data_3P40 # _entry.id 3P40 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.281 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3P40 RCSB RCSB061927 WWPDB D_1000061927 # _pdbx_database_related.db_name PDB _pdbx_database_related.db_id 3P3Y _pdbx_database_related.details . _pdbx_database_related.content_type unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 3P40 _pdbx_database_status.recvd_initial_deposition_date 2010-10-05 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Liu, H.' 1 'He, X.' 2 # _citation.id primary _citation.title 'Homophilic adhesion mechanism of neurofascin, a member of the l1 family of neural cell adhesion molecules.' _citation.journal_abbrev J.Biol.Chem. _citation.journal_volume 286 _citation.page_first 797 _citation.page_last 805 _citation.year 2011 _citation.journal_id_ASTM JBCHA3 _citation.country US _citation.journal_id_ISSN 0021-9258 _citation.journal_id_CSD 0071 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 21047790 _citation.pdbx_database_id_DOI 10.1074/jbc.M110.180281 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Liu, H.' 1 primary 'Focia, P.J.' 2 primary 'He, X.' 3 # _cell.entry_id 3P40 _cell.length_a 94.508 _cell.length_b 94.508 _cell.length_c 126.723 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 120.00 _cell.Z_PDB 6 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 3P40 _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 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man Neurofascin 45285.199 1 ? ? 'N-terminal four Ig domains (UNP residues 25-428)' ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 1 ? ? ? ? 3 water nat water 18.015 255 ? ? ? ? # _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 ;IEIPMDPSIQNELTQPPTITKQSAKDHIVDPRDNILIECEAKGNPAPSFHWTRNSRFFNIAKDPRVSMRRRSGTLVIDFR SGGRPEEYEGEYQCFARNKFGTALSNRIRLQVSKSPLWPKENLDPVVVQEGAPLTLQCNPPPGLPSPVIFWMSSSMEPIT QDKRVSQGHNGDLYFSNVMLQDMQTDYSCNARFHFTHTIQQKNPFTLKVLTTRGVAERTPSFMYPQGTASSQMVLRGMDL LLECIASGVPTPDIAWYKKGGDLPSDKAKFENFNKALRITNVSEEDSGEYFCLASNKMGSIRHTISVRVKAAPYWLDEPK NLILAPGEDGRLVCRANGNPKPTVQWMVNGEPLQSAPPNPNREVAGDTIIFRDTQISSRAVYQCNTSNEHGYLLANAFVS VLDV ; _entity_poly.pdbx_seq_one_letter_code_can ;IEIPMDPSIQNELTQPPTITKQSAKDHIVDPRDNILIECEAKGNPAPSFHWTRNSRFFNIAKDPRVSMRRRSGTLVIDFR SGGRPEEYEGEYQCFARNKFGTALSNRIRLQVSKSPLWPKENLDPVVVQEGAPLTLQCNPPPGLPSPVIFWMSSSMEPIT QDKRVSQGHNGDLYFSNVMLQDMQTDYSCNARFHFTHTIQQKNPFTLKVLTTRGVAERTPSFMYPQGTASSQMVLRGMDL LLECIASGVPTPDIAWYKKGGDLPSDKAKFENFNKALRITNVSEEDSGEYFCLASNKMGSIRHTISVRVKAAPYWLDEPK NLILAPGEDGRLVCRANGNPKPTVQWMVNGEPLQSAPPNPNREVAGDTIIFRDTQISSRAVYQCNTSNEHGYLLANAFVS VLDV ; _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 ILE n 1 2 GLU n 1 3 ILE n 1 4 PRO n 1 5 MET n 1 6 ASP n 1 7 PRO n 1 8 SER n 1 9 ILE n 1 10 GLN n 1 11 ASN n 1 12 GLU n 1 13 LEU n 1 14 THR n 1 15 GLN n 1 16 PRO n 1 17 PRO n 1 18 THR n 1 19 ILE n 1 20 THR n 1 21 LYS n 1 22 GLN n 1 23 SER n 1 24 ALA n 1 25 LYS n 1 26 ASP n 1 27 HIS n 1 28 ILE n 1 29 VAL n 1 30 ASP n 1 31 PRO n 1 32 ARG n 1 33 ASP n 1 34 ASN n 1 35 ILE n 1 36 LEU n 1 37 ILE n 1 38 GLU n 1 39 CYS n 1 40 GLU n 1 41 ALA n 1 42 LYS n 1 43 GLY n 1 44 ASN n 1 45 PRO n 1 46 ALA n 1 47 PRO n 1 48 SER n 1 49 PHE n 1 50 HIS n 1 51 TRP n 1 52 THR n 1 53 ARG n 1 54 ASN n 1 55 SER n 1 56 ARG n 1 57 PHE n 1 58 PHE n 1 59 ASN n 1 60 ILE n 1 61 ALA n 1 62 LYS n 1 63 ASP n 1 64 PRO n 1 65 ARG n 1 66 VAL n 1 67 SER n 1 68 MET n 1 69 ARG n 1 70 ARG n 1 71 ARG n 1 72 SER n 1 73 GLY n 1 74 THR n 1 75 LEU n 1 76 VAL n 1 77 ILE n 1 78 ASP n 1 79 PHE n 1 80 ARG n 1 81 SER n 1 82 GLY n 1 83 GLY n 1 84 ARG n 1 85 PRO n 1 86 GLU n 1 87 GLU n 1 88 TYR n 1 89 GLU n 1 90 GLY n 1 91 GLU n 1 92 TYR n 1 93 GLN n 1 94 CYS n 1 95 PHE n 1 96 ALA n 1 97 ARG n 1 98 ASN n 1 99 LYS n 1 100 PHE n 1 101 GLY n 1 102 THR n 1 103 ALA n 1 104 LEU n 1 105 SER n 1 106 ASN n 1 107 ARG n 1 108 ILE n 1 109 ARG n 1 110 LEU n 1 111 GLN n 1 112 VAL n 1 113 SER n 1 114 LYS n 1 115 SER n 1 116 PRO n 1 117 LEU n 1 118 TRP n 1 119 PRO n 1 120 LYS n 1 121 GLU n 1 122 ASN n 1 123 LEU n 1 124 ASP n 1 125 PRO n 1 126 VAL n 1 127 VAL n 1 128 VAL n 1 129 GLN n 1 130 GLU n 1 131 GLY n 1 132 ALA n 1 133 PRO n 1 134 LEU n 1 135 THR n 1 136 LEU n 1 137 GLN n 1 138 CYS n 1 139 ASN n 1 140 PRO n 1 141 PRO n 1 142 PRO n 1 143 GLY n 1 144 LEU n 1 145 PRO n 1 146 SER n 1 147 PRO n 1 148 VAL n 1 149 ILE n 1 150 PHE n 1 151 TRP n 1 152 MET n 1 153 SER n 1 154 SER n 1 155 SER n 1 156 MET n 1 157 GLU n 1 158 PRO n 1 159 ILE n 1 160 THR n 1 161 GLN n 1 162 ASP n 1 163 LYS n 1 164 ARG n 1 165 VAL n 1 166 SER n 1 167 GLN n 1 168 GLY n 1 169 HIS n 1 170 ASN n 1 171 GLY n 1 172 ASP n 1 173 LEU n 1 174 TYR n 1 175 PHE n 1 176 SER n 1 177 ASN n 1 178 VAL n 1 179 MET n 1 180 LEU n 1 181 GLN n 1 182 ASP n 1 183 MET n 1 184 GLN n 1 185 THR n 1 186 ASP n 1 187 TYR n 1 188 SER n 1 189 CYS n 1 190 ASN n 1 191 ALA n 1 192 ARG n 1 193 PHE n 1 194 HIS n 1 195 PHE n 1 196 THR n 1 197 HIS n 1 198 THR n 1 199 ILE n 1 200 GLN n 1 201 GLN n 1 202 LYS n 1 203 ASN n 1 204 PRO n 1 205 PHE n 1 206 THR n 1 207 LEU n 1 208 LYS n 1 209 VAL n 1 210 LEU n 1 211 THR n 1 212 THR n 1 213 ARG n 1 214 GLY n 1 215 VAL n 1 216 ALA n 1 217 GLU n 1 218 ARG n 1 219 THR n 1 220 PRO n 1 221 SER n 1 222 PHE n 1 223 MET n 1 224 TYR n 1 225 PRO n 1 226 GLN n 1 227 GLY n 1 228 THR n 1 229 ALA n 1 230 SER n 1 231 SER n 1 232 GLN n 1 233 MET n 1 234 VAL n 1 235 LEU n 1 236 ARG n 1 237 GLY n 1 238 MET n 1 239 ASP n 1 240 LEU n 1 241 LEU n 1 242 LEU n 1 243 GLU n 1 244 CYS n 1 245 ILE n 1 246 ALA n 1 247 SER n 1 248 GLY n 1 249 VAL n 1 250 PRO n 1 251 THR n 1 252 PRO n 1 253 ASP n 1 254 ILE n 1 255 ALA n 1 256 TRP n 1 257 TYR n 1 258 LYS n 1 259 LYS n 1 260 GLY n 1 261 GLY n 1 262 ASP n 1 263 LEU n 1 264 PRO n 1 265 SER n 1 266 ASP n 1 267 LYS n 1 268 ALA n 1 269 LYS n 1 270 PHE n 1 271 GLU n 1 272 ASN n 1 273 PHE n 1 274 ASN n 1 275 LYS n 1 276 ALA n 1 277 LEU n 1 278 ARG n 1 279 ILE n 1 280 THR n 1 281 ASN n 1 282 VAL n 1 283 SER n 1 284 GLU n 1 285 GLU n 1 286 ASP n 1 287 SER n 1 288 GLY n 1 289 GLU n 1 290 TYR n 1 291 PHE n 1 292 CYS n 1 293 LEU n 1 294 ALA n 1 295 SER n 1 296 ASN n 1 297 LYS n 1 298 MET n 1 299 GLY n 1 300 SER n 1 301 ILE n 1 302 ARG n 1 303 HIS n 1 304 THR n 1 305 ILE n 1 306 SER n 1 307 VAL n 1 308 ARG n 1 309 VAL n 1 310 LYS n 1 311 ALA n 1 312 ALA n 1 313 PRO n 1 314 TYR n 1 315 TRP n 1 316 LEU n 1 317 ASP n 1 318 GLU n 1 319 PRO n 1 320 LYS n 1 321 ASN n 1 322 LEU n 1 323 ILE n 1 324 LEU n 1 325 ALA n 1 326 PRO n 1 327 GLY n 1 328 GLU n 1 329 ASP n 1 330 GLY n 1 331 ARG n 1 332 LEU n 1 333 VAL n 1 334 CYS n 1 335 ARG n 1 336 ALA n 1 337 ASN n 1 338 GLY n 1 339 ASN n 1 340 PRO n 1 341 LYS n 1 342 PRO n 1 343 THR n 1 344 VAL n 1 345 GLN n 1 346 TRP n 1 347 MET n 1 348 VAL n 1 349 ASN n 1 350 GLY n 1 351 GLU n 1 352 PRO n 1 353 LEU n 1 354 GLN n 1 355 SER n 1 356 ALA n 1 357 PRO n 1 358 PRO n 1 359 ASN n 1 360 PRO n 1 361 ASN n 1 362 ARG n 1 363 GLU n 1 364 VAL n 1 365 ALA n 1 366 GLY n 1 367 ASP n 1 368 THR n 1 369 ILE n 1 370 ILE n 1 371 PHE n 1 372 ARG n 1 373 ASP n 1 374 THR n 1 375 GLN n 1 376 ILE n 1 377 SER n 1 378 SER n 1 379 ARG n 1 380 ALA n 1 381 VAL n 1 382 TYR n 1 383 GLN n 1 384 CYS n 1 385 ASN n 1 386 THR n 1 387 SER n 1 388 ASN n 1 389 GLU n 1 390 HIS n 1 391 GLY n 1 392 TYR n 1 393 LEU n 1 394 LEU n 1 395 ALA n 1 396 ASN n 1 397 ALA n 1 398 PHE n 1 399 VAL n 1 400 SER n 1 401 VAL n 1 402 LEU n 1 403 ASP n 1 404 VAL 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 'NFASC, KIAA0756' _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 'cabbage looper' _entity_src_gen.pdbx_host_org_scientific_name 'Trichoplusia ni' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 7111 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line Hi5 _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code NFASC_HUMAN _struct_ref.pdbx_db_accession O94856 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;IEIPMDPSIQNELTQPPTITKQSAKDHIVDPRDNILIECEAKGNPAPSFHWTRNSRFFNIAKDPRVSMRRRSGTLVIDFR SGGRPEEYEGEYQCFARNKFGTALSNRIRLQVSKSPLWPKENLDPVVVQEGAPLTLQCNPPPGLPSPVIFWMSSSMEPIT QDKRVSQGHNGDLYFSNVMLQDMQTDYSCNARFHFTHTIQQKNPFTLKVLTTRGVAERTPSFMYPQGTASSQMVLRGMDL LLECIASGVPTPDIAWYKKGGDLPSDKAKFENFNKALRITNVSEEDSGEYFCLASNKMGSIRHTISVRVKAAPYWLDEPK NLILAPGEDGRLVCRANGNPKPTVQWMVNGEPLQSAPPNPNREVAGDTIIFRDTQISSRAVYQCNTSNEHGYLLANAFVS VLDV ; _struct_ref.pdbx_align_begin 25 _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 3P40 _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 404 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession O94856 _struct_ref_seq.db_align_beg 25 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 428 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 25 _struct_ref_seq.pdbx_auth_seq_align_end 428 # 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 . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 3P40 _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.61 _exptl_crystal.density_percent_sol 65.90 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 7.5 _exptl_crystal_grow.pdbx_details '30%(w/v) PEG400, 0.1 M HEPES, 0.2 lithium sulfate, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'MARMOSAIC 300 mm CCD' _diffrn_detector.pdbx_collection_date 2008-08-14 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'Si(111)' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.54981 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'APS BEAMLINE 21-ID-D' _diffrn_source.pdbx_synchrotron_site APS _diffrn_source.pdbx_synchrotron_beamline 21-ID-D _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.54981 # _reflns.entry_id 3P40 _reflns.observed_criterion_sigma_I 0.0 _reflns.observed_criterion_sigma_F 0.0 _reflns.d_resolution_low 50 _reflns.d_resolution_high 3.1 _reflns.number_obs 12195 _reflns.number_all 12256 _reflns.percent_possible_obs 99.5 _reflns.pdbx_Rmerge_I_obs 0.099 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 13.7 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 3.6 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 # _reflns_shell.d_res_high 3.1 _reflns_shell.d_res_low 3.21 _reflns_shell.percent_possible_all 99.7 _reflns_shell.Rmerge_I_obs 0.515 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs 4.4 _reflns_shell.pdbx_redundancy 3.7 _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all 1210 _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_diffrn_id ? _reflns_shell.pdbx_ordinal 1 # _refine.entry_id 3P40 _refine.ls_number_reflns_obs 11191 _refine.ls_number_reflns_all 11235 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.0 _refine.pdbx_data_cutoff_high_absF 1838684.22 _refine.pdbx_data_cutoff_low_absF 0.000000 _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 40.92 _refine.ls_d_res_high 3.20 _refine.ls_percent_reflns_obs 99.6 _refine.ls_R_factor_obs 0.273 _refine.ls_R_factor_all 0.296 _refine.ls_R_factor_R_work 0.273 _refine.ls_R_factor_R_free 0.316 _refine.ls_R_factor_R_free_error 0.013 _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.0 _refine.ls_number_reflns_R_free 563 _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 63.1 _refine.aniso_B[1][1] -8.95 _refine.aniso_B[2][2] -8.95 _refine.aniso_B[3][3] 17.90 _refine.aniso_B[1][2] 8.33 _refine.aniso_B[1][3] 0.00 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_details 'FLAT MODEL' _refine.solvent_model_param_ksol 0.303892 _refine.solvent_model_param_bsol 62.5836 _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details 'BULK SOLVENT MODEL USED' _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct SIRAS _refine.pdbx_isotropic_thermal_model RESTRAINED _refine.pdbx_stereochemistry_target_values 'Engh & Huber' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML ? _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_overall_phase_error ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_overall_ESU_R ? _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_analyze.entry_id 3P40 _refine_analyze.Luzzati_coordinate_error_obs 0.48 _refine_analyze.Luzzati_sigma_a_obs 0.59 _refine_analyze.Luzzati_d_res_low_obs 5.00 _refine_analyze.Luzzati_coordinate_error_free 0.58 _refine_analyze.Luzzati_sigma_a_free 0.67 _refine_analyze.Luzzati_d_res_low_free ? _refine_analyze.number_disordered_residues ? _refine_analyze.occupancy_sum_hydrogen ? _refine_analyze.occupancy_sum_non_hydrogen ? _refine_analyze.pdbx_Luzzati_d_res_high_obs ? _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 3068 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 14 _refine_hist.number_atoms_solvent 255 _refine_hist.number_atoms_total 3337 _refine_hist.d_res_high 3.20 _refine_hist.d_res_low 40.92 # 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 0.010 ? ? ? 'X-RAY DIFFRACTION' ? c_angle_deg 1.5 ? ? ? 'X-RAY DIFFRACTION' ? c_dihedral_angle_d 26.8 ? ? ? 'X-RAY DIFFRACTION' ? c_improper_angle_d 1.23 ? ? ? 