595 -0.256 1.00 47.48 C +ATOM 1743 CG PRO A 217 47.686 8.646 -1.065 1.00 48.01 C +ATOM 1744 CD PRO A 217 48.504 9.402 -0.040 1.00 48.05 C +ATOM 1745 N ASN A 218 47.628 7.024 2.713 1.00 50.14 N +ATOM 1746 CA ASN A 218 47.593 6.120 3.839 1.00 52.71 C +ATOM 1747 C ASN A 218 47.484 6.833 5.161 1.00 52.85 C +ATOM 1748 O ASN A 218 46.788 6.384 6.059 1.00 53.68 O +ATOM 1749 CB ASN A 218 48.824 5.231 3.808 1.00 55.95 C +ATOM 1750 CG ASN A 218 48.914 4.394 2.519 1.00 60.44 C +ATOM 1751 OD1 ASN A 218 50.018 4.084 2.048 1.00 62.36 O +ATOM 1752 ND2 ASN A 218 47.751 4.014 1.951 1.00 60.91 N +ATOM 1753 N MET A 219 48.155 7.963 5.280 1.00 53.83 N +ATOM 1754 CA MET A 219 48.128 8.704 6.521 1.00 53.75 C +ATOM 1755 C MET A 219 46.719 9.143 6.743 1.00 55.09 C +ATOM 1756 O MET A 219 46.281 9.306 7.874 1.00 55.63 O +ATOM 1757 CB MET A 219 49.049 9.910 6.436 1.00 53.01 C +ATOM 1758 CG MET A 219 49.138 10.701 7.709 1.00 54.67 C +ATOM 1759 SD MET A 219 50.496 11.878 7.716 1.00 55.27 S +ATOM 1760 CE MET A 219 51.874 10.818 8.187 1.00 53.02 C +ATOM 1761 N LYS A 220 45.996 9.307 5.644 1.00 57.66 N +ATOM 1762 CA LYS A 220 44.606 9.752 5.688 1.00 59.93 C +ATOM 1763 C LYS A 220 43.649 8.641 6.101 1.00 61.76 C +ATOM 1764 O LYS A 220 42.575 8.926 6.630 1.00 60.72 O +ATOM 1765 CB LYS A 220 44.216 10.305 4.323 1.00 59.98 C +ATOM 1766 CG LYS A 220 42.777 10.725 4.195 1.00 61.37 C +ATOM 1767 CD LYS A 220 42.534 11.326 2.816 1.00 63.72 C +ATOM 1768 CE LYS A 220 42.917 10.357 1.682 1.00 64.84 C +ATOM 1769 NZ LYS A 220 43.117 11.035 0.344 1.00 66.84 N +ATOM 1770 N LYS A 221 44.056 7.387 5.853 1.00 64.88 N +ATOM 1771 CA LYS A 221 43.273 6.184 6.190 1.00 67.71 C +ATOM 1772 C LYS A 221 42.912 6.127 7.663 1.00 68.62 C +ATOM 1773 O LYS A 221 41.837 5.659 8.030 1.00 68.92 O +ATOM 1774 CB LYS A 221 44.043 4.895 5.861 1.00 69.09 C +ATOM 1775 CG LYS A 221 44.061 4.468 4.384 1.00 71.06 C +ATOM 1776 CD LYS A 221 44.861 3.149 4.203 1.00 72.15 C +ATOM 1777 CE LYS A 221 46.211 3.177 4.972 1.00 72.31 C +ATOM 1778 NZ LYS A 221 47.027 1.919 4.921 1.00 71.19 N +ATOM 1779 N GLY A 222 43.823 6.577 8.511 1.00 69.47 N +ATOM 1780 CA GLY A 222 43.537 6.557 9.925 1.00 70.72 C +ATOM 1781 C GLY A 222 43.658 5.165 10.516 1.00 71.79 C +ATOM 1782 O GLY A 222 44.279 5.003 11.563 1.00 72.78 O +ATOM 1783 N ASP A 223 43.049 4.167 9.875 1.00 71.94 N +ATOM 1784 CA ASP A 223 43.125 2.776 10.341 1.00 71.50 C +ATOM 1785 C ASP A 223 44.203 2.196 9.449 1.00 70.95 C +ATOM 1786 O ASP A 223 43.901 1.642 8.385 1.00 71.72 O +ATOM 1787 CB ASP A 223 41.774 2.093 10.157 1.00 99.99 C +ATOM 1788 CG ASP A 223 40.782 2.640 11.181 0.00 99.99 C +ATOM 1789 OD1 ASP A 223 41.116 2.580 12.395 0.00 99.99 O +ATOM 1790 OD2 ASP A 223 39.701 3.114 10.740 0.00 99.99 O +ATOM 1791 N GLU A 224 45.458 2.334 9.873 1.00 69.24 N +ATOM 1792 CA GLU A 224 46.570 1.886 9.051 1.00 68.50 C +ATOM 1793 C GLU A 224 47.676 1.056 9.703 1.00 67.63 C +ATOM 1794 O GLU A 224 48.103 0.047 9.119 1.00 68.83 O +ATOM 1795 CB GLU A 224 47.295 3.090 8.459 1.00 99.99 C +ATOM 1796 CG GLU A 224 47.797 2.747 7.077 0.00 99.99 C +ATOM 1797 CD GLU A 224 48.854 1.650 7.178 0.00 99.99 C +ATOM 1798 OE1 GLU A 224 48.456 0.457 7.121 0.00 99.99 O +ATOM 1799 OE2 GLU A 224 50.054 2.016 7.313 0.00 99.99 O +ATOM 1800 N CYS A 225 48.157 1.455 10.883 1.00 65.19 N +ATOM 1801 CA CYS A 225 49.235 0.697 11.534 1.00 62.33 C +ATOM 1802 C CYS A 225 48.746 -0.400 12.456 1.00 61.91 C +ATOM 1803 O CYS A 225 47.930 -0.167 13.343 1.00 61.05 O +ATOM 1804 CB CYS A 225 50.176 1.626 12.298 1.00 59.80 C +ATOM 1805 SG CYS A 225 51.022 2.853 11.249 1.00 55.28 S +ATOM 1806 N LYS A 226 49.268 -1.602 12.238 1.00 62.63 N +ATOM 1807 CA LYS A 226 48.876 -2.772 13.016 1.00 63.53 C +ATOM 1808 C LYS A 226 49.235 -2.705 14.486 1.00 63.45 C +ATOM 1809 O LYS A 226 48.419 -2.294 15.320 1.00 64.23 O +ATOM 1810 CB LYS A 226 49.475 -4.046 12.404 1.00 63.79 C +ATOM 1811 CG LYS A 226 48.714 -4.558 11.186 1.00 64.43 C +ATOM 1812 CD LYS A 226 49.630 -5.300 10.220 1.00 65.63 C +ATOM 1813 CE LYS A 226 50.647 -4.365 9.586 0.00 65.44 C +ATOM 1814 NZ LYS A 226 49.988 -3.285 8.801 0.00 65.64 N +ATOM 1815 N ASN A 227 50.453 -3.109 14.812 1.00 62.16 N +ATOM 1816 CA ASN A 227 50.864 -3.115 16.197 1.00 61.70 C +ATOM 1817 C ASN A 227 50.807 -1.716 16.849 1.00 61.90 C +ATOM 1818 O ASN A 227 51.173 -1.535 18.011 1.00 63.82 O +ATOM 1819 CB ASN A 227 52.250 -3.759 16.301 1.00 59.12 C +ATOM 1820 CG ASN A 227 52.261 -5.174 15.764 0.00 60.05 C +ATOM 1821 OD1 ASN A 227 52.378 -5.394 14.559 0.00 59.78 O +ATOM 1822 ND2 ASN A 227 52.109 -6.143 16.655 0.00 59.78 N +ATOM 1823 N LYS A 228 50.300 -0.730 16.125 1.00 60.48 N +ATOM 1824 CA LYS A 228 50.233 0.616 16.680 1.00 59.17 C +ATOM 1825 C LYS A 228 48.834 1.206 16.833 1.00 58.74 C +ATOM 1826 O LYS A 228 47.851 0.663 16.340 1.00 58.81 O +ATOM 1827 CB LYS A 228 51.050 1.575 15.812 1.00 57.73 C +ATOM 1828 CG LYS A 228 52.500 1.685 16.169 1.00 56.01 C +ATOM 1829 CD LYS A 228 53.307 0.595 15.535 1.00 55.27 C +ATOM 1830 CE LYS A 228 54.711 0.654 16.067 1.00 53.95 C +ATOM 1831 NZ LYS A 228 54.655 0.502 17.553 1.00 53.46 N +ATOM 1832 N MET A 229 48.763 2.336 17.525 1.00 57.79 N +ATOM 1833 CA MET A 229 47.513 3.047 17.685 1.00 57.60 C +ATOM 1834 C MET A 229 47.292 3.823 16.404 1.00 59.64 C +ATOM 1835 O MET A 229 48.249 4.146 15.688 1.00 60.22 O +ATOM 1836 CB MET A 229 47.591 4.057 18.812 1.00 56.77 C +ATOM 1837 CG MET A 229 46.458 5.048 18.737 1.00 54.63 C +ATOM 1838 SD MET A 229 46.172 5.858 20.254 1.00 52.44 S +ATOM 1839 CE MET A 229 44.877 7.054 19.772 1.00 50.44 C +ATOM 1840 N ASN A 230 46.038 4.149 16.120 1.00 60.75 N +ATOM 1841 CA ASN A 230 45.733 4.895 14.911 1.00 62.04 C +ATOM 1842 C ASN A 230 44.848 6.111 15.177 1.00 61.85 C +ATOM 1843 O ASN A 230 44.194 6.197 16.219 1.00 62.15 O +ATOM 1844 CB ASN A 230 45.138 3.949 13.861 1.00 63.35 C +ATOM 1845 CG ASN A 230 46.207 3.068 13.207 1.00 65.01 C +ATOM 1846 OD1 ASN A 230 46.827 2.233 13.868 1.00 66.71 O +ATOM 1847 ND2 ASN A 230 46.437 3.266 11.913 1.00 65.48 N +ATOM 1848 N PHE A 231 44.841 7.055 14.238 1.00 60.51 N +ATOM 1849 CA PHE A 231 44.090 8.288 14.414 1.00 59.56 C +ATOM 1850 C PHE A 231 43.140 8.524 13.251 1.00 60.65 C +ATOM 1851 O PHE A 231 43.291 7.917 12.201 1.00 61.66 O +ATOM 1852 CB PHE A 231 45.096 9.427 14.544 1.00 56.71 C +ATOM 1853 CG PHE A 231 46.301 9.057 15.360 1.00 53.53 C +ATOM 1854 CD1 PHE A 231 46.357 9.337 16.713 1.00 52.18 C +ATOM 1855 CD2 PHE A 231 47.345 8.340 14.786 1.00 52.53 C +ATOM 1856 CE1 PHE A 231 47.430 8.903 17.480 1.00 52.13 C +ATOM 1857 CE2 PHE A 231 48.419 7.903 15.549 1.00 51.02 C +ATOM 1858 CZ PHE A 231 48.462 8.182 16.896 1.00 51.05 C +ATOM 1859 N PRO A 232 42.147 9.413 13.421 1.00 61.45 N +ATOM 1860 CA PRO A 232 41.169 9.719 12.371 1.00 61.69 C +ATOM 1861 C PRO A 232 41.643 10.873 11.483 1.00 61.62 C +ATOM 1862 O PRO A 232 41.941 11.960 11.965 1.00 62.64 O +ATOM 1863 CB PRO A 232 39.946 10.095 13.173 1.00 62.22 C +ATOM 1864 CG PRO A 232 40.577 10.946 14.276 1.00 62.88 C +ATOM 1865 CD PRO A 232 41.851 10.177 14.650 1.00 62.05 C +ATOM 1866 N ASN A 233 41.700 10.641 10.183 1.00 61.37 N +ATOM 1867 CA ASN A 233 42.159 11.668 9.258 1.00 61.43 C +ATOM 1868 C ASN A 233 43.655 11.793 9.362 1.00 60.13 C +ATOM 1869 O ASN A 233 44.274 12.612 8.673 1.00 60.68 O +ATOM 1870 CB ASN A 233 41.523 13.011 9.568 1.00 63.62 C +ATOM 1871 CG ASN A 233 40.029 12.951 9.501 1.00 66.00 C +ATOM 1872 OD1 ASN A 233 39.458 12.427 8.531 1.00 65.98 O +ATOM 1873 ND2 ASN A 233 39.373 13.482 10.530 1.00 66.71 N +ATOM 1874 N GLY A 234 44.225 10.979 10.241 1.00 57.56 N +ATOM 1875 CA GLY A 234 45.658 10.967 10.421 1.00 54.89 C +ATOM 1876 C GLY A 234 46.254 12.148 11.147 1.00 52.74 C +ATOM 1877 O GLY A 234 47.451 12.384 11.041 1.00 53.73 O +ATOM 1878 N VAL A 235 45.449 12.902 11.872 1.00 49.70 N +ATOM 1879 CA VAL A 235 46.007 14.019 12.580 1.00 49.33 C +ATOM 1880 C VAL A 235 45.624 13.867 14.023 1.00 50.34 C +ATOM 1881 O VAL A 235 44.634 13.215 14.335 1.00 50.76 O +ATOM 1882 CB VAL A 235 45.486 15.361 12.049 1.00 48.84 C +ATOM 1883 CG1 VAL A 235 45.591 15.391 10.568 1.00 49.71 C +ATOM 1884 CG2 VAL A 235 44.067 15.587 12.461 1.00 49.77 C +ATOM 1885 N THR A 236 46.405 14.488 14.898 1.00 51.18 N +ATOM 1886 CA THR A 236 46.175 14.421 16.331 1.00 52.07 C +ATOM 1887 C THR A 236 47.033 15.439 17.081 1.00 53.15 C +ATOM 1888 O THR A 236 48.034 15.957 16.546 1.00 54.04 O +ATOM 1889 CB THR A 236 46.527 13.012 16.854 1.00 52.33 C +ATOM 1890 OG1 THR A 236 46.864 13.059 18.248 1.00 51.97 O +ATOM 1891 CG2 THR A 236 47.693 12.462 16.076 1.00 52.57 C +ATOM 1892 N ASN A 237 46.625 15.729 18.317 1.00 52.29 N +ATOM 1893 CA ASN A 237 47.378 16.623 19.173 1.00 50.48 C +ATOM 1894 C ASN A 237 48.474 15.754 19.787 1.00 48.87 C +ATOM 1895 O ASN A 237 48.319 14.540 19.907 1.00 47.50 O +ATOM 1896 CB ASN A 237 46.511 17.183 20.283 1.00 53.00 C +ATOM 1897 CG ASN A 237 47.206 18.285 21.042 1.00 56.16 C +ATOM 1898 OD1 ASN A 237 47.193 19.428 20.606 1.00 59.64 O +ATOM 1899 ND2 ASN A 237 47.845 17.951 22.170 1.00 56.92 N +ATOM 1900 N GLY A 238 49.576 16.381 20.180 1.00 47.88 N +ATOM 1901 CA GLY A 238 50.695 15.647 20.744 1.00 47.46 C +ATOM 1902 C GLY A 238 50.369 14.974 22.044 1.00 47.27 C +ATOM 1903 O GLY A 238 50.673 13.806 22.236 1.00 45.03 O +ATOM 1904 N TYR A 239 49.741 15.745 22.927 1.00 49.40 N +ATOM 1905 CA TYR A 239 49.329 15.303 24.252 1.00 49.99 C +ATOM 1906 C TYR A 239 48.255 14.211 24.146 1.00 50.01 C +ATOM 1907 O TYR A 239 48.400 13.141 24.745 1.00 51.65 O +ATOM 1908 CB TYR A 239 48.811 16.514 25.044 1.00 51.53 C +ATOM 1909 CG TYR A 239 49.020 16.404 26.538 1.00 53.38 C +ATOM 1910 CD1 TYR A 239 47.936 16.297 27.418 1.00 53.78 C +ATOM 1911 CD2 TYR A 239 50.305 16.378 27.072 1.00 53.22 C +ATOM 1912 CE1 TYR A 239 48.138 16.159 28.792 1.00 53.96 C +ATOM 1913 CE2 TYR A 239 50.515 16.245 28.437 1.00 53.14 C +ATOM 1914 CZ TYR A 239 49.435 16.130 29.291 1.00 54.01 C +ATOM 1915 OH TYR A 239 49.668 15.956 30.637 1.00 54.53 O +ATOM 1916 N SER A 240 47.188 14.467 23.388 1.00 48.27 N +ATOM 1917 CA SER A 240 46.135 13.478 23.210 1.00 48.33 C +ATOM 1918 C SER A 240 46.745 12.183 22.749 1.00 47.96 C +ATOM 1919 O SER A 240 46.091 11.155 22.714 1.00 48.48 O +ATOM 1920 CB SER A 240 45.144 13.917 22.155 1.00 50.17 C +ATOM 1921 OG SER A 240 44.175 14.795 22.683 1.00 55.65 O +ATOM 1922 N TRP A 241 48.005 12.237 22.360 1.00 47.95 N +ATOM 1923 CA TRP A 241 48.680 11.039 21.909 1.00 47.84 C +ATOM 1924 C TRP A 241 49.558 10.525 23.019 1.00 49.56 C +ATOM 1925 O TRP A 241 49.406 9.398 23.460 1.00 51.22 O +ATOM 1926 CB TRP A 241 49.541 11.315 20.666 1.00 44.80 C +ATOM 1927 CG TRP A 241 50.117 10.074 20.085 1.00 40.81 C +ATOM 1928 CD1 TRP A 241 49.711 8.814 20.334 1.00 39.02 C +ATOM 1929 CD2 TRP A 241 51.221 9.970 19.184 1.00 40.46 C +ATOM 1930 NE1 TRP A 241 50.491 7.921 19.657 1.00 40.52 N +ATOM 1931 CE2 TRP A 241 51.431 8.607 18.942 1.00 40.64 C +ATOM 1932 CE3 TRP A 241 52.057 10.897 18.559 1.00 40.86 C +ATOM 1933 CZ2 TRP A 241 52.443 8.144 18.106 1.00 40.69 C +ATOM 1934 CZ3 TRP A 241 53.068 10.435 17.725 1.00 39.07 C +ATOM 1935 CH2 TRP A 241 53.251 9.080 17.509 1.00 39.92 C +ATOM 1936 N TYR A 242 50.464 11.373 23.483 1.00 50.98 N +ATOM 1937 CA TYR A 242 51.400 10.991 24.513 1.00 51.65 C +ATOM 1938 C TYR A 242 52.239 12.180 24.930 1.00 50.73 C +ATOM 1939 O TYR A 242 53.112 12.643 24.207 1.00 49.13 O +ATOM 1940 CB TYR A 242 52.314 9.874 23.992 1.00 55.97 C +ATOM 1941 CG TYR A 242 53.395 9.414 24.961 1.00 62.37 C +ATOM 1942 CD1 TYR A 242 53.963 8.145 24.844 1.00 64.04 C +ATOM 1943 CD2 TYR A 242 53.828 10.229 26.021 1.00 64.96 C +ATOM 1944 CE1 TYR A 242 54.921 7.693 25.762 1.00 66.86 C +ATOM 1945 CE2 TYR A 242 54.796 9.789 26.944 1.00 66.90 C +ATOM 1946 CZ TYR A 242 55.338 8.516 26.813 1.00 67.76 C +ATOM 1947 OH TYR A 242 56.278 8.065 27.732 1.00 68.30 O +ATOM 1948 N PRO A 243 51.984 12.681 26.126 1.00 50.68 N +ATOM 1949 CA PRO A 243 52.694 13.816 26.700 1.00 50.97 C +ATOM 1950 C PRO A 243 54.145 13.577 26.451 1.00 50.43 C +ATOM 1951 O PRO A 243 54.691 12.634 26.985 1.00 51.36 O +ATOM 1952 CB PRO A 243 52.366 13.701 28.169 1.00 51.96 C +ATOM 1953 CG PRO A 243 50.953 13.199 28.132 1.00 52.34 C +ATOM 1954 CD PRO A 243 51.009 12.130 27.076 1.00 51.68 C +ATOM 1955 N LEU A 244 54.765 14.423 25.645 1.00 50.38 N +ATOM 1956 CA LEU A 244 56.173 14.272 25.310 1.00 50.79 C +ATOM 1957 C LEU A 244 56.975 15.371 25.946 1.00 52.01 C +ATOM 1958 O LEU A 244 56.801 16.534 25.607 1.00 53.84 O +ATOM 1959 CB LEU A 244 56.335 14.360 23.806 1.00 50.55 C +ATOM 1960 CG LEU A 244 57.700 14.087 23.202 1.00 50.37 C +ATOM 1961 CD1 LEU A 244 58.148 12.643 23.464 1.00 49.45 C +ATOM 1962 CD2 LEU A 244 57.579 14.352 21.722 1.00 51.32 C +ATOM 1963 N GLN A 245 57.873 15.022 26.851 1.00 53.12 N +ATOM 1964 CA GLN A 245 58.670 16.047 27.522 1.00 54.73 C +ATOM 1965 C GLN A 245 59.988 16.354 26.816 1.00 54.36 C +ATOM 1966 O GLN A 245 60.778 15.455 26.498 1.00 53.49 O +ATOM 1967 CB GLN A 245 58.949 15.621 28.965 1.00 57.59 C +ATOM 1968 CG GLN A 245 59.816 16.570 29.764 1.00 61.23 C +ATOM 1969 CD GLN A 245 60.253 15.969 31.092 1.00 63.22 C +ATOM 1970 OE1 GLN A 245 61.040 16.569 31.830 1.00 64.78 O +ATOM 1971 NE2 GLN A 245 59.741 14.778 31.401 1.00 63.28 N +ATOM 1972 N GLY A 246 60.219 17.638 26.577 1.00 54.02 N +ATOM 1973 CA GLY A 246 61.444 18.056 25.921 1.00 54.78 C +ATOM 1974 C GLY A 246 61.615 17.671 24.460 1.00 54.43 C +ATOM 1975 O GLY A 246 62.640 17.094 24.096 1.00 54.67 O +ATOM 1976 N GLY A 247 60.631 18.000 23.627 1.00 53.96 N +ATOM 1977 CA GLY A 247 60.708 17.672 22.216 1.00 53.66 C +ATOM 1978 C GLY A 247 60.964 18.893 21.346 1.00 53.86 C +ATOM 1979 O GLY A 247 60.584 20.016 21.717 1.00 53.81 O +ATOM 1980 N MET A 248 61.582 18.672 20.183 1.00 52.31 N +ATOM 1981 CA MET A 248 61.909 19.760 19.267 1.00 52.26 C +ATOM 1982 C MET A 248 60.700 20.584 18.834 1.00 52.47 C +ATOM 1983 O MET A 248 60.765 21.801 18.725 1.00 52.15 O +ATOM 1984 CB MET A 248 62.613 19.212 18.027 1.00 51.81 C +ATOM 1985 CG MET A 248 63.523 20.220 17.324 1.00 49.73 C +ATOM 1986 SD MET A 248 64.128 19.641 15.735 1.00 50.05 S +ATOM 1987 CE MET A 248 64.649 18.016 16.103 1.00 45.85 C +ATOM 1988 N GLN A 249 59.593 19.911 18.574 1.00 53.48 N +ATOM 1989 CA GLN A 249 58.373 20.588 18.149 1.00 53.63 C +ATOM 1990 C GLN A 249 57.999 21.714 19.119 1.00 53.59 C +ATOM 1991 O GLN A 249 57.757 22.853 18.710 1.00 52.86 O +ATOM 1992 CB GLN A 249 57.239 19.565 18.069 0.00 53.72 C +ATOM 1993 CG GLN A 249 56.037 19.993 17.251 0.00 53.94 C +ATOM 1994 CD GLN A 249 54.994 18.894 17.148 0.00 54.06 C +ATOM 1995 OE1 GLN A 249 54.006 19.025 16.429 0.00 54.14 O +ATOM 1996 NE2 GLN A 249 55.212 17.803 17.871 0.00 54.14 N +ATOM 1997 N ASP A 250 57.958 21.391 20.410 1.00 54.45 N +ATOM 1998 CA ASP A 250 57.585 22.381 21.429 1.00 54.12 C +ATOM 1999 C ASP A 250 58.584 23.531 21.498 1.00 52.40 C +ATOM 2000 O ASP A 250 58.231 24.683 21.704 1.00 50.60 O +ATOM 2001 CB ASP A 250 57.472 21.714 22.815 1.00 55.36 C +ATOM 2002 CG ASP A 250 56.199 20.881 22.979 1.00 54.91 C +ATOM 2003 OD1 ASP A 250 55.104 21.419 22.699 1.00 52.21 O +ATOM 2004 OD2 ASP A 250 56.303 19.702 23.399 1.00 55.39 O +ATOM 2005 N TYR A 251 59.845 23.190 21.321 1.00 52.07 N +ATOM 2006 CA TYR A 251 60.910 24.163 21.378 1.00 51.49 C +ATOM 2007 C TYR A 251 60.675 25.212 20.292 1.00 50.41 C +ATOM 2008 O TYR A 251 60.347 26.361 20.586 1.00 51.81 O +ATOM 2009 CB TYR A 251 62.248 23.425 21.205 1.00 52.68 C +ATOM 2010 CG TYR A 251 63.475 24.263 21.415 1.00 54.91 C +ATOM 2011 CD1 TYR A 251 63.806 24.766 22.674 1.00 55.78 C +ATOM 2012 CD2 TYR A 251 64.309 24.566 20.343 1.00 56.28 C +ATOM 2013 CE1 TYR A 251 64.951 25.562 22.852 1.00 56.94 C +ATOM 2014 CE2 TYR A 251 65.445 25.343 20.508 1.00 57.17 C +ATOM 2015 CZ TYR A 251 65.767 25.838 21.755 1.00 57.26 C +ATOM 2016 OH TYR A 251 66.925 26.570 21.878 1.00 57.14 O +ATOM 2017 N ASN A 252 60.800 24.792 19.039 1.00 48.31 N +ATOM 2018 CA ASN A 252 60.625 25.664 17.891 1.00 45.64 C +ATOM 2019 C ASN A 252 59.535 26.681 18.037 1.00 43.81 C +ATOM 2020 O ASN A 252 59.674 27.801 17.569 1.00 44.21 O +ATOM 2021 CB ASN A 252 60.331 24.850 16.637 1.00 45.82 C +ATOM 2022 CG ASN A 252 61.569 24.240 16.036 1.00 47.60 C +ATOM 2023 OD1 ASN A 252 62.109 23.249 16.545 1.00 48.87 O +ATOM 2024 ND2 ASN A 252 62.042 24.837 14.943 1.00 47.68 N +ATOM 2025 N TYR A 253 58.449 26.276 18.676 1.00 42.55 N +ATOM 2026 CA TYR A 253 57.286 27.121 18.861 1.00 41.37 C +ATOM 2027 C TYR A 253 57.339 28.038 20.053 1.00 43.37 C +ATOM 2028 O TYR A 253 56.720 29.091 20.053 1.00 44.29 O +ATOM 2029 CB TYR A 253 56.060 26.253 19.013 1.00 37.40 C +ATOM 2030 CG TYR A 253 54.795 27.047 19.072 1.00 35.33 C +ATOM 2031 CD1 TYR A 253 54.361 27.775 17.970 1.00 35.10 C +ATOM 2032 CD2 TYR A 253 54.002 27.046 20.203 1.00 34.56 C +ATOM 2033 CE1 TYR A 253 53.160 28.479 17.990 1.00 32.77 C +ATOM 2034 CE2 TYR A 253 52.793 27.745 20.231 1.00 33.13 C +ATOM 2035 CZ TYR A 253 52.385 28.456 19.120 1.00 32.38 C +ATOM 2036 OH TYR A 253 51.200 29.155 19.139 1.00 33.42 O +ATOM 2037 N ILE A 254 58.057 27.619 21.084 1.00 45.33 N +ATOM 2038 CA ILE A 254 58.140 28.383 22.312 1.00 46.57 C +ATOM 2039 C ILE A 254 59.249 29.383 22.272 1.00 48.78 C +ATOM 2040 O ILE A 254 59.025 30.572 22.499 1.00 50.98 O +ATOM 2041 CB ILE A 254 58.384 27.460 23.533 1.00 45.19 C +ATOM 2042 CG1 ILE A 254 57.125 26.639 23.829 1.00 44.63 C +ATOM 2043 CG2 ILE A 254 58.782 28.273 24.756 1.00 43.48 C +ATOM 2044 CD1 ILE A 254 56.039 27.367 24.535 1.00 41.35 C +ATOM 2045 N TRP A 255 60.440 28.893 21.965 1.00 49.91 N +ATOM 2046 CA TRP A 255 61.647 29.712 21.959 1.00 51.43 C +ATOM 2047 C TRP A 255 62.256 30.106 20.614 1.00 50.29 C +ATOM 2048 O TRP A 255 63.128 30.970 20.554 1.00 49.93 O +ATOM 2049 CB TRP A 255 62.732 28.983 22.774 1.00 54.37 C +ATOM 2050 CG TRP A 255 62.458 28.852 24.260 1.00 57.72 C +ATOM 2051 CD1 TRP A 255 62.611 29.819 25.210 1.00 58.58 C +ATOM 2052 CD2 TRP A 255 62.030 27.677 24.954 1.00 58.70 C +ATOM 2053 NE1 TRP A 255 62.315 29.319 26.451 1.00 59.31 N +ATOM 2054 CE2 TRP A 255 61.954 28.005 26.324 1.00 59.08 C +ATOM 2055 CE3 TRP A 255 61.707 26.376 24.553 1.00 58.95 C +ATOM 2056 CZ2 TRP A 255 61.567 27.082 27.295 1.00 59.31 C +ATOM 2057 CZ3 TRP A 255 61.322 25.453 25.522 1.00 59.45 C +ATOM 2058 CH2 TRP A 255 61.257 25.813 26.877 1.00 59.68 C +ATOM 2059 N ALA A 256 61.823 29.472 19.536 1.00 49.99 N +ATOM 2060 CA ALA A 256 62.411 29.756 18.238 1.00 48.28 C +ATOM 2061 C ALA A 256 61.488 30.496 17.332 1.00 47.15 C +ATOM 2062 O ALA A 256 61.825 30.754 16.202 1.00 48.68 O +ATOM 2063 CB ALA A 256 62.850 28.473 17.575 1.00 47.93 C +ATOM 2064 N GLN A 257 60.308 30.817 17.818 1.00 47.00 N +ATOM 2065 CA GLN A 257 59.350 31.560 17.019 1.00 47.01 C +ATOM 2066 C GLN A 257 58.802 30.896 15.748 1.00 46.33 C +ATOM 2067 O GLN A 257 58.124 31.563 14.981 1.00 46.15 O +ATOM 2068 CB GLN A 257 59.953 32.921 16.667 1.00 48.31 C +ATOM 2069 CG GLN A 257 59.145 34.117 17.171 1.00 51.26 C +ATOM 2070 CD GLN A 257 60.037 35.277 17.591 1.00 52.08 C +ATOM 2071 OE1 GLN A 257 59.616 36.189 18.319 1.00 51.64 O +ATOM 2072 NE2 GLN A 257 61.283 35.240 17.132 1.00 52.58 N +ATOM 2073 N CYS A 258 59.078 29.612 15.504 1.00 45.55 N +ATOM 2074 CA CYS A 258 58.512 28.969 14.312 1.00 46.40 C +ATOM 2075 C CYS A 258 57.606 27.763 14.620 1.00 44.58 C +ATOM 2076 O CYS A 258 57.745 27.129 15.651 1.00 46.00 O +ATOM 2077 CB CYS A 258 59.611 28.518 13.370 1.00 49.17 C +ATOM 2078 SG CYS A 258 60.181 26.890 13.737 1.00 56.51 S +ATOM 2079 N PHE A 259 56.699 27.442 13.703 1.00 41.97 N +ATOM 2080 CA PHE A 259 55.752 26.346 13.864 1.00 39.89 C +ATOM 2081 C PHE A 259 56.258 25.015 13.376 1.00 40.91 C +ATOM 2082 O PHE A 259 56.438 24.860 12.171 1.00 41.98 O +ATOM 2083 CB PHE A 259 54.488 26.621 13.070 1.00 37.90 C +ATOM 2084 CG PHE A 259 53.640 27.713 13.619 1.00 36.51 C +ATOM 2085 CD1 PHE A 259 54.214 28.835 14.206 1.00 34.81 C +ATOM 2086 CD2 PHE A 259 52.249 27.636 13.500 1.00 35.63 C +ATOM 2087 CE1 PHE A 259 53.415 29.867 14.664 1.00 36.26 C +ATOM 2088 CE2 PHE A 259 51.440 28.659 13.951 1.00 35.54 C +ATOM 2089 CZ PHE A 259 52.013 29.782 14.534 1.00 36.18 C +ATOM 2090 N GLU A 260 56.464 24.040 14.269 1.00 41.30 N +ATOM 2091 CA GLU A 260 56.915 22.715 13.812 1.00 40.29 C +ATOM 2092 C GLU A 260 55.806 21.730 14.163 1.00 40.66 C +ATOM 2093 O GLU A 260 55.118 21.966 15.149 1.00 44.21 O +ATOM 2094 CB GLU A 260 58.220 22.316 14.509 1.00 37.22 C +ATOM 2095 CG GLU A 260 59.207 21.607 13.583 1.00 39.65 C +ATOM 2096 CD GLU A 260 60.565 21.263 14.227 1.00 41.06 C +ATOM 2097 OE1 GLU A 260 60.556 20.500 15.208 1.00 41.60 O +ATOM 2098 OE2 GLU A 260 61.642 21.738 13.757 1.00 41.57 O +ATOM 2099 N ILE A 261 55.551 20.713 13.332 1.00 38.66 N +ATOM 2100 CA ILE A 261 54.568 19.670 13.666 1.00 37.66 C +ATOM 2101 C ILE A 261 55.375 18.424 13.393 1.00 40.04 C +ATOM 2102 O ILE A 261 56.438 18.530 12.801 1.00 43.47 O +ATOM 2103 CB ILE A 261 53.291 19.627 12.797 1.00 36.03 C +ATOM 2104 CG1 ILE A 261 53.558 18.966 11.452 1.00 33.58 C +ATOM 2105 CG2 ILE A 261 52.722 21.005 12.654 1.00 36.15 C +ATOM 2106 CD1 ILE A 261 52.284 18.650 10.721 1.00 31.44 C +ATOM 2107 N THR A 262 54.901 17.248 13.805 1.00 41.30 N +ATOM 2108 CA THR A 262 55.669 15.996 13.633 1.00 39.49 C +ATOM 2109 C THR A 262 55.047 15.085 12.594 1.00 39.93 C +ATOM 2110 O THR A 262 53.879 14.720 12.678 1.00 40.97 O +ATOM 2111 CB THR A 262 55.743 15.196 14.957 1.00 37.11 C +ATOM 2112 OG1 THR A 262 55.976 16.077 16.053 1.00 35.95 O +ATOM 2113 CG2 THR A 262 56.839 14.233 14.917 1.00 35.91 C +ATOM 2114 N LEU A 263 55.816 14.694 11.610 1.00 39.30 N +ATOM 2115 CA LEU A 263 55.213 13.835 10.639 1.00 41.64 C +ATOM 2116 C LEU A 263 55.635 12.400 10.900 1.00 43.15 C +ATOM 2117 O LEU A 263 56.827 12.086 10.864 1.00 45.09 O +ATOM 2118 CB LEU A 263 55.621 14.290 9.238 1.00 41.95 C +ATOM 2119 CG LEU A 263 55.215 15.732 8.882 1.00 41.53 C +ATOM 2120 CD1 LEU A 263 55.760 16.092 7.489 1.00 38.33 C +ATOM 2121 CD2 LEU A 263 53.681 15.870 8.942 1.00 38.27 C +ATOM 2122 N GLU A 264 54.667 11.534 11.209 1.00 43.05 N +ATOM 2123 CA GLU A 264 54.956 10.106 11.437 1.00 41.96 