'X-RAY DIFFRACTION' ? # _refine_ls_restr_ncs.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_restr_ncs.dom_id 1 _refine_ls_restr_ncs.ncs_model_details NONE _refine_ls_restr_ncs.rms_dev_position ? _refine_ls_restr_ncs.weight_position ? _refine_ls_restr_ncs.rms_dev_B_iso ? _refine_ls_restr_ncs.weight_B_iso ? _refine_ls_restr_ncs.pdbx_ordinal 1 _refine_ls_restr_ncs.pdbx_type . _refine_ls_restr_ncs.pdbx_auth_asym_id . _refine_ls_restr_ncs.pdbx_ens_id 1 _refine_ls_restr_ncs.pdbx_number ? # _refine_ls_shell.pdbx_total_number_of_bins_used 6 _refine_ls_shell.d_res_high 3.20 _refine_ls_shell.d_res_low 3.40 _refine_ls_shell.number_reflns_R_work 1751 _refine_ls_shell.R_factor_R_work 0.348 _refine_ls_shell.percent_reflns_obs 99.5 _refine_ls_shell.R_factor_R_free 0.401 _refine_ls_shell.R_factor_R_free_error 0.044 _refine_ls_shell.percent_reflns_R_free 4.6 _refine_ls_shell.number_reflns_R_free 84 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.number_reflns_obs 1751 _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' # loop_ _pdbx_xplor_file.serial_no _pdbx_xplor_file.param_file _pdbx_xplor_file.topol_file _pdbx_xplor_file.pdbx_refine_id 1 protein_rep.param protein.top 'X-RAY DIFFRACTION' 2 water_rep.param water.top 'X-RAY DIFFRACTION' 3 carbohydrate.param carbohydrate.top 'X-RAY DIFFRACTION' 4 ion.param ion.top 'X-RAY DIFFRACTION' # _struct_ncs_dom.id 1 _struct_ncs_dom.details ? _struct_ncs_dom.pdbx_ens_id 1 # _struct_ncs_ens.id 1 _struct_ncs_ens.details ? # _struct.entry_id 3P40 _struct.title 'Crystal structure of neurofascin adhesion complex in space group p3221' _struct.pdbx_descriptor Neurofascin _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3P40 _struct_keywords.pdbx_keywords 'CELL ADHESION' _struct_keywords.text 'Ig domains, CELL ADHESION' # 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 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 ARG A 84 ? GLU A 89 ? ARG A 108 GLU A 113 5 ? 6 HELX_P HELX_P2 2 GLN A 181 ? THR A 185 ? GLN A 205 THR A 209 5 ? 5 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 39 SG ? ? ? 1_555 A CYS 94 SG ? ? A CYS 63 A CYS 118 1_555 ? ? ? ? ? ? ? 2.035 ? disulf2 disulf ? ? A CYS 138 SG ? ? ? 1_555 A CYS 189 SG ? ? A CYS 162 A CYS 213 1_555 ? ? ? ? ? ? ? 2.049 ? disulf3 disulf ? ? A CYS 244 SG ? ? ? 1_555 A CYS 292 SG ? ? A CYS 268 A CYS 316 1_555 ? ? ? ? ? ? ? 2.032 ? disulf4 disulf ? ? A CYS 334 SG ? ? ? 1_555 A CYS 384 SG ? ? A CYS 358 A CYS 408 1_555 ? ? ? ? ? ? ? 2.046 ? covale1 covale ? ? A ASN 385 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 409 A NAG 1 1_555 ? ? ? ? ? ? ? 1.461 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 LEU 144 A . ? LEU 168 A PRO 145 A ? PRO 169 A 1 -0.56 2 ASN 339 A . ? ASN 363 A PRO 340 A ? PRO 364 A 1 0.71 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 2 ? B ? 3 ? C ? 3 ? D ? 2 ? E ? 3 ? F ? 3 ? G ? 2 ? H ? 4 ? I ? 3 ? J ? 3 ? K ? 5 ? L ? 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 A 1 2 ? anti-parallel B 1 2 ? parallel B 2 3 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel D 1 2 ? parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel G 1 2 ? anti-parallel H 1 2 ? parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel I 1 2 ? parallel I 2 3 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel K 1 2 ? parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel K 4 5 ? anti-parallel L 1 2 ? anti-parallel L 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 A 1 LYS A 21 ? GLN A 22 ? LYS A 45 GLN A 46 A 2 CYS A 39 ? GLU A 40 ? CYS A 63 GLU A 64 B 1 ASP A 26 ? VAL A 29 ? ASP A 50 VAL A 53 B 2 ILE A 108 ? VAL A 112 ? ILE A 132 VAL A 136 B 3 GLY A 90 ? TYR A 92 ? GLY A 114 TYR A 116 C 1 SER A 48 ? PHE A 49 ? SER A 72 PHE A 73 C 2 PHE A 95 ? ARG A 97 ? PHE A 119 ARG A 121 C 3 THR A 102 ? LEU A 104 ? THR A 126 LEU A 128 D 1 VAL A 126 ? GLN A 129 ? VAL A 150 GLN A 153 D 2 LEU A 207 ? LEU A 210 ? LEU A 231 LEU A 234 E 1 LEU A 134 ? LEU A 136 ? LEU A 158 LEU A 160 E 2 LEU A 173 ? PHE A 175 ? LEU A 197 PHE A 199 E 3 VAL A 165 ? GLN A 167 ? VAL A 189 GLN A 191 F 1 VAL A 148 ? MET A 152 ? VAL A 172 MET A 176 F 2 SER A 188 ? PHE A 193 ? SER A 212 PHE A 217 F 3 THR A 198 ? GLN A 201 ? THR A 222 GLN A 225 G 1 SER A 221 ? PHE A 222 ? SER A 245 PHE A 246 G 2 ALA A 246 ? SER A 247 ? ALA A 270 SER A 271 H 1 ALA A 229 ? LEU A 235 ? ALA A 253 LEU A 259 H 2 SER A 300 ? ASP A 317 ? SER A 324 ASP A 341 H 3 GLY A 288 ? SER A 295 ? GLY A 312 SER A 319 H 4 ASP A 253 ? LYS A 258 ? ASP A 277 LYS A 282 I 1 ALA A 229 ? LEU A 235 ? ALA A 253 LEU A 259 I 2 SER A 300 ? ASP A 317 ? SER A 324 ASP A 341 I 3 ARG A 335 ? ASN A 339 ? ARG A 359 ASN A 363 J 1 LEU A 240 ? GLU A 243 ? LEU A 264 GLU A 267 J 2 ALA A 276 ? ILE A 279 ? ALA A 300 ILE A 303 J 3 ALA A 268 ? PHE A 270 ? ALA A 292 PHE A 294 K 1 LEU A 322 ? LEU A 324 ? LEU A 346 LEU A 348 K 2 LEU A 394 ? VAL A 401 ? LEU A 418 VAL A 425 K 3 ALA A 380 ? SER A 387 ? ALA A 404 SER A 411 K 4 THR A 343 ? VAL A 348 ? THR A 367 VAL A 372 K 5 GLU A 351 ? PRO A 352 ? GLU A 375 PRO A 376 L 1 GLY A 330 ? VAL A 333 ? GLY A 354 VAL A 357 L 2 THR A 368 ? PHE A 371 ? THR A 392 PHE A 395 L 3 ARG A 362 ? VAL A 364 ? ARG A 386 VAL A 388 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N LYS A 21 ? N LYS A 45 O GLU A 40 ? O GLU A 64 B 1 2 N HIS A 27 ? N HIS A 51 O GLN A 111 ? O GLN A 135 B 2 3 O LEU A 110 ? O LEU A 134 N GLY A 90 ? N GLY A 114 C 1 2 N SER A 48 ? N SER A 72 O ARG A 97 ? O ARG A 121 C 2 3 N ALA A 96 ? N ALA A 120 O ALA A 103 ? O ALA A 127 D 1 2 N VAL A 128 ? N VAL A 152 O LYS A 208 ? O LYS A 232 E 1 2 N LEU A 134 ? N LEU A 158 O PHE A 175 ? O PHE A 199 E 2 3 O TYR A 174 ? O TYR A 198 N SER A 166 ? N SER A 190 F 1 2 N VAL A 148 ? N VAL A 172 O ARG A 192 ? O ARG A 216 F 2 3 N ALA A 191 ? N ALA A 215 O GLN A 200 ? O GLN A 224 G 1 2 N SER A 221 ? N SER A 245 O SER A 247 ? O SER A 271 H 1 2 N GLN A 232 ? N GLN A 256 O SER A 306 ? O SER A 330 H 2 3 O ILE A 305 ? O ILE A 329 N TYR A 290 ? N TYR A 314 H 3 4 O PHE A 291 ? O PHE A 315 N TYR A 257 ? N TYR A 281 I 1 2 N GLN A 232 ? N GLN A 256 O SER A 306 ? O SER A 330 I 2 3 N TYR A 314 ? N TYR A 338 O ASN A 337 ? O ASN A 361 J 1 2 N LEU A 240 ? N LEU A 264 O ILE A 279 ? O ILE A 303 J 2 3 O ARG A 278 ? O ARG A 302 N LYS A 269 ? N LYS A 293 K 1 2 N LEU A 322 ? N LEU A 346 O PHE A 398 ? O PHE A 422 K 2 3 O ALA A 397 ? O ALA A 421 N TYR A 382 ? N TYR A 406 K 3 4 O SER A 387 ? O SER A 411 N THR A 343 ? N THR A 367 K 4 5 N VAL A 348 ? N VAL A 372 O GLU A 351 ? O GLU A 375 L 1 2 N GLY A 330 ? N GLY A 354 O PHE A 371 ? O PHE A 395 L 2 3 O ILE A 370 ? O ILE A 394 N GLU A 363 ? N GLU A 387 # _struct_site.id AC1 _struct_site.pdbx_evidence_code Software _struct_site.pdbx_auth_asym_id ? _struct_site.pdbx_auth_comp_id ? _struct_site.pdbx_auth_seq_id ? _struct_site.pdbx_auth_ins_code ? _struct_site.pdbx_num_residues 4 _struct_site.details 'BINDING SITE FOR RESIDUE NAG A 1' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 4 ARG A 107 ? ARG A 131 . ? 1_555 ? 2 AC1 4 ASN A 385 ? ASN A 409 . ? 1_555 ? 3 AC1 4 SER A 387 ? SER A 411 . ? 1_555 ? 4 AC1 4 HOH C . ? HOH A 582 . ? 1_555 ? # _database_PDB_matrix.entry_id 3P40 _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 3P40 _atom_sites.fract_transf_matrix[1][1] 0.010581 _atom_sites.fract_transf_matrix[1][2] 0.006109 _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] 0.012218 _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] 0.007891 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . LEU A 1 13 ? -68.746 31.364 3.320 1.00 111.23 ? 37 LEU A N 1 ATOM 2 C CA . LEU A 1 13 ? -69.813 32.408 3.189 1.00 111.45 ? 37 LEU A CA 1 ATOM 3 C C . LEU A 1 13 ? -69.611 33.545 4.190 1.00 110.88 ? 37 LEU A C 1 ATOM 4 O O . LEU A 1 13 ? -69.177 33.305 5.319 1.00 110.46 ? 37 LEU A O 1 ATOM 5 C CB . LEU A 1 13 ? -71.199 31.786 3.378 1.00 111.89 ? 37 LEU A CB 1 ATOM 6 C CG . LEU A 1 13 ? -71.755 31.008 2.179 1.00 112.12 ? 37 LEU A CG 1 ATOM 7 C CD1 . LEU A 1 13 ? -70.757 29.952 1.738 1.00 111.84 ? 37 LEU A CD1 1 ATOM 8 C CD2 . LEU A 1 13 ? -73.084 30.366 2.554 1.00 112.77 ? 37 LEU A CD2 1 ATOM 9 N N . THR A 1 14 ? -69.926 34.771 3.752 1.00 109.69 ? 38 THR A N 1 ATOM 10 C CA . THR A 1 14 ? -69.785 36.001 4.540 1.00 108.32 ? 38 THR A CA 1 ATOM 11 C C . THR A 1 14 ? -68.507 36.007 5.367 1.00 105.92 ? 38 THR A C 1 ATOM 12 O O . THR A 1 14 ? -68.532 35.882 6.596 1.00 106.66 ? 38 THR A O 1 ATOM 13 C CB . THR A 1 14 ? -70.997 36.229 5.485 1.00 110.09 ? 38 THR A CB 1 ATOM 14 O OG1 . THR A 1 14 ? -70.753 37.386 6.297 1.00 110.51 ? 38 THR A OG1 1 ATOM 15 C CG2 . THR A 1 14 ? -71.235 35.018 6.386 1.00 110.46 ? 38 THR A CG2 1 ATOM 16 N N . GLN A 1 15 ? -67.379 36.193 4.693 1.00 102.34 ? 39 GLN A N 1 ATOM 17 C CA . GLN A 1 15 ? -66.102 36.186 5.394 1.00 98.64 ? 39 GLN A CA 1 ATOM 18 C C . GLN A 1 15 ? -65.081 37.134 4.809 1.00 97.36 ? 39 GLN A C 1 ATOM 19 O O . GLN A 1 15 ? -65.094 37.440 3.608 1.00 97.07 ? 39 GLN A O 1 ATOM 20 C CB . GLN A 1 15 ? -65.549 34.759 5.440 1.00 96.61 ? 39 GLN A CB 1 ATOM 21 C CG . GLN A 1 15 ? -64.052 34.649 5.471 1.00 92.59 ? 39 GLN A CG 1 ATOM 22 C CD . GLN A 1 15 ? -63.571 33.681 4.429 1.00 91.23 ? 39 GLN A CD 1 ATOM 23 O OE1 . GLN A 1 15 ? -63.981 32.522 4.408 1.00 90.37 ? 39 GLN A OE1 1 ATOM 24 N NE2 . GLN A 1 15 ? -62.711 34.148 3.547 1.00 90.34 ? 39 GLN A NE2 1 ATOM 25 N N . PRO A 1 16 ? -64.203 37.646 5.676 1.00 95.33 ? 40 PRO A N 1 ATOM 26 C CA . PRO A 1 16 ? -63.132 38.571 5.311 1.00 93.76 ? 40 PRO A CA 1 ATOM 27 C C . PRO A 1 16 ? -62.089 37.845 4.444 1.00 92.10 ? 40 PRO A C 1 ATOM 28 O O . PRO A 1 16 ? -61.976 36.614 4.473 1.00 92.62 ? 40 PRO A O 1 ATOM 29 C CB . PRO A 1 16 ? -62.595 39.008 6.664 1.00 94.44 ? 40 PRO A CB 1 ATOM 30 C CG . PRO A 1 16 ? -63.833 38.956 7.520 1.00 94.03 ? 40 PRO A CG 1 ATOM 31 C CD . PRO A 1 16 ? -64.401 37.633 7.133 1.00 93.80 ? 40 PRO A CD 1 ATOM 32 N N . PRO A 1 17 ? -61.316 38.602 3.661 1.00 89.92 ? 41 PRO A N 1 ATOM 33 C CA . PRO A 1 17 ? -60.263 38.110 2.751 1.00 88.67 ? 41 PRO A CA 1 ATOM 34 C C . PRO A 1 17 ? -59.168 37.181 3.337 1.00 87.14 ? 41 PRO A C 1 ATOM 35 O O . PRO A 1 17 ? -58.755 37.344 4.480 1.00 87.20 ? 41 PRO A O 1 ATOM 36 C CB . PRO A 1 17 ? -59.655 39.405 2.212 1.00 89.57 ? 41 PRO A CB 1 ATOM 37 C CG . PRO A 1 17 ? -60.769 40.397 2.324 1.00 89.20 ? 41 PRO A CG 1 ATOM 38 C CD . PRO A 1 17 ? -61.370 40.074 3.651 1.00 88.95 ? 41 PRO A CD 1 ATOM 39 N N . THR A 1 18 ? -58.699 36.217 2.543 1.00 84.17 ? 42 THR A N 1 ATOM 40 C CA . THR A 1 18 ? -57.642 35.283 2.970 1.00 80.71 ? 42 THR A CA 1 ATOM 41 C C . THR A 1 18 ? -56.677 35.058 1.819 1.00 78.87 ? 42 THR A C 1 ATOM 42 O O . THR A 1 18 ? -57.025 34.312 0.909 1.00 80.01 ? 42 THR A O 1 ATOM 43 C CB . THR A 1 18 ? -58.206 33.905 3.370 1.00 81.02 ? 42 THR A CB 1 ATOM 44 O OG1 . THR A 1 18 ? -59.630 33.983 3.490 1.00 81.11 ? 42 THR A OG1 1 ATOM 45 C CG2 . THR A 1 18 ? -57.612 33.454 4.694 1.00 80.36 ? 42 THR A CG2 1 ATOM 46 N N . ILE A 1 19 ? -55.473 35.637 1.841 1.00 75.31 ? 43 ILE A N 1 ATOM 47 C CA . ILE A 1 19 ? -54.552 35.431 0.711 1.00 70.88 ? 43 ILE A CA 1 ATOM 48 C C . ILE A 1 19 ? -54.052 34.008 0.531 1.00 70.83 ? 43 ILE A C 1 ATOM 49 O O . ILE A 1 19 ? -53.529 33.402 1.460 1.00 71.44 ? 43 ILE A O 1 ATOM 50 C CB . ILE A 1 19 ? -53.322 36.334 0.792 1.00 66.85 ? 43 ILE A CB 1 ATOM 51 C CG1 . ILE A 1 19 ? -53.745 37.794 0.947 1.00 65.36 ? 43 ILE A CG1 1 ATOM 52 C CG2 . ILE A 1 19 ? -52.516 36.172 -0.466 1.00 64.27 ? 43 ILE A CG2 1 ATOM 53 C CD1 . ILE A 1 19 ? -52.616 38.728 1.321 1.00 64.81 ? 43 ILE A CD1 1 ATOM 54 N N . THR A 1 20 ? -54.191 33.498 -0.689 1.00 70.54 ? 44 THR A N 1 ATOM 55 C CA . THR A 1 20 ? -53.809 32.129 -0.994 1.00 70.13 ? 44 THR A CA 1 ATOM 56 C C . THR A 1 20 ? -52.395 31.989 -1.517 1.00 68.85 ? 44 THR A C 1 ATOM 57 O O . THR A 1 20 ? -51.652 31.113 -1.085 1.00 69.89 ? 44 THR A O 1 ATOM 58 C CB . THR A 1 20 ? -54.791 31.463 -2.006 1.00 71.35 ? 44 THR A CB 1 ATOM 59 O OG1 . THR A 1 20 ? -56.145 31.827 -1.685 1.00 70.89 ? 44 THR A OG1 1 ATOM 60 C CG2 . THR A 1 20 ? -54.665 29.927 -1.944 1.00 71.60 ? 44 THR A CG2 1 ATOM 61 N N . LYS A 1 21 ? -52.028 32.847 -2.459 1.00 66.79 ? 45 LYS A N 1 ATOM 62 C CA . LYS A 1 21 ? -50.709 32.754 -3.082 1.00 64.97 ? 45 LYS A CA 1 ATOM 63 C C . LYS A 1 21 ? -50.193 34.140 -3.477 1.00 63.84 ? 45 LYS A C 1 ATOM 64 O O . LYS A 1 21 ? -50.944 35.019 -3.870 1.00 63.19 ? 45 LYS A O 1 ATOM 65 C CB . LYS A 1 21 ? -50.781 31.858 -4.323 1.00 64.99 ? 45 LYS A CB 1 ATOM 66 C CG . LYS A 1 21 ? -49.455 31.671 -5.009 1.00 66.41 ? 45 LYS A CG 1 ATOM 67 C CD . LYS A 1 21 ? -49.615 31.187 -6.450 1.00 68.25 ? 45 LYS A CD 1 ATOM 68 C CE . LYS A 1 21 ? -50.140 29.758 -6.549 1.00 69.53 ? 45 LYS A CE 1 ATOM 69 N NZ . LYS A 1 21 ? -50.085 29.255 -7.962 1.00 71.05 ? 45 LYS A NZ 1 ATOM 70 N N . GLN A 1 22 ? -48.896 34.347 -3.337 1.00 63.52 ? 46 GLN A N 1 ATOM 71 C CA . GLN A 1 22 ? -48.323 35.640 -3.667 1.00 61.29 ? 