C +ATOM 2124 C GLU A 264 54.657 9.456 10.095 1.00 39.91 C +ATOM 2125 O GLU A 264 53.527 9.094 9.807 1.00 38.69 O +ATOM 2126 CB GLU A 264 54.070 9.545 12.562 1.00 41.84 C +ATOM 2127 CG GLU A 264 54.485 10.047 13.962 1.00 41.32 C +ATOM 2128 CD GLU A 264 55.819 9.477 14.463 1.00 40.03 C +ATOM 2129 OE1 GLU A 264 56.311 9.937 15.513 1.00 38.91 O +ATOM 2130 OE2 GLU A 264 56.367 8.563 13.821 1.00 39.45 O +ATOM 2131 N LEU A 265 55.696 9.304 9.289 1.00 38.64 N +ATOM 2132 CA LEU A 265 55.521 8.828 7.937 1.00 39.64 C +ATOM 2133 C LEU A 265 55.498 7.374 7.606 1.00 40.38 C +ATOM 2134 O LEU A 265 55.187 7.015 6.471 1.00 40.66 O +ATOM 2135 CB LEU A 265 56.535 9.517 7.040 1.00 39.37 C +ATOM 2136 CG LEU A 265 56.480 11.031 7.193 1.00 38.93 C +ATOM 2137 CD1 LEU A 265 57.473 11.617 6.262 1.00 40.18 C +ATOM 2138 CD2 LEU A 265 55.101 11.560 6.891 1.00 38.48 C +ATOM 2139 N SER A 266 55.827 6.531 8.570 1.00 41.90 N +ATOM 2140 CA SER A 266 55.808 5.095 8.325 1.00 43.20 C +ATOM 2141 C SER A 266 55.490 4.294 9.577 1.00 44.35 C +ATOM 2142 O SER A 266 55.937 4.638 10.663 1.00 45.16 O +ATOM 2143 CB SER A 266 57.158 4.631 7.789 1.00 41.83 C +ATOM 2144 OG SER A 266 58.130 4.651 8.816 1.00 42.81 O +ATOM 2145 N CYS A 267 54.706 3.232 9.428 1.00 46.09 N +ATOM 2146 CA CYS A 267 54.403 2.365 10.561 1.00 47.04 C +ATOM 2147 C CYS A 267 55.726 1.699 10.926 1.00 45.85 C +ATOM 2148 O CYS A 267 56.209 1.801 12.054 1.00 46.56 O +ATOM 2149 CB CYS A 267 53.397 1.261 10.190 1.00 48.32 C +ATOM 2150 SG CYS A 267 51.737 1.798 9.677 1.00 51.84 S +ATOM 2151 N CYS A 268 56.299 1.012 9.946 1.00 44.83 N +ATOM 2152 CA CYS A 268 57.549 0.302 10.110 1.00 44.85 C +ATOM 2153 C CYS A 268 58.718 1.271 10.121 1.00 45.51 C +ATOM 2154 O CYS A 268 59.085 1.813 9.081 1.00 46.29 O +ATOM 2155 CB CYS A 268 57.718 -0.686 8.979 1.00 45.41 C +ATOM 2156 SG CYS A 268 59.354 -1.422 9.050 1.00 49.44 S +ATOM 2157 N LYS A 269 59.312 1.454 11.297 1.00 45.15 N +ATOM 2158 CA LYS A 269 60.411 2.383 11.505 1.00 45.19 C +ATOM 2159 C LYS A 269 61.597 2.310 10.548 1.00 45.83 C +ATOM 2160 O LYS A 269 62.192 3.344 10.217 1.00 45.73 O +ATOM 2161 CB LYS A 269 60.889 2.270 12.956 1.00 45.93 C +ATOM 2162 CG LYS A 269 59.788 2.579 13.982 1.00 46.96 C +ATOM 2163 CD LYS A 269 60.252 2.417 15.426 1.00 47.72 C +ATOM 2164 CE LYS A 269 60.689 3.736 16.059 1.00 48.52 C +ATOM 2165 NZ LYS A 269 59.516 4.625 16.245 1.00 45.56 N +ATOM 2166 N TYR A 270 61.946 1.107 10.094 1.00 46.20 N +ATOM 2167 CA TYR A 270 63.069 0.940 9.166 1.00 46.69 C +ATOM 2168 C TYR A 270 62.706 -0.087 8.101 1.00 47.19 C +ATOM 2169 O TYR A 270 63.290 -1.168 8.070 1.00 47.87 O +ATOM 2170 CB TYR A 270 64.304 0.473 9.931 1.00 45.69 C +ATOM 2171 CG TYR A 270 65.630 0.753 9.247 1.00 47.77 C +ATOM 2172 CD1 TYR A 270 66.810 0.874 10.003 1.00 47.74 C +ATOM 2173 CD2 TYR A 270 65.724 0.878 7.853 1.00 47.01 C +ATOM 2174 CE1 TYR A 270 68.031 1.109 9.395 1.00 46.45 C +ATOM 2175 CE2 TYR A 270 66.952 1.113 7.242 1.00 46.87 C +ATOM 2176 CZ TYR A 270 68.094 1.225 8.022 1.00 47.38 C +ATOM 2177 OH TYR A 270 69.311 1.445 7.436 1.00 49.20 O +ATOM 2178 N PRO A 271 61.763 0.256 7.198 1.00 47.21 N +ATOM 2179 CA PRO A 271 61.236 -0.562 6.093 1.00 48.61 C +ATOM 2180 C PRO A 271 62.260 -1.036 5.069 1.00 50.50 C +ATOM 2181 O PRO A 271 63.337 -0.466 4.986 1.00 52.67 O +ATOM 2182 CB PRO A 271 60.173 0.345 5.477 1.00 48.32 C +ATOM 2183 CG PRO A 271 60.750 1.699 5.674 1.00 47.47 C +ATOM 2184 CD PRO A 271 61.315 1.653 7.066 1.00 46.51 C +ATOM 2185 N ARG A 272 61.937 -2.066 4.283 1.00 52.17 N +ATOM 2186 CA ARG A 272 62.883 -2.564 3.280 1.00 53.35 C +ATOM 2187 C ARG A 272 63.029 -1.598 2.090 1.00 53.15 C +ATOM 2188 O ARG A 272 62.078 -0.919 1.730 1.00 53.43 O +ATOM 2189 CB ARG A 272 62.449 -3.947 2.812 1.00 55.37 C +ATOM 2190 CG ARG A 272 62.461 -4.983 3.922 1.00 60.08 C +ATOM 2191 CD ARG A 272 62.120 -6.394 3.417 1.00 64.80 C +ATOM 2192 NE ARG A 272 60.936 -6.418 2.542 1.00 69.45 N +ATOM 2193 CZ ARG A 272 60.979 -6.334 1.208 1.00 70.40 C +ATOM 2194 NH1 ARG A 272 59.857 -6.357 0.485 1.00 69.21 N +ATOM 2195 NH2 ARG A 272 62.153 -6.241 0.590 1.00 71.56 N +ATOM 2196 N GLU A 273 64.220 -1.542 1.489 1.00 53.13 N +ATOM 2197 CA GLU A 273 64.518 -0.634 0.372 1.00 53.64 C +ATOM 2198 C GLU A 273 63.484 -0.612 -0.734 1.00 54.80 C +ATOM 2199 O GLU A 273 63.109 0.441 -1.263 1.00 55.42 O +ATOM 2200 CB GLU A 273 65.868 -0.982 -0.246 1.00 53.56 C +ATOM 2201 CG GLU A 273 67.063 -0.598 0.590 1.00 56.13 C +ATOM 2202 CD GLU A 273 68.379 -0.831 -0.126 1.00 57.51 C +ATOM 2203 OE1 GLU A 273 69.396 -0.231 0.270 1.00 60.09 O +ATOM 2204 OE2 GLU A 273 68.409 -1.619 -1.083 1.00 57.34 O +ATOM 2205 N GLU A 274 63.032 -1.793 -1.098 1.00 55.15 N +ATOM 2206 CA GLU A 274 62.049 -1.943 -2.148 1.00 55.69 C +ATOM 2207 C GLU A 274 60.763 -1.107 -1.945 1.00 54.05 C +ATOM 2208 O GLU A 274 59.952 -0.957 -2.862 1.00 54.17 O +ATOM 2209 CB GLU A 274 61.753 -3.436 -2.243 1.00 58.48 C +ATOM 2210 CG GLU A 274 62.964 -4.238 -1.756 1.00 64.09 C +ATOM 2211 CD GLU A 274 63.035 -5.653 -2.323 1.00 70.13 C +ATOM 2212 OE1 GLU A 274 62.982 -5.806 -3.580 1.00 71.48 O +ATOM 2213 OE2 GLU A 274 63.162 -6.615 -1.512 1.00 71.05 O +ATOM 2214 N LYS A 275 60.589 -0.539 -0.755 1.00 52.09 N +ATOM 2215 CA LYS A 275 59.389 0.240 -0.447 1.00 50.55 C +ATOM 2216 C LYS A 275 59.489 1.764 -0.565 1.00 47.59 C +ATOM 2217 O LYS A 275 58.486 2.471 -0.479 1.00 46.33 O +ATOM 2218 CB LYS A 275 58.913 -0.093 0.965 1.00 52.58 C +ATOM 2219 CG LYS A 275 58.624 -1.555 1.240 1.00 56.79 C +ATOM 2220 CD LYS A 275 58.142 -1.711 2.701 1.00 61.65 C +ATOM 2221 CE LYS A 275 57.840 -3.167 3.121 1.00 63.34 C +ATOM 2222 NZ LYS A 275 56.486 -3.658 2.691 1.00 62.58 N +ATOM 2223 N LEU A 276 60.693 2.268 -0.760 1.00 44.44 N +ATOM 2224 CA LEU A 276 60.890 3.691 -0.845 1.00 42.55 C +ATOM 2225 C LEU A 276 60.102 4.340 -1.995 1.00 43.89 C +ATOM 2226 O LEU A 276 59.399 5.346 -1.810 1.00 43.31 O +ATOM 2227 CB LEU A 276 62.392 3.940 -0.924 1.00 39.24 C +ATOM 2228 CG LEU A 276 62.956 3.474 0.427 1.00 38.94 C +ATOM 2229 CD1 LEU A 276 64.433 3.152 0.361 1.00 35.92 C +ATOM 2230 CD2 LEU A 276 62.662 4.546 1.477 1.00 37.13 C +ATOM 2231 N PRO A 277 60.202 3.779 -3.205 1.00 44.67 N +ATOM 2232 CA PRO A 277 59.445 4.397 -4.285 1.00 44.01 C +ATOM 2233 C PRO A 277 58.053 4.699 -3.805 1.00 44.93 C +ATOM 2234 O PRO A 277 57.551 5.783 -4.026 1.00 46.38 O +ATOM 2235 CB PRO A 277 59.468 3.333 -5.348 1.00 43.63 C +ATOM 2236 CG PRO A 277 60.873 2.830 -5.214 1.00 44.61 C +ATOM 2237 CD PRO A 277 61.059 2.697 -3.719 1.00 45.65 C +ATOM 2238 N SER A 278 57.437 3.754 -3.105 1.00 45.57 N +ATOM 2239 CA SER A 278 56.073 3.963 -2.621 1.00 45.66 C +ATOM 2240 C SER A 278 55.961 5.019 -1.541 1.00 45.47 C +ATOM 2241 O SER A 278 54.953 5.735 -1.425 1.00 44.82 O +ATOM 2242 CB SER A 278 55.504 2.681 -2.073 1.00 46.26 C +ATOM 2243 OG SER A 278 54.123 2.862 -1.817 1.00 50.18 O +ATOM 2244 N PHE A 279 56.999 5.083 -0.724 1.00 45.21 N +ATOM 2245 CA PHE A 279 57.047 6.052 0.345 1.00 43.21 C +ATOM 2246 C PHE A 279 57.211 7.403 -0.307 1.00 43.60 C +ATOM 2247 O PHE A 279 56.507 8.358 0.036 1.00 43.64 O +ATOM 2248 CB PHE A 279 58.201 5.728 1.292 1.00 40.77 C +ATOM 2249 CG PHE A 279 57.848 4.704 2.328 1.00 38.54 C +ATOM 2250 CD1 PHE A 279 56.722 4.877 3.130 1.00 37.15 C +ATOM 2251 CD2 PHE A 279 58.635 3.583 2.519 1.00 39.55 C +ATOM 2252 CE1 PHE A 279 56.384 3.967 4.095 1.00 35.62 C +ATOM 2253 CE2 PHE A 279 58.306 2.641 3.503 1.00 38.62 C +ATOM 2254 CZ PHE A 279 57.178 2.839 4.288 1.00 38.17 C +ATOM 2255 N TRP A 280 58.125 7.490 -1.264 1.00 43.26 N +ATOM 2256 CA TRP A 280 58.279 8.751 -1.933 1.00 44.32 C +ATOM 2257 C TRP A 280 56.887 9.068 -2.471 1.00 45.30 C +ATOM 2258 O TRP A 280 56.323 10.122 -2.202 1.00 44.76 O +ATOM 2259 CB TRP A 280 59.290 8.658 -3.089 1.00 44.14 C +ATOM 2260 CG TRP A 280 59.228 9.877 -4.000 1.00 43.99 C +ATOM 2261 CD1 TRP A 280 58.833 9.909 -5.311 1.00 44.84 C +ATOM 2262 CD2 TRP A 280 59.458 11.238 -3.628 1.00 43.75 C +ATOM 2263 NE1 TRP A 280 58.790 11.207 -5.777 1.00 44.06 N +ATOM 2264 CE2 TRP A 280 59.169 12.042 -4.763 1.00 44.14 C +ATOM 2265 CE3 TRP A 280 59.878 11.860 -2.448 1.00 42.60 C +ATOM 2266 CZ2 TRP A 280 59.286 13.421 -4.746 1.00 44.06 C +ATOM 2267 CZ3 TRP A 280 59.995 13.225 -2.430 1.00 43.03 C +ATOM 2268 CH2 TRP A 280 59.700 13.996 -3.572 1.00 45.79 C +ATOM 2269 N ASN A 281 56.308 8.108 -3.177 1.00 46.78 N +ATOM 2270 CA ASN A 281 55.014 8.309 -3.787 1.00 48.87 C +ATOM 2271 C ASN A 281 53.882 8.781 -2.879 1.00 48.70 C +ATOM 2272 O ASN A 281 53.157 9.708 -3.242 1.00 47.81 O +ATOM 2273 CB ASN A 281 54.586 7.050 -4.542 1.00 52.30 C +ATOM 2274 CG ASN A 281 53.434 7.322 -5.524 1.00 56.29 C +ATOM 2275 OD1 ASN A 281 53.561 8.163 -6.433 1.00 56.70 O +ATOM 2276 ND2 ASN A 281 52.306 6.611 -5.342 1.00 56.23 N +ATOM 2277 N ASN A 282 53.701 8.160 -1.715 1.00 49.29 N +ATOM 2278 CA ASN A 282 52.614 8.593 -0.827 1.00 49.17 C +ATOM 2279 C ASN A 282 52.938 9.829 -0.018 1.00 49.68 C +ATOM 2280 O ASN A 282 52.172 10.172 0.880 1.00 50.16 O +ATOM 2281 CB ASN A 282 52.228 7.513 0.158 1.00 49.95 C +ATOM 2282 CG ASN A 282 51.509 6.388 -0.480 1.00 51.49 C +ATOM 2283 OD1 ASN A 282 50.298 6.461 -0.723 1.00 52.13 O +ATOM 2284 ND2 ASN A 282 52.246 5.319 -0.775 1.00 51.86 N +ATOM 2285 N ASN A 283 54.062 10.491 -0.312 1.00 48.99 N +ATOM 2286 CA ASN A 283 54.423 11.697 0.423 1.00 47.23 C +ATOM 2287 C ASN A 283 54.718 12.932 -0.416 1.00 46.79 C +ATOM 2288 O ASN A 283 54.476 14.050 0.014 1.00 47.11 O +ATOM 2289 CB ASN A 283 55.564 11.378 1.367 1.00 44.87 C +ATOM 2290 CG ASN A 283 55.112 10.523 2.509 1.00 43.63 C +ATOM 2291 OD1 ASN A 283 54.904 9.320 2.364 1.00 41.34 O +ATOM 2292 ND2 ASN A 283 54.915 11.148 3.654 1.00 43.50 N +ATOM 2293 N LYS A 284 55.226 12.716 -1.616 1.00 46.95 N +ATOM 2294 CA LYS A 284 55.521 13.777 -2.567 1.00 47.16 C +ATOM 2295 C LYS A 284 54.615 14.985 -2.361 1.00 47.01 C +ATOM 2296 O LYS A 284 54.998 15.983 -1.763 1.00 47.77 O +ATOM 2297 CB LYS A 284 55.305 13.217 -3.962 1.00 48.72 C +ATOM 2298 CG LYS A 284 56.023 13.927 -5.079 1.00 52.36 C +ATOM 2299 CD LYS A 284 56.068 13.035 -6.345 1.00 53.92 C +ATOM 2300 CE LYS A 284 54.697 12.804 -6.972 1.00 51.87 C +ATOM 2301 NZ LYS A 284 54.811 11.885 -8.127 1.00 53.93 N +ATOM 2302 N ALA A 285 53.394 14.883 -2.852 1.00 47.27 N +ATOM 2303 CA ALA A 285 52.428 15.971 -2.729 1.00 48.06 C +ATOM 2304 C ALA A 285 52.272 16.553 -1.319 1.00 47.51 C +ATOM 2305 O ALA A 285 51.971 17.732 -1.142 1.00 46.79 O +ATOM 2306 CB ALA A 285 51.076 15.496 -3.242 1.00 48.65 C +ATOM 2307 N SER A 286 52.457 15.721 -0.311 1.00 47.91 N +ATOM 2308 CA SER A 286 52.317 16.207 1.049 1.00 48.42 C +ATOM 2309 C SER A 286 53.461 17.124 1.475 1.00 47.19 C +ATOM 2310 O SER A 286 53.212 18.153 2.101 1.00 45.61 O +ATOM 2311 CB SER A 286 52.164 15.031 2.019 1.00 49.47 C +ATOM 2312 OG SER A 286 50.838 14.532 1.976 1.00 49.15 O +ATOM 2313 N LEU A 287 54.704 16.755 1.152 1.00 46.22 N +ATOM 2314 CA LEU A 287 55.840 17.619 1.489 1.00 44.95 C +ATOM 2315 C LEU A 287 55.594 18.956 0.774 1.00 44.50 C +ATOM 2316 O LEU A 287 55.573 20.010 1.409 1.00 44.82 O +ATOM 2317 CB LEU A 287 57.196 17.047 1.018 1.00 41.76 C +ATOM 2318 CG LEU A 287 57.846 15.784 1.595 1.00 39.51 C +ATOM 2319 CD1 LEU A 287 57.964 15.849 3.090 1.00 38.22 C +ATOM 2320 CD2 LEU A 287 57.042 14.611 1.189 1.00 38.62 C +ATOM 2321 N ILE A 288 55.372 18.912 -0.537 1.00 43.37 N +ATOM 2322 CA ILE A 288 55.158 20.152 -1.278 1.00 43.27 C +ATOM 2323 C ILE A 288 54.006 21.024 -0.726 1.00 44.37 C +ATOM 2324 O ILE A 288 54.198 22.220 -0.468 1.00 44.72 O +ATOM 2325 CB ILE A 288 54.922 19.889 -2.815 1.00 41.11 C +ATOM 2326 CG1 ILE A 288 56.048 19.016 -3.396 1.00 39.62 C +ATOM 2327 CG2 ILE A 288 54.823 21.204 -3.562 1.00 35.37 C +ATOM 2328 CD1 ILE A 288 57.458 19.541 -3.212 1.00 38.44 C +ATOM 2329 N GLU A 289 52.825 20.440 -0.533 1.00 44.75 N +ATOM 2330 CA GLU A 289 51.692 21.220 -0.043 1.00 44.65 C +ATOM 2331 C GLU A 289 51.928 21.852 1.317 1.00 44.26 C +ATOM 2332 O GLU A 289 51.345 22.899 1.646 1.00 42.99 O +ATOM 2333 CB GLU A 289 50.434 20.365 0.003 1.00 44.92 C +ATOM 2334 CG GLU A 289 49.534 20.565 -1.201 1.00 47.90 C +ATOM 2335 CD GLU A 289 48.869 21.959 -1.256 1.00 50.34 C +ATOM 2336 OE1 GLU A 289 48.874 22.553 -2.351 1.00 52.03 O +ATOM 2337 OE2 GLU A 289 48.323 22.466 -0.237 1.00 50.96 O +ATOM 2338 N TYR A 290 52.806 21.216 2.090 1.00 44.17 N +ATOM 2339 CA TYR A 290 53.140 21.655 3.446 1.00 42.59 C +ATOM 2340 C TYR A 290 54.060 22.862 3.387 1.00 42.38 C +ATOM 2341 O TYR A 290 53.772 23.905 3.983 1.00 42.21 O +ATOM 2342 CB TYR A 290 53.806 20.508 4.210 1.00 41.04 C +ATOM 2343 CG TYR A 290 53.965 20.794 5.656 1.00 39.23 C +ATOM 2344 CD1 TYR A 290 52.866 20.772 6.510 1.00 39.46 C +ATOM 2345 CD2 TYR A 290 55.198 21.214 6.153 1.00 39.45 C +ATOM 2346 CE1 TYR A 290 52.988 21.183 7.846 1.00 41.65 C +ATOM 2347 CE2 TYR A 290 55.350 21.631 7.472 1.00 40.09 C +ATOM 2348 CZ TYR A 290 54.243 21.621 8.323 1.00 42.27 C +ATOM 2349 OH TYR A 290 54.395 22.079 9.623 1.00 42.67 O +ATOM 2350 N ILE A 291 55.172 22.699 2.674 1.00 42.44 N +ATOM 2351 CA ILE A 291 56.150 23.765 2.474 1.00 41.29 C +ATOM 2352 C ILE A 291 55.331 24.981 2.058 1.00 41.43 C +ATOM 2353 O ILE A 291 55.348 26.031 2.692 1.00 40.84 O +ATOM 2354 CB ILE A 291 57.172 23.375 1.327 1.00 40.26 C +ATOM 2355 CG1 ILE A 291 58.348 22.573 1.915 1.00 40.15 C +ATOM 2356 CG2 ILE A 291 57.668 24.608 0.594 1.00 39.17 C +ATOM 2357 CD1 ILE A 291 59.325 22.009 0.892 1.00 36.33 C +ATOM 2358 N LYS A 292 54.567 24.790 0.998 1.00 42.02 N +ATOM 2359 CA LYS A 292 53.735 25.828 0.428 1.00 42.48 C +ATOM 2360 C LYS A 292 52.948 26.623 1.454 1.00 41.75 C +ATOM 2361 O LYS A 292 52.519 27.729 1.186 1.00 39.71 O +ATOM 2362 CB LYS A 292 52.798 25.169 -0.596 1.00 45.01 C +ATOM 2363 CG LYS A 292 51.904 26.118 -1.399 1.00 48.28 C +ATOM 2364 CD LYS A 292 51.596 25.591 -2.817 1.00 47.86 C +ATOM 2365 CE LYS A 292 50.883 24.248 -2.809 1.00 47.50 C +ATOM 2366 NZ LYS A 292 50.419 23.826 -4.167 1.00 47.17 N +ATOM 2367 N GLN A 293 52.770 26.063 2.642 1.00 43.31 N +ATOM 2368 CA GLN A 293 51.972 26.720 3.688 1.00 43.70 C +ATOM 2369 C GLN A 293 52.707 27.830 4.423 1.00 44.28 C +ATOM 2370 O GLN A 293 52.110 28.587 5.218 1.00 44.96 O +ATOM 2371 CB GLN A 293 51.483 25.671 4.694 1.00 42.45 C +ATOM 2372 CG GLN A 293 50.499 24.693 4.122 1.00 42.52 C +ATOM 2373 CD GLN A 293 49.350 25.389 3.425 1.00 43.20 C +ATOM 2374 OE1 GLN A 293 48.870 26.416 3.890 1.00 43.21 O +ATOM 2375 NE2 GLN A 293 48.904 24.831 2.304 1.00 44.35 N +ATOM 2376 N VAL A 294 54.007 27.913 4.151 1.00 43.19 N +ATOM 2377 CA VAL A 294 54.874 28.905 4.764 1.00 41.47 C +ATOM 2378 C VAL A 294 54.376 30.304 4.367 1.00 41.92 C +ATOM 2379 O VAL A 294 54.884 31.326 4.843 1.00 43.62 O +ATOM 2380 CB VAL A 294 56.336 28.678 4.297 1.00 39.88 C +ATOM 2381 CG1 VAL A 294 56.615 29.462 3.042 1.00 38.76 C +ATOM 2382 CG2 VAL A 294 57.299 29.009 5.412 1.00 39.17 C +ATOM 2383 N HIS A 295 53.350 30.342 3.519 1.00 40.34 N +ATOM 2384 CA HIS A 295 52.804 31.596 3.057 1.00 38.08 C +ATOM 2385 C HIS A 295 51.420 31.912 3.595 1.00 39.08 C +ATOM 2386 O HIS A 295 50.660 32.613 2.937 1.00 41.35 O +ATOM 2387 CB HIS A 295 52.777 31.622 1.526 1.00 35.54 C +ATOM 2388 CG HIS A 295 54.125 31.492 0.896 1.00 35.20 C +ATOM 2389 ND1 HIS A 295 55.115 32.438 1.057 1.00 37.64 N +ATOM 2390 CD2 HIS A 295 54.685 30.477 0.198 1.00 35.84 C +ATOM 2391 CE1 HIS A 295 56.232 32.002 0.501 1.00 38.49 C +ATOM 2392 NE2 HIS A 295 55.998 30.811 -0.026 1.00 36.92 N +ATOM 2393 N LEU A 296 51.063 31.424 4.776 1.00 39.18 N +ATOM 2394 CA LEU A 296 49.731 31.747 5.303 1.00 40.05 C +ATOM 2395 C LEU A 296 49.812 33.080 6.027 1.00 40.72 C +ATOM 2396 O LEU A 296 50.871 33.463 6.494 1.00 41.97 O +ATOM 2397 CB LEU A 296 49.267 30.686 6.312 1.00 40.53 C +ATOM 2398 CG LEU A 296 48.892 29.243 5.977 1.00 38.89 C +ATOM 2399 CD1 LEU A 296 49.129 28.421 7.199 1.00 38.66 C +ATOM 2400 CD2 LEU A 296 47.434 29.132 5.563 1.00 39.36 C +ATOM 2401 N GLY A 297 48.703 33.792 6.126 1.00 42.92 N +ATOM 2402 CA GLY A 297 48.696 35.056 6.863 1.00 45.80 C +ATOM 2403 C GLY A 297 49.418 36.287 6.330 1.00 47.30 C +ATOM 2404 O GLY A 297 49.369 36.575 5.139 1.00 46.84 O +ATOM 2405 N VAL A 298 50.080 37.014 7.235 1.00 49.35 N +ATOM 2406 CA VAL A 298 50.817 38.236 6.901 1.00 50.46 C +ATOM 2407 C VAL A 298 52.267 38.273 7.307 1.00 51.41 C +ATOM 2408 O VAL A 298 52.717 37.508 8.163 1.00 51.99 O +ATOM 2409 CB VAL A 298 50.213 39.466 7.549 1.00 50.63 C +ATOM 2410 CG1 VAL A 298 48.884 39.779 6.905 1.00 52.06 C +ATOM 2411 CG2 VAL A 298 50.073 39.231 9.043 1.00 48.74 C +ATOM 2412 N LYS A 299 52.981 39.215 6.690 1.00 52.35 N +ATOM 2413 CA LYS A 299 54.405 39.444 6.937 1.00 52.22 C +ATOM 2414 C LYS A 299 54.711 40.898 6.602 1.00 53.02 C +ATOM 2415 O LYS A 299 53.887 41.591 6.013 1.00 54.51 O +ATOM 2416 CB LYS A 299 55.250 38.545 6.048 1.00 50.49 C +ATOM 2417 CG LYS A 299 54.959 38.731 4.557 1.00 48.92 C +ATOM 2418 CD LYS A 299 56.004 37.995 3.713 1.00 47.82 C +ATOM 2419 CE LYS A 299 55.541 37.804 2.293 1.00 45.92 C +ATOM 2420 NZ LYS A 299 56.448 36.877 1.596 1.00 46.10 N +ATOM 2421 N GLY A 300 55.893 41.355 6.975 1.00 53.04 N +ATOM 2422 CA GLY A 300 56.273 42.722 6.694 1.00 55.05 C +ATOM 2423 C GLY A 300 57.345 43.112 7.685 1.00 57.62 C +ATOM 2424 O GLY A 300 57.869 42.253 8.416 1.00 57.87 O +ATOM 2425 N GLN A 301 57.716 44.387 7.703 1.00 57.64 N +ATOM 2426 CA GLN A 301 58.696 44.822 8.676 1.00 57.99 C +ATOM 2427 C GLN A 301 58.145 46.068 9.335 1.00 58.90 C +ATOM 2428 O GLN A 301 57.163 46.640 8.846 1.00 58.87 O +ATOM 2429 CB GLN A 301 60.083 45.036 8.052 1.00 57.30 C +ATOM 2430 CG GLN A 301 60.133 45.615 6.655 1.00 56.81 C +ATOM 2431 CD GLN A 301 61.545 45.600 6.099 1.00 55.10 C +ATOM 2432 OE1 GLN A 301 61.807 46.090 5.004 1.00 56.18 O +ATOM 2433 NE2 GLN A 301 62.462 45.032 6.857 1.00 53.92 N +ATOM 2434 N VAL A 302 58.759 46.456 10.453 1.00 59.46 N +ATOM 2435 CA VAL A 302 58.320 47.589 11.260 1.00 59.54 C +ATOM 2436 C VAL A 302 59.336 48.700 11.432 1.00 59.29 C +ATOM 2437 O VAL A 302 60.425 48.456 11.939 1.00 58.31 O +ATOM 2438 CB VAL A 302 57.953 47.095 12.679 1.00 60.83 C +ATOM 2439 CG1 VAL A 302 57.725 48.280 13.621 1.00 60.37 C +ATOM 2440 CG2 VAL A 302 56.732 46.177 12.612 1.00 60.94 C +ATOM 2441 N PHE A 303 58.981 49.922 11.038 1.00 60.18 N +ATOM 2442 CA PHE A 303 59.906 51.047 11.237 1.00 61.29 C +ATOM 2443 C PHE A 303 59.325 52.197 12.049 1.00 61.38 C +ATOM 2444 O PHE A 303 58.103 52.396 12.109 1.00 60.75 O +ATOM 2445 CB PHE A 303 60.401 51.693 9.930 1.00 61.32 C +ATOM 2446 CG PHE A 303 60.299 50.838 8.724 1.00 61.50 C +ATOM 2447 CD1 PHE A 303 59.085 50.702 8.061 1.00 61.97 C +ATOM 2448 CD2 PHE A 303 61.440 50.243 8.188 1.00 61.77 C +ATOM 2449 CE1 PHE A 303 59.004 49.985 6.863 1.00 63.16 C +ATOM 2450 CE2 PHE A 303 61.375 49.528 6.996 1.00 63.27 C +ATOM 2451 CZ PHE A 303 60.148 49.399 6.326 1.00 63.00 C +ATOM 2452 N ASP A 304 60.233 52.969 12.645 1.00 62.19 N +ATOM 2453 CA ASP A 304 59.882 54.159 13.412 1.00 63.30 C +ATOM 2454 C ASP A 304 59.692 55.250 12.372 1.00 63.74 C +ATOM 2455 O ASP A 304 59.848 55.005 11.178 1.00 64.20 O +ATOM 2456 CB ASP A 304 61.009 54.556 14.365 1.00 62.77 C +ATOM 2457 CG ASP A 304 62.355 54.642 13.670 1.00 63.91 C +ATOM 2458 OD1 ASP A 304 62.372 54.807 12.420 1.00 63.12 O +ATOM 2459 OD2 ASP A 304 63.393 54.550 14.377 1.00 64.52 O +ATOM 2460 N GLN A 305 59.386 56.459 12.818 1.00 64.92 N +ATOM 2461 CA GLN A 305 59.147 57.562 11.889 1.00 65.59 C +ATOM 2462 C GLN A 305 60.327 57.947 10.972 1.00 64.90 C +ATOM 2463 O GLN A 305 60.127 58.669 9.997 1.00 64.89 O +ATOM 2464 CB GLN A 305 58.793 58.826 12.665 1.00 99.99 C +ATOM 2465 CG GLN A 305 57.422 58.661 13.310 0.00 99.99 C +ATOM 2466 CD GLN A 305 56.315 58.714 12.267 0.00 99.99 C +ATOM 2467 OE1 GLN A 305 56.585 58.872 11.079 0.00 99.99 O +ATOM 2468 NE2 GLN A 305 55.065 58.580 12.716 0.00 99.99 N +ATOM 2469 N ASN A 306 61.537 57.470 11.274 1.00 64.36 N +ATOM 2470 CA ASN A 306 62.716 57.767 10.444 1.00 64.50 C +ATOM 2471 C ASN A 306 62.967 56.594 9.512 1.00 64.87 C +ATOM 2472 O ASN A 306 64.094 56.406 9.031 1.00 64.49 O +ATOM 2473 CB ASN A 306 63.977 57.958 11.286 1.00 63.28 C +ATOM 2474 CG ASN A 306 63.754 58.856 12.453 1.00 62.68 C +ATOM 2475 OD1 ASN A 306 64.365 58.677 13.506 1.00 62.11 O +ATOM 2476 ND2 ASN A 306 62.872 59.839 12.286 1.00 63.12 N +ATOM 2477 N GLY A 307 61.914 55.804 9.288 1.00 64.89 N +ATOM 2478 CA GLY A 307 61.997 54.653 8.408 1.00 63.36 C +ATOM 2479 C GLY A 307 63.159 53.763 8.782 1.00 62.78 C +ATOM 2480 O GLY A 307 64.018 53.422 7.945 1.00 62.96 O +ATOM 2481 N ASN A 308 63.206 53.386 10.050 1.00 61.28 N +ATOM 2482 CA ASN A 308 64.285 52.525 10.496 1.00 60.73 C +ATOM 2483 C ASN A 308 63.738 51.256 11.101 1.00 58.49 C +ATOM 2484 O ASN A 308 63.058 51.286 12.107 1.00 59.00 O +ATOM 2485 CB ASN A 308 65.170 53.281 11.485 1.00 62.75 C +ATOM 2486 CG ASN A 308 66.100 54.282 10.788 1.00 64.57 C +ATOM 2487 OD1 ASN A 308 66.411 55.348 11.337 1.00 65.09 O +ATOM 2488 ND2 ASN A 308 66.556 53.931 9.578 1.00 64.49 N +ATOM 2489 N PRO A 309 64.009 50.114 10.473 1.00 57.04 N +ATOM 2490 CA PRO A 309 63.489 48.872 11.039 1.00 56.29 C +ATOM 2491 C PRO A 309 63.862 48.735 12.508 1.00 54.47 C +ATOM 2492 O PRO A 309 65.053 48.706 12.839 1.00 54.86 O +ATOM 2493 CB PRO A 309 64.163 47.805 10.186 1.00 56.75 C +ATOM 2494 CG PRO A 309 65.484 48.452 9.863 1.00 57.07 C +ATOM 2495 CD PRO A 309 65.027 49.827 9.454 1.00 57.21 C +ATOM 2496 N LEU A 310 62.854 48.669 13.378 1.00 51.09 N +ATOM 2497 CA LEU A 310 63.107 48.501 14.792 1.00 48.33 C +ATOM 2498 C LEU A 310 63.082 47.008 14.969 1.00 47.36 C +ATOM 2499 O LEU A 310 62.082 46.358 14.704 1.00 45.39 O +ATOM 2500 CB LEU A 310 61.985 49.070 15.655 1.00 50.59 C +ATOM 2501 CG LEU A 310 61.223 50.361 15.337 1.00 52.17 C +ATOM 2502 CD1 LEU A 310 59.913 50.419 16.143 1.00 49.09 C +ATOM 2503 CD2 LEU A 310 62.119 51.555 15.637 1.00 53.07 C +ATOM 2504 N PRO A 311 64.192 46.430 15.401 1.00 47.64 N +ATOM 2505 CA PRO A 311 64.213 44.984 15.599 1.00 48.88 C +ATOM 2506 C PRO A 311 63.687 44.682 17.004 1.00 48.70 C +ATOM 2507 O PRO A 311 63.190 45.561 17.690 1.00 48.37 