46 GLN A CA 1 ATOM 72 C C . GLN A 1 22 ? -46.875 35.464 -4.080 1.00 60.62 ? 46 GLN A C 1 ATOM 73 O O . GLN A 1 22 ? -46.306 34.383 -3.928 1.00 61.20 ? 46 GLN A O 1 ATOM 74 C CB . GLN A 1 22 ? -48.420 36.603 -2.474 1.00 60.34 ? 46 GLN A CB 1 ATOM 75 C CG . GLN A 1 22 ? -47.526 36.301 -1.267 1.00 57.28 ? 46 GLN A CG 1 ATOM 76 C CD . GLN A 1 22 ? -47.860 37.184 -0.058 1.00 56.99 ? 46 GLN A CD 1 ATOM 77 O OE1 . GLN A 1 22 ? -48.609 36.768 0.826 1.00 56.22 ? 46 GLN A OE1 1 ATOM 78 N NE2 . GLN A 1 22 ? -47.318 38.409 -0.026 1.00 53.95 ? 46 GLN A NE2 1 ATOM 79 N N . SER A 1 23 ? -46.284 36.516 -4.627 1.00 58.54 ? 47 SER A N 1 ATOM 80 C CA . SER A 1 23 ? -44.900 36.440 -5.064 1.00 57.97 ? 47 SER A CA 1 ATOM 81 C C . SER A 1 23 ? -43.916 36.552 -3.910 1.00 56.77 ? 47 SER A C 1 ATOM 82 O O . SER A 1 23 ? -44.297 36.998 -2.818 1.00 57.38 ? 47 SER A O 1 ATOM 83 C CB . SER A 1 23 ? -44.616 37.534 -6.085 1.00 57.99 ? 47 SER A CB 1 ATOM 84 O OG . SER A 1 23 ? -45.162 37.182 -7.341 1.00 60.91 ? 47 SER A OG 1 ATOM 85 N N . ALA A 1 24 ? -42.658 36.155 -4.156 1.00 55.09 ? 48 ALA A N 1 ATOM 86 C CA . ALA A 1 24 ? -41.590 36.185 -3.136 1.00 53.78 ? 48 ALA A CA 1 ATOM 87 C C . ALA A 1 24 ? -41.206 37.590 -2.671 1.00 52.97 ? 48 ALA A C 1 ATOM 88 O O . ALA A 1 24 ? -41.477 38.571 -3.382 1.00 51.69 ? 48 ALA A O 1 ATOM 89 C CB . ALA A 1 24 ? -40.367 35.477 -3.665 1.00 53.65 ? 48 ALA A CB 1 ATOM 90 N N . LYS A 1 25 ? -40.582 37.695 -1.491 1.00 52.12 ? 49 LYS A N 1 ATOM 91 C CA . LYS A 1 25 ? -40.212 39.024 -0.999 1.00 50.84 ? 49 LYS A CA 1 ATOM 92 C C . LYS A 1 25 ? -39.142 39.661 -1.882 1.00 50.11 ? 49 LYS A C 1 ATOM 93 O O . LYS A 1 25 ? -39.201 40.861 -2.179 1.00 47.90 ? 49 LYS A O 1 ATOM 94 C CB . LYS A 1 25 ? -39.695 38.984 0.447 1.00 50.57 ? 49 LYS A CB 1 ATOM 95 C CG . LYS A 1 25 ? -40.740 38.884 1.544 1.00 48.26 ? 49 LYS A CG 1 ATOM 96 C CD . LYS A 1 25 ? -40.831 37.460 2.050 1.00 48.76 ? 49 LYS A CD 1 ATOM 97 C CE . LYS A 1 25 ? -41.404 37.395 3.459 1.00 48.66 ? 49 LYS A CE 1 ATOM 98 N NZ . LYS A 1 25 ? -40.501 37.984 4.477 1.00 48.89 ? 49 LYS A NZ 1 ATOM 99 N N . ASP A 1 26 ? -38.156 38.857 -2.280 1.00 50.01 ? 50 ASP A N 1 ATOM 100 C CA . ASP A 1 26 ? -37.085 39.342 -3.134 1.00 51.06 ? 50 ASP A CA 1 ATOM 101 C C . ASP A 1 26 ? -37.430 38.812 -4.535 1.00 49.70 ? 50 ASP A C 1 ATOM 102 O O . ASP A 1 26 ? -37.068 37.701 -4.917 1.00 49.94 ? 50 ASP A O 1 ATOM 103 C CB . ASP A 1 26 ? -35.755 38.768 -2.657 1.00 55.90 ? 50 ASP A CB 1 ATOM 104 C CG . ASP A 1 26 ? -34.586 39.658 -3.002 1.00 61.31 ? 50 ASP A CG 1 ATOM 105 O OD1 . ASP A 1 26 ? -34.657 40.869 -2.674 1.00 64.06 ? 50 ASP A OD1 1 ATOM 106 O OD2 . ASP A 1 26 ? -33.598 39.149 -3.591 1.00 64.99 ? 50 ASP A OD2 1 ATOM 107 N N . HIS A 1 27 ? -38.167 39.627 -5.282 1.00 47.07 ? 51 HIS A N 1 ATOM 108 C CA . HIS A 1 27 ? -38.631 39.301 -6.613 1.00 44.09 ? 51 HIS A CA 1 ATOM 109 C C . HIS A 1 27 ? -37.643 39.840 -7.629 1.00 42.47 ? 51 HIS A C 1 ATOM 110 O O . HIS A 1 27 ? -37.653 41.027 -7.982 1.00 40.22 ? 51 HIS A O 1 ATOM 111 C CB . HIS A 1 27 ? -40.009 39.927 -6.809 1.00 45.91 ? 51 HIS A CB 1 ATOM 112 C CG . HIS A 1 27 ? -40.842 39.260 -7.854 1.00 47.41 ? 51 HIS A CG 1 ATOM 113 N ND1 . HIS A 1 27 ? -40.901 37.888 -7.992 1.00 48.66 ? 51 HIS A ND1 1 ATOM 114 C CD2 . HIS A 1 27 ? -41.684 39.772 -8.781 1.00 47.85 ? 51 HIS A CD2 1 ATOM 115 C CE1 . HIS A 1 27 ? -41.746 37.586 -8.963 1.00 50.01 ? 51 HIS A CE1 1 ATOM 116 N NE2 . HIS A 1 27 ? -42.235 38.710 -9.459 1.00 49.42 ? 51 HIS A NE2 1 ATOM 117 N N . ILE A 1 28 ? -36.762 38.968 -8.095 1.00 43.13 ? 52 ILE A N 1 ATOM 118 C CA . ILE A 1 28 ? -35.777 39.377 -9.090 1.00 43.36 ? 52 ILE A CA 1 ATOM 119 C C . ILE A 1 28 ? -36.196 38.760 -10.434 1.00 43.34 ? 52 ILE A C 1 ATOM 120 O O . ILE A 1 28 ? -36.624 37.600 -10.491 1.00 42.96 ? 52 ILE A O 1 ATOM 121 C CB . ILE A 1 28 ? -34.322 38.927 -8.705 1.00 43.87 ? 52 ILE A CB 1 ATOM 122 C CG1 . ILE A 1 28 ? -34.255 37.407 -8.524 1.00 46.61 ? 52 ILE A CG1 1 ATOM 123 C CG2 . ILE A 1 28 ? -33.860 39.630 -7.430 1.00 41.52 ? 52 ILE A CG2 1 ATOM 124 C CD1 . ILE A 1 28 ? -35.133 36.838 -7.420 1.00 49.67 ? 52 ILE A CD1 1 ATOM 125 N N . VAL A 1 29 ? -36.121 39.561 -11.498 1.00 43.84 ? 53 VAL A N 1 ATOM 126 C CA . VAL A 1 29 ? -36.483 39.133 -12.857 1.00 45.61 ? 53 VAL A CA 1 ATOM 127 C C . VAL A 1 29 ? -35.504 39.649 -13.909 1.00 46.51 ? 53 VAL A C 1 ATOM 128 O O . VAL A 1 29 ? -34.860 40.686 -13.693 1.00 44.62 ? 53 VAL A O 1 ATOM 129 C CB . VAL A 1 29 ? -37.894 39.633 -13.196 1.00 46.97 ? 53 VAL A CB 1 ATOM 130 C CG1 . VAL A 1 29 ? -38.913 38.769 -12.471 1.00 48.39 ? 53 VAL A CG1 1 ATOM 131 C CG2 . VAL A 1 29 ? -38.048 41.117 -12.790 1.00 45.20 ? 53 VAL A CG2 1 ATOM 132 N N . ASP A 1 30 ? -35.394 38.944 -15.043 1.00 48.61 ? 54 ASP A N 1 ATOM 133 C CA . ASP A 1 30 ? -34.488 39.404 -16.104 1.00 51.26 ? 54 ASP A CA 1 ATOM 134 C C . ASP A 1 30 ? -35.213 40.311 -17.068 1.00 53.04 ? 54 ASP A C 1 ATOM 135 O O . ASP A 1 30 ? -36.450 40.313 -17.120 1.00 52.58 ? 54 ASP A O 1 ATOM 136 C CB . ASP A 1 30 ? -33.829 38.233 -16.853 1.00 51.13 ? 54 ASP A CB 1 ATOM 137 C CG . ASP A 1 30 ? -34.825 37.322 -17.503 1.00 51.29 ? 54 ASP A CG 1 ATOM 138 O OD1 . ASP A 1 30 ? -35.994 37.348 -17.075 1.00 52.78 ? 54 ASP A OD1 1 ATOM 139 O OD2 . ASP A 1 30 ? -34.441 36.571 -18.424 1.00 49.72 ? 54 ASP A OD2 1 ATOM 140 N N . PRO A 1 31 ? -34.442 41.116 -17.827 1.00 55.06 ? 55 PRO A N 1 ATOM 141 C CA . PRO A 1 31 ? -34.919 42.080 -18.817 1.00 58.26 ? 55 PRO A CA 1 ATOM 142 C C . PRO A 1 31 ? -35.505 41.365 -20.021 1.00 62.59 ? 55 PRO A C 1 ATOM 143 O O . PRO A 1 31 ? -36.367 41.884 -20.709 1.00 63.64 ? 55 PRO A O 1 ATOM 144 C CB . PRO A 1 31 ? -33.655 42.865 -19.168 1.00 57.23 ? 55 PRO A CB 1 ATOM 145 C CG . PRO A 1 31 ? -32.728 42.622 -17.989 1.00 54.58 ? 55 PRO A CG 1 ATOM 146 C CD . PRO A 1 31 ? -32.975 41.187 -17.714 1.00 54.13 ? 55 PRO A CD 1 ATOM 147 N N . ARG A 1 32 ? -35.028 40.157 -20.268 1.00 67.62 ? 56 ARG A N 1 ATOM 148 C CA . ARG A 1 32 ? -35.513 39.349 -21.370 1.00 71.99 ? 56 ARG A CA 1 ATOM 149 C C . ARG A 1 32 ? -37.048 39.145 -21.293 1.00 74.24 ? 56 ARG A C 1 ATOM 150 O O . ARG A 1 32 ? -37.762 39.501 -22.234 1.00 75.90 ? 56 ARG A O 1 ATOM 151 C CB . ARG A 1 32 ? -34.782 38.012 -21.337 1.00 73.88 ? 56 ARG A CB 1 ATOM 152 C CG . ARG A 1 32 ? -35.333 36.948 -22.238 1.00 78.35 ? 56 ARG A CG 1 ATOM 153 C CD . ARG A 1 32 ? -34.843 35.567 -21.807 1.00 81.58 ? 56 ARG A CD 1 ATOM 154 N NE . ARG A 1 32 ? -33.407 35.358 -22.008 1.00 83.32 ? 56 ARG A NE 1 ATOM 155 C CZ . ARG A 1 32 ? -32.441 35.867 -21.247 1.00 83.24 ? 56 ARG A CZ 1 ATOM 156 N NH1 . ARG A 1 32 ? -32.727 36.635 -20.206 1.00 84.30 ? 56 ARG A NH1 1 ATOM 157 N NH2 . ARG A 1 32 ? -31.175 35.593 -21.527 1.00 84.06 ? 56 ARG A NH2 1 ATOM 158 N N . ASP A 1 33 ? -37.549 38.604 -20.173 1.00 75.85 ? 57 ASP A N 1 ATOM 159 C CA . ASP A 1 33 ? -38.988 38.336 -19.973 1.00 77.15 ? 57 ASP A CA 1 ATOM 160 C C . ASP A 1 33 ? -39.834 39.539 -19.518 1.00 77.55 ? 57 ASP A C 1 ATOM 161 O O . ASP A 1 33 ? -39.333 40.663 -19.385 1.00 76.85 ? 57 ASP A O 1 ATOM 162 C CB . ASP A 1 33 ? -39.190 37.220 -18.947 1.00 79.42 ? 57 ASP A CB 1 ATOM 163 C CG . ASP A 1 33 ? -38.608 35.902 -19.397 1.00 83.17 ? 57 ASP A CG 1 ATOM 164 O OD1 . ASP A 1 33 ? -38.910 34.873 -18.751 1.00 85.15 ? 57 ASP A OD1 1 ATOM 165 O OD2 . ASP A 1 33 ? -37.845 35.896 -20.391 1.00 83.60 ? 57 ASP A OD2 1 ATOM 166 N N . ASN A 1 34 ? -41.123 39.277 -19.286 1.00 77.75 ? 58 ASN A N 1 ATOM 167 C CA . ASN A 1 34 ? -42.078 40.293 -18.832 1.00 78.75 ? 58 ASN A CA 1 ATOM 168 C C . ASN A 1 34 ? -42.321 40.195 -17.308 1.00 78.41 ? 58 ASN A C 1 ATOM 169 O O . ASN A 1 34 ? -41.922 39.204 -16.673 1.00 79.90 ? 58 ASN A O 1 ATOM 170 C CB . ASN A 1 34 ? -43.400 40.152 -19.601 1.00 81.78 ? 58 ASN A CB 1 ATOM 171 C CG . ASN A 1 34 ? -43.947 38.728 -19.589 1.00 85.05 ? 58 ASN A CG 1 ATOM 172 O OD1 . ASN A 1 34 ? -44.380 38.215 -20.626 1.00 86.22 ? 58 ASN A OD1 1 ATOM 173 N ND2 . ASN A 1 34 ? -43.945 38.089 -18.417 1.00 85.45 ? 58 ASN A ND2 1 ATOM 174 N N . ILE A 1 35 ? -42.955 41.219 -16.726 1.00 76.45 ? 59 ILE A N 1 ATOM 175 C CA . ILE A 1 35 ? -43.236 41.255 -15.285 1.00 74.27 ? 59 ILE A CA 1 ATOM 176 C C . ILE A 1 35 ? -44.495 40.510 -14.896 1.00 75.30 ? 59 ILE A C 1 ATOM 177 O O . ILE A 1 35 ? -45.535 40.681 -15.497 1.00 75.18 ? 59 ILE A O 1 ATOM 178 C CB . ILE A 1 35 ? -43.406 42.690 -14.782 1.00 71.42 ? 59 ILE A CB 1 ATOM 179 C CG1 . ILE A 1 35 ? -42.177 43.515 -15.136 1.00 71.01 ? 59 ILE A CG1 1 ATOM 180 C CG2 . ILE A 1 35 ? -43.624 42.689 -13.290 1.00 70.15 ? 59 ILE A CG2 1 ATOM 181 C CD1 . ILE A 1 35 ? -40.882 42.904 -14.679 1.00 72.51 ? 59 ILE A CD1 1 ATOM 182 N N . LEU A 1 36 ? -44.410 39.690 -13.867 1.00 76.39 ? 60 LEU A N 1 ATOM 183 C CA . LEU A 1 36 ? -45.579 38.950 -13.438 1.00 77.64 ? 60 LEU A CA 1 ATOM 184 C C . LEU A 1 36 ? -45.655 38.898 -11.920 1.00 77.84 ? 60 LEU A C 1 ATOM 185 O O . LEU A 1 36 ? -45.205 37.937 -11.289 1.00 79.97 ? 60 LEU A O 1 ATOM 186 C CB . LEU A 1 36 ? -45.548 37.533 -14.017 1.00 78.09 ? 60 LEU A CB 1 ATOM 187 C CG . LEU A 1 36 ? -46.889 36.793 -14.108 1.00 78.69 ? 60 LEU A CG 1 ATOM 188 C CD1 . LEU A 1 36 ? -47.411 36.423 -12.740 1.00 78.97 ? 60 LEU A CD1 1 ATOM 189 C CD2 . LEU A 1 36 ? -47.888 37.679 -14.834 1.00 80.39 ? 60 LEU A CD2 1 ATOM 190 N N . ILE A 1 37 ? -46.225 39.948 -11.342 1.00 76.17 ? 61 ILE A N 1 ATOM 191 C CA . ILE A 1 37 ? -46.391 40.052 -9.902 1.00 74.46 ? 61 ILE A CA 1 ATOM 192 C C . ILE A 1 37 ? -47.705 39.323 -9.521 1.00 74.69 ? 61 ILE A C 1 ATOM 193 O O . ILE A 1 37 ? -48.772 39.636 -10.040 1.00 74.94 ? 61 ILE A O 1 ATOM 194 C CB . ILE A 1 37 ? -46.465 41.520 -9.473 1.00 72.90 ? 61 ILE A CB 1 ATOM 195 C CG1 . ILE A 1 37 ? -45.408 42.323 -10.224 1.00 71.62 ? 61 ILE A CG1 1 ATOM 196 C CG2 . ILE A 1 37 ? -46.218 41.638 -7.980 1.00 72.85 ? 61 ILE A CG2 1 ATOM 197 C CD1 . ILE A 1 37 ? -45.452 43.794 -9.936 1.00 71.20 ? 61 ILE A CD1 1 ATOM 198 N N . GLU A 1 38 ? -47.638 38.356 -8.614 1.00 75.31 ? 62 GLU A N 1 ATOM 199 C CA . GLU A 1 38 ? -48.831 37.605 -8.230 1.00 76.07 ? 62 GLU A CA 1 ATOM 200 C C . GLU A 1 38 ? -49.464 38.014 -6.898 1.00 78.12 ? 62 GLU A C 1 ATOM 201 O O . GLU A 1 38 ? -48.824 38.630 -6.049 1.00 78.51 ? 62 GLU A O 1 ATOM 202 C CB . GLU A 1 38 ? -48.494 36.116 -8.194 1.00 75.29 ? 62 GLU A CB 1 ATOM 203 C CG . GLU A 1 38 ? -47.697 35.657 -9.392 1.00 74.24 ? 62 GLU A CG 1 ATOM 204 C CD . GLU A 1 38 ? -47.405 34.175 -9.353 1.00 74.33 ? 62 GLU A CD 1 ATOM 205 O OE1 . GLU A 1 38 ? -48.371 33.386 -9.273 1.00 74.02 ? 62 GLU A OE1 1 ATOM 206 O OE2 . GLU A 1 38 ? -46.214 33.800 -9.402 1.00 74.70 ? 62 GLU A OE2 1 ATOM 207 N N . CYS A 1 39 ? -50.733 37.644 -6.730 1.00 79.03 ? 63 CYS A N 1 ATOM 208 C CA . CYS A 1 39 ? -51.504 37.968 -5.537 1.00 79.45 ? 63 CYS A CA 1 ATOM 209 C C . CYS A 1 39 ? -52.901 37.360 -5.629 1.00 83.64 ? 63 CYS A C 1 ATOM 210 O O . CYS A 1 39 ? -53.816 38.011 -6.104 1.00 84.30 ? 63 CYS A O 1 ATOM 211 C CB . CYS A 1 39 ? -51.622 39.480 -5.366 1.00 75.31 ? 63 CYS A CB 1 ATOM 212 S SG . CYS A 1 39 ? -52.511 39.908 -3.846 1.00 70.29 ? 63 CYS A SG 1 ATOM 213 N N . GLU A 1 40 ? -53.071 36.118 -5.187 1.00 88.82 ? 64 GLU A N 1 ATOM 214 C CA . GLU A 1 40 ? -54.387 35.477 -5.250 1.00 94.13 ? 64 GLU A CA 1 ATOM 215 C C . GLU A 1 40 ? -55.114 35.521 -3.911 1.00 96.80 ? 64 GLU A C 1 ATOM 216 O O . GLU A 1 40 ? -54.501 35.329 -2.854 1.00 97.85 ? 64 GLU A O 1 ATOM 217 C CB . GLU A 1 40 ? -54.260 34.028 -5.723 1.00 95.29 ? 64 GLU A CB 1 ATOM 218 C CG . GLU A 1 40 ? -53.495 33.859 -7.021 1.00 98.45 ? 64 GLU A CG 1 ATOM 219 C CD . GLU A 1 40 ? -53.853 32.568 -7.739 1.00 100.96 ? 64 GLU A CD 1 ATOM 220 O OE1 . GLU A 1 40 ? -54.128 31.556 -7.052 1.00 101.79 ? 64 GLU A OE1 1 ATOM 221 O OE2 . GLU A 1 40 ? -53.849 32.565 -8.992 1.00 102.15 ? 64 GLU A OE2 1 ATOM 222 N N . ALA A 1 41 ? -56.423 35.765 -3.962 1.00 99.35 ? 65 ALA A N 1 ATOM 223 C CA . ALA A 1 41 ? -57.234 35.853 -2.754 1.00 101.67 ? 65 ALA A CA 1 ATOM 224 C C . ALA A 1 41 ? -58.215 34.693 -2.544 1.00 103.37 ? 65 ALA A C 1 ATOM 225 O O . ALA A 1 41 ? -58.099 33.627 -3.170 1.00 104.05 ? 65 ALA A O 1 ATOM 226 C CB . ALA A 1 41 ? -57.983 37.178 -2.728 1.00 101.07 ? 65 ALA A CB 1 ATOM 227 N N . LYS A 1 42 ? -59.181 34.921 -1.650 1.00 105.36 ? 66 LYS A N 1 ATOM 228 C CA . LYS A 1 42 ? -60.186 33.920 -1.288 1.00 107.02 ? 66 LYS A CA 1 ATOM 229 C C . LYS A 1 42 ? -61.206 34.520 -0.288 1.00 107.74 ? 66 LYS A C 1 ATOM 230 O O . LYS A 1 42 ? -60.838 35.200 0.687 1.00 107.20 ? 66 LYS A O 1 ATOM 231 C CB . LYS A 1 42 ? -59.472 32.721 -0.661 1.00 107.45 ? 66 LYS A CB 1 ATOM 232 C CG . LYS A 1 42 ? -60.136 31.382 -0.850 1.00 109.38 ? 66 LYS A CG 1 ATOM 233 C CD . LYS A 1 42 ? -59.306 30.319 -0.143 1.00 111.38 ? 66 LYS A CD 1 ATOM 234 C CE . LYS A 1 42 ? -59.976 28.959 -0.168 1.00 113.06 ? 66 LYS A CE 1 ATOM 235 N NZ . LYS A 1 42 ? -59.286 28.006 0.749 1.00 114.44 ? 