O +ATOM 2508 CB PRO A 311 65.692 44.659 15.468 1.00 49.23 C +ATOM 2509 CG PRO A 311 66.317 45.829 16.145 1.00 46.47 C +ATOM 2510 CD PRO A 311 65.539 46.994 15.565 1.00 47.04 C +ATOM 2511 N ASN A 312 63.789 43.435 17.422 1.00 48.81 N +ATOM 2512 CA ASN A 312 63.359 43.061 18.749 1.00 49.45 C +ATOM 2513 C ASN A 312 62.012 43.581 19.277 1.00 48.38 C +ATOM 2514 O ASN A 312 61.728 43.496 20.461 1.00 46.85 O +ATOM 2515 CB ASN A 312 64.449 43.450 19.719 1.00 51.68 C +ATOM 2516 CG ASN A 312 64.483 42.547 20.890 1.00 54.81 C +ATOM 2517 OD1 ASN A 312 63.598 42.582 21.749 1.00 56.88 O +ATOM 2518 ND2 ASN A 312 65.486 41.683 20.924 1.00 57.99 N +ATOM 2519 N VAL A 313 61.181 44.123 18.413 1.00 48.92 N +ATOM 2520 CA VAL A 313 59.895 44.627 18.860 1.00 50.12 C +ATOM 2521 C VAL A 313 58.933 43.453 18.904 1.00 52.07 C +ATOM 2522 O VAL A 313 59.198 42.427 18.281 1.00 53.69 O +ATOM 2523 CB VAL A 313 59.373 45.684 17.878 1.00 48.46 C +ATOM 2524 CG1 VAL A 313 57.874 45.831 17.993 1.00 47.82 C +ATOM 2525 CG2 VAL A 313 60.049 46.996 18.159 1.00 48.57 C +ATOM 2526 N ILE A 314 57.828 43.593 19.636 1.00 52.46 N +ATOM 2527 CA ILE A 314 56.828 42.526 19.708 1.00 51.93 C +ATOM 2528 C ILE A 314 55.720 42.763 18.696 1.00 52.41 C +ATOM 2529 O ILE A 314 55.108 43.825 18.664 1.00 53.11 O +ATOM 2530 CB ILE A 314 56.151 42.430 21.115 1.00 50.87 C +ATOM 2531 CG1 ILE A 314 57.082 41.719 22.099 1.00 50.24 C +ATOM 2532 CG2 ILE A 314 54.818 41.690 21.018 1.00 47.87 C +ATOM 2533 CD1 ILE A 314 56.516 41.588 23.484 1.00 47.82 C +ATOM 2534 N VAL A 315 55.460 41.778 17.856 1.00 52.77 N +ATOM 2535 CA VAL A 315 54.366 41.924 16.918 1.00 53.24 C +ATOM 2536 C VAL A 315 53.516 40.665 16.933 1.00 53.42 C +ATOM 2537 O VAL A 315 53.928 39.640 16.411 1.00 53.10 O +ATOM 2538 CB VAL A 315 54.857 42.151 15.479 1.00 53.15 C +ATOM 2539 CG1 VAL A 315 53.682 42.571 14.592 1.00 51.63 C +ATOM 2540 CG2 VAL A 315 55.960 43.187 15.462 1.00 53.31 C +ATOM 2541 N GLU A 316 52.362 40.710 17.578 1.00 54.20 N +ATOM 2542 CA GLU A 316 51.503 39.553 17.536 1.00 57.24 C +ATOM 2543 C GLU A 316 50.072 39.958 17.512 1.00 58.67 C +ATOM 2544 O GLU A 316 49.763 41.101 17.802 1.00 58.87 O +ATOM 2545 CB GLU A 316 51.780 38.543 18.653 1.00 59.07 C +ATOM 2546 CG GLU A 316 52.051 39.010 20.062 1.00 60.94 C +ATOM 2547 CD GLU A 316 52.878 37.951 20.816 1.00 61.97 C +ATOM 2548 OE1 GLU A 316 52.934 37.956 22.069 1.00 64.90 O +ATOM 2549 OE2 GLU A 316 53.489 37.105 20.133 1.00 59.95 O +ATOM 2550 N VAL A 317 49.209 39.031 17.108 1.00 60.42 N +ATOM 2551 CA VAL A 317 47.788 39.303 17.000 1.00 62.01 C +ATOM 2552 C VAL A 317 47.182 39.575 18.362 1.00 64.87 C +ATOM 2553 O VAL A 317 47.648 39.048 19.364 1.00 66.05 O +ATOM 2554 CB VAL A 317 47.085 38.148 16.353 1.00 60.43 C +ATOM 2555 CG1 VAL A 317 45.667 38.538 16.033 1.00 60.96 C +ATOM 2556 CG2 VAL A 317 47.825 37.758 15.108 1.00 59.84 C +ATOM 2557 N GLN A 318 46.133 40.392 18.397 1.00 67.38 N +ATOM 2558 CA GLN A 318 45.501 40.790 19.657 1.00 69.14 C +ATOM 2559 C GLN A 318 45.343 39.710 20.719 1.00 69.44 C +ATOM 2560 O GLN A 318 45.864 39.861 21.823 1.00 69.81 O +ATOM 2561 CB GLN A 318 44.139 41.458 19.386 1.00 70.37 C +ATOM 2562 CG GLN A 318 43.529 42.184 20.582 0.00 70.25 C +ATOM 2563 CD GLN A 318 43.102 41.246 21.695 0.00 70.49 C +ATOM 2564 OE1 GLN A 318 42.246 40.382 21.500 0.00 70.53 O +ATOM 2565 NE2 GLN A 318 43.698 41.410 22.870 0.00 70.53 N +ATOM 2566 N ASP A 319 44.642 38.627 20.389 1.00 69.99 N +ATOM 2567 CA ASP A 319 44.377 37.534 21.347 1.00 70.39 C +ATOM 2568 C ASP A 319 45.273 36.269 21.280 1.00 68.66 C +ATOM 2569 O ASP A 319 44.920 35.217 21.839 1.00 67.50 O +ATOM 2570 CB ASP A 319 42.912 37.112 21.200 1.00 72.65 C +ATOM 2571 CG ASP A 319 42.586 36.629 19.786 1.00 74.07 C +ATOM 2572 OD1 ASP A 319 41.427 36.223 19.535 1.00 74.96 O +ATOM 2573 OD2 ASP A 319 43.497 36.656 18.925 1.00 75.04 O +ATOM 2574 N ARG A 320 46.421 36.384 20.609 1.00 66.65 N +ATOM 2575 CA ARG A 320 47.363 35.278 20.439 1.00 64.26 C +ATOM 2576 C ARG A 320 48.716 35.553 21.066 1.00 63.27 C +ATOM 2577 O ARG A 320 49.755 35.402 20.408 1.00 62.39 O +ATOM 2578 CB ARG A 320 47.593 34.992 18.958 1.00 63.94 C +ATOM 2579 CG ARG A 320 46.445 34.334 18.222 1.00 63.21 C +ATOM 2580 CD ARG A 320 46.854 34.081 16.781 1.00 62.36 C +ATOM 2581 NE ARG A 320 46.211 32.904 16.208 1.00 61.06 N +ATOM 2582 CZ ARG A 320 44.912 32.805 15.967 1.00 60.97 C +ATOM 2583 NH1 ARG A 320 44.437 31.684 15.440 1.00 59.46 N +ATOM 2584 NH2 ARG A 320 44.095 33.825 16.249 1.00 59.71 N +ATOM 2585 N LYS A 321 48.721 35.962 22.328 1.00 62.34 N +ATOM 2586 CA LYS A 321 49.991 36.229 22.986 1.00 61.45 C +ATOM 2587 C LYS A 321 50.644 34.888 23.317 1.00 60.51 C +ATOM 2588 O LYS A 321 50.001 33.958 23.810 1.00 58.29 O +ATOM 2589 CB LYS A 321 49.775 37.089 24.232 1.00 60.51 C +ATOM 2590 CG LYS A 321 48.835 38.258 23.959 1.00 59.39 C +ATOM 2591 CD LYS A 321 48.681 39.167 25.159 1.00 59.99 C +ATOM 2592 CE LYS A 321 47.651 40.257 24.898 1.00 60.29 C +ATOM 2593 NZ LYS A 321 46.260 39.749 24.752 1.00 61.01 N +ATOM 2594 N HIS A 322 51.925 34.798 22.990 1.00 60.90 N +ATOM 2595 CA HIS A 322 52.710 33.587 23.196 1.00 61.60 C +ATOM 2596 C HIS A 322 53.374 33.623 24.564 1.00 62.57 C +ATOM 2597 O HIS A 322 53.610 34.712 25.095 1.00 63.80 O +ATOM 2598 CB HIS A 322 53.752 33.480 22.074 1.00 59.18 C +ATOM 2599 CG HIS A 322 53.140 33.464 20.712 1.00 56.10 C +ATOM 2600 ND1 HIS A 322 52.613 32.326 20.154 1.00 55.27 N +ATOM 2601 CD2 HIS A 322 52.834 34.470 19.863 1.00 56.34 C +ATOM 2602 CE1 HIS A 322 52.003 32.628 19.024 1.00 54.67 C +ATOM 2603 NE2 HIS A 322 52.122 33.926 18.826 1.00 54.93 N +ATOM 2604 N ILE A 323 53.656 32.451 25.143 1.00 62.33 N +ATOM 2605 CA ILE A 323 54.289 32.428 26.451 1.00 62.47 C +ATOM 2606 C ILE A 323 55.546 33.325 26.362 1.00 64.62 C +ATOM 2607 O ILE A 323 55.693 34.277 27.150 1.00 64.61 O +ATOM 2608 CB ILE A 323 54.597 30.988 26.879 1.00 59.47 C +ATOM 2609 CG1 ILE A 323 55.101 30.975 28.314 1.00 58.60 C +ATOM 2610 CG2 ILE A 323 55.587 30.378 25.977 1.00 59.23 C +ATOM 2611 CD1 ILE A 323 54.109 31.497 29.308 1.00 56.46 C +ATOM 2612 N CYS A 324 56.443 33.034 25.411 1.00 66.12 N +ATOM 2613 CA CYS A 324 57.605 33.898 25.174 1.00 66.40 C +ATOM 2614 C CYS A 324 57.075 34.567 23.932 1.00 65.71 C +ATOM 2615 O CYS A 324 56.896 33.893 22.905 1.00 64.67 O +ATOM 2616 CB CYS A 324 58.875 33.125 24.831 1.00 68.08 C +ATOM 2617 SG CYS A 324 60.326 34.223 24.623 1.00 69.26 S +ATOM 2618 N PRO A 325 56.776 35.887 24.027 1.00 65.24 N +ATOM 2619 CA PRO A 325 56.229 36.780 22.992 1.00 64.48 C +ATOM 2620 C PRO A 325 57.070 36.905 21.736 1.00 64.13 C +ATOM 2621 O PRO A 325 58.288 37.055 21.820 1.00 64.19 O +ATOM 2622 CB PRO A 325 56.071 38.106 23.733 1.00 63.88 C +ATOM 2623 CG PRO A 325 57.229 38.089 24.661 1.00 64.02 C +ATOM 2624 CD PRO A 325 57.193 36.673 25.204 1.00 63.76 C +ATOM 2625 N TYR A 326 56.398 36.846 20.580 1.00 63.92 N +ATOM 2626 CA TYR A 326 57.029 36.928 19.252 1.00 62.54 C +ATOM 2627 C TYR A 326 57.516 38.321 18.877 1.00 62.37 C +ATOM 2628 O TYR A 326 56.746 39.269 18.752 1.00 62.79 O +ATOM 2629 CB TYR A 326 56.068 36.400 18.171 1.00 60.49 C +ATOM 2630 CG TYR A 326 55.962 34.896 18.168 1.00 59.78 C +ATOM 2631 CD1 TYR A 326 55.300 34.212 17.153 1.00 60.31 C +ATOM 2632 CD2 TYR A 326 56.568 34.145 19.164 1.00 60.37 C +ATOM 2633 CE1 TYR A 326 55.258 32.805 17.132 1.00 59.56 C +ATOM 2634 CE2 TYR A 326 56.527 32.758 19.153 1.00 59.79 C +ATOM 2635 CZ TYR A 326 55.882 32.095 18.142 1.00 58.95 C +ATOM 2636 OH TYR A 326 55.908 30.725 18.158 1.00 57.55 O +ATOM 2637 N ARG A 327 58.815 38.439 18.686 1.00 62.64 N +ATOM 2638 CA ARG A 327 59.388 39.724 18.347 1.00 63.62 C +ATOM 2639 C ARG A 327 59.876 39.770 16.895 1.00 61.78 C +ATOM 2640 O ARG A 327 59.973 38.732 16.232 1.00 61.96 O +ATOM 2641 CB ARG A 327 60.549 40.019 19.306 1.00 66.65 C +ATOM 2642 CG ARG A 327 60.139 40.083 20.770 1.00 69.79 C +ATOM 2643 CD ARG A 327 61.348 40.182 21.680 1.00 72.60 C +ATOM 2644 NE ARG A 327 60.937 40.185 23.077 1.00 76.69 N +ATOM 2645 CZ ARG A 327 60.295 41.186 23.677 1.00 78.12 C +ATOM 2646 NH1 ARG A 327 59.996 42.281 22.992 1.00 78.77 N +ATOM 2647 NH2 ARG A 327 59.937 41.083 24.960 1.00 78.22 N +ATOM 2648 N THR A 328 60.176 40.969 16.402 1.00 57.85 N +ATOM 2649 CA THR A 328 60.685 41.096 15.053 1.00 55.48 C +ATOM 2650 C THR A 328 62.145 40.603 14.983 1.00 53.98 C +ATOM 2651 O THR A 328 62.800 40.392 16.000 1.00 52.68 O +ATOM 2652 CB THR A 328 60.610 42.553 14.585 1.00 55.42 C +ATOM 2653 OG1 THR A 328 61.226 43.400 15.558 1.00 55.08 O +ATOM 2654 CG2 THR A 328 59.172 42.973 14.397 1.00 55.83 C +ATOM 2655 N ASN A 329 62.655 40.397 13.780 1.00 52.94 N +ATOM 2656 CA ASN A 329 64.032 39.954 13.649 1.00 52.48 C +ATOM 2657 C ASN A 329 65.016 41.141 13.504 1.00 53.05 C +ATOM 2658 O ASN A 329 64.639 42.316 13.616 1.00 51.51 O +ATOM 2659 CB ASN A 329 64.160 38.995 12.464 1.00 50.46 C +ATOM 2660 CG ASN A 329 63.852 39.658 11.152 1.00 51.14 C +ATOM 2661 OD1 ASN A 329 63.337 40.783 11.113 1.00 52.59 O +ATOM 2662 ND2 ASN A 329 64.153 38.966 10.058 1.00 49.21 N +ATOM 2663 N LYS A 330 66.287 40.835 13.268 1.00 53.54 N +ATOM 2664 CA LYS A 330 67.261 41.898 13.142 1.00 53.14 C +ATOM 2665 C LYS A 330 66.864 42.838 12.020 1.00 51.68 C +ATOM 2666 O LYS A 330 67.221 44.002 12.033 1.00 52.14 O +ATOM 2667 CB LYS A 330 68.650 41.325 12.898 1.00 53.93 C +ATOM 2668 CG LYS A 330 68.814 40.748 11.544 1.00 57.33 C +ATOM 2669 CD LYS A 330 70.251 40.384 11.296 1.00 60.82 C +ATOM 2670 CE LYS A 330 70.745 39.392 12.307 1.00 62.37 C +ATOM 2671 NZ LYS A 330 72.093 38.946 11.876 1.00 65.97 N +ATOM 2672 N TYR A 331 66.112 42.348 11.052 1.00 50.66 N +ATOM 2673 CA TYR A 331 65.700 43.217 9.962 1.00 50.47 C +ATOM 2674 C TYR A 331 64.358 43.845 10.266 1.00 50.12 C +ATOM 2675 O TYR A 331 63.706 44.411 9.401 1.00 50.72 O +ATOM 2676 CB TYR A 331 65.677 42.447 8.641 1.00 49.67 C +ATOM 2677 CG TYR A 331 67.012 41.809 8.381 1.00 49.85 C +ATOM 2678 CD1 TYR A 331 67.189 40.449 8.514 1.00 50.53 C +ATOM 2679 CD2 TYR A 331 68.125 42.581 8.107 1.00 49.92 C +ATOM 2680 CE1 TYR A 331 68.441 39.884 8.390 1.00 50.59 C +ATOM 2681 CE2 TYR A 331 69.373 42.024 7.980 1.00 49.59 C +ATOM 2682 CZ TYR A 331 69.520 40.682 8.128 1.00 50.10 C +ATOM 2683 OH TYR A 331 70.763 40.131 8.062 1.00 53.04 O +ATOM 2684 N GLY A 332 63.950 43.747 11.519 1.00 49.41 N +ATOM 2685 CA GLY A 332 62.697 44.357 11.922 1.00 48.23 C +ATOM 2686 C GLY A 332 61.458 43.809 11.263 1.00 45.97 C +ATOM 2687 O GLY A 332 60.351 44.327 11.463 1.00 44.69 O +ATOM 2688 N GLU A 333 61.636 42.764 10.473 1.00 45.27 N +ATOM 2689 CA GLU A 333 60.485 42.158 9.819 1.00 46.20 C +ATOM 2690 C GLU A 333 59.777 41.204 10.788 1.00 45.53 C +ATOM 2691 O GLU A 333 60.357 40.774 11.803 1.00 42.46 O +ATOM 2692 CB GLU A 333 60.909 41.405 8.554 1.00 46.22 C +ATOM 2693 CG GLU A 333 61.920 40.338 8.797 1.00 43.45 C +ATOM 2694 CD GLU A 333 62.519 39.826 7.529 1.00 45.47 C +ATOM 2695 OE1 GLU A 333 63.513 39.091 7.637 1.00 47.60 O +ATOM 2696 OE2 GLU A 333 62.006 40.139 6.426 1.00 45.58 O +ATOM 2697 N TYR A 334 58.519 40.896 10.473 1.00 44.72 N +ATOM 2698 CA TYR A 334 57.727 40.006 11.304 1.00 44.95 C +ATOM 2699 C TYR A 334 56.943 39.025 10.439 1.00 45.27 C +ATOM 2700 O TYR A 334 56.493 39.372 9.350 1.00 46.43 O +ATOM 2701 CB TYR A 334 56.778 40.838 12.183 1.00 43.66 C +ATOM 2702 CG TYR A 334 55.611 41.440 11.446 1.00 43.16 C +ATOM 2703 CD1 TYR A 334 54.351 40.841 11.505 1.00 43.64 C +ATOM 2704 CD2 TYR A 334 55.771 42.565 10.632 1.00 40.97 C +ATOM 2705 CE1 TYR A 334 53.281 41.346 10.758 1.00 43.51 C +ATOM 2706 CE2 TYR A 334 54.708 43.078 9.880 1.00 39.64 C +ATOM 2707 CZ TYR A 334 53.470 42.460 9.942 1.00 41.97 C +ATOM 2708 OH TYR A 334 52.423 42.886 9.149 1.00 42.28 O +ATOM 2709 N TYR A 335 56.811 37.791 10.900 1.00 45.41 N +ATOM 2710 CA TYR A 335 56.036 36.809 10.155 1.00 47.34 C +ATOM 2711 C TYR A 335 55.028 36.154 11.095 1.00 46.29 C +ATOM 2712 O TYR A 335 55.377 35.710 12.189 1.00 47.32 O +ATOM 2713 CB TYR A 335 56.931 35.714 9.567 1.00 50.58 C +ATOM 2714 CG TYR A 335 57.864 36.117 8.443 1.00 54.95 C +ATOM 2715 CD1 TYR A 335 57.471 36.043 7.092 1.00 56.22 C +ATOM 2716 CD2 TYR A 335 59.170 36.489 8.725 1.00 55.19 C +ATOM 2717 CE1 TYR A 335 58.384 36.325 6.065 1.00 56.22 C +ATOM 2718 CE2 TYR A 335 60.070 36.770 7.723 1.00 56.46 C +ATOM 2719 CZ TYR A 335 59.690 36.690 6.401 1.00 57.04 C +ATOM 2720 OH TYR A 335 60.656 36.987 5.454 1.00 58.34 O +ATOM 2721 N LEU A 336 53.779 36.081 10.672 1.00 44.74 N +ATOM 2722 CA LEU A 336 52.766 35.455 11.502 1.00 44.97 C +ATOM 2723 C LEU A 336 51.850 34.506 10.710 1.00 46.67 C +ATOM 2724 O LEU A 336 50.932 34.981 10.011 1.00 47.10 O +ATOM 2725 CB LEU A 336 51.905 36.526 12.164 1.00 42.05 C +ATOM 2726 CG LEU A 336 52.596 37.502 13.114 1.00 40.75 C +ATOM 2727 CD1 LEU A 336 51.537 38.403 13.773 1.00 39.57 C +ATOM 2728 CD2 LEU A 336 53.372 36.735 14.160 1.00 37.66 C +ATOM 2729 N LEU A 337 52.078 33.189 10.805 1.00 45.44 N +ATOM 2730 CA LEU A 337 51.203 32.268 10.092 1.00 45.78 C +ATOM 2731 C LEU A 337 49.788 32.349 10.714 1.00 47.24 C +ATOM 2732 O LEU A 337 49.599 32.110 11.911 1.00 46.20 O +ATOM 2733 CB LEU A 337 51.719 30.841 10.183 1.00 44.74 C +ATOM 2734 CG LEU A 337 53.159 30.593 9.765 1.00 46.14 C +ATOM 2735 CD1 LEU A 337 53.513 29.131 10.028 1.00 46.67 C +ATOM 2736 CD2 LEU A 337 53.351 30.924 8.319 1.00 46.75 C +ATOM 2737 N LEU A 338 48.807 32.711 9.887 1.00 48.74 N +ATOM 2738 CA LEU A 338 47.409 32.842 10.306 1.00 49.72 C +ATOM 2739 C LEU A 338 46.425 32.294 9.256 1.00 51.54 C +ATOM 2740 O LEU A 338 46.756 32.179 8.063 1.00 51.18 O +ATOM 2741 CB LEU A 338 47.072 34.309 10.562 1.00 46.38 C +ATOM 2742 CG LEU A 338 47.786 35.039 11.693 1.00 45.37 C +ATOM 2743 CD1 LEU A 338 47.233 36.443 11.699 1.00 44.70 C +ATOM 2744 CD2 LEU A 338 47.583 34.374 13.056 1.00 41.98 C +ATOM 2745 N LEU A 339 45.214 31.951 9.698 1.00 52.73 N +ATOM 2746 CA LEU A 339 44.218 31.460 8.753 1.00 53.86 C +ATOM 2747 C LEU A 339 43.360 32.597 8.188 1.00 54.81 C +ATOM 2748 O LEU A 339 43.287 33.692 8.742 1.00 56.76 O +ATOM 2749 CB LEU A 339 43.322 30.414 9.408 1.00 52.22 C +ATOM 2750 CG LEU A 339 44.032 29.108 9.763 1.00 51.24 C +ATOM 2751 CD1 LEU A 339 43.003 28.072 10.133 1.00 48.08 C +ATOM 2752 CD2 LEU A 339 44.858 28.628 8.585 1.00 50.03 C +ATOM 2753 N PRO A 340 42.712 32.360 7.058 1.00 54.33 N +ATOM 2754 CA PRO A 340 41.882 33.417 6.489 1.00 54.49 C +ATOM 2755 C PRO A 340 40.926 34.053 7.513 1.00 55.72 C +ATOM 2756 O PRO A 340 40.041 33.387 8.075 1.00 55.54 O +ATOM 2757 CB PRO A 340 41.141 32.692 5.382 1.00 54.21 C +ATOM 2758 CG PRO A 340 42.160 31.680 4.921 1.00 54.63 C +ATOM 2759 CD PRO A 340 42.729 31.162 6.208 1.00 54.23 C +ATOM 2760 N GLY A 341 41.104 35.346 7.748 1.00 56.38 N +ATOM 2761 CA GLY A 341 40.243 36.038 8.679 1.00 58.57 C +ATOM 2762 C GLY A 341 40.757 37.428 8.967 1.00 60.70 C +ATOM 2763 O GLY A 341 41.897 37.755 8.634 1.00 61.67 O +ATOM 2764 N SER A 342 39.923 38.251 9.597 1.00 61.69 N +ATOM 2765 CA SER A 342 40.312 39.617 9.931 1.00 61.78 C +ATOM 2766 C SER A 342 40.986 39.695 11.296 1.00 61.90 C +ATOM 2767 O SER A 342 40.436 39.273 12.318 1.00 60.65 O +ATOM 2768 CB SER A 342 39.085 40.530 9.913 1.00 62.63 C +ATOM 2769 OG SER A 342 38.495 40.556 8.625 1.00 63.59 O +ATOM 2770 N TYR A 343 42.187 40.253 11.306 1.00 62.86 N +ATOM 2771 CA TYR A 343 42.935 40.384 12.545 1.00 63.62 C +ATOM 2772 C TYR A 343 43.273 41.816 12.963 1.00 63.32 C +ATOM 2773 O TYR A 343 42.973 42.790 12.267 1.00 63.82 O +ATOM 2774 CB TYR A 343 44.217 39.569 12.456 1.00 64.26 C +ATOM 2775 CG TYR A 343 43.965 38.130 12.126 1.00 65.24 C +ATOM 2776 CD1 TYR A 343 43.693 37.731 10.816 1.00 65.34 C +ATOM 2777 CD2 TYR A 343 43.994 37.165 13.121 1.00 65.58 C +ATOM 2778 CE1 TYR A 343 43.463 36.403 10.507 1.00 66.14 C +ATOM 2779 CE2 TYR A 343 43.769 35.841 12.830 1.00 67.14 C +ATOM 2780 CZ TYR A 343 43.507 35.459 11.520 1.00 67.82 C +ATOM 2781 OH TYR A 343 43.332 34.119 11.239 1.00 70.60 O +ATOM 2782 N ILE A 344 43.910 41.913 14.121 1.00 61.88 N +ATOM 2783 CA ILE A 344 44.318 43.169 14.711 1.00 60.76 C +ATOM 2784 C ILE A 344 45.652 42.822 15.313 1.00 60.47 C +ATOM 2785 O ILE A 344 45.740 41.945 16.175 1.00 60.43 O +ATOM 2786 CB ILE A 344 43.368 43.567 15.842 1.00 60.99 C +ATOM 2787 CG1 ILE A 344 42.035 44.030 15.270 1.00 60.44 C +ATOM 2788 CG2 ILE A 344 43.998 44.632 16.702 1.00 62.52 C +ATOM 2789 CD1 ILE A 344 41.000 44.241 16.330 1.00 60.14 C +ATOM 2790 N ILE A 345 46.701 43.489 14.867 1.00 59.63 N +ATOM 2791 CA ILE A 345 48.009 43.172 15.404 1.00 59.46 C +ATOM 2792 C ILE A 345 48.397 44.260 16.398 1.00 59.14 C +ATOM 2793 O ILE A 345 48.112 45.421 16.171 1.00 59.36 O +ATOM 2794 CB ILE A 345 49.029 43.023 14.229 1.00 59.00 C +ATOM 2795 CG1 ILE A 345 48.466 42.010 13.221 1.00 57.27 C +ATOM 2796 CG2 ILE A 345 50.387 42.562 14.736 1.00 58.34 C +ATOM 2797 CD1 ILE A 345 49.440 41.502 12.214 1.00 57.60 C +ATOM 2798 N ASN A 346 48.992 43.880 17.523 1.00 59.28 N +ATOM 2799 CA ASN A 346 49.407 44.854 18.527 1.00 60.15 C +ATOM 2800 C ASN A 346 50.909 44.981 18.461 1.00 61.67 C +ATOM 2801 O ASN A 346 51.651 44.081 18.910 1.00 61.81 O +ATOM 2802 CB ASN A 346 49.015 44.414 19.942 1.00 60.17 C +ATOM 2803 CG ASN A 346 47.524 44.474 20.182 1.00 60.45 C +ATOM 2804 OD1 ASN A 346 46.908 45.534 20.072 0.00 60.37 O +ATOM 2805 ND2 ASN A 346 46.932 43.333 20.515 0.00 60.37 N +ATOM 2806 N VAL A 347 51.356 46.093 17.886 1.00 62.21 N +ATOM 2807 CA VAL A 347 52.780 46.355 17.763 1.00 62.77 C +ATOM 2808 C VAL A 347 53.205 47.074 19.031 1.00 63.51 C +ATOM 2809 O VAL A 347 52.873 48.233 19.271 1.00 63.60 O +ATOM 2810 CB VAL A 347 53.088 47.227 16.551 1.00 62.38 C +ATOM 2811 CG1 VAL A 347 54.589 47.204 16.280 1.00 61.58 C +ATOM 2812 CG2 VAL A 347 52.274 46.748 15.348 1.00 61.00 C +ATOM 2813 N THR A 348 53.940 46.358 19.859 1.00 65.16 N +ATOM 2814 CA THR A 348 54.373 46.911 21.117 1.00 66.39 C +ATOM 2815 C THR A 348 55.880 47.026 21.146 1.00 66.36 C +ATOM 2816 O THR A 348 56.594 46.025 21.306 1.00 63.96 O +ATOM 2817 CB THR A 348 53.864 46.033 22.288 1.00 67.59 C +ATOM 2818 OG1 THR A 348 52.433 45.881 22.187 1.00 68.32 O +ATOM 2819 CG2 THR A 348 54.199 46.678 23.626 1.00 67.89 C +ATOM 2820 N VAL A 349 56.342 48.265 20.952 1.00 67.43 N +ATOM 2821 CA VAL A 349 57.766 48.583 20.961 1.00 68.44 C +ATOM 2822 C VAL A 349 58.113 48.954 22.382 1.00 68.89 C +ATOM 2823 O VAL A 349 57.431 49.774 23.002 1.00 68.53 O +ATOM 2824 CB VAL A 349 58.094 49.757 20.037 1.00 67.96 C +ATOM 2825 CG1 VAL A 349 56.963 50.735 20.051 1.00 67.82 C +ATOM 2826 CG2 VAL A 349 59.389 50.430 20.494 1.00 68.03 C +ATOM 2827 N PRO A 350 59.190 48.362 22.916 1.00 69.77 N +ATOM 2828 CA PRO A 350 59.607 48.634 24.287 1.00 70.66 C +ATOM 2829 C PRO A 350 59.355 50.033 24.804 1.00 71.70 C +ATOM 2830 O PRO A 350 59.706 51.033 24.173 1.00 71.93 O +ATOM 2831 CB PRO A 350 61.070 48.234 24.281 1.00 69.35 C +ATOM 2832 CG PRO A 350 61.017 47.006 23.446 1.00 70.27 C +ATOM 2833 CD PRO A 350 60.151 47.460 22.261 1.00 69.85 C +ATOM 2834 N GLY A 351 58.703 50.068 25.961 1.00 72.76 N +ATOM 2835 CA GLY A 351 58.396 51.315 26.614 1.00 74.28 C +ATOM 2836 C GLY A 351 57.443 52.134 25.795 1.00 75.49 C +ATOM 2837 O GLY A 351 57.624 53.342 25.649 1.00 76.59 O +ATOM 2838 N HIS A 352 56.426 51.479 25.255 1.00 76.23 N +ATOM 2839 CA HIS A 352 55.438 52.186 24.458 1.00 77.30 C +ATOM 2840 C HIS A 352 54.053 51.576 24.546 1.00 77.82 C +ATOM 2841 O HIS A 352 53.888 50.415 24.941 1.00 77.69 O +ATOM 2842 CB HIS A 352 55.876 52.228 23.003 1.00 76.75 C +ATOM 2843 CG HIS A 352 56.882 53.286 22.718 1.00 77.01 C +ATOM 2844 ND1 HIS A 352 56.525 54.568 22.365 1.00 77.26 N +ATOM 2845 CD2 HIS A 352 58.236 53.266 22.768 1.00 78.27 C +ATOM 2846 CE1 HIS A 352 57.619 55.294 22.206 1.00 79.18 C +ATOM 2847 NE2 HIS A 352 58.671 54.528 22.446 1.00 78.98 N +ATOM 2848 N ASP A 353 53.055 52.378 24.195 1.00 77.73 N +ATOM 2849 CA ASP A 353 51.695 51.897 24.193 1.00 77.89 C +ATOM 2850 C ASP A 353 51.649 50.979 22.997 1.00 77.75 C +ATOM 2851 O ASP A 353 52.206 51.284 21.938 1.00 77.62 O +ATOM 2852 CB ASP A 353 50.704 53.047 24.011 1.00 79.65 C +ATOM 2853 CG ASP A 353 50.069 53.492 25.325 1.00 81.58 C +ATOM 2854 OD1 ASP A 353 50.657 53.202 26.403 1.00 81.86 O +ATOM 2855 OD2 ASP A 353 48.987 54.136 25.271 1.00 80.84 O +ATOM 2856 N PRO A 354 51.029 49.809 23.159 1.00 77.88 N +ATOM 2857 CA PRO A 354 50.978 48.921 22.002 1.00 77.50 C +ATOM 2858 C PRO A 354 50.295 49.635 20.837 1.00 76.82 C +ATOM 2859 O PRO A 354 49.275 50.308 21.004 1.00 76.42 O +ATOM 2860 CB PRO A 354 50.192 47.719 22.528 1.00 77.02 C +ATOM 2861 CG PRO A 354 49.349 48.318 23.633 1.00 77.24 C +ATOM 2862 CD PRO A 354 50.327 49.224 24.311 1.00 77.73 C +ATOM 2863 N HIS A 355 50.877 49.504 19.658 1.00 75.94 N +ATOM 2864 CA HIS A 355 50.315 50.134 18.492 1.00 75.71 C +ATOM 2865 C HIS A 355 49.375 49.203 17.761 1.00 75.02 C +ATOM 2866 O HIS A 355 49.753 48.101 17.382 1.00 74.73 O +ATOM 2867 CB HIS A 355 51.420 50.545 17.534 1.00 78.15 C +ATOM 2868 CG HIS A 355 50.924 51.284 16.334 1.00 80.64 C +ATOM 2869 ND1 HIS A 355 50.530 52.604 16.384 1.00 81.40 N +ATOM 2870 CD2 HIS A 355 50.694 50.870 15.066 1.00 82.45 C +ATOM 2871 CE1 HIS A 355 50.074 52.970 15.200 1.00 82.68 C +ATOM 2872 NE2 HIS A 355 50.161 51.936 14.382 1.00 83.40 N +ATOM 2873 N ILE A 356 48.142 49.646 17.573 1.00 74.52 N +ATOM 2874 CA ILE A 356 47.177 48.858 16.832 1.00 74.40 C +ATOM 2875 C ILE A 356 47.450 49.064 15.336 1.00 75.31 C +ATOM 2876 O ILE A 356 47.861 50.147 14.897 1.00 76.17 O +ATOM 2877 CB ILE A 356 45.718 49.314 17.090 1.00 73.74 C +ATOM 2878 CG1 ILE A 356 45.235 48.867 18.462 1.00 73.76 C +ATOM 2879 CG2 ILE A 356 44.801 48.735 16.039 1.00 72.84 C +ATOM 2880 CD1 ILE A 356 43.724 49.103 18.663 1.00 72.78 C +ATOM 2881 N THR A 357 47.214 48.010 14.566 1.00 75.53 N +ATOM 2882 CA THR A 357 47.362 48.015 13.116 1.00 75.55 C +ATOM 2883 C THR A 357 46.533 46.816 12.669 1.00 75.14 C +ATOM 2884 O THR A 357 46.855 45.665 12.992 1.00 75.16 O +ATOM 2885 CB THR A 357 48.847 47.898 12.693 1.00 76.83 C +ATOM 2886 OG1 THR A 357 49.331 49.197 12.302 1.00 76.89 O +ATOM 2887 CG2 THR