66 LYS A NZ 1 ATOM 236 N N . GLY A 1 43 ? -62.487 34.257 -0.546 1.00 108.79 ? 67 GLY A N 1 ATOM 237 C CA . GLY A 1 43 ? -63.564 34.758 0.298 1.00 108.92 ? 67 GLY A CA 1 ATOM 238 C C . GLY A 1 43 ? -64.829 34.892 -0.533 1.00 108.74 ? 67 GLY A C 1 ATOM 239 O O . GLY A 1 43 ? -64.743 35.247 -1.715 1.00 109.53 ? 67 GLY A O 1 ATOM 240 N N . ASN A 1 44 ? -65.998 34.619 0.048 1.00 107.93 ? 68 ASN A N 1 ATOM 241 C CA . ASN A 1 44 ? -67.235 34.724 -0.727 1.00 106.87 ? 68 ASN A CA 1 ATOM 242 C C . ASN A 1 44 ? -67.620 36.155 -1.139 1.00 105.65 ? 68 ASN A C 1 ATOM 243 O O . ASN A 1 44 ? -68.049 36.365 -2.280 1.00 105.66 ? 68 ASN A O 1 ATOM 244 C CB . ASN A 1 44 ? -68.388 34.010 -0.027 1.00 106.37 ? 68 ASN A CB 1 ATOM 245 C CG . ASN A 1 44 ? -68.331 32.505 -0.230 1.00 105.94 ? 68 ASN A CG 1 ATOM 246 O OD1 . ASN A 1 44 ? -69.305 31.793 0.010 1.00 105.75 ? 68 ASN A OD1 1 ATOM 247 N ND2 . ASN A 1 44 ? -67.179 32.016 -0.677 1.00 104.87 ? 68 ASN A ND2 1 ATOM 248 N N . PRO A 1 45 ? -67.526 37.149 -0.222 1.00 104.27 ? 69 PRO A N 1 ATOM 249 C CA . PRO A 1 45 ? -67.884 38.484 -0.733 1.00 103.82 ? 69 PRO A CA 1 ATOM 250 C C . PRO A 1 45 ? -66.689 38.913 -1.607 1.00 102.29 ? 69 PRO A C 1 ATOM 251 O O . PRO A 1 45 ? -65.691 39.419 -1.098 1.00 102.38 ? 69 PRO A O 1 ATOM 252 C CB . PRO A 1 45 ? -68.010 39.321 0.539 1.00 102.87 ? 69 PRO A CB 1 ATOM 253 C CG . PRO A 1 45 ? -68.487 38.326 1.537 1.00 103.80 ? 69 PRO A CG 1 ATOM 254 C CD . PRO A 1 45 ? -67.597 37.131 1.247 1.00 104.01 ? 69 PRO A CD 1 ATOM 255 N N . ALA A 1 46 ? -66.798 38.663 -2.913 1.00 100.84 ? 70 ALA A N 1 ATOM 256 C CA . ALA A 1 46 ? -65.761 38.969 -3.914 1.00 98.47 ? 70 ALA A CA 1 ATOM 257 C C . ALA A 1 46 ? -64.753 40.047 -3.532 1.00 95.81 ? 70 ALA A C 1 ATOM 258 O O . ALA A 1 46 ? -65.095 41.228 -3.473 1.00 96.49 ? 70 ALA A O 1 ATOM 259 C CB . ALA A 1 46 ? -66.424 39.336 -5.243 1.00 100.12 ? 70 ALA A CB 1 ATOM 260 N N . PRO A 1 47 ? -63.486 39.655 -3.296 1.00 92.49 ? 71 PRO A N 1 ATOM 261 C CA . PRO A 1 47 ? -62.432 40.611 -2.919 1.00 89.09 ? 71 PRO A CA 1 ATOM 262 C C . PRO A 1 47 ? -61.951 41.476 -4.089 1.00 85.12 ? 71 PRO A C 1 ATOM 263 O O . PRO A 1 47 ? -61.753 40.981 -5.189 1.00 84.13 ? 71 PRO A O 1 ATOM 264 C CB . PRO A 1 47 ? -61.304 39.714 -2.397 1.00 89.42 ? 71 PRO A CB 1 ATOM 265 C CG . PRO A 1 47 ? -61.980 38.399 -2.087 1.00 91.18 ? 71 PRO A CG 1 ATOM 266 C CD . PRO A 1 47 ? -62.988 38.275 -3.198 1.00 92.21 ? 71 PRO A CD 1 ATOM 267 N N . SER A 1 48 ? -61.786 42.770 -3.847 1.00 81.66 ? 72 SER A N 1 ATOM 268 C CA . SER A 1 48 ? -61.298 43.691 -4.864 1.00 78.57 ? 72 SER A CA 1 ATOM 269 C C . SER A 1 48 ? -59.856 44.043 -4.468 1.00 75.98 ? 72 SER A C 1 ATOM 270 O O . SER A 1 48 ? -59.557 44.185 -3.282 1.00 75.24 ? 72 SER A O 1 ATOM 271 C CB . SER A 1 48 ? -62.154 44.959 -4.910 1.00 79.54 ? 72 SER A CB 1 ATOM 272 O OG . SER A 1 48 ? -62.031 45.723 -3.724 1.00 80.40 ? 72 SER A OG 1 ATOM 273 N N . PHE A 1 49 ? -58.960 44.207 -5.440 1.00 73.28 ? 73 PHE A N 1 ATOM 274 C CA . PHE A 1 49 ? -57.558 44.486 -5.113 1.00 70.95 ? 73 PHE A CA 1 ATOM 275 C C . PHE A 1 49 ? -56.985 45.832 -5.499 1.00 70.28 ? 73 PHE A C 1 ATOM 276 O O . PHE A 1 49 ? -57.482 46.504 -6.385 1.00 71.07 ? 73 PHE A O 1 ATOM 277 C CB . PHE A 1 49 ? -56.660 43.411 -5.723 1.00 69.39 ? 73 PHE A CB 1 ATOM 278 C CG . PHE A 1 49 ? -57.190 42.018 -5.573 1.00 68.35 ? 73 PHE A CG 1 ATOM 279 C CD1 . PHE A 1 49 ? -58.129 41.522 -6.459 1.00 68.29 ? 73 PHE A CD1 1 ATOM 280 C CD2 . PHE A 1 49 ? -56.750 41.200 -4.542 1.00 68.47 ? 73 PHE A CD2 1 ATOM 281 C CE1 . PHE A 1 49 ? -58.622 40.222 -6.320 1.00 69.41 ? 73 PHE A CE1 1 ATOM 282 C CE2 . PHE A 1 49 ? -57.236 39.902 -4.394 1.00 68.46 ? 73 PHE A CE2 1 ATOM 283 C CZ . PHE A 1 49 ? -58.174 39.412 -5.286 1.00 68.59 ? 73 PHE A CZ 1 ATOM 284 N N . HIS A 1 50 ? -55.928 46.229 -4.818 1.00 69.65 ? 74 HIS A N 1 ATOM 285 C CA . HIS A 1 50 ? -55.258 47.468 -5.167 1.00 71.01 ? 74 HIS A CA 1 ATOM 286 C C . HIS A 1 50 ? -53.831 47.503 -4.560 1.00 71.03 ? 74 HIS A C 1 ATOM 287 O O . HIS A 1 50 ? -53.640 47.260 -3.360 1.00 72.35 ? 74 HIS A O 1 ATOM 288 C CB . HIS A 1 50 ? -56.092 48.695 -4.751 1.00 71.98 ? 74 HIS A CB 1 ATOM 289 C CG . HIS A 1 50 ? -55.795 49.219 -3.380 1.00 73.18 ? 74 HIS A CG 1 ATOM 290 N ND1 . HIS A 1 50 ? -56.284 48.631 -2.237 1.00 73.73 ? 74 HIS A ND1 1 ATOM 291 C CD2 . HIS A 1 50 ? -55.095 50.308 -2.979 1.00 73.68 ? 74 HIS A CD2 1 ATOM 292 C CE1 . HIS A 1 50 ? -55.901 49.337 -1.184 1.00 74.48 ? 74 HIS A CE1 1 ATOM 293 N NE2 . HIS A 1 50 ? -55.180 50.358 -1.608 1.00 74.50 ? 74 HIS A NE2 1 ATOM 294 N N . TRP A 1 51 ? -52.829 47.768 -5.403 1.00 68.94 ? 75 TRP A N 1 ATOM 295 C CA . TRP A 1 51 ? -51.457 47.753 -4.946 1.00 67.50 ? 75 TRP A CA 1 ATOM 296 C C . TRP A 1 51 ? -50.973 49.086 -4.464 1.00 67.14 ? 75 TRP A C 1 ATOM 297 O O . TRP A 1 51 ? -51.740 50.016 -4.397 1.00 66.60 ? 75 TRP A O 1 ATOM 298 C CB . TRP A 1 51 ? -50.538 47.242 -6.056 1.00 67.43 ? 75 TRP A CB 1 ATOM 299 C CG . TRP A 1 51 ? -50.905 45.877 -6.579 1.00 67.08 ? 75 TRP A CG 1 ATOM 300 C CD1 . TRP A 1 51 ? -51.965 45.562 -7.386 1.00 66.63 ? 75 TRP A CD1 1 ATOM 301 C CD2 . TRP A 1 51 ? -50.201 44.651 -6.345 1.00 66.68 ? 75 TRP A CD2 1 ATOM 302 N NE1 . TRP A 1 51 ? -51.962 44.217 -7.673 1.00 66.97 ? 75 TRP A NE1 1 ATOM 303 C CE2 . TRP A 1 51 ? -50.892 43.633 -7.047 1.00 66.76 ? 75 TRP A CE2 1 ATOM 304 C CE3 . TRP A 1 51 ? -49.056 44.312 -5.611 1.00 65.98 ? 75 TRP A CE3 1 ATOM 305 C CZ2 . TRP A 1 51 ? -50.472 42.297 -7.037 1.00 66.57 ? 75 TRP A CZ2 1 ATOM 306 C CZ3 . TRP A 1 51 ? -48.639 42.982 -5.601 1.00 66.68 ? 75 TRP A CZ3 1 ATOM 307 C CH2 . TRP A 1 51 ? -49.348 41.991 -6.312 1.00 66.47 ? 75 TRP A CH2 1 ATOM 308 N N . THR A 1 52 ? -49.693 49.164 -4.126 1.00 67.51 ? 76 THR A N 1 ATOM 309 C CA . THR A 1 52 ? -49.104 50.387 -3.628 1.00 69.18 ? 76 THR A CA 1 ATOM 310 C C . THR A 1 52 ? -47.607 50.458 -3.944 1.00 70.49 ? 76 THR A C 1 ATOM 311 O O . THR A 1 52 ? -46.759 50.155 -3.112 1.00 71.75 ? 76 THR A O 1 ATOM 312 C CB . THR A 1 52 ? -49.300 50.490 -2.117 1.00 69.54 ? 76 THR A CB 1 ATOM 313 O OG1 . THR A 1 52 ? -48.570 49.445 -1.463 1.00 71.00 ? 76 THR A OG1 1 ATOM 314 C CG2 . THR A 1 52 ? -50.764 50.342 -1.773 1.00 70.27 ? 76 THR A CG2 1 ATOM 315 N N . ARG A 1 53 ? -47.281 50.871 -5.156 1.00 71.40 ? 77 ARG A N 1 ATOM 316 C CA . ARG A 1 53 ? -45.894 50.980 -5.597 1.00 72.33 ? 77 ARG A CA 1 ATOM 317 C C . ARG A 1 53 ? -45.207 51.874 -4.592 1.00 73.78 ? 77 ARG A C 1 ATOM 318 O O . ARG A 1 53 ? -45.462 53.061 -4.561 1.00 72.99 ? 77 ARG A O 1 ATOM 319 C CB . ARG A 1 53 ? -45.832 51.623 -6.989 1.00 71.98 ? 77 ARG A CB 1 ATOM 320 C CG . ARG A 1 53 ? -44.779 51.052 -7.932 1.00 71.79 ? 77 ARG A CG 1 ATOM 321 C CD . ARG A 1 53 ? -44.676 51.870 -9.220 1.00 71.97 ? 77 ARG A CD 1 ATOM 322 N NE . ARG A 1 53 ? -43.903 53.101 -9.047 1.00 72.09 ? 77 ARG A NE 1 ATOM 323 C CZ . ARG A 1 53 ? -42.572 53.157 -8.993 1.00 71.48 ? 77 ARG A CZ 1 ATOM 324 N NH1 . ARG A 1 53 ? -41.845 52.052 -9.104 1.00 70.40 ? 77 ARG A NH1 1 ATOM 325 N NH2 . ARG A 1 53 ? -41.962 54.324 -8.824 1.00 71.72 ? 77 ARG A NH2 1 ATOM 326 N N . ASN A 1 54 ? -44.322 51.295 -3.790 1.00 76.53 ? 78 ASN A N 1 ATOM 327 C CA . ASN A 1 54 ? -43.589 52.021 -2.755 1.00 80.22 ? 78 ASN A CA 1 ATOM 328 C C . ASN A 1 54 ? -44.566 52.418 -1.649 1.00 83.41 ? 78 ASN A C 1 ATOM 329 O O . ASN A 1 54 ? -45.546 51.697 -1.399 1.00 83.78 ? 78 ASN A O 1 ATOM 330 C CB . ASN A 1 54 ? -42.889 53.257 -3.337 1.00 80.39 ? 78 ASN A CB 1 ATOM 331 C CG . ASN A 1 54 ? -41.537 52.924 -3.950 1.00 80.53 ? 78 ASN A CG 1 ATOM 332 O OD1 . ASN A 1 54 ? -41.409 51.961 -4.702 1.00 80.05 ? 78 ASN A OD1 1 ATOM 333 N ND2 . ASN A 1 54 ? -40.522 53.724 -3.630 1.00 80.70 ? 78 ASN A ND2 1 ATOM 334 N N . SER A 1 55 ? -44.310 53.546 -0.986 1.00 86.07 ? 79 SER A N 1 ATOM 335 C CA . SER A 1 55 ? -45.191 53.992 0.094 1.00 88.02 ? 79 SER A CA 1 ATOM 336 C C . SER A 1 55 ? -46.348 54.885 -0.373 1.00 89.68 ? 79 SER A C 1 ATOM 337 O O . SER A 1 55 ? -46.808 55.765 0.355 1.00 90.40 ? 79 SER A O 1 ATOM 338 C CB . SER A 1 55 ? -44.384 54.699 1.192 1.00 87.25 ? 79 SER A CB 1 ATOM 339 O OG . SER A 1 55 ? -43.656 53.762 1.971 1.00 84.74 ? 79 SER A OG 1 ATOM 340 N N . ARG A 1 56 ? -46.819 54.633 -1.591 1.00 90.79 ? 80 ARG A N 1 ATOM 341 C CA . ARG A 1 56 ? -47.921 55.384 -2.179 1.00 92.16 ? 80 ARG A CA 1 ATOM 342 C C . ARG A 1 56 ? -48.802 54.504 -3.072 1.00 92.32 ? 80 ARG A C 1 ATOM 343 O O . ARG A 1 56 ? -48.443 53.367 -3.411 1.00 92.51 ? 80 ARG A O 1 ATOM 344 C CB . ARG A 1 56 ? -47.382 56.588 -2.959 1.00 93.37 ? 80 ARG A CB 1 ATOM 345 C CG . ARG A 1 56 ? -47.014 57.750 -2.045 1.00 95.67 ? 80 ARG A CG 1 ATOM 346 C CD . ARG A 1 56 ? -46.470 58.956 -2.791 1.00 97.14 ? 80 ARG A CD 1 ATOM 347 N NE . ARG A 1 56 ? -46.360 60.120 -1.909 1.00 98.51 ? 80 ARG A NE 1 ATOM 348 C CZ . ARG A 1 56 ? -45.772 61.266 -2.241 1.00 99.13 ? 80 ARG A CZ 1 ATOM 349 N NH1 . ARG A 1 56 ? -45.228 61.414 -3.442 1.00 99.54 ? 80 ARG A NH1 1 ATOM 350 N NH2 . ARG A 1 56 ? -45.729 62.269 -1.371 1.00 98.35 ? 80 ARG A NH2 1 ATOM 351 N N . PHE A 1 57 ? -49.961 55.036 -3.445 1.00 92.95 ? 81 PHE A N 1 ATOM 352 C CA . PHE A 1 57 ? -50.930 54.312 -4.266 1.00 92.88 ? 81 PHE A CA 1 ATOM 353 C C . PHE A 1 57 ? -50.508 54.036 -5.702 1.00 92.92 ? 81 PHE A C 1 ATOM 354 O O . PHE A 1 57 ? -49.908 54.872 -6.373 1.00 92.39 ? 81 PHE A O 1 ATOM 355 C CB . PHE A 1 57 ? -52.256 55.069 -4.266 1.00 92.91 ? 81 PHE A CB 1 ATOM 356 C CG . PHE A 1 57 ? -53.323 54.420 -5.087 1.00 93.03 ? 81 PHE A CG 1 ATOM 357 C CD1 . PHE A 1 57 ? -53.734 53.121 -4.812 1.00 93.53 ? 81 PHE A CD1 1 ATOM 358 C CD2 . PHE A 1 57 ? -53.927 55.110 -6.131 1.00 92.91 ? 81 PHE A CD2 1 ATOM 359 C CE1 . PHE A 1 57 ? -54.735 52.518 -5.566 1.00 93.84 ? 81 PHE A CE1 1 ATOM 360 C CE2 . PHE A 1 57 ? -54.925 54.520 -6.888 1.00 93.10 ? 81 PHE A CE2 1 ATOM 361 C CZ . PHE A 1 57 ? -55.333 53.220 -6.607 1.00 93.43 ? 81 PHE A CZ 1 ATOM 362 N N . PHE A 1 58 ? -50.850 52.851 -6.182 1.00 93.70 ? 82 PHE A N 1 ATOM 363 C CA . PHE A 1 58 ? -50.494 52.452 -7.542 1.00 94.93 ? 82 PHE A CA 1 ATOM 364 C C . PHE A 1 58 ? -51.726 52.522 -8.467 1.00 95.87 ? 82 PHE A C 1 ATOM 365 O O . PHE A 1 58 ? -52.765 51.921 -8.158 1.00 95.63 ? 82 PHE A O 1 ATOM 366 C CB . PHE A 1 58 ? -49.937 51.016 -7.503 1.00 94.03 ? 82 PHE A CB 1 ATOM 367 C CG . PHE A 1 58 ? -49.282 50.554 -8.791 1.00 92.69 ? 82 PHE A CG 1 ATOM 368 C CD1 . PHE A 1 58 ? -49.706 49.375 -9.413 1.00 91.50 ? 82 PHE A CD1 1 ATOM 369 C CD2 . PHE A 1 58 ? -48.219 51.264 -9.354 1.00 91.53 ? 82 PHE A CD2 1 ATOM 370 C CE1 . PHE A 1 58 ? -49.087 48.909 -10.568 1.00 90.92 ? 82 PHE A CE1 1 ATOM 371 C CE2 . PHE A 1 58 ? -47.591 50.806 -10.513 1.00 90.99 ? 82 PHE A CE2 1 ATOM 372 C CZ . PHE A 1 58 ? -48.028 49.624 -11.120 1.00 91.25 ? 82 PHE A CZ 1 ATOM 373 N N . ASN A 1 59 ? -51.614 53.254 -9.583 1.00 96.54 ? 83 ASN A N 1 ATOM 374 C CA . ASN A 1 59 ? -52.720 53.369 -10.534 1.00 97.51 ? 83 ASN A CA 1 ATOM 375 C C . ASN A 1 59 ? -52.608 52.402 -11.721 1.00 97.87 ? 83 ASN A C 1 ATOM 376 O O . ASN A 1 59 ? -51.746 52.553 -12.576 1.00 97.42 ? 83 ASN A O 1 ATOM 377 C CB . ASN A 1 59 ? -52.829 54.805 -11.051 1.00 98.08 ? 83 ASN A CB 1 ATOM 378 C CG . ASN A 1 59 ? -54.271 55.297 -11.105 1.00 98.83 ? 83 ASN A CG 1 ATOM 379 O OD1 . ASN A 1 59 ? -55.144 54.639 -11.674 1.00 97.78 ? 83 ASN A OD1 1 ATOM 380 N ND2 . ASN A 1 59 ? -54.525 56.460 -10.508 1.00 98.30 ? 83 ASN A ND2 1 ATOM 381 N N . ILE A 1 60 ? -53.497 51.414 -11.759 1.00 99.75 ? 84 ILE A N 1 ATOM 382 C CA . ILE A 1 60 ? -53.547 50.412 -12.824 1.00 102.31 ? 84 ILE A CA 1 ATOM 383 C C . ILE A 1 60 ? -54.054 50.994 -14.161 1.00 103.20 ? 84 ILE A C 1 ATOM 384 O O . ILE A 1 60 ? -53.593 50.612 -15.246 1.00 103.52 ? 84 ILE A O 1 ATOM 385 C CB . ILE A 1 60 ? -54.482 49.235 -12.426 1.00 103.42 ? 84 ILE A CB 1 ATOM 386 C CG1 . ILE A 1 60 ? -54.070 48.674 -11.066 1.00 103.98 ? 84 ILE A CG1 1 ATOM 387 C CG2 . ILE A 1 60 ? -54.427 48.133 -13.473 1.00 103.76 ? 84 ILE A CG2 1 ATOM 388 C CD1 . ILE A 1 60 ? -52.616 48.290 -10.990 1.00 105.44 ? 84 ILE A CD1 1 ATOM 389 N N . ALA A 1 61 ? -55.019 51.907 -14.075 1.00 103.83 ? 85 ALA A N 1 ATOM 390 C CA . ALA A 1 61 ? -55.600 52.533 -15.261 1.00 103.56 ? 85 ALA A CA 1 ATOM 391 C C . ALA A 1 61 ? -54.701 53.595 -15.878 1.00 103.97 ? 85 ALA A C 1 ATOM 392 O O . ALA A 1 61 ? -54.443 53.559 -17.073 1.00 103.02 ? 85 ALA A O 1 ATOM 393 C CB . ALA A 1 61 ? -56.948 53.139 -14.914 1.00 103.38 ? 85 ALA A CB 1 ATOM 394 N N . LYS A 1 62 ? -54.227 54.533 -15.063 1.00 104.68 ? 86 LYS A N 1 ATOM 395 C CA . LYS A 1 62 ? -53.370 55.613 -15.544 1.00 105.51 ? 86 LYS A CA 1 ATOM 396 C C . LYS A 1 62 ? -52.145 55.114 -16.296 1.00 106.17 ? 86 LYS A C 1 ATOM 397 O O . LYS A 1 62 ? -51.453 55.913 -16.948 1.00 106.64 ? 86 LYS A O 1 ATOM 398 C CB . LYS A 1 62 ? -52.921 56.491 -14.372 1.00 107.00 ? 86 LYS A CB 1 ATOM 399 C CG . LYS A 1 62 ? -52.591 57.935 -14.744 1.00 108.59 ? 86 LYS A CG 1 ATOM 400 C CD . LYS A 1 62 ? -53.858 58.721 -15.067 1.00 109.35 ? 86 LYS A CD 1 ATOM 401 C CE . LYS A 1 62 ? -53.581 60.212 -15.162 1.00 109.79 ? 86 LYS A CE 1 ATOM 402 N NZ . LYS A 1 62 ? -54.832 61.010 -15.318 1.00 109.91 ? 86 LYS A NZ 1 ATOM 403 N N . ASP A 1 63 ? -51.852 53.816 -16.185 1.00 105.76 ? 87 ASP A N 1 ATOM 404 C CA . ASP A 1 63 ? -50.722 53.246 -16.916 1.00 105.04 ? 87 ASP A CA 1 ATOM 405 C C . ASP A 1 63 ? -51.286 52.159 -17.832 1.00 104.78 ? 87 ASP A C 1 ATOM 406 O O . ASP A 1 63 ? -51.979 51.235 -17.375 1.00 103.73 ? 87 ASP A O 1 ATOM 407 C CB . ASP A 1 63 ? -49.663 52.682 -15.971 1.00 105.85 ? 87 ASP A CB 1 ATOM 408 C CG . ASP A 1 63 ? -48.251 53.011 -16.430 1.00 106.72 ? 87 ASP A CG 1 ATOM 409 O OD1 . ASP A 1 63 ? -47.874 52.623 -17.559 1.00 107.04 ? 87 ASP A OD1 1 ATOM 410 O OD2 . ASP A 1 63 ? -47.519 53.670 -15.663 1.00 106.51 ? 87 ASP A OD2 1 ATOM 411 N N . PRO A 1 64 ? -51.019 52.284 -19.149 1.00 104.48 ? 88 PRO A N 1 ATOM 412 C CA . PRO A 1 64 ? -51.451 51.391 -20.234 1.00 103.37 ? 88 PRO A CA 1 ATOM 413 C C . PRO A 1 64 ? -50.994 49.923 -20.209 1.00 102.45 ? 88 PRO A C 1 ATOM 414 O O . PRO A 1 64 ? -51.827 49.013 -20.281 1.00 102.22 ? 88 PRO A O 1 ATOM 415 C CB . PRO A 1 64 ? -50.944 52.110 -21.486 1.00 104.16 ? 88 PRO A CB 1 ATOM 416 C CG . PRO A 1 64 ? -50.886 53.563 -21.065 1.00 104.02 ? 88 PRO A CG 1 ATOM 417 C CD . PRO A 1 64 ? -50.290 53.443 -19.698 1.00 104.33 ? 88 PRO A CD 1 ATOM 418 N N . ARG A 1 65 ? -49.680 49.701 -20.115 1.00 101.11 ? 89 ARG A N 1 ATOM 419 C CA . ARG A 1 65 ? -49.116 48.350 -20.120 1.00 99.32 ? 89 ARG A CA 1 ATOM 420 C C . ARG A 1 65 ? -49.436 47.487 -18.914 1.00 97.71 ? 89 ARG A C 1 ATOM 421 O O . ARG A 1 65 ? -49.367 46.260 -18.993 1.00 97.73 ? 89 ARG A O 1 ATOM 422 C CB . ARG A 1 65 ? -47.599 48.429 -20.365 1.00 100.13 ? 89 ARG A CB 1 ATOM 423 C CG . ARG A 1 65 ? -46.936 49.750 -19.981 1.00 101.13 ? 89 ARG A CG 1 ATOM 424 C CD . ARG A 1 65 ? -45.822 50.080 -20.969 1.00 102.44 ? 89 ARG A CD 1 ATOM 425 N NE . ARG A 1 65 ? -45.004 51.221 -20.558 1.00 104.18 ? 89 ARG A NE 1 ATOM 426 C CZ . ARG A 1 65 ? -44.124 51.840 -21.347 1.00 105.30 ? 89 ARG A CZ 1 ATOM 427 N NH1 . ARG A 1 65 ? -43.947 51.436 -22.602 1.00 105.35 ? 89 ARG A NH1 1 ATOM 428 N NH2 . ARG A 1 65 ? -43.409 52.858 -20.878 1.00 105.45 ? 89 ARG A NH2 1 ATOM 429 N N . VAL A 1 66 ? -49.797 48.128 -17.807 1.00 96.08 ? 90 VAL A N 1 ATOM 430 C CA . VAL A 1 66 ? -50.135 47.425 -16.571 1.00 94.22 ? 90 VAL A CA 1 ATOM 431 C C . VAL A 1 66 ? -51.622 47.047 -16.545 1.00 93.90 ? 90 VAL A C 1 ATOM 432 O O . VAL A 1 66 ? -52.485 47.802 -17.035 1.00 93.46 ? 90 VAL A O 1 ATOM 433 C CB . VAL A 1 66 ? -49.828 48.287 -15.341 1.00 93.72 ? 90 VAL A CB 1 ATOM 434 C CG1 . VAL A 1 66 ? -49.972 47.459 -14.079 1.00 93.31 ? 90 VAL A CG1 1 ATOM 435 C CG2 . VAL A 1 66 ? -48.429 48.858 -15.449 1.00 92.73 ? 90 VAL A CG2 1 ATOM 436 N N . SER A 1 67 ? -51.931 45.892 -15.959 1.00 93.66 ? 91 SER A N 1 ATOM 437 C CA . SER A 1 67 ? -53.318 45.432 -15.908 1.00 93.67 ? 91 SER A CA 1 ATOM 438 C C . SER A 1 67 ? -53.579 44.390 -14.825 1.00 94.26 ? 91 SER A C 1 ATOM 439 O O . SER A 1 67 ? -52.807 43.453 -14.673 1.00 93.73 ? 91 SER A O 1 ATOM 440 C CB . SER A 1 67 ? -53.713 44.850 -17.266 1.00 93.15 ? 91 SER A CB 1 ATOM 441 O OG . SER A 1 67 ? -52.898 43.740 -17.602 1.00 91.63 ? 91 SER A OG 1 ATOM 442 N N . MET A 1 68 ? -54.672 44.527 -14.084 1.00 95.27 ? 92 MET A N 1 ATOM 443 C CA . MET A 1 68 ? -54.948 43.531 -13.064 1.00 97.56 ? 92 MET A CA 1 ATOM 444 C C . MET A 1 68 ? -55.434 42.242 -13.716 1.00 97.52 ? 92 MET A C 1 ATOM 445 O O . MET A 1 68 ? -55.188 42.024 -14.893 1.00 95.72 ? 92 MET A O 1 ATOM 446 C CB . MET A 1 68 ? -55.979 44.037 -12.067 1.00 99.79 ? 92 MET A CB 1 ATOM 447 C CG . MET A 1 68 ? -56.006 43.210 -10.800 1.00 101.68 ? 92 MET A CG 1 ATOM 448 S SD . MET A 1 68 ? -57.077 43.934 -9.592 1.00 104.97 ? 92 MET A SD 1 ATOM 449 C CE . MET A 1 68 ? -58.621 43.045 -9.964 1.00 105.32 ? 92 MET A CE 1 ATOM 450 N N . ARG A 1 69 ? -56.105 41.379 -12.960 1.00 99.55 ? 93 ARG A N 1 ATOM 451 C CA . ARG A 1 69 ? -56.591 40.120 -13.526 1.00 102.48 ? 93 ARG A CA 1 ATOM 452 C C . ARG A 1 69 ? -58.025 39.817 -13.086 1.00 103.06 ? 93 ARG A C 1 ATOM 453 O O . ARG A 1 69 ? -58.523 40.385 -12.113 1.00 102.41 ? 93 ARG A O 1 ATOM 454 C CB . ARG A 1 69 ? -55.660 38.975 -13.124 1.00 104.71 ? 93 ARG A CB 1 ATOM 455 C CG . ARG A 1 69 ? -55.460 37.911 -14.198 1.00 107.49 ? 93 ARG A CG 1 ATOM 456 C CD . ARG A 1 69 ? -54.636 38.457 -15.357 1.00 109.90 ? 93 ARG A CD 1 ATOM 457 N NE . ARG A 1 69 ? -54.322 37.436 -16.357 1.00 111.61 ? 93 ARG A NE 1 ATOM 458 C CZ . ARG A 1 69 ? -53.580 36.356 -16.127 1.00 112.00 ? 93 ARG A CZ 1 ATOM 459 N NH1 . ARG A 1 69 ? -53.065 36.139 -14.924 1.00 112.12 ? 93 ARG A NH1 1 ATOM 460 N NH2 . ARG A 1 69 ? -53.349 35.492 -17.108 1.00 112.40 ? 93 ARG A NH2 1 ATOM 461 N N . ARG A 1 70 ? -58.678 38.910 -13.805 1.00 104.51 ? 94 ARG A N 1 ATOM 462 C CA . ARG A 1 70 ? -60.061 38.542 -13.510 1.00 106.02 ? 94 ARG A CA 1 ATOM 463 C C . ARG A 1 70 ? -60.322 38.124 -12.053 1.00 105.64 ? 94 ARG A C 1 ATOM 464 O O . ARG A 1 70 ? -60.590 38.983 -11.199 1.00 105.75 ? 94 ARG A O 1 ATOM 465 C CB . ARG A 1 70 ? -60.556 37.446 -14.469 1.00 107.99 ? 94 ARG A CB 1 ATOM 466 C CG . ARG A 1 70 ? -60.983 37.935 -15.871 1.00 110.46 ? 94 ARG A CG 1 ATOM 467 C CD . ARG A 1 70 ? -59.799 38.105 -16.833 1.00 113.61 ? 94 ARG A CD 1 ATOM 468 N NE . ARG A 1 70 ? -59.192 39.438 -16.810 1.00 116.95 ? 94 ARG A NE 1 ATOM 469 C CZ . ARG A 1 70 ? -59.664 40.498 -17.465 1.00 118.49 ? 94 ARG A CZ 1 ATOM 470 N NH1 . ARG A 1 70 ? -60.759 40.394 -18.205 1.00 119.57 ? 94 ARG A NH1 1 ATOM 471 N NH2 . ARG A 1 70 ? -59.035 41.666 -17.386 1.00 118.97 ? 94 ARG A NH2 1 ATOM 472 N N . ARG A 1 71 ? -60.247 36.820 -11.772 1.00 104.70 ? 95 ARG A N 1 ATOM 473 C CA . ARG A 1 71 ? -60.507 36.302 -10.424 1.00 103.51 ? 95 ARG A CA 1 ATOM 474 C C . ARG A 1 71 ? -59.336 36.460 -9.447 1.00 100.81 ? 95 ARG A C 1 ATOM 475 O O . ARG A 1 71 ? -59.031 35.541 -8.679 1.00 101.88 ? 95 ARG A O 1 ATOM 476 C CB . ARG A 1 71 ? -60.921 34.822 -10.499 1.00 106.08 ? 95 ARG A CB 1 ATOM 477 C CG . ARG A 1 71 ? -62.224 34.551 -11.260 1.00 108.61 ? 95 ARG A CG 1 ATOM 478 C CD . ARG A 1 71 ? -62.542 33.048 -11.347 1.00 111.50 ? 95 ARG A CD 1 ATOM 479 N NE . ARG A 1 71 ? -63.063 32.480 -10.099 1.00 114.01 ? 95 ARG A NE 1 ATOM 480 C CZ . ARG A 1 71 ? -63.340 31.188 -9.920 1.00 114.85 ? 95 ARG A CZ 1 ATOM 481 N NH1 . ARG A 1 71 ? -63.143 30.322 -10.906 1.00 115.68 ? 95 ARG A NH1 1 ATOM 482 N NH2 . ARG A 1 71 ? -63.825 30.759 -8.760 1.00 114.93 ? 95 ARG A NH2 1 ATOM 483 N N . SER A 1 72 ? -58.693 37.628 -9.473 1.00 96.47 ? 96 SER A N 1 ATOM 484 C CA . SER A 1 72 ? -57.556 37.914 -8.592 1.00 90.86 ? 96 SER A CA 1 ATOM 485 C C . SER A 1 72 ? -57.022 39.330 -8.800 1.00 87.90 ? 96 SER A C 1 ATOM 486 O O . SER A 1 72 ? -57.566 40.116 -9.583 1.00 87.80 ? 96 SER A O 1 ATOM 487 C CB . SER A 1 72 ? -56.418 36.917 -8.848 1.00 90.60 ? 96 SER A CB 1 ATOM 488 O OG . SER A 1 72 ? -55.358 37.521 -9.571 1.00 88.12 ? 96 SER A OG 1 ATOM 489 N N . GLY A 1 73 ? -55.934 39.630 -8.097 1.00 84.55 ? 97 GLY A N 1 ATOM 490 C CA . GLY A 1 73 ? -55.298 40.929 -8.200 1.00 80.02 ? 97 GLY A CA 1 ATOM 491 C C . GLY A 1 73 ? -53.904 40.803 -8.792 1.00 76.79 ? 97 GLY A C 1 ATOM 492 O O . GLY A 1 73 ? -53.124 41.772 -8.791 1.00 75.93 ? 97 GLY A O 1 ATOM 493 N N . THR A 1 74 ? -53.590 39.610 -9.302 1.00 73.02 ? 98 THR A N 1 ATOM 494 C CA . THR A 1 74 ? -52.294 39.363 -9.910 1.00 70.43 ? 98 THR A CA 1 ATOM 495 C C . THR A 1 74 ? -51.957 40.492 -10.886 1.00 69.84 ? 98 THR A C 1 ATOM 496 O O . THR A 1 74 ? -52.807 41.314 -11.180 1.00 70.68 ? 98 THR A O 1 ATOM 497 C CB . THR A 1 74 ? -52.304 38.032 -10.692 1.00 68.77 ? 98 THR A CB 1 ATOM 498 O OG1 . THR A 1 74 ? -52.576 36.950 -9.795 1.00 69.06 ? 98 THR A OG1 1 ATOM 499 C CG2 . THR A 1 74 ? -50.960 37.785 -11.364 1.00 68.27 ? 98 THR A CG2 1 ATOM 500 N N . LEU A 1 75 ? -50.714 40.567 -11.358 1.00 70.18 ? 99 LEU A N 1 ATOM 501 C CA . LEU A 1 75 ? -50.341 41.589 -12.340 1.00 70.86 ? 99 LEU A CA 1 ATOM 502 C C . LEU A 1 75 ? -49.638 40.937 -13.492 1.00 73.51 ? 99 LEU A C 1 ATOM 503 O O . LEU A 1 75 ? -49.038 39.870 -13.340 1.00 73.48 ? 99 LEU A O 1 ATOM 504 C CB . LEU A 1 75 ? -49.429 42.666 -11.746 1.00 66.36 ? 99 LEU A CB 1 ATOM 505 C CG . LEU A 1 75 ? -50.018 43.682 -10.773 1.00 62.56 ? 99 LEU A CG 1 ATOM 506 C CD1 . LEU A 1 75 ? -49.326 45.028 -10.960 1.00 60.44 ? 99 LEU A CD1 1 ATOM 507 C CD2 . LEU A 1 75 ? -51.494 43.824 -11.026 1.00 61.64 ? 99 LEU A CD2 1 ATOM 508 N N . VAL A 1 76 ? -49.739 41.576 -14.651 1.00 77.70 ? 100 VAL A N 1 ATOM 509 C CA . VAL A 1 76 ? -49.095 41.104 -15.865 1.00 81.53 ? 100 VAL A CA 1 ATOM 510 C C . VAL A 1 76 ? -48.770 42.367 -16.626 1.00 83.69 ? 100 VAL A C 1 ATOM 511 O O . VAL A 1 76 ? -49.653 43.082 -17.096 1.00 84.80 ? 100 VAL A O 1 ATOM 512 C CB . VAL A 1 76 ? -50.015 40.175 -16.699 1.00 80.79 ? 100 VAL A CB 1 ATOM 513 C CG1 . VAL A 1 76 ? -51.414 40.759 -16.801 1.00 80.63 ? 100 VAL A CG1 1 ATOM 514 C CG2 . VAL A 1 76 ? -49.416 39.970 -18.084 1.00 81.06 ? 100 VAL A CG2 1 ATOM 515 N N . ILE A 1 77 ? -47.477 42.637 -16.722 1.00 87.11 ? 101 ILE A N 1 ATOM 516 C CA . ILE A 1 77 ? -46.979 43.837 -17.360 1.00 91.79 ? 101 ILE A CA 1 ATOM 517 C C . ILE A 1 77 ? -45.933 43.532 -18.422 1.00 96.12 ? 101 ILE A C 1 ATOM 518 O O . ILE A 1 77 ? -44.752 43.384 -18.096 1.00 97.42 ? 101 ILE A O 1 ATOM 519 C CB . ILE A 1 77 ? -46.384 44.775 -16.301 1.00 89.71 ? 101 ILE A CB 1 ATOM 520 C CG1 . ILE A 1 77 ? -47.411 44.976 -15.191 1.00 89.24 ? 101 ILE A CG1 1 ATOM 521 C CG2 . ILE A 1 77 ? -46.007 46.107 -16.915 1.00 87.82 ? 101 ILE A CG2 1 ATOM 522 C CD1 . ILE A 1 77 ? -46.860 45.662 -13.977 1.00 90.19 ? 101 ILE A CD1 1 ATOM 523 N N . ASP A 1 78 ? -46.367 43.427 -19.684 1.00 101.86 ? 102 ASP A N 1 ATOM 524 C CA . ASP A 1 78 ? -45.452 43.168 -20.806 1.00 106.74 ? 102 ASP A CA 1 ATOM 525 C C . ASP A 1 78 ? -45.187 44.462 -21.585 1.00 109.06 ? 102 ASP A C 1 ATOM 526 O O . ASP A 1 78 ? -46.086 45.269 -21.817 1.00 109.38 ? 102 ASP A O 1 ATOM 527 C CB . ASP A 1 78 ? -45.999 42.065 -21.738 1.00 108.09 ? 102 ASP A CB 1 ATOM 528 C CG . ASP A 1 78 ? -47.523 42.065 -21.848 1.00 109.28 ? 102 ASP A CG 1 ATOM 529 O OD1 . ASP A 1 78 ? -48.107 43.092 -22.258 1.00 109.49 ? 102 ASP A OD1 1 ATOM 530 O OD2 . ASP A 1 78 ? -48.136 41.019 -21.532 1.00 110.64 ? 102 ASP A OD2 1 ATOM 531 N N . PHE A 1 79 ? -43.933 44.658 -21.969 1.00 112.14 ? 103 PHE A N 1 ATOM 532 C CA . PHE A 1 79 ? -43.515 45.865 -22.678 1.00 115.29 ? 103 PHE A CA 1 ATOM 533 C C . PHE A 1 79 ? -43.378 45.602 -24.178 1.00 116.71 ? 103 PHE A C 1 ATOM 534 O O . PHE A 1 79 ? -42.331 45.157 -24.654 1.00 117.15 ? 103 PHE A O 1 ATOM 535 C CB . PHE A 1 79 ? -42.181 46.332 -22.104 1.00 116.85 ? 103 PHE A CB 1 ATOM 536 C CG . PHE A 1 79 ? -41.971 45.910 -20.682 1.00 118.14 ? 103 PHE A CG 1 ATOM 537 C CD1 . PHE A 1 79 ? -42.575 46.603 -19.639 1.00 118.30 ? 103 PHE A CD1 1 ATOM 538 C CD2 . PHE A 1 79 ? -41.227 44.771 -20.390 1.00 118.99 ? 103 PHE A CD2 1 ATOM 539 C CE1 . PHE A 1 79 ? -42.444 46.165 -18.326 1.00 118.94 ? 103 PHE A CE1 1 ATOM 540 C CE2 . PHE A 1 79 ? -41.091 44.326 -19.084 1.00 119.70 ? 103 PHE A CE2 1 ATOM 541 C CZ . PHE A 1 79 ? -41.701 45.024 -18.050 1.00 119.70 ? 103 PHE A CZ 1 ATOM 542 N N . ARG A 1 80 ? -44.433 45.891 -24.927 1.00 117.65 ? 104 ARG A N 1 ATOM 543 C CA . ARG A 1 80 ? -44.409 45.652 -26.360 1.00 118.68 ? 104 ARG A CA 1 ATOM 544 C C . ARG A 1 80 ? -44.093 46.924 -27.119 1.00 119.85 ? 104 ARG A C 1 ATOM 545 O O . ARG A 1 80 ? -43.405 46.901 -28.140 1.00 120.35 ? 104 ARG A O 1 ATOM 546 C CB . ARG A 1 80 ? -45.754 45.085 -26.801 1.00 117.58 ? 104 ARG A CB 1 ATOM 547 C CG . ARG A 1 80 ? -45.649 43.963 -27.807 1.00 116.10 ? 104 ARG A CG 1 ATOM 548 C CD . ARG A 1 80 ? -46.902 43.126 -27.769 1.00 115.48 ? 104 ARG A CD 1 ATOM 549 N NE . ARG A 1 80 ? -47.090 42.507 -26.459 1.00 115.41 ? 104 ARG A NE 1 ATOM 550 C CZ . ARG A 1 80 ? -46.899 41.214 -26.208 1.00 115.93 ? 104 ARG A CZ 1 ATOM 551 N NH1 . ARG A 1 80 ? -46.514 40.388 -27.178 1.00 116.63 ? 104 ARG A NH1 1 ATOM 552 N NH2 . ARG A 1 80 ? -47.094 40.738 -24.985 1.00 115.84 ? 104 ARG A NH2 1 ATOM 553 N N . SER A 1 81 ? -44.611 48.032 -26.606 1.00 121.39 ? 105 SER A N 1 ATOM 554 C CA . SER A 1 81 ? -44.394 49.347 -27.193 1.00 122.83 ? 105 SER A CA 1 ATOM 555 C C . SER A 1 81 ? -42.982 49.789 -26.841 1.00 123.59 ? 105 SER A C 1 ATOM 556 O O . SER A 1 81 ? -42.071 49.775 -27.683 1.00 123.57 ? 105 SER A O 1 ATOM 557 C CB . SER A 1 81 ? -45.395 50.345 -26.606 1.00 123.16 ? 105 SER A CB 1 ATOM 558 O OG . SER A 1 81 ? -44.880 51.665 -26.631 1.00 123.57 ? 105 SER A OG 1 ATOM 559 N N . GLY A 1 82 ? -42.828 50.186 -25.580 1.00 124.11 ? 106 GLY A N 1 ATOM 560 C CA . GLY A 1 82 ? -41.548 50.624 -25.061 1.00 124.39 ? 