A 357 49.008 46.925 11.536 1.00 77.13 C +ATOM 2888 N LYS A 358 45.438 47.105 11.965 1.00 74.51 N +ATOM 2889 CA LYS A 358 44.508 46.072 11.516 1.00 73.68 C +ATOM 2890 C LYS A 358 44.785 45.501 10.129 1.00 73.43 C +ATOM 2891 O LYS A 358 45.235 46.212 9.216 1.00 73.79 O +ATOM 2892 CB LYS A 358 43.071 46.600 11.574 1.00 72.60 C +ATOM 2893 CG LYS A 358 42.021 45.528 11.325 1.00 72.79 C +ATOM 2894 CD LYS A 358 40.611 46.088 11.335 1.00 73.48 C +ATOM 2895 CE LYS A 358 40.264 46.722 12.677 1.00 73.97 C +ATOM 2896 NZ LYS A 358 38.879 47.289 12.680 1.00 74.35 N +ATOM 2897 N VAL A 359 44.499 44.206 9.987 1.00 72.09 N +ATOM 2898 CA VAL A 359 44.704 43.498 8.737 1.00 70.15 C +ATOM 2899 C VAL A 359 43.678 42.392 8.450 1.00 69.20 C +ATOM 2900 O VAL A 359 43.378 41.569 9.309 1.00 69.13 O +ATOM 2901 CB VAL A 359 46.113 42.881 8.707 1.00 69.81 C +ATOM 2902 CG1 VAL A 359 46.223 41.912 7.541 1.00 70.76 C +ATOM 2903 CG2 VAL A 359 47.163 43.981 8.582 1.00 68.05 C +ATOM 2904 N ILE A 360 43.137 42.399 7.234 1.00 68.11 N +ATOM 2905 CA ILE A 360 42.191 41.385 6.778 1.00 67.40 C +ATOM 2906 C ILE A 360 43.037 40.393 5.982 1.00 68.48 C +ATOM 2907 O ILE A 360 43.610 40.753 4.964 1.00 69.42 O +ATOM 2908 CB ILE A 360 41.135 41.972 5.812 1.00 66.08 C +ATOM 2909 CG1 ILE A 360 40.004 42.627 6.602 1.00 66.95 C +ATOM 2910 CG2 ILE A 360 40.596 40.888 4.909 1.00 64.93 C +ATOM 2911 CD1 ILE A 360 38.785 43.063 5.764 1.00 66.48 C +ATOM 2912 N ILE A 361 43.141 39.153 6.439 1.00 69.27 N +ATOM 2913 CA ILE A 361 43.932 38.179 5.703 1.00 69.83 C +ATOM 2914 C ILE A 361 43.054 37.479 4.686 1.00 71.51 C +ATOM 2915 O ILE A 361 42.250 36.627 5.041 1.00 71.66 O +ATOM 2916 CB ILE A 361 44.541 37.139 6.624 1.00 68.71 C +ATOM 2917 CG1 ILE A 361 45.479 37.820 7.607 1.00 67.50 C +ATOM 2918 CG2 ILE A 361 45.297 36.114 5.807 1.00 67.62 C +ATOM 2919 CD1 ILE A 361 46.222 36.848 8.463 1.00 69.79 C +ATOM 2920 N PRO A 362 43.241 37.805 3.397 1.00 73.69 N +ATOM 2921 CA PRO A 362 42.540 37.307 2.206 1.00 75.01 C +ATOM 2922 C PRO A 362 41.563 36.158 2.392 1.00 76.19 C +ATOM 2923 O PRO A 362 40.719 36.173 3.281 1.00 77.26 O +ATOM 2924 CB PRO A 362 43.681 36.946 1.273 1.00 75.27 C +ATOM 2925 CG PRO A 362 44.607 38.096 1.499 1.00 76.23 C +ATOM 2926 CD PRO A 362 44.584 38.288 3.021 1.00 74.51 C +ATOM 2927 N GLU A 363 41.669 35.166 1.528 1.00 77.21 N +ATOM 2928 CA GLU A 363 40.789 34.021 1.592 1.00 78.75 C +ATOM 2929 C GLU A 363 41.053 33.209 0.362 1.00 79.40 C +ATOM 2930 O GLU A 363 40.148 32.583 -0.172 1.00 80.68 O +ATOM 2931 CB GLU A 363 39.326 34.458 1.606 1.00 79.08 C +ATOM 2932 CG GLU A 363 38.600 34.129 2.905 1.00 81.74 C +ATOM 2933 CD GLU A 363 38.553 32.627 3.212 1.00 83.41 C +ATOM 2934 OE1 GLU A 363 38.060 32.254 4.304 1.00 84.22 O +ATOM 2935 OE2 GLU A 363 39.002 31.817 2.368 1.00 83.51 O +ATOM 2936 N LYS A 364 42.305 33.244 -0.077 1.00 80.09 N +ATOM 2937 CA LYS A 364 42.778 32.541 -1.265 1.00 80.78 C +ATOM 2938 C LYS A 364 43.801 33.446 -1.928 1.00 81.17 C +ATOM 2939 O LYS A 364 43.462 34.545 -2.356 1.00 80.67 O +ATOM 2940 CB LYS A 364 41.637 32.275 -2.253 0.00 80.87 C +ATOM 2941 CG LYS A 364 42.057 31.540 -3.518 0.00 81.08 C +ATOM 2942 CD LYS A 364 42.483 30.107 -3.226 0.00 81.22 C +ATOM 2943 CE LYS A 364 41.320 29.277 -2.704 0.00 81.30 C +ATOM 2944 NZ LYS A 364 41.714 27.864 -2.446 0.00 81.40 N +ATOM 2945 N SER A 365 45.050 32.985 -1.993 1.00 82.20 N +ATOM 2946 CA SER A 365 46.132 33.748 -2.617 1.00 82.25 C +ATOM 2947 C SER A 365 46.517 33.176 -3.991 1.00 82.25 C +ATOM 2948 O SER A 365 46.620 31.950 -4.173 1.00 82.44 O +ATOM 2949 CB SER A 365 47.368 33.780 -1.711 1.00 82.16 C +ATOM 2950 OG SER A 365 48.330 34.694 -2.219 1.00 81.80 O +ATOM 2951 N GLN A 366 46.739 34.089 -4.940 1.00 81.29 N +ATOM 2952 CA GLN A 366 47.097 33.756 -6.317 1.00 79.37 C +ATOM 2953 C GLN A 366 48.599 33.624 -6.497 1.00 77.40 C +ATOM 2954 O GLN A 366 49.067 33.177 -7.545 1.00 77.39 O +ATOM 2955 CB GLN A 366 46.554 34.834 -7.252 1.00 80.49 C +ATOM 2956 CG GLN A 366 45.269 35.472 -6.726 1.00 83.33 C +ATOM 2957 CD GLN A 366 44.240 34.449 -6.216 1.00 84.58 C +ATOM 2958 OE1 GLN A 366 43.314 34.804 -5.485 1.00 84.67 O +ATOM 2959 NE2 GLN A 366 44.397 33.181 -6.610 1.00 85.74 N +ATOM 2960 N ASN A 367 49.343 34.022 -5.466 1.00 74.56 N +ATOM 2961 CA ASN A 367 50.797 33.948 -5.466 1.00 71.26 C +ATOM 2962 C ASN A 367 51.228 33.073 -4.286 1.00 68.92 C +ATOM 2963 O ASN A 367 50.380 32.570 -3.534 1.00 67.29 O +ATOM 2964 CB ASN A 367 51.406 35.351 -5.332 1.00 70.73 C +ATOM 2965 CG ASN A 367 52.874 35.392 -5.716 0.00 70.98 C +ATOM 2966 OD1 ASN A 367 53.531 36.425 -5.591 0.00 70.95 O +ATOM 2967 ND2 ASN A 367 53.395 34.267 -6.194 0.00 70.95 N +ATOM 2968 N PHE A 368 52.544 32.887 -4.158 1.00 66.64 N +ATOM 2969 CA PHE A 368 53.155 32.100 -3.087 1.00 64.05 C +ATOM 2970 C PHE A 368 53.878 33.022 -2.110 1.00 62.18 C +ATOM 2971 O PHE A 368 55.089 32.947 -1.941 1.00 62.73 O +ATOM 2972 CB PHE A 368 54.169 31.089 -3.643 1.00 64.92 C +ATOM 2973 CG PHE A 368 53.555 29.953 -4.420 1.00 66.78 C +ATOM 2974 CD1 PHE A 368 52.318 29.416 -4.053 1.00 67.27 C +ATOM 2975 CD2 PHE A 368 54.228 29.396 -5.506 1.00 67.69 C +ATOM 2976 CE1 PHE A 368 51.761 28.346 -4.760 1.00 67.94 C +ATOM 2977 CE2 PHE A 368 53.678 28.321 -6.223 1.00 67.84 C +ATOM 2978 CZ PHE A 368 52.443 27.797 -5.850 1.00 67.57 C +ATOM 2979 N SER A 369 53.132 33.920 -1.488 1.00 59.30 N +ATOM 2980 CA SER A 369 53.693 34.835 -0.515 1.00 56.16 C +ATOM 2981 C SER A 369 52.565 35.200 0.412 1.00 55.52 C +ATOM 2982 O SER A 369 51.422 35.290 -0.014 1.00 54.74 O +ATOM 2983 CB SER A 369 54.213 36.093 -1.185 1.00 54.78 C +ATOM 2984 OG SER A 369 54.246 37.177 -0.267 1.00 52.09 O +ATOM 2985 N ALA A 370 52.871 35.392 1.686 1.00 55.25 N +ATOM 2986 CA ALA A 370 51.826 35.758 2.624 1.00 55.70 C +ATOM 2987 C ALA A 370 51.343 37.169 2.269 1.00 55.30 C +ATOM 2988 O ALA A 370 51.729 37.710 1.244 1.00 54.65 O +ATOM 2989 CB ALA A 370 52.371 35.714 4.042 1.00 56.33 C +ATOM 2990 N LEU A 371 50.484 37.752 3.098 1.00 54.97 N +ATOM 2991 CA LEU A 371 50.011 39.099 2.853 1.00 54.56 C +ATOM 2992 C LEU A 371 51.105 40.022 3.372 1.00 56.38 C +ATOM 2993 O LEU A 371 51.633 39.810 4.483 1.00 57.20 O +ATOM 2994 CB LEU A 371 48.704 39.364 3.612 1.00 53.98 C +ATOM 2995 CG LEU A 371 48.011 40.711 3.341 1.00 54.55 C +ATOM 2996 CD1 LEU A 371 46.513 40.614 3.593 1.00 53.28 C +ATOM 2997 CD2 LEU A 371 48.627 41.784 4.217 1.00 55.11 C +ATOM 2998 N LYS A 372 51.476 41.028 2.576 1.00 56.01 N +ATOM 2999 CA LYS A 372 52.498 41.960 3.027 1.00 55.74 C +ATOM 3000 C LYS A 372 51.839 43.171 3.675 1.00 56.46 C +ATOM 3001 O LYS A 372 50.846 43.704 3.172 1.00 55.78 O +ATOM 3002 CB LYS A 372 53.400 42.375 1.871 1.00 54.65 C +ATOM 3003 CG LYS A 372 54.563 41.429 1.630 1.00 53.91 C +ATOM 3004 CD LYS A 372 55.241 41.691 0.295 0.00 54.25 C +ATOM 3005 CE LYS A 372 54.314 41.360 -0.865 0.00 54.22 C +ATOM 3006 NZ LYS A 372 54.974 41.549 -2.185 0.00 54.27 N +ATOM 3007 N LYS A 373 52.374 43.568 4.827 1.00 58.04 N +ATOM 3008 CA LYS A 373 51.859 44.714 5.573 1.00 59.53 C +ATOM 3009 C LYS A 373 52.973 45.272 6.414 1.00 59.56 C +ATOM 3010 O LYS A 373 53.389 44.662 7.402 1.00 59.43 O +ATOM 3011 CB LYS A 373 50.706 44.322 6.505 1.00 61.49 C +ATOM 3012 CG LYS A 373 49.596 45.355 6.595 1.00 61.57 C +ATOM 3013 CD LYS A 373 50.173 46.733 6.813 1.00 64.10 C +ATOM 3014 CE LYS A 373 49.128 47.807 6.527 1.00 66.56 C +ATOM 3015 NZ LYS A 373 49.704 49.181 6.551 1.00 67.25 N +ATOM 3016 N ASP A 374 53.470 46.427 5.990 1.00 60.00 N +ATOM 3017 CA ASP A 374 54.531 47.117 6.698 1.00 59.42 C +ATOM 3018 C ASP A 374 53.896 48.034 7.734 1.00 58.44 C +ATOM 3019 O ASP A 374 52.776 48.534 7.566 1.00 57.22 O +ATOM 3020 CB ASP A 374 55.382 47.915 5.714 1.00 60.10 C +ATOM 3021 CG ASP A 374 56.509 47.097 5.128 1.00 60.96 C +ATOM 3022 OD1 ASP A 374 57.019 47.472 4.044 1.00 60.02 O +ATOM 3023 OD2 ASP A 374 56.888 46.089 5.771 1.00 62.19 O +ATOM 3024 N ILE A 375 54.627 48.257 8.808 1.00 57.96 N +ATOM 3025 CA ILE A 375 54.124 49.081 9.877 1.00 58.17 C +ATOM 3026 C ILE A 375 54.996 50.300 10.188 1.00 57.92 C +ATOM 3027 O ILE A 375 56.197 50.195 10.494 1.00 57.83 O +ATOM 3028 CB ILE A 375 53.934 48.198 11.119 1.00 58.68 C +ATOM 3029 CG1 ILE A 375 52.907 47.121 10.783 1.00 58.19 C +ATOM 3030 CG2 ILE A 375 53.494 49.024 12.313 1.00 59.38 C +ATOM 3031 CD1 ILE A 375 52.738 46.092 11.837 1.00 58.96 C +ATOM 3032 N LEU A 376 54.379 51.468 10.086 1.00 56.93 N +ATOM 3033 CA LEU A 376 55.080 52.699 10.376 1.00 57.71 C +ATOM 3034 C LEU A 376 54.590 53.211 11.724 1.00 58.77 C +ATOM 3035 O LEU A 376 53.497 53.780 11.833 1.00 59.16 O +ATOM 3036 CB LEU A 376 54.784 53.741 9.309 1.00 57.21 C +ATOM 3037 CG LEU A 376 55.952 54.375 8.560 1.00 56.59 C +ATOM 3038 CD1 LEU A 376 55.382 55.592 7.862 1.00 57.17 C +ATOM 3039 CD2 LEU A 376 57.110 54.770 9.478 1.00 54.98 C +ATOM 3040 N LEU A 377 55.374 52.998 12.766 1.00 58.94 N +ATOM 3041 CA LEU A 377 54.930 53.488 14.047 1.00 59.76 C +ATOM 3042 C LEU A 377 54.982 54.980 13.925 1.00 60.75 C +ATOM 3043 O LEU A 377 55.834 55.513 13.209 1.00 61.00 O +ATOM 3044 CB LEU A 377 55.846 53.016 15.156 1.00 58.16 C +ATOM 3045 CG LEU A 377 55.745 51.510 15.227 1.00 57.52 C +ATOM 3046 CD1 LEU A 377 56.613 51.027 16.368 1.00 57.47 C +ATOM 3047 CD2 LEU A 377 54.264 51.100 15.369 1.00 55.49 C +ATOM 3048 N PRO A 378 54.056 55.678 14.600 1.00 61.56 N +ATOM 3049 CA PRO A 378 53.988 57.138 14.570 1.00 61.74 C +ATOM 3050 C PRO A 378 54.958 57.814 15.548 1.00 62.53 C +ATOM 3051 O PRO A 378 54.672 58.895 16.056 1.00 62.94 O +ATOM 3052 CB PRO A 378 52.536 57.403 14.898 1.00 60.92 C +ATOM 3053 CG PRO A 378 52.274 56.340 15.912 1.00 62.09 C +ATOM 3054 CD PRO A 378 52.896 55.115 15.312 1.00 61.12 C +ATOM 3055 N PHE A 379 56.096 57.171 15.807 1.00 63.31 N +ATOM 3056 CA PHE A 379 57.114 57.715 16.696 1.00 65.13 C +ATOM 3057 C PHE A 379 58.466 57.096 16.429 1.00 67.48 C +ATOM 3058 O PHE A 379 58.715 56.616 15.333 1.00 68.38 O +ATOM 3059 CB PHE A 379 56.738 57.526 18.167 1.00 64.03 C +ATOM 3060 CG PHE A 379 56.398 56.124 18.534 1.00 62.86 C +ATOM 3061 CD1 PHE A 379 57.361 55.130 18.507 1.00 62.71 C +ATOM 3062 CD2 PHE A 379 55.097 55.791 18.886 1.00 63.04 C +ATOM 3063 CE1 PHE A 379 57.032 53.817 18.821 1.00 61.72 C +ATOM 3064 CE2 PHE A 379 54.761 54.492 19.199 1.00 62.44 C +ATOM 3065 CZ PHE A 379 55.731 53.502 19.166 1.00 62.14 C +ATOM 3066 N GLN A 380 59.337 57.103 17.431 1.00 70.21 N +ATOM 3067 CA GLN A 380 60.683 56.562 17.281 1.00 73.60 C +ATOM 3068 C GLN A 380 61.080 55.584 18.374 1.00 74.86 C +ATOM 3069 O GLN A 380 60.524 55.618 19.472 1.00 75.90 O +ATOM 3070 CB GLN A 380 61.705 57.700 17.272 1.00 74.82 C +ATOM 3071 CG GLN A 380 63.138 57.220 17.483 1.00 78.08 C +ATOM 3072 CD GLN A 380 64.097 58.332 17.890 1.00 80.84 C +ATOM 3073 OE1 GLN A 380 64.513 59.158 17.059 1.00 81.99 O +ATOM 3074 NE2 GLN A 380 64.452 58.362 19.181 1.00 80.86 N +ATOM 3075 N GLY A 381 62.058 54.726 18.082 1.00 75.76 N +ATOM 3076 CA GLY A 381 62.535 53.773 19.077 1.00 76.87 C +ATOM 3077 C GLY A 381 64.015 53.993 19.385 1.00 77.71 C +ATOM 3078 O GLY A 381 64.401 54.085 20.548 1.00 99.99 O +ATOM 3079 OXT GLY A 381 64.521 55.076 19.009 1.00 77.68 O +ATOM 3080 N PRO A 391 68.265 37.617 23.247 1.00 83.53 N +ATOM 3081 CA PRO A 391 67.769 37.609 24.666 1.00 83.84 C +ATOM 3082 C PRO A 391 66.512 36.718 24.928 1.00 83.70 C +ATOM 3083 O PRO A 391 66.259 36.309 26.074 1.00 83.83 O +ATOM 3084 CB PRO A 391 67.444 39.056 24.786 1.00 99.99 C +ATOM 3085 CG PRO A 391 68.305 39.763 23.766 0.00 99.99 C +ATOM 3086 CD PRO A 391 68.552 39.060 22.730 0.00 99.99 C +ATOM 3087 N SER A 392 65.762 36.408 23.859 1.00 83.25 N +ATOM 3088 CA SER A 392 64.518 35.604 23.887 1.00 81.60 C +ATOM 3089 C SER A 392 63.834 35.428 25.257 1.00 80.54 C +ATOM 3090 O SER A 392 63.121 36.325 25.703 1.00 80.82 O +ATOM 3091 CB SER A 392 64.720 34.229 23.185 1.00 81.23 C +ATOM 3092 OG SER A 392 66.039 33.695 23.310 1.00 80.17 O +ATOM 3093 N CYS A 393 64.036 34.288 25.914 1.00 78.06 N +ATOM 3094 CA CYS A 393 63.428 34.027 27.214 1.00 75.65 C +ATOM 3095 C CYS A 393 64.205 32.962 27.919 1.00 75.77 C +ATOM 3096 O CYS A 393 64.715 32.047 27.288 1.00 76.09 O +ATOM 3097 CB CYS A 393 62.010 33.512 27.068 1.00 73.92 C +ATOM 3098 SG CYS A 393 60.830 34.756 26.518 1.00 72.73 S +ATOM 3099 N PRO A 394 64.281 33.038 29.250 1.00 75.92 N +ATOM 3100 CA PRO A 394 65.039 31.997 29.951 1.00 75.55 C +ATOM 3101 C PRO A 394 64.477 30.640 29.551 1.00 74.64 C +ATOM 3102 O PRO A 394 63.274 30.411 29.638 1.00 75.57 O +ATOM 3103 CB PRO A 394 64.791 32.324 31.419 1.00 76.15 C +ATOM 3104 CG PRO A 394 63.394 32.907 31.392 1.00 76.45 C +ATOM 3105 CD PRO A 394 63.442 33.811 30.181 1.00 76.02 C +ATOM 3106 N MET A 395 65.334 29.748 29.084 1.00 73.44 N +ATOM 3107 CA MET A 395 64.859 28.435 28.689 1.00 72.77 C +ATOM 3108 C MET A 395 64.536 27.595 29.925 1.00 71.12 C +ATOM 3109 O MET A 395 65.197 26.598 30.229 1.00 70.73 O +ATOM 3110 CB MET A 395 65.900 27.760 27.799 1.00 73.72 C +ATOM 3111 CG MET A 395 65.894 28.298 26.374 1.00 73.67 C +ATOM 3112 SD MET A 395 67.251 27.571 25.461 1.00 75.42 S +ATOM 3113 CE MET A 395 67.385 28.685 24.018 1.00 74.41 C +ATOM 3114 N ILE A 396 63.486 28.026 30.613 1.00 69.43 N +ATOM 3115 CA ILE A 396 63.001 27.415 31.839 1.00 68.89 C +ATOM 3116 C ILE A 396 61.482 27.298 31.753 1.00 68.85 C +ATOM 3117 O ILE A 396 60.817 28.209 31.288 1.00 68.62 O +ATOM 3118 CB ILE A 396 63.334 28.307 33.013 1.00 68.38 C +ATOM 3119 CG1 ILE A 396 62.705 29.684 32.766 1.00 67.74 C +ATOM 3120 CG2 ILE A 396 64.843 28.405 33.171 1.00 67.00 C +ATOM 3121 CD1 ILE A 396 62.896 30.671 33.852 1.00 66.96 C +ATOM 3122 N PRO A 397 60.916 26.191 32.247 1.00 69.36 N +ATOM 3123 CA PRO A 397 59.465 25.934 32.225 1.00 69.86 C +ATOM 3124 C PRO A 397 58.576 27.150 32.461 1.00 70.25 C +ATOM 3125 O PRO A 397 58.084 27.355 33.567 1.00 71.97 O +ATOM 3126 CB PRO A 397 59.284 24.848 33.296 1.00 69.52 C +ATOM 3127 CG PRO A 397 60.533 24.954 34.144 1.00 69.31 C +ATOM 3128 CD PRO A 397 61.604 25.253 33.149 1.00 69.27 C +ATOM 3129 N LEU A 398 58.342 27.934 31.413 1.00 69.96 N +ATOM 3130 CA LEU A 398 57.543 29.146 31.535 1.00 69.69 C +ATOM 3131 C LEU A 398 56.088 28.888 31.885 1.00 70.78 C +ATOM 3132 O LEU A 398 55.547 29.473 32.826 1.00 71.25 O +ATOM 3133 CB LEU A 398 57.637 29.961 30.248 1.00 67.62 C +ATOM 3134 CG LEU A 398 59.059 30.198 29.727 1.00 67.53 C +ATOM 3135 CD1 LEU A 398 59.018 31.160 28.558 1.00 68.51 C +ATOM 3136 CD2 LEU A 398 59.940 30.765 30.817 1.00 67.27 C +ATOM 3137 N TYR A 399 55.456 28.005 31.126 1.00 72.16 N +ATOM 3138 CA TYR A 399 54.053 27.667 31.342 1.00 72.97 C +ATOM 3139 C TYR A 399 53.790 27.115 32.745 1.00 76.08 C +ATOM 3140 O TYR A 399 52.737 27.362 33.325 1.00 76.42 O +ATOM 3141 CB TYR A 399 53.601 26.651 30.290 1.00 68.61 C +ATOM 3142 CG TYR A 399 52.978 27.256 29.055 1.00 63.31 C +ATOM 3143 CD1 TYR A 399 51.809 27.982 29.144 1.00 61.87 C +ATOM 3144 CD2 TYR A 399 53.515 27.043 27.796 1.00 61.33 C +ATOM 3145 CE1 TYR A 399 51.169 28.477 28.010 1.00 60.49 C +ATOM 3146 CE2 TYR A 399 52.881 27.538 26.654 1.00 59.99 C +ATOM 3147 CZ TYR A 399 51.703 28.251 26.772 1.00 59.21 C +ATOM 3148 OH TYR A 399 51.029 28.723 25.670 1.00 57.67 O +ATOM 3149 N ARG A 400 54.744 26.356 33.281 1.00 80.04 N +ATOM 3150 CA ARG A 400 54.602 25.774 34.620 1.00 83.19 C +ATOM 3151 C ARG A 400 54.032 26.842 35.542 1.00 85.03 C +ATOM 3152 O ARG A 400 52.837 26.806 35.888 1.00 85.80 O +ATOM 3153 CB ARG A 400 55.963 25.314 35.133 1.00 99.99 C +ATOM 3154 CG ARG A 400 55.798 24.667 36.502 0.00 99.99 C +ATOM 3155 CD ARG A 400 57.142 24.119 36.971 0.00 99.99 C +ATOM 3156 NE ARG A 400 57.912 25.152 37.698 0.00 99.99 N +ATOM 3157 CZ ARG A 400 57.685 25.463 38.971 0.00 99.99 C +ATOM 3158 NH1 ARG A 400 56.738 24.860 39.686 0.00 99.99 N +ATOM 3159 NH2 ARG A 400 58.436 26.408 39.528 0.00 99.99 N +ATOM 3160 N ASN A 401 54.896 27.785 35.925 1.00 86.21 N +ATOM 3161 CA ASN A 401 54.514 28.892 36.792 1.00 87.61 C +ATOM 3162 C ASN A 401 53.779 29.941 35.957 1.00 88.81 C +ATOM 3163 O ASN A 401 54.160 31.118 35.949 1.00 88.79 O +ATOM 3164 CB ASN A 401 55.758 29.514 37.418 1.00 99.99 C +ATOM 3165 CG ASN A 401 55.384 30.542 38.476 0.00 99.99 C +ATOM 3166 OD1 ASN A 401 55.739 31.713 38.362 0.00 99.99 O +ATOM 3167 ND2 ASN A 401 54.667 30.099 39.511 0.00 99.99 N +ATOM 3168 N LEU A 402 52.729 29.487 35.259 1.00 89.87 N +ATOM 3169 CA LEU A 402 51.880 30.326 34.392 1.00 90.16 C +ATOM 3170 C LEU A 402 50.412 29.835 34.352 1.00 89.91 C +ATOM 3171 O LEU A 402 49.488 30.622 34.544 1.00 99.99 O +ATOM 3172 CB LEU A 402 52.418 30.308 32.965 1.00 99.99 C +ATOM 3173 CG LEU A 402 51.889 31.518 32.205 0.00 99.99 C +ATOM 3174 CD1 LEU A 402 52.328 32.795 32.916 0.00 99.99 C +ATOM 3175 CD2 LEU A 402 52.443 31.511 30.785 0.00 99.99 C +ATOM 3176 N PRO A 403 49.638 31.600 33.018 1.00 89.84 N +TER 3177 PRO A 403 +HETATM 3178 C1 NAG B 1 62.117 32.333 -10.851 1.00 86.48 C +HETATM 3179 C2 NAG B 1 61.640 33.306 -11.943 1.00 88.39 C +HETATM 3180 C3 NAG B 1 62.455 33.072 -13.216 1.00 89.93 C +HETATM 3181 C4 NAG B 1 63.973 33.100 -12.963 1.00 91.46 C +HETATM 3182 C5 NAG B 1 64.333 32.202 -11.769 1.00 90.89 C +HETATM 3183 C6 NAG B 1 65.794 32.332 -11.347 1.00 91.57 C +HETATM 3184 C7 NAG B 1 59.292 33.666 -11.460 1.00 91.93 C +HETATM 3185 C8 NAG B 1 59.572 35.021 -10.803 1.00 91.98 C +HETATM 3186 N2 NAG B 1 60.230 33.123 -12.238 1.00 89.59 N +HETATM 3187 O3 NAG B 1 62.125 34.045 -14.197 1.00 90.20 O +HETATM 3188 O4 NAG B 1 64.620 32.592 -14.148 1.00 94.81 O +HETATM 3189 O5 NAG B 1 63.520 32.542 -10.618 1.00 89.48 O +HETATM 3190 O6 NAG B 1 66.588 31.264 -11.855 1.00 92.26 O +HETATM 3191 O7 NAG B 1 58.201 33.121 -11.271 1.00 93.62 O +HETATM 3192 C1 NAG B 2 65.884 33.027 -14.514 1.00 95.43 C +HETATM 3193 C2 NAG B 2 66.169 32.456 -15.910 1.00 96.55 C +HETATM 3194 C3 NAG B 2 67.347 33.147 -16.631 1.00 98.14 C +HETATM 3195 C4 NAG B 2 67.286 34.672 -16.474 1.00 98.34 C +HETATM 3196 C5 NAG B 2 67.119 35.014 -14.998 1.00 97.94 C +HETATM 3197 C6 NAG B 2 67.113 36.512 -14.712 1.00 98.10 C +HETATM 3198 C7 NAG B 2 65.555 30.159 -16.315 1.00 93.56 C +HETATM 3199 C8 NAG B 2 65.804 29.681 -17.737 0.00 94.03 C +HETATM 3200 N2 NAG B 2 66.422 31.029 -15.806 1.00 94.72 N +HETATM 3201 O3 NAG B 2 67.293 32.824 -18.020 1.00100.07 O +HETATM 3202 O4 NAG B 2 68.470 35.271 -16.987 1.00 99.03 O +HETATM 3203 O5 NAG B 2 65.870 34.462 -14.534 1.00 96.53 O +HETATM 3204 O6 NAG B 2 68.344 36.930 -14.140 0.00 98.05 O +HETATM 3205 O7 NAG B 2 64.583 29.739 -15.688 0.00 94.03 O +HETATM 3206 ZN ZN A1405 60.286 8.974 16.065 1.00 54.07 ZN +HETATM 3207 O HOH A2001 78.132 27.878 -4.180 1.00 45.05 O +HETATM 3208 O HOH A2002 82.330 6.013 0.636 1.00 64.86 O +HETATM 3209 O HOH A2003 81.835 16.713 -6.124 1.00 59.84 O +HETATM 3210 O HOH A2004 75.514 29.636 -3.926 1.00 41.20 O +HETATM 3211 O HOH A2005 80.196 25.633 12.190 1.00 57.41 O +HETATM 3212 O HOH A2006 62.684 12.475 -8.452 1.00 13.19 O +HETATM 3213 O HOH A2007 52.879 18.275 -6.726 1.00 39.30 O +HETATM 3214 O HOH A2008 72.319 -2.856 5.537 1.00 42.24 O +HETATM 3215 O HOH A2009 67.653 37.005 13.102 1.00 25.37 O +HETATM 3216 O HOH A2010 41.088 20.285 19.349 1.00 54.42 O +HETATM 3217 O HOH A2011 38.875 16.995 9.527 1.00 56.21 O +HETATM 3218 O HOH A2012 47.976 13.079 -3.204 1.00 32.64 O +HETATM 3219 O HOH A2013 50.367 1.553 -0.172 1.00 32.17 O +HETATM 3220 O HOH A2014 64.677 32.680 17.442 1.00 33.13 O +HETATM 3221 O HOH A2015 55.922 11.228 19.777 1.00 32.14 O +HETATM 3222 O HOH A2016 62.771 -4.388 6.952 1.00 32.97 O +HETATM 3223 O HOH A2017 55.391 -5.228 5.992 1.00 26.00 O +HETATM 3224 O HOH A2018 51.337 3.270 -2.361 1.00 45.64 O +HETATM 3225 O HOH A2019 52.499 35.911 28.860 1.00 46.53 O +HETATM 3226 O HOH A2020 61.821 56.186 24.783 1.00 49.46 O +HETATM 3227 O HOH A2021 49.263 55.398 13.697 1.00 33.87 O +HETATM 3228 O HOH A2022 47.187 44.309 1.811 1.00 66.55 O +HETATM 3229 O HOH A2023 58.981 60.180 15.029 1.00 38.43 O +HETATM 3230 O HOH A2024 69.184 33.070 -13.978 1.00 71.63 O +HETATM 3231 O HOH A2025 69.863 34.623 -19.663 1.00 50.39 O +CONECT 540 3206 +CONECT 563 3206 +CONECT 564 3206 +CONECT 792 3178 +CONECT 969 2156 +CONECT 1408 3206 +CONECT 1805 2150 +CONECT 2150 1805 +CONECT 2156 969 +CONECT 2617 3098 +CONECT 3098 2617 +CONECT 3178 792 3179 3189 +CONECT 3179 3178 3180 3186 +CONECT 3180 3179 3181 3187 +CONECT 3181 3180 3182 3188 +CONECT 3182 3181 3183 3189 +CONECT 3183 3182 3190 +CONECT 3184 3185 3186 3191 +CONECT 3185 3184 +CONECT 3186 3179 3184 +CONECT 3187 3180 +CONECT 3188 3181 3192 +CONECT 3189 3178 3182 +CONECT 3190 3183 +CONECT 3191 3184 +CONECT 3192 3188 3193 3203 +CONECT 3193 3192 3194 3200 +CONECT 3194 3193 3195 3201 +CONECT 3195 3194 3196 3202 +CONECT 3196 3195 3197 3203 +CONECT 3197 3196 3204 +CONECT 3198 3199 3200 3205 +CONECT 3199 3198 +CONECT 3200 3193 3198 +CONECT 3201 3194 +CONECT 3202 3195 +CONECT 3203 3192 3196 +CONECT 3204 3197 +CONECT 3205 3198 +CONECT 3206 540 563 564 1408 +MASTER 470 0 3 13 22 0 0 6 3230 1 40 33 +END diff --git a/src/test/resources/data/tricky_cases/readme.md b/src/test/resources/data/tricky_cases/readme.md index 5cb1d417..6e3cf00e 100644 --- a/src/test/resources/data/tricky_cases/readme.md +++ b/src/test/resources/data/tricky_cases/readme.md @@ -1,13 +1,16 @@ - - -# 1o6u.pdb / 1o6u.cif - -Has chain discontinuity in A (321 -> 326) and C (322 -> 332). +# Chain discontinuities + P2Rank 2.4.1 cuts the chains at first break * in _residues.csv there are no residues after A_321 and C_322 * seems that rest of the atoms are considered non-protein internally + + + +## 1o6u.pdb / 1o6u.cif + +Has chain discontinuity in A (321 -> 326) and C (322 -> 332). ~~~pdb REMARK 465 MISSING RESIDUES @@ -24,5 +27,14 @@ ATOM 2601 N GLU A 326 -16.965 29.270 66.824 1.00 48.21 N ATOM 5791 OXT THR C 322 12.751 14.157 -6.216 1.00 51.08 O ATOM 5792 N GLU C 332 9.550 11.736 -12.274 1.00 44.39 N ~~~ + + +## 1uwy.pdb / 1uwy.cif +Has chain discontinuity in A (381 -> 391) + +~~~pdb +ATOM 3079 OXT GLY A 381 64.521 55.076 19.009 1.00 77.68 O +ATOM 3080 N PRO A 391 68.265 37.617 23.247 1.00 83.53 N +~~~ \ No newline at end of file