106 GLY A CA 1 ATOM 561 C C . GLY A 1 82 ? -41.412 50.056 -23.664 1.00 124.29 ? 106 GLY A C 1 ATOM 562 O O . GLY A 1 82 ? -41.458 48.836 -23.477 1.00 124.62 ? 106 GLY A O 1 ATOM 563 N N . GLY A 1 83 ? -41.237 50.933 -22.682 1.00 124.19 ? 107 GLY A N 1 ATOM 564 C CA . GLY A 1 83 ? -41.135 50.490 -21.302 1.00 124.00 ? 107 GLY A CA 1 ATOM 565 C C . GLY A 1 83 ? -39.959 49.629 -20.879 1.00 123.23 ? 107 GLY A C 1 ATOM 566 O O . GLY A 1 83 ? -39.864 48.451 -21.236 1.00 123.35 ? 107 GLY A O 1 ATOM 567 N N . ARG A 1 84 ? -39.079 50.231 -20.083 1.00 122.05 ? 108 ARG A N 1 ATOM 568 C CA . ARG A 1 84 ? -37.889 49.564 -19.569 1.00 121.48 ? 108 ARG A CA 1 ATOM 569 C C . ARG A 1 84 ? -38.215 48.999 -18.178 1.00 119.83 ? 108 ARG A C 1 ATOM 570 O O . ARG A 1 84 ? -38.730 49.727 -17.327 1.00 120.81 ? 108 ARG A O 1 ATOM 571 C CB . ARG A 1 84 ? -36.746 50.575 -19.436 1.00 121.71 ? 108 ARG A CB 1 ATOM 572 C CG . ARG A 1 84 ? -36.607 51.545 -20.597 1.00 122.52 ? 108 ARG A CG 1 ATOM 573 C CD . ARG A 1 84 ? -35.696 52.711 -20.220 1.00 123.81 ? 108 ARG A CD 1 ATOM 574 N NE . ARG A 1 84 ? -35.458 53.618 -21.342 1.00 124.89 ? 108 ARG A NE 1 ATOM 575 C CZ . ARG A 1 84 ? -34.666 54.686 -21.291 1.00 125.10 ? 108 ARG A CZ 1 ATOM 576 N NH1 . ARG A 1 84 ? -34.028 54.996 -20.171 1.00 124.77 ? 108 ARG A NH1 1 ATOM 577 N NH2 . ARG A 1 84 ? -34.501 55.443 -22.368 1.00 125.60 ? 108 ARG A NH2 1 ATOM 578 N N . PRO A 1 85 ? -37.933 47.696 -17.927 1.00 118.04 ? 109 PRO A N 1 ATOM 579 C CA . PRO A 1 85 ? -38.240 47.168 -16.597 1.00 116.52 ? 109 PRO A CA 1 ATOM 580 C C . PRO A 1 85 ? -37.421 47.825 -15.494 1.00 115.29 ? 109 PRO A C 1 ATOM 581 O O . PRO A 1 85 ? -37.743 47.679 -14.344 1.00 114.26 ? 109 PRO A O 1 ATOM 582 C CB . PRO A 1 85 ? -37.923 45.685 -16.735 1.00 115.62 ? 109 PRO A CB 1 ATOM 583 C CG . PRO A 1 85 ? -38.226 45.409 -18.154 1.00 116.39 ? 109 PRO A CG 1 ATOM 584 C CD . PRO A 1 85 ? -37.619 46.600 -18.857 1.00 117.51 ? 109 PRO A CD 1 ATOM 585 N N . GLU A 1 86 ? -36.367 48.550 -15.839 1.00 114.94 ? 110 GLU A N 1 ATOM 586 C CA . GLU A 1 86 ? -35.564 49.223 -14.823 1.00 114.87 ? 110 GLU A CA 1 ATOM 587 C C . GLU A 1 86 ? -36.358 50.366 -14.171 1.00 113.56 ? 110 GLU A C 1 ATOM 588 O O . GLU A 1 86 ? -35.979 50.866 -13.107 1.00 113.56 ? 110 GLU A O 1 ATOM 589 C CB . GLU A 1 86 ? -34.281 49.803 -15.436 1.00 117.27 ? 110 GLU A CB 1 ATOM 590 C CG . GLU A 1 86 ? -34.506 51.019 -16.347 1.00 121.33 ? 110 GLU A CG 1 ATOM 591 C CD . GLU A 1 86 ? -33.235 51.834 -16.604 1.00 122.86 ? 110 GLU A CD 1 ATOM 592 O OE1 . GLU A 1 86 ? -32.710 52.454 -15.647 1.00 122.84 ? 110 GLU A OE1 1 ATOM 593 O OE2 . GLU A 1 86 ? -32.763 51.854 -17.765 1.00 122.98 ? 110 GLU A OE2 1 ATOM 594 N N . GLU A 1 87 ? -37.457 50.777 -14.805 1.00 111.43 ? 111 GLU A N 1 ATOM 595 C CA . GLU A 1 87 ? -38.280 51.875 -14.286 1.00 109.00 ? 111 GLU A CA 1 ATOM 596 C C . GLU A 1 87 ? -39.438 51.374 -13.429 1.00 106.06 ? 111 GLU A C 1 ATOM 597 O O . GLU A 1 87 ? -40.314 52.141 -13.053 1.00 105.20 ? 111 GLU A O 1 ATOM 598 C CB . GLU A 1 87 ? -38.828 52.724 -15.441 1.00 111.47 ? 111 GLU A CB 1 ATOM 599 C CG . GLU A 1 87 ? -37.766 53.335 -16.372 1.00 114.54 ? 111 GLU A CG 1 ATOM 600 C CD . GLU A 1 87 ? -37.014 54.522 -15.766 1.00 115.75 ? 111 GLU A CD 1 ATOM 601 O OE1 . GLU A 1 87 ? -36.183 55.124 -16.486 1.00 115.78 ? 111 GLU A OE1 1 ATOM 602 O OE2 . GLU A 1 87 ? -37.251 54.855 -14.582 1.00 115.95 ? 111 GLU A OE2 1 ATOM 603 N N . TYR A 1 88 ? -39.428 50.081 -13.126 1.00 103.26 ? 112 TYR A N 1 ATOM 604 C CA . TYR A 1 88 ? -40.459 49.452 -12.298 1.00 100.20 ? 112 TYR A CA 1 ATOM 605 C C . TYR A 1 88 ? -39.887 48.885 -10.979 1.00 97.07 ? 112 TYR A C 1 ATOM 606 O O . TYR A 1 88 ? -40.525 48.079 -10.313 1.00 96.34 ? 112 TYR A O 1 ATOM 607 C CB . TYR A 1 88 ? -41.130 48.308 -13.068 1.00 101.00 ? 112 TYR A CB 1 ATOM 608 C CG . TYR A 1 88 ? -42.248 48.695 -14.023 1.00 102.95 ? 112 TYR A CG 1 ATOM 609 C CD1 . TYR A 1 88 ? -42.177 49.857 -14.797 1.00 104.17 ? 112 TYR A CD1 1 ATOM 610 C CD2 . TYR A 1 88 ? -43.349 47.848 -14.211 1.00 103.07 ? 112 TYR A CD2 1 ATOM 611 C CE1 . TYR A 1 88 ? -43.179 50.162 -15.742 1.00 104.67 ? 112 TYR A CE1 1 ATOM 612 C CE2 . TYR A 1 88 ? -44.344 48.142 -15.148 1.00 103.22 ? 112 TYR A CE2 1 ATOM 613 C CZ . TYR A 1 88 ? -44.253 49.296 -15.909 1.00 104.08 ? 112 TYR A CZ 1 ATOM 614 O OH . TYR A 1 88 ? -45.226 49.578 -16.839 1.00 104.34 ? 112 TYR A OH 1 ATOM 615 N N . GLU A 1 89 ? -38.677 49.292 -10.612 1.00 93.96 ? 113 GLU A N 1 ATOM 616 C CA . GLU A 1 89 ? -38.076 48.819 -9.373 1.00 92.31 ? 113 GLU A CA 1 ATOM 617 C C . GLU A 1 89 ? -38.768 49.486 -8.177 1.00 89.37 ? 113 GLU A C 1 ATOM 618 O O . GLU A 1 89 ? -39.316 50.576 -8.320 1.00 89.40 ? 113 GLU A O 1 ATOM 619 C CB . GLU A 1 89 ? -36.574 49.122 -9.351 1.00 94.17 ? 113 GLU A CB 1 ATOM 620 C CG . GLU A 1 89 ? -35.711 48.101 -10.089 1.00 96.35 ? 113 GLU A CG 1 ATOM 621 C CD . GLU A 1 89 ? -34.272 48.081 -9.591 1.00 98.21 ? 113 GLU A CD 1 ATOM 622 O OE1 . GLU A 1 89 ? -33.509 47.182 -10.006 1.00 98.23 ? 113 GLU A OE1 1 ATOM 623 O OE2 . GLU A 1 89 ? -33.906 48.964 -8.782 1.00 98.98 ? 113 GLU A OE2 1 ATOM 624 N N . GLY A 1 90 ? -38.745 48.823 -7.015 1.00 86.14 ? 114 GLY A N 1 ATOM 625 C CA . GLY A 1 90 ? -39.383 49.351 -5.820 1.00 80.92 ? 114 GLY A CA 1 ATOM 626 C C . GLY A 1 90 ? -40.163 48.299 -5.052 1.00 77.53 ? 114 GLY A C 1 ATOM 627 O O . GLY A 1 90 ? -40.208 47.140 -5.458 1.00 76.68 ? 114 GLY A O 1 ATOM 628 N N . GLU A 1 91 ? -40.770 48.697 -3.936 1.00 74.96 ? 115 GLU A N 1 ATOM 629 C CA . GLU A 1 91 ? -41.542 47.768 -3.115 1.00 72.10 ? 115 GLU A CA 1 ATOM 630 C C . GLU A 1 91 ? -43.013 47.724 -3.539 1.00 68.54 ? 115 GLU A C 1 ATOM 631 O O . GLU A 1 91 ? -43.608 48.738 -3.863 1.00 66.72 ? 115 GLU A O 1 ATOM 632 C CB . GLU A 1 91 ? -41.453 48.161 -1.640 1.00 75.41 ? 115 GLU A CB 1 ATOM 633 C CG . GLU A 1 91 ? -40.030 48.275 -1.099 1.00 80.81 ? 115 GLU A CG 1 ATOM 634 C CD . GLU A 1 91 ? -39.977 48.331 0.425 1.00 83.80 ? 115 GLU A CD 1 ATOM 635 O OE1 . GLU A 1 91 ? -40.642 49.221 1.010 1.00 84.73 ? 115 GLU A OE1 1 ATOM 636 O OE2 . GLU A 1 91 ? -39.266 47.487 1.029 1.00 84.47 ? 115 GLU A OE2 1 ATOM 637 N N . TYR A 1 92 ? -43.613 46.551 -3.523 1.00 65.97 ? 116 TYR A N 1 ATOM 638 C CA . TYR A 1 92 ? -44.993 46.463 -3.921 1.00 64.73 ? 116 TYR A CA 1 ATOM 639 C C . TYR A 1 92 ? -45.818 45.773 -2.868 1.00 63.40 ? 116 TYR A C 1 ATOM 640 O O . TYR A 1 92 ? -45.457 44.695 -2.455 1.00 63.26 ? 116 TYR A O 1 ATOM 641 C CB . TYR A 1 92 ? -45.119 45.666 -5.219 1.00 65.54 ? 116 TYR A CB 1 ATOM 642 C CG . TYR A 1 92 ? -44.752 46.422 -6.473 1.00 66.52 ? 116 TYR A CG 1 ATOM 643 C CD1 . TYR A 1 92 ? -43.664 47.297 -6.495 1.00 67.55 ? 116 TYR A CD1 1 ATOM 644 C CD2 . TYR A 1 92 ? -45.467 46.234 -7.657 1.00 66.06 ? 116 TYR A CD2 1 ATOM 645 C CE1 . TYR A 1 92 ? -43.296 47.963 -7.664 1.00 66.63 ? 116 TYR A CE1 1 ATOM 646 C CE2 . TYR A 1 92 ? -45.104 46.896 -8.829 1.00 65.64 ? 116 TYR A CE2 1 ATOM 647 C CZ . TYR A 1 92 ? -44.019 47.753 -8.818 1.00 65.63 ? 116 TYR A CZ 1 ATOM 648 O OH . TYR A 1 92 ? -43.637 48.396 -9.959 1.00 66.48 ? 116 TYR A OH 1 ATOM 649 N N . GLN A 1 93 ? -46.938 46.354 -2.453 1.00 63.16 ? 117 GLN A N 1 ATOM 650 C CA . GLN A 1 93 ? -47.800 45.674 -1.473 1.00 63.27 ? 117 GLN A CA 1 ATOM 651 C C . GLN A 1 93 ? -49.233 45.457 -2.022 1.00 63.40 ? 117 GLN A C 1 ATOM 652 O O . GLN A 1 93 ? -49.877 46.384 -2.482 1.00 63.68 ? 117 GLN A O 1 ATOM 653 C CB . GLN A 1 93 ? -47.839 46.485 -0.168 1.00 61.58 ? 117 GLN A CB 1 ATOM 654 C CG . GLN A 1 93 ? -48.411 45.727 1.035 1.00 59.60 ? 117 GLN A CG 1 ATOM 655 C CD . GLN A 1 93 ? -48.218 46.488 2.330 1.00 58.22 ? 117 GLN A CD 1 ATOM 656 O OE1 . GLN A 1 93 ? -47.949 47.690 2.317 1.00 58.45 ? 117 GLN A OE1 1 ATOM 657 N NE2 . GLN A 1 93 ? -48.362 45.798 3.454 1.00 56.64 ? 117 GLN A NE2 1 ATOM 658 N N . CYS A 1 94 ? -49.731 44.235 -1.975 1.00 63.67 ? 118 CYS A N 1 ATOM 659 C CA . CYS A 1 94 ? -51.066 43.961 -2.484 1.00 64.68 ? 118 CYS A CA 1 ATOM 660 C C . CYS A 1 94 ? -52.095 44.169 -1.365 1.00 64.89 ? 118 CYS A C 1 ATOM 661 O O . CYS A 1 94 ? -51.789 43.923 -0.192 1.00 64.99 ? 118 CYS A O 1 ATOM 662 C CB . CYS A 1 94 ? -51.113 42.506 -2.989 1.00 66.42 ? 118 CYS A CB 1 ATOM 663 S SG . CYS A 1 94 ? -52.635 41.939 -3.828 1.00 68.82 ? 118 CYS A SG 1 ATOM 664 N N . PHE A 1 95 ? -53.298 44.640 -1.699 1.00 64.62 ? 119 PHE A N 1 ATOM 665 C CA . PHE A 1 95 ? -54.363 44.809 -0.687 1.00 63.61 ? 119 PHE A CA 1 ATOM 666 C C . PHE A 1 95 ? -55.694 44.129 -1.101 1.00 64.85 ? 119 PHE A C 1 ATOM 667 O O . PHE A 1 95 ? -56.393 44.638 -1.953 1.00 65.15 ? 119 PHE A O 1 ATOM 668 C CB . PHE A 1 95 ? -54.668 46.287 -0.475 1.00 62.15 ? 119 PHE A CB 1 ATOM 669 C CG . PHE A 1 95 ? -53.597 47.050 0.233 1.00 61.68 ? 119 PHE A CG 1 ATOM 670 C CD1 . PHE A 1 95 ? -52.303 47.106 -0.264 1.00 61.67 ? 119 PHE A CD1 1 ATOM 671 C CD2 . PHE A 1 95 ? -53.903 47.779 1.381 1.00 61.86 ? 119 PHE A CD2 1 ATOM 672 C CE1 . PHE A 1 95 ? -51.322 47.889 0.381 1.00 61.96 ? 119 PHE A CE1 1 ATOM 673 C CE2 . PHE A 1 95 ? -52.931 48.558 2.026 1.00 61.34 ? 119 PHE A CE2 1 ATOM 674 C CZ . PHE A 1 95 ? -51.642 48.612 1.523 1.00 60.52 ? 119 PHE A CZ 1 ATOM 675 N N . ALA A 1 96 ? -56.055 42.982 -0.533 1.00 67.06 ? 120 ALA A N 1 ATOM 676 C CA . ALA A 1 96 ? -57.352 42.356 -0.888 1.00 70.94 ? 120 ALA A CA 1 ATOM 677 C C . ALA A 1 96 ? -58.433 42.902 0.109 1.00 73.73 ? 120 ALA A C 1 ATOM 678 O O . ALA A 1 96 ? -58.500 42.515 1.290 1.00 74.55 ? 120 ALA A O 1 ATOM 679 C CB . ALA A 1 96 ? -57.263 40.817 -0.816 1.00 68.05 ? 120 ALA A CB 1 ATOM 680 N N . ARG A 1 97 ? -59.265 43.817 -0.396 1.00 76.69 ? 121 ARG A N 1 ATOM 681 C CA . ARG A 1 97 ? -60.329 44.475 0.371 1.00 79.53 ? 121 ARG A CA 1 ATOM 682 C C . ARG A 1 97 ? -61.720 43.832 0.333 1.00 80.66 ? 121 ARG A C 1 ATOM 683 O O . ARG A 1 97 ? -62.100 43.196 -0.635 1.00 80.90 ? 121 ARG A O 1 ATOM 684 C CB . ARG A 1 97 ? -60.432 45.944 -0.058 1.00 81.52 ? 121 ARG A CB 1 ATOM 685 C CG . ARG A 1 97 ? -61.508 46.714 0.666 1.00 84.01 ? 121 ARG A CG 1 ATOM 686 C CD . ARG A 1 97 ? -61.405 48.210 0.456 1.00 87.00 ? 121 ARG A CD 1 ATOM 687 N NE . ARG A 1 97 ? -62.303 48.899 1.380 1.00 90.77 ? 121 ARG A NE 1 ATOM 688 C CZ . ARG A 1 97 ? -62.360 50.216 1.543 1.00 92.05 ? 121 ARG A CZ 1 ATOM 689 N NH1 . ARG A 1 97 ? -61.565 51.007 0.833 1.00 93.33 ? 121 ARG A NH1 1 ATOM 690 N NH2 . ARG A 1 97 ? -63.203 50.740 2.427 1.00 91.41 ? 121 ARG A NH2 1 ATOM 691 N N . ASN A 1 98 ? -62.482 44.040 1.401 1.00 82.12 ? 122 ASN A N 1 ATOM 692 C CA . ASN A 1 98 ? -63.818 43.465 1.569 1.00 83.42 ? 122 ASN A CA 1 ATOM 693 C C . ASN A 1 98 ? -64.610 44.442 2.472 1.00 85.32 ? 122 ASN A C 1 ATOM 694 O O . ASN A 1 98 ? -64.032 45.341 3.096 1.00 86.28 ? 122 ASN A O 1 ATOM 695 C CB . ASN A 1 98 ? -63.673 42.100 2.252 1.00 82.49 ? 122 ASN A CB 1 ATOM 696 C CG . ASN A 1 98 ? -64.832 41.175 1.991 1.00 81.05 ? 122 ASN A CG 1 ATOM 697 O OD1 . ASN A 1 98 ? -65.956 41.443 2.389 1.00 82.30 ? 122 ASN A OD1 1 ATOM 698 N ND2 . ASN A 1 98 ? -64.560 40.065 1.333 1.00 79.76 ? 122 ASN A ND2 1 ATOM 699 N N . LYS A 1 99 ? -65.929 44.293 2.539 1.00 86.98 ? 123 LYS A N 1 ATOM 700 C CA . LYS A 1 99 ? -66.729 45.201 3.356 1.00 88.08 ? 123 LYS A CA 1 ATOM 701 C C . LYS A 1 99 ? -66.350 45.097 4.806 1.00 87.67 ? 123 LYS A C 1 ATOM 702 O O . LYS A 1 99 ? -66.580 46.019 5.569 1.00 88.17 ? 123 LYS A O 1 ATOM 703 C CB . LYS A 1 99 ? -68.225 44.890 3.242 1.00 89.54 ? 123 LYS A CB 1 ATOM 704 C CG . LYS A 1 99 ? -68.872 45.230 1.909 1.00 92.38 ? 123 LYS A CG 1 ATOM 705 C CD . LYS A 1 99 ? -70.377 45.432 2.088 1.00 93.89 ? 123 LYS A CD 1 ATOM 706 C CE . LYS A 1 99 ? -71.129 45.437 0.760 1.00 94.56 ? 123 LYS A CE 1 ATOM 707 N NZ . LYS A 1 99 ? -71.311 44.064 0.190 1.00 94.76 ? 123 LYS A NZ 1 ATOM 708 N N . PHE A 1 100 ? -65.751 43.973 5.175 1.00 87.21 ? 124 PHE A N 1 ATOM 709 C CA . PHE A 1 100 ? -65.374 43.713 6.562 1.00 86.57 ? 124 PHE A CA 1 ATOM 710 C C . PHE A 1 100 ? -63.951 44.106 6.964 1.00 84.55 ? 124 PHE A C 1 ATOM 711 O O . PHE A 1 100 ? -63.737 44.710 8.043 1.00 84.33 ? 124 PHE A O 1 ATOM 712 C CB . PHE A 1 100 ? -65.630 42.240 6.879 1.00 89.10 ? 124 PHE A CB 1 ATOM 713 C CG . PHE A 1 100 ? -66.891 41.713 6.263 1.00 91.20 ? 124 PHE A CG 1 ATOM 714 C CD1 . PHE A 1 100 ? -66.847 40.998 5.071 1.00 92.81 ? 124 PHE A CD1 1 ATOM 715 C CD2 . PHE A 1 100 ? -68.129 41.990 6.835 1.00 92.16 ? 124 PHE A CD2 1 ATOM 716 C CE1 . PHE A 1 100 ? -68.018 40.567 4.449 1.00 93.83 ? 124 PHE A CE1 1 ATOM 717 C CE2 . PHE A 1 100 ? -69.305 41.567 6.226 1.00 93.45 ? 124 PHE A CE2 1 ATOM 718 C CZ . PHE A 1 100 ? -69.250 40.854 5.027 1.00 94.04 ? 124 PHE A CZ 1 ATOM 719 N N . GLY A 1 101 ? -62.992 43.773 6.099 1.00 82.37 ? 125 GLY A N 1 ATOM 720 C CA . GLY A 1 101 ? -61.605 44.100 6.372 1.00 79.65 ? 125 GLY A CA 1 ATOM 721 C C . GLY A 1 101 ? -60.716 44.052 5.156 1.00 77.49 ? 125 GLY A C 1 ATOM 722 O O . GLY A 1 101 ? -61.147 43.645 4.091 1.00 77.69 ? 125 GLY A O 1 ATOM 723 N N . THR A 1 102 ? -59.462 44.456 5.334 1.00 75.24 ? 126 THR A N 1 ATOM 724 C CA . THR A 1 102 ? -58.471 44.482 4.253 1.00 72.35 ? 126 THR A CA 1 ATOM 725 C C . THR A 1 102 ? -57.218 43.624 4.579 1.00 70.02 ? 126 THR A C 1 ATOM 726 O O . THR A 1 102 ? -56.610 43.787 5.649 1.00 70.16 ? 126 THR A O 1 ATOM 727 C CB . THR A 1 102 ? -58.032 45.941 3.963 1.00 72.96 ? 126 THR A CB 1 ATOM 728 O OG1 . THR A 1 102 ? -59.152 46.696 3.480 1.00 73.09 ? 126 THR A OG1 1 ATOM 729 C CG2 . THR A 1 102 ? -56.925 45.975 2.926 1.00 73.30 ? 126 THR A CG2 1 ATOM 730 N N . ALA A 1 103 ? -56.857 42.716 3.657 1.00 66.15 ? 127 ALA A N 1 ATOM 731 C CA . ALA A 1 103 ? -55.701 41.808 3.793 1.00 61.60 ? 127 ALA A CA 1 ATOM 732 C C . ALA A 1 103 ? -54.397 42.417 3.271 1.00 58.40 ? 127 ALA A C 1 ATOM 733 O O . ALA A 1 103 ? -54.412 43.224 2.370 1.00 58.95 ? 127 ALA A O 1 ATOM 734 C CB . ALA A 1 103 ? -55.995 40.486 3.072 1.00 60.11 ? 127 ALA A CB 1 ATOM 735 N N . LEU A 1 104 ? -53.261 42.045 3.837 1.00 55.07 ? 128 LEU A N 1 ATOM 736 C CA . LEU A 1 104 ? -52.011 42.581 3.333 1.00 51.66 ? 128 LEU A CA 1 ATOM 737 C C . LEU A 1 104 ? -51.008 41.507 2.874 1.00 50.67 ? 128 LEU A C 1 ATOM 738 O O . LEU A 1 104 ? -51.050 40.349 3.317 1.00 50.06 ? 128 LEU A O 1 ATOM 739 C CB . LEU A 1 104 ? -51.373 43.519 4.356 1.00 50.52 ? 128 LEU A CB 1 ATOM 740 C CG . LEU A 1 104 ? -52.040 44.896 4.454 1.00 49.19 ? 128 LEU A CG 1 ATOM 741 C CD1 . LEU A 1 104 ? -51.054 45.935 4.985 1.00 49.33 ? 128 LEU A CD1 1 ATOM 742 C CD2 . LEU A 1 104 ? -52.501 45.320 3.078 1.00 49.88 ? 128 LEU A CD2 1 ATOM 743 N N . SER A 1 105 ? -50.126 41.879 1.946 1.00 49.92 ? 129 SER A N 1 ATOM 744 C CA . SER A 1 105 ? -49.113 40.945 1.419 1.00 48.28 ? 129 SER A CA 1 ATOM 745 C C . SER A 1 105 ? -47.763 41.519 1.762 1.00 46.41 ? 129 SER A C 1 ATOM 746 O O . SER A 1 105 ? -47.655 42.731 2.000 1.00 45.73 ? 129 SER A O 1 ATOM 747 C CB . SER A 1 105 ? -49.200 40.843 -0.102 1.00 48.98 ? 129 SER A CB 1 ATOM 748 O OG . SER A 1 105 ? -48.669 42.019 -0.698 1.00 48.86 ? 129 SER A OG 1 ATOM 749 N N . ASN A 1 106 ? -46.743 40.656 1.745 1.00 44.50 ? 130 ASN A N 1 ATOM 750 C CA . ASN A 1 106 ? -45.362 41.046 2.080 1.00 42.35 ? 130 ASN A CA 1 ATOM 751 C C . ASN A 1 106 ? -44.894 42.153 1.160 1.00 41.22 ? 130 ASN A C 1 ATOM 752 O O . ASN A 1 106 ? -45.122 42.043 -0.003 1.00 40.54 ? 130 ASN A O 1 ATOM 753 C CB . ASN A 1 106 ? -44.411 39.850 1.935 1.00 41.89 ? 130 ASN A CB 1 ATOM 754 C CG . ASN A 1 106 ? -44.896 38.601 2.675 1.00 40.93 ? 130 ASN A CG 1 ATOM 755 O OD1 . ASN A 1 106 ? -45.204 38.642 3.860 1.00 40.77 ? 130 ASN A OD1 1 ATOM 756 N ND2 . ASN A 1 106 ? -44.940 37.480 1.971 1.00 41.72 ? 130 ASN A ND2 1 ATOM 757 N N . ARG A 1 107 ? -44.235 43.203 1.639 1.00 42.10 ? 131 ARG A N 1 ATOM 758 C CA . ARG A 1 107 ? -43.761 44.262 0.721 1.00 44.29 ? 131 ARG A CA 1 ATOM 759 C C . ARG A 1 107 ? -42.705 43.701 -0.250 1.00 44.30 ? 131 ARG A C 1 ATOM 760 O O . ARG A 1 107 ? -41.526 43.666 0.073 1.00 46.68 ? 131 ARG A O 1 ATOM 761 C CB . ARG A 1 107 ? -43.154 45.455 1.472 1.00 47.18 ? 131 ARG A CB 1 ATOM 762 C CG . ARG A 1 107 ? -44.134 46.386 2.158 1.00 51.28 ? 131 ARG A CG 1 ATOM 763 C CD . ARG A 1 107 ? -43.398 47.597 2.713 1.00 55.66 ? 131 ARG A CD 1 ATOM 764 N NE . ARG A 1 107 ? -44.189 48.331 3.699 1.00 59.82 ? 131 ARG A NE 1 ATOM 765 C CZ . ARG A 1 107 ? -43.766 49.410 4.357 1.00 62.14 ? 131 ARG A CZ 1 ATOM 766 N NH1 . ARG A 1 107 ? -42.547 49.897 4.138 1.00 63.55 ? 131 ARG A NH1 1 ATOM 767 N NH2 . ARG A 1 107 ? -44.560 49.998 5.246 1.00 62.37 ? 131 ARG A NH2 1 ATOM 768 N N . ILE A 1 108 ? -43.139 43.290 -1.435 1.00 43.25 ? 132 ILE A N 1 ATOM 769 C CA . ILE A 1 108 ? -42.302 42.721 -2.465 1.00 41.46 ? 132 ILE A CA 1 ATOM 770 C C . ILE A 1 108 ? -41.313 43.660 -3.088 1.00 43.37 ? 132 ILE A C 1 ATOM 771 O O . ILE A 1 108 ? -41.735 44.632 -3.692 1.00 43.77 ? 132 ILE A O 1 ATOM 772 C CB . ILE A 1 108 ? -43.138 42.175 -3.584 1.00 39.40 ? 132 ILE A CB 1 ATOM 773 C CG1 . ILE A 1 108 ? -43.930 40.976 -3.086 1.00 40.88 ? 132 ILE A CG1 1 ATOM 774 C CG2 . ILE A 1 108 ? -42.250 41.806 -4.737 1.00 38.56 ? 132 ILE A CG2 1 ATOM 775 C CD1 . ILE A 1 108 ? -44.988 40.514 -4.048 1.00 43.40 ? 132 ILE A CD1 1 ATOM 776 N N . ARG A 1 109 ? -40.013 43.348 -2.990 1.00 45.50 ? 133 ARG A N 1 ATOM 777 C CA . ARG A 1 109 ? -38.970 44.187 -3.564 1.00 46.99 ? 133 ARG A CA 1 ATOM 778 C C . ARG A 1 109 ? -38.699 43.767 -5.009 1.00 47.37 ? 133 ARG A C 1 ATOM 779 O O . ARG A 1 109 ? -37.908 42.846 -5.232 1.00 47.36 ? 133 ARG A O 1 ATOM 780 C CB . ARG A 1 109 ? -37.687 44.012 -2.756 1.00 50.01 ? 133 ARG A CB 1 ATOM 781 C CG . ARG A 1 109 ? -37.116 45.283 -2.164 1.00 57.17 ? 133 ARG A CG 1 ATOM 782 C CD . ARG A 1 109 ? -36.708 46.286 -3.240 1.00 62.95 ? 133 ARG A CD 1 ATOM 783 N NE . ARG A 1 109 ? -36.241 47.546 -2.656 1.00 68.46 ? 133 ARG A NE 1 ATOM 784 C CZ . ARG A 1 109 ? -35.103 47.683 -1.978 1.00 71.24 ? 133 ARG A CZ 1 ATOM 785 N NH1 . ARG A 1 109 ? -34.303 46.636 -1.800 1.00 71.47 ? 133 ARG A NH1 1 ATOM 786 N NH2 . ARG A 1 109 ? -34.767 48.863 -1.465 1.00 72.12 ? 133 ARG A NH2 1 ATOM 787 N N . LEU A 1 110 ? -39.336 44.421 -5.990 1.00 47.60 ? 134 LEU A N 1 ATOM 788 C CA . LEU A 1 110 ? -39.113 44.068 -7.410 1.00 47.92 ? 134 LEU A CA 1 ATOM 789 C C . LEU A 1 110 ? -37.786 44.587 -7.932 1.00 48.18 ? 134 LEU A C 1 ATOM 790 O O . LEU A 1 110 ? -37.522 45.782 -7.895 1.00 47.33 ? 134 LEU A O 1 ATOM 791 C CB . LEU A 1 110 ? -40.233 44.599 -8.309 1.00 47.83 ? 134 LEU A CB 1 ATOM 792 C CG . LEU A 1 110 ? -40.258 43.973 -9.715 1.00 48.41 ? 134 LEU A CG 1 ATOM 793 C CD1 . LEU A 1 110 ? -40.234 42.454 -9.628 1.00 47.24 ? 134 LEU A CD1 1 ATOM 794 C CD2 . LEU A 1 110 ? -41.510 44.404 -10.444 1.00 49.43 ? 134 LEU A CD2 1 ATOM 795 N N . GLN A 1 111 ? -36.949 43.683 -8.423 1.00 49.08 ? 135 GLN A N 1 ATOM 796 C CA . GLN A 1 111 ? -35.645 44.079 -8.957 1.00 50.36 ? 135 GLN A CA 1 ATOM 797 C C . GLN A 1 111 ? -35.273 43.294 -10.212 1.00 49.36 ? 135 GLN A C 1 ATOM 798 O O . GLN A 1 111 ? -35.745 42.169 -10.400 1.00 48.26 ? 135 GLN A O 1 ATOM 799 C CB . GLN A 1 111 ? -34.560 43.862 -7.911 1.00 52.16 ? 135 GLN A CB 1 ATOM 800 C CG . GLN A 1 111 ? -34.369 45.005 -6.961 1.00 55.79 ? 135 GLN A CG 1 ATOM 801 C CD . GLN A 1 111 ? -33.326 44.688 -5.914 1.00 57.96 ? 135 GLN A CD 1 ATOM 802 O OE1 . GLN A 1 111 ? -33.483 43.750 -5.129 1.00 58.58 ? 135 GLN A OE1 1 ATOM 803 N NE2 . GLN A 1 111 ? -32.246 45.465 -5.899 1.00 58.32 ? 135 GLN A NE2 1 ATOM 804 N N . VAL A 1 112 ? -34.424 43.897 -11.051 1.00 48.68 ? 136 VAL A N 1 ATOM 805 C CA . VAL A 1 112 ? -33.981 43.275 -12.290 1.00 48.49 ? 136 VAL A CA 1 ATOM 806 C C . VAL A 1 112 ? -32.580 42.784 -12.178 1.00 48.87 ? 136 VAL A C 1 ATOM 807 O O . VAL A 1 112 ? -31.731 43.465 -11.578 1.00 48.92 ? 136 VAL A O 1 ATOM 808 C CB . VAL A 1 112 ? -34.056 44.228 -13.477 1.00 47.88 ? 136 VAL A CB 1 ATOM 809 C CG1 . VAL A 1 112 ? -35.456 44.236 -14.022 1.00 49.27 ? 136 VAL A CG1 1 ATOM 810 C CG2 . VAL A 1 112 ? -33.653 45.624 -13.048 1.00 48.80 ? 136 VAL A CG2 1 ATOM 811 N N . SER A 1 113 ? -32.348 41.615 -12.783 1.00 49.81 ? 137 SER A N 1 ATOM 812 C CA . SER A 1 113 ? -31.041 40.962 -12.787 1.00 51.50 ? 137 SER A CA 1 ATOM 813 C C . SER A 1 113 ? -30.028 41.792 -13.568 1.00 52.74 ? 137 SER A C 1 ATOM 814 O O . SER A 1 113 ? -30.308 42.288 -14.657 1.00 53.74 ? 137 SER A O 1 ATOM 815 C CB . SER A 1 113 ? -31.161 39.551 -13.368 1.00 52.60 ? 137 SER A CB 1 ATOM 816 O OG . SER A 1 113 ? -31.950 38.716 -12.530 1.00 52.89 ? 137 SER A OG 1 ATOM 817 N N . LYS A 1 114 ? -28.834 41.933 -13.012 1.00 53.84 ? 138 LYS A N 1 ATOM 818 C CA . LYS A 1 114 ? -27.803 42.711 -13.676 1.00 55.17 ? 138 LYS A CA 1 ATOM 819 C C . LYS A 1 114 ? -26.561 41.907 -14.035 1.00 54.74 ? 138 LYS A C 1 ATOM 820 O O . LYS A 1 114 ? -26.145 41.053 -13.278 1.00 55.30 ? 138 LYS A O 1 ATOM 821 C CB . LYS A 1 114 ? -27.422 43.890 -12.786 1.00 58.02 ? 138 LYS A CB 1 ATOM 822 C CG . LYS A 1 114 ? -28.588 44.826 -12.537 1.00 62.02 ? 138 LYS A CG 1 ATOM 823 C CD . LYS A 1 114 ? -29.183 45.339 -13.849 1.00 62.95 ? 138 LYS A CD 1 ATOM 824 C CE . LYS A 1 114 ? -28.257 46.345 -14.544 1.00 64.01 ? 138 LYS A CE 1 ATOM 825 N NZ . LYS A 1 114 ? -26.960 45.772 -14.999 1.00 62.55 ? 138 LYS A NZ 1 ATOM 826 N N . SER A 1 115 ? -25.995 42.171 -15.205 1.00 53.17 ? 139 SER A N 1 ATOM 827 C CA . SER A 1 115 ? -24.787 41.507 -15.653 1.00 51.40 ? 139 SER A CA 1 ATOM 828 C C . SER A 1 115 ? -23.859 42.627 -16.161 1.00 50.10 ? 139 SER A C 1 ATOM 829 O O . SER A 1 115 ? -23.804 42.926 -17.355 1.00 51.60 ? 139 SER A O 1 ATOM 830 C CB . SER A 1 115 ? -25.143 40.526 -16.755 1.00 53.33 ? 139 SER A CB 1 ATOM 831 O OG . SER A 1 115 ? -26.251 39.743 -16.345 1.00 55.30 ? 139 SER A OG 1 ATOM 832 N N . PRO A 1 116 ? -23.156 43.299 -15.245 1.00 47.93 ? 140 PRO A N 1 ATOM 833 C CA . PRO A 1 116 ? -22.224 44.395 -15.510 1.00 48.46 ? 140 PRO A CA 1 ATOM 834 C C . PRO A 1 116 ? -20.916 43.964 -16.104 1.00 50.47 ? 140 PRO A C 1 ATOM 835 O O . PRO A 1 116 ? -20.494 42.824 -15.906 1.00 50.52 ? 140 PRO A O 1 ATOM 836 C CB . PRO A 1 116 ? -22.039 45.022 -14.135 1.00 46.87 ? 140 PRO A CB 1 ATOM 837 C CG . PRO A 1 116 ? -23.324 44.732 -13.475 1.00 47.46 ? 140 PRO A CG 1 ATOM 838 C CD . PRO A 1 116 ? -23.535 43.299 -13.830 1.00 47.32 ? 140 PRO A CD 1 ATOM 839 N N . LEU A 1 117 ? -20.269 44.892 -16.805 1.00 52.75 ? 141 LEU A N 1 ATOM 840 C CA . LEU A 1 117 ? -18.986 44.643 -17.438 1.00 54.28 ? 141 LEU A CA 1 ATOM 841 C C . LEU A 1 117 ? -17.938 44.995 -16.398 1.00 55.03 ? 141 LEU A C 1 ATOM 842 O O . LEU A 1 117 ? -18.216 45.727 -15.445 1.00 55.16 ? 141 LEU A O 1 ATOM 843 C CB . LEU A 1 117 ? -18.845 45.555 -18.646 1.00 56.10 ? 141 LEU A CB 1 ATOM 844 C CG . LEU A 1 117 ? -20.008 45.448 -19.638 1.00 58.76 ? 141 LEU A CG 1 ATOM 845 C CD1 . LEU A 1 117 ? -20.053 46.664 -20.556 1.00 58.63 ? 141 LEU A CD1 1 ATOM 846 C CD2 . LEU A 1 117 ? -19.850 44.161 -20.440 1.00 60.39 ? 141 LEU A CD2 1 ATOM 847 N N . TRP A 1 118 ? -16.734 44.471 -16.555 1.00 56.52 ? 142 TRP A N 1 ATOM 848 C CA . TRP A 1 118 ? -15.686 44.765 -15.575 1.00 60.13 ? 142 TRP A CA 1 ATOM 849 C C . TRP A 1 118 ? -15.059 46.089 -15.866 1.00 64.69 ? 142 TRP A C 1 ATOM 850 O O . TRP A 1 118 ? -15.048 46.551 -16.998 1.00 63.92 ? 142 TRP A O 1 ATOM 851 C CB . TRP A 1 118 ? -14.581 43.721 -15.636 1.00 56.86 ? 142 TRP A CB 1 ATOM 852 C CG . TRP A 1 118 ? -15.015 42.319 -15.527 1.00 51.72 ? 142 TRP A CG 1 ATOM 853 C CD1 . TRP A 1 118 ? -15.804 41.621 -16.408 1.00 51.31 ? 142 TRP A CD1 1 ATOM 854 C CD2 . TRP A 1 118 ? -14.664 41.409 -14.487 1.00 47.92 ? 142 TRP A CD2 1 ATOM 855 N NE1 . TRP A 1 118 ? -15.963 40.325 -15.966 1.00 49.22 ? 142 TRP A NE1 1 ATOM 856 C CE2 . TRP A 1 118 ? -15.277 40.170 -14.789 1.00 47.23 ? 142 TRP A CE2 1 ATOM 857 C CE3 . TRP A 1 118 ? -13.896 41.520 -13.329 1.00 45.64 ? 142 TRP A CE3 1 ATOM 858 C CZ2 . TRP A 1 118 ? -15.139 39.050 -13.977 1.00 44.69 ? 142 TRP A CZ2 1 ATOM 859 C CZ3 . TRP A 1 118 ? -13.759 40.416 -12.531 1.00 46.93 ? 142 TRP A CZ3 1 ATOM 860 C CH2 . TRP A 1 118 ? -14.383 39.189 -12.856 1.00 45.41 ? 142 TRP A CH2 1 ATOM 861 N N . PRO A 1 119 ? -14.498 46.711 -14.842 1.00 70.37 ? 143 PRO A N 1 ATOM 862 C CA . PRO A 1 119 ? -13.872 48.010 -15.072 1.00 74.89 ? 143 PRO A CA 1 ATOM 863 C C . PRO A 1 119 ? -12.610 47.910 -15.941 1.00 77.33 ? 143 PRO A C 1 ATOM 864 O O . PRO A 1 119 ? -12.097 46.820 -16.201 1.00 75.80 ? 143 PRO A O 1 ATOM 865 C CB . PRO A 1 119 ? -13.565 48.502 -13.656 1.00 75.74 ? 143 PRO A CB 1 ATOM 866 C CG . PRO A 1 119 ? -14.665 47.876 -12.835 1.00 75.64 ? 143 PRO A CG 1 ATOM 867 C CD . PRO A 1 119 ? -14.704 46.467 -13.404 1.00 72.59 ? 143 PRO A CD 1 ATOM 868 N N . LYS A 1 120 ? -12.128 49.064 -16.390 1.00 81.87 ? 144 LYS A N 1 ATOM 869 C CA . LYS A 1 120 ? -10.932 49.147 -17.213 1.00 86.20 ? 144 LYS A CA 1 ATOM 870 C C . LYS A 1 120 ? -9.754 48.623 -16.397 1.00 88.23 ? 144 LYS A C 1 ATOM 871 O O . LYS A 1 120 ? -9.255 49.320 -15.509 1.00 89.27 ? 144 LYS A O 1 ATOM 872 C CB . LYS A 1 120 ? -10.659 50.602 -17.627 1.00 87.55 ? 144 LYS A CB 1 ATOM 873 C CG . LYS A 1 120 ? -11.878 51.394 -18.097 1.00 88.36 ? 144 LYS A CG 1 ATOM 874 C CD . LYS A 1 120 ? -12.354 52.375 -17.026 1.00 90.26 ? 144 LYS A CD 1 ATOM 875 C CE . LYS A 1 120 ? -13.510 53.236 -17.523 1.00 91.70 ? 144 LYS A CE 1 ATOM 876 N NZ . LYS A 1 120 ? -13.938 54.257 -16.524 1.00 92.71 ? 144 LYS A NZ 1 ATOM 877 N N . GLU A 1 121 ? -9.303 47.408 -16.687 1.00 90.05 ? 145 GLU A N 1 ATOM 878 C CA . GLU A 1 121 ? -8.173 46.858 -15.937 1.00 92.85 ? 145 GLU A CA 1 ATOM 879 C C . GLU A 1 121 ? -6.975 46.524 -16.827 1.00 93.16 ? 145 GLU A C 1 ATOM 880 O O . GLU A 1 121 ? -7.011 45.548 -17.568 1.00 92.82 ? 145 GLU A O 1 ATOM 881 C CB . GLU A 1 121 ? -8.607 45.613 -15.157 1.00 94.95 ? 145 GLU A CB 1 ATOM 882 C CG . GLU A 1 121 ? -9.587 45.902 -14.021 1.00 97.85 ? 145 GLU A CG 1 ATOM 883 C CD . GLU A 1 121 ? -10.011 44.650 -13.262 1.00 98.26 ? 145 GLU A CD 1 ATOM 884 O OE1 . GLU A 1 121 ? -10.480 43.689 -13.910 1.00 98.69 ? 145 GLU A OE1 1 ATOM 885 O OE2 . GLU A 1 121 ? -9.886 44.631 -12.018 1.00 98.13 ? 145 GLU A OE2 1 ATOM 886 N N . ASN A 1 122 ? -5.928 47.347 -16.763 1.00 94.11 ? 146 ASN A N 1 ATOM 887 C CA . ASN A 1 122 ? -4.726 47.139 -17.564 1.00 94.76 ? 146 ASN A CA 1 ATOM 888 C C . ASN A 1 122 ? -3.789 46.357 -16.651 1.00 94.41 ? 146 ASN A C 1 ATOM 889 O O . ASN A 1 122 ? -3.106 46.933 -15.809 1.00 94.63 ? 146 ASN A O 1 ATOM 890 C CB . ASN A 1 122 ? -4.093 48.474 -17.948 1.00 96.47 ? 146 ASN A CB 1 ATOM 891 C CG . ASN A 1 122 ? -3.123 48.345 -19.107 1.00 97.63 ? 146 ASN A CG 1 ATOM 892 O OD1 . ASN A 1 122 ? -2.166 47.571 -19.054 1.00 98.50 ? 146 ASN A OD1 1 ATOM 893 N ND2 . ASN A 1 122 ? -3.369 49.106 -20.166 1.00 98.46 ? 146 ASN A ND2 1 ATOM 894 N N . LEU A 1 123 ? -3.772 45.040 -16.833 1.00 94.13 ? 147 LEU A N 1 ATOM 895 C CA . LEU A 1 123 ? -2.967 44.115 -16.034 1.00 93.75 ? 147 LEU A CA 1 ATOM 896 C C . LEU A 1 123 ? -1.557 43.883 -16.534 1.00 94.41 ? 147 LEU A C 1 ATOM 897 O O . LEU A 1 123 ? -1.368 43.518 -17.693 1.00 94.79 ? 147 LEU A O 1 ATOM 898 C CB . LEU A 1 123 ? -3.671 42.765 -15.978 1.00 92.85 ? 147 LEU A CB 1 ATOM 899 C CG . LEU A 1 123 ? -5.084 42.681 -15.408 1.00 92.11 ? 147 LEU A CG 1 ATOM 900 C CD1 . LEU A 1 123 ? -5.752 41.419 -15.914 1.00 91.43 ? 147 LEU A CD1 1 ATOM 901 C CD2 . LEU A 1 123 ? -5.033 42.710 -13.890 1.00 91.96 ? 147 LEU A CD2 1 ATOM 902 N N . ASP A 1 124 ? -0.576 44.050 -15.649 1.00 94.68 ? 148 ASP A N 1 ATOM 903 C CA . ASP A 1 124 ? 0.823 43.852 -16.022 1.00 94.97 ? 148 ASP A CA 1 ATOM 904 C C . ASP A 1 124 ? 1.184 42.375 -15.877 1.00 94.20 ? 148 ASP A C 1 ATOM 905 O O . ASP A 1 124 ? 0.528 41.644 -15.144 1.00 93.90 ? 148 ASP A O 1 ATOM 906 C CB . ASP A 1 124 ? 1.737 44.706 -15.136 1.00 97.58 ? 148 ASP A CB 1 ATOM 907 C CG . ASP A 1 124 ? 1.625 46.201 -15.434 1.00 99.78 ? 148 ASP A CG 1 ATOM 908 O OD1 . ASP A 1 124 ? 2.108 47.005 -14.608 1.00 100.19 ? 148 ASP A OD1 1 ATOM 909 O OD2 . ASP A 1 124 ? 1.071 46.575 -16.492 1.00 100.75 ? 148 ASP A OD2 1 ATOM 910 N N . PRO A 1 125 ? 2.219 41.910 -16.593 1.00 94.12 ? 149 PRO A N 1 ATOM 911 C CA . PRO A 1 125 ? 2.593 40.502 -16.474 1.00 93.36 ? 149 PRO A CA 1 ATOM 912 C C . PRO A 1 125 ? 3.076 40.275 -15.063 1.00 93.03 ? 149 PRO A C 1 ATOM 913 O O . PRO A 1 125 ? 3.925 41.028 -14.569 1.00 92.11 ? 149 PRO A O 1 ATOM 914 C CB . PRO A 1 125 ? 3.717 40.352 -17.496 1.00 93.88 ? 149 PRO A CB 1 ATOM 915 C CG . PRO A 1 125 ? 3.381 41.392 -18.521 1.00 94.41 ? 149 PRO A CG 1 ATOM 916 C CD . PRO A 1 125 ? 2.983 42.569 -17.663 1.00 94.03 ? 149 PRO A CD 1 ATOM 917 N N . VAL A 1 126 ? 2.529 39.243 -14.423 1.00 93.11 ? 150 VAL A N 1 ATOM 918 C CA . VAL A 1 126 ? 2.879 38.887 -13.045 1.00 93.35 ? 150 VAL A CA 1 ATOM 919 C C . VAL A 1 126 ? 4.159 38.043 -12.971 1.00 92.78 ? 150 VAL A C 1 ATOM 920 O O . VAL A 1 126 ? 4.231 36.933 -13.513 1.00 91.82 ? 150 VAL A O 1 ATOM 921 C CB . VAL A 1 126 ? 1.730 38.111 -12.356 1.00 94.42 ? 150 VAL A CB 1 ATOM 922 C CG1 . VAL A 1 126 ? 1.862 38.229 -10.843 1.00 95.16 ? 150 VAL A CG1 1 ATOM 923 C CG2 . VAL A 1 126 ? 0.384 38.638 -12.824 1.00 95.33 ? 150 VAL A CG2 1 ATOM 924 N N . VAL A 1 127 ? 5.168 38.581 -12.298 1.00 92.20 ? 151 VAL A N 1 ATOM 925 C CA . VAL A 1 127 ? 6.441 37.897 -12.170 1.00 91.00 ? 151 VAL A CA 1 ATOM 926 C C . VAL A 1 127 ? 6.655 37.546 -10.721 1.00 89.37 ? 151 VAL A C 1 ATOM 927 O O . VAL A 1 127 ? 6.746 38.434 -9.860 1.00 89.11 ? 151 VAL A O 1 ATOM 928 C CB . VAL A 1 127 ? 7.611 38.780 -12.656 1.00 92.15 ? 151 VAL A CB 1 ATOM 929 C CG1 . VAL A 1 127 ? 8.927 38.220 -12.159 1.00 93.58 ? 151 VAL A CG1 1 ATOM 930 C CG2 . VAL A 1 127 ? 7.617 38.844 -14.174 1.00 92.43 ? 151 VAL A CG2 1 ATOM 931 N N . VAL A 1 128 ? 6.735 36.248 -10.453 1.00 87.08 ? 152 VAL A N 1 ATOM 932 C CA . VAL A 1 128 ? 6.925 35.781 -9.086 1.00 85.45 ? 152 VAL A CA 1 ATOM 933 C C . VAL A 1 128 ? 7.932 34.639 -9.026 1.00 85.52 ? 152 VAL A C 1 ATOM 934 O O . VAL A 1 128 ? 8.076 33.882 -9.998 1.00 85.79 ? 152 VAL A O 1 ATOM 935 C CB . VAL A 1 128 ? 5.579 35.335 -8.477 1.00 83.91 ? 152 VAL A CB 1 ATOM 936 C CG1 . VAL A 1 128 ? 5.013 34.175 -9.258 1.00 82.21 ? 152 VAL A CG1 1 ATOM 937 C CG2 . VAL A 1 128 ? 5.758 34.981 -7.012 1.00 82.45 ? 152 VAL A CG2 1 ATOM 938 N N . GLN A 1 129 ? 8.635 34.527 -7.897 1.00 84.96 ? 153 GLN A N 1 ATOM 939 C CA . GLN A 1 129 ? 9.631 33.474 -7.710 1.00 84.16 ? 153 GLN A CA 1 ATOM 940 C C . GLN A 1 129 ? 8.978 32.136 -7.410 1.00 81.06 ? 153 GLN A C 1 ATOM 941 O O . GLN A 1 129 ? 7.915 32.085 -6.809 1.00 81.41 ? 153 GLN A O 1 ATOM 942 C CB . GLN A 1 129 ? 10.601 33.831 -6.583 1.00 88.16 ? 153 GLN A CB 1 ATOM 943 C CG . GLN A 1 129 ? 11.639 34.878 -6.978 1.00 94.52 ? 153 GLN A CG 1 ATOM 944 C CD . GLN A 1 129 ? 12.754 35.025 -5.952 1.00 98.17 ? 153 GLN A CD 1 ATOM 945 O OE1 . GLN A 1 129 ? 13.652 35.865 -6.104 1.00 99.82 ? 153 GLN A OE1 1 ATOM 946 N NE2 . GLN A 1 129 ? 12.706 34.204 -4.902 1.00 98.98 ? 153 GLN A NE2 1 ATOM 947 N N . GLU A 1 130 ? 9.625 31.055 -7.830 1.00 76.03 ? 154 GLU A N 1 ATOM 948 C CA . GLU A 1 130 ? 9.114 29.713 -7.627 1.00 69.41 ? 154 GLU A CA 1 ATOM 949 C C . GLU A 1 130 ? 9.050 29.399 -6.142 1.00 65.58 ? 154 GLU A C 1 ATOM 950 O O . GLU A 1 130 ? 10.012 29.661 -5.423 1.00 63.66 ? 154 GLU A O 1 ATOM 951 C CB . GLU A 1 130 ? 10.004 28.703 -8.336 1.00 71.68 ? 154 GLU A CB 1 ATOM 952 C CG . GLU A 1 130 ? 9.355 27.357 -8.566 1.00 74.60 ? 154 GLU A CG 1 ATOM 953 C CD . GLU A 1 130 ? 10.286 26.382 -9.256 1.00 76.32 ? 154 GLU A CD 1 ATOM 954 O OE1 . GLU A 1 130 ? 9.822 25.288 -9.650 1.00 76.65 ? 154 GLU A OE1 1 ATOM 955 O OE2 . GLU A 1 130 ? 11.485 26.713 -9.400 1.00 76.90 ? 154 GLU A OE2 1 ATOM 956 N N . GLY A 1 131 ? 7.909 28.856 -5.693 1.00 61.64 ? 155 GLY A N 1 ATOM 957 C CA . GLY A 1 131 ? 7.714 28.479 -4.299 1.00 58.24 ? 155 GLY A CA 1 ATOM 958 C C . GLY A 1 131 ? 7.056 29.524 -3.421 1.00 56.49 ? 155 GLY A C 1 ATOM 959 O O . GLY A 1 131 ? 6.590 29.259 -2.307 1.00 58.12 ? 155 GLY A O 1 ATOM 960 N N . ALA A 1 132 ? 7.010 30.738 -3.927 1.00 54.73 ? 156 ALA A N 1 ATOM 961 C CA . ALA A 1 132 ? 6.417 31.820 -3.174 1.00 52.52 ? 156 ALA A CA 1 ATOM 962 C C . ALA A 1 132 ? 4.897 31.825 -3.330 1.00 50.57 ? 156 ALA A C 1 ATOM 963 O O . ALA A 1 132 ? 4.366 31.414 -4.377 1.00 51.25 ? 156 ALA A O 1 ATOM 964 C CB . ALA A 1 132 ? 7.002 33.144 -3.639 1.00 54.05 ? 156 ALA A CB 1 ATOM 965 N N . PRO A 1 133 ? 4.177 32.226 -2.260 1.00 46.80 ? 157 PRO A N 1 ATOM 966 C CA . PRO A 1 133 ? 2.724 32.293 -2.287 1.00 44.13 ? 157 PRO A CA 1 ATOM 967 C C . PRO A 1 133 ? 2.285 33.308 -3.310 1.00 42.47 ? 157 PRO A C 1 ATOM 968 O O . PRO A 1 133 ? 3.025 34.208 -3.637 1.00 41.49 ? 157 PRO A O 1 ATOM 969 C CB . PRO A 1 133 ? 2.354 32.672 -0.852 1.00 43.95 ? 157 PRO A CB 1 ATOM 970 C CG . PRO A 1 133 ? 3.627 33.165 -0.250 1.00 44.72 ? 157 PRO A CG 1 ATOM 971 C CD . PRO A 1 133 ? 4.657 32.287 -0.873 1.00 45.92 ? 157 PRO A CD 1 ATOM 972 N N . LEU A 1 134 ? 1.066 33.168 -3.808 1.00 43.52 ? 158 LEU A N 1 ATOM 973 C CA . LEU A 1 134 ? 0.539 34.066 -4.827 1.00 45.28 ? 158 LEU A CA 1 ATOM 974 C C . LEU A 1 134 ? -0.980 34.203 -4.790 1.00 47.50 ? 158 LEU A C 1 ATOM 975 O O . LEU A 1 134 ? -1.694 33.197 -4.804 1.00 48.56 ? 158 LEU A O 1 ATOM 976 C CB . LEU A 1 134 ? 0.957 33.570 -6.209 1.00 40.84 ? 158 LEU A CB 1 ATOM 977 C CG . LEU A 1 134 ? 0.279 34.282 -7.369 1.00 37.26 ? 158 LEU A CG 1 ATOM 978 C CD1 . LEU A 1 134 ? 0.792 35.680 -7.416 1.00 36.16 ? 158 LEU A CD1 1 ATOM 979 C CD2 . LEU A 1 134 ? 0.550 33.586 -8.681 1.00 37.88 ? 158 LEU A CD2 1 ATOM 980 N N . THR A 1 135 ? -1.482 35.434 -4.744 1.00 48.58 ? 159 THR A N 1 ATOM 981 C CA . THR A 1 135 ? -2.930 35.607 -4.734 1.00 48.71 ? 159 THR A CA 1 ATOM 982 C C . THR A 1 135 ? -3.320 36.451 -5.923 1.00 48.58 ? 159 THR A C 1 ATOM 983 O O . THR A 1 135 ? -2.750 37.510 -6.152 1.00 49.31 ? 159 THR A O 1 ATOM 984 C CB . THR A 1 135 ? -3.447 36.309 -3.467 1.00 49.43 ? 159 THR A CB 1 ATOM 985 O OG1 . THR A 1 135 ? -3.022 35.597 -2.297 1.00 49.74 ? 159 THR A OG1 1 ATOM 986 C CG2 . THR A 1 135 ? -4.966 36.359 -3.496 1.00 48.78 ? 159 THR A CG2 1 ATOM 987 N N . LEU A 1 136 ? -4.269 35.962 -6.703 1.00 47.65 ? 160 LEU A N 1 ATOM 988 C CA . LEU A 1 136 ? -4.751 36.696 -7.860 1.00 48.29 ? 160 LEU A CA 1 ATOM 989 C C . LEU A 1 136 ? -6.199 37.088 -7.567 1.00 49.68 ? 160 LEU A C 1 ATOM 990 O O . LEU A 1 136 ? -7.103 36.243 -7.660 1.00 49.11 ? 160 LEU A O 1 ATOM 991 C CB . LEU A 1 136 ? -4.705 35.825 -9.116 1.00 47.89 ? 160 LEU A CB 1 ATOM 992 C CG . LEU A 1 136 ? -3.355 35.326 -9.636 1.00 46.95 ? 160 LEU A CG 1 ATOM 993 C CD1 . LEU A 1 136 ? -3.546 34.642 -10.974 1.00 45.00 ? 160 LEU A CD1 1 ATOM 994 C CD2 . LEU A 1 136 ? -2.401 36.493 -9.788 1.00 48.62 ? 160 LEU A CD2 1 ATOM 995 N N . GLN A 1 137 ? -6.432 38.353 -7.217 1.00 51.08 ? 161 GLN A N 1 ATOM 996 C CA . GLN A 1 137 ? -7.787 38.777 -6.905 1.00 52.69 ? 161 GLN A CA 1 ATOM 997 C C . GLN A 1 137 ? -8.688 38.884 -8.137 1.00 51.74 ? 161 GLN A C 1 ATOM 998 O O . GLN A 1 137 ? -8.299 39.418 -9.162 1.00 50.07 ? 161 GLN A O 1 ATOM 999 C CB . GLN A 1 137 ? -7.804 40.099 -6.140 1.00 57.09 ? 161 GLN A CB 1 ATOM 1000 C CG . GLN A 1 137 ? -6.733 41.083 -6.540 1.00 65.08 ? 161 GLN A CG 1 ATOM 1001 C CD . GLN A 1 137 ? -5.521 41.021 -5.616 1.00 69.88 ? 161 GLN A CD 1 ATOM 1002 O OE1 . GLN A 1 137 ? -5.634 41.262 -4.406 1.00 71.37 ? 161 GLN A OE1 1 ATOM 1003 N NE2 . GLN A 1 137 ? -4.354 40.696 -6.181 1.00 71.57 ? 161 GLN A NE2 1 ATOM 1004 N N . CYS A 1 138 ? -9.898 38.348 -8.021 1.00 52.67 ? 162 CYS A N 1 ATOM 1005 C CA . CYS A 1 138 ? -10.866 38.375 -9.097 1.00 55.53 ? 162 CYS A CA 1 ATOM 1006 C C . CYS A 1 138 ? -11.647 39.691 -9.053 1.00 57.69 ? 162 CYS A C 1 ATOM 1007 O O . CYS A 1 138 ? -11.725 40.410 -10.063 1.00 58.05 ? 162 CYS A O 1 ATOM 1008 C CB . CYS A 1 138 ? -11.805 37.165 -9.000 1.00 54.60 ? 162 CYS A CB 1 ATOM 1009 S SG . CYS A 1 138 ? -13.111 37.089 -10.283 1.00 57.88 ? 162 CYS A SG 1 ATOM 1010 N N . ASN A 1 139 ? -12.194 40.028 -7.884 1.00 60.12 ? 163 ASN A N 1 ATOM 1011 C CA . ASN A 1 139 ? -12.980 41.268 -7.710 1.00 61.70 ? 163 ASN A CA 1 ATOM 1012 C C . ASN A 1 139 ? -14.088 41.437 -8.739 1.00 61.80 ? 163 ASN A C 1 ATOM 1013 O O . ASN A 1 139 ? -14.082 42.351 -9.570 1.00 61.11 ? 163 ASN A O 1 ATOM 1014 C CB . ASN A 1 139 ? -12.092 42.501 -7.737 1.00 63.63 ? 163 ASN A CB 1 ATOM 1015 C CG . ASN A 1 139 ? -11.615 42.876 -6.368 1.00 67.18 ? 163 ASN A CG 1 ATOM 1016 O OD1 . ASN A 1 139 ? -12.358 42.751 -5.385 1.00 68.34 ? 163 ASN A OD1 1 ATOM 1017 N ND2 . ASN A 1 139 ? -10.376 43.351 -6.282 1.00 69.47 ? 163 ASN A ND2 1 ATOM 1018 N N . PRO A 1 140 ? -15.076 40.546 -8.672 1.00 61.75 ? 164 PRO A N 1 ATOM 1019 C CA . PRO A 1 140 ? -16.188 40.590 -9.608 1.00 61.06 ? 164 PRO A CA 1 ATOM 1020 C C . PRO A 1 140 ? -17.142 41.743 -9.442 1.00 61.33 ? 164 PRO A C 1 ATOM 1021 O O . PRO A 1 140 ? -17.220 42.363 -8.383 1.00 61.74 ? 164 PRO A O 1 ATOM 1022 C CB . PRO A 1 140 ? -16.857 39.239 -9.395 1.00 60.77 ? 164 PRO A CB 1 ATOM 1023 C CG . PRO A 1 140 ? -16.647 39.001 -7.938 1.00 60.47 ? 164 PRO A CG 1 ATOM 1024 C CD . PRO A 1 140 ? -15.209 39.403 -7.750 1.00 61.00 ? 164 PRO A CD 1 ATOM 1025 N N . PRO A 1 141 ? -17.867 42.060 -10.518 1.00 61.49 ? 165 PRO A N 1 ATOM 1026 C CA . PRO A 1 141 ? -18.854 43.138 -10.547 1.00 61.87 ? 165 PRO A CA 1 ATOM 1027 C C . PRO A 1 141 ? -20.099 42.739 -9.737 1.00 62.34 ? 165 PRO A C 1 ATOM 1028 O O . PRO A 1 141 ? -20.367 41.557 -9.517 1.00 61.48 ? 165 PRO A O 1 ATOM 1029 C CB . PRO A 1 141 ? -19.152 43.288 -12.035 1.00 62.00 ? 165 PRO A CB 1 ATOM 1030 C CG . PRO A 1 141 ? -18.949 41.921 -12.555 1.00 61.22 ? 165 PRO A CG 1 ATOM 1031 C CD . PRO A 1 141 ? -17.675 41.506 -11.866 1.00 61.23 ? 165 PRO A CD 1 ATOM 1032 N N . PRO A 1 142 ? -20.868 43.726 -9.279 1.00 63.49 ? 166 PRO A N 1 ATOM 1033 C CA . PRO A 1 142 ? -22.076 43.483 -8.490 1.00 63.36 ? 166 PRO A CA 1 ATOM 1034 C C . PRO A 1 142 ? -23.079 42.500 -9.076 1.00 61.83 ? 166 PRO A C 1 ATOM 1035 O O . PRO A 1 142 ? -22.852 41.305 -9.056 1.00 63.58 ? 166 PRO A O 1 ATOM 1036 C CB . PRO A 1 142 ? -22.652 44.887 -8.329 1.00 65.10 ? 166 PRO A CB 1 ATOM 1037 C CG . PRO A 1 142 ? -21.399 45.746 -8.254 1.00 65.73 ? 166 PRO A CG 1 ATOM 1038 C CD . PRO A 1 142 ? -20.570 45.169 -9.374 1.00 64.50 ? 166 PRO A CD 1 ATOM 1039 N N . GLY A 1 143 ? -24.203 43.012 -9.562 1.00 59.70 ? 167 GLY A N 1 ATOM 1040 C CA . GLY A 1 143 ? -25.238 42.168 -10.142 1.00 56.22 ? 167 GLY A CA 1 ATOM 1041 C C . GLY A 1 143 ? -26.098 41.366 -9.170 1.00 54.02 ? 167 GLY A C 1 ATOM 1042 O O . GLY A 1 143 ? -25.634 40.948 -8.103 1.00 53.73 ? 167 GLY A O 1 ATOM 1043 N N . LEU A 1 144 ? -27.362 41.152 -9.536 1.00 51.20 ? 168 LEU A N 1 ATOM 1044 C CA . LEU A 1 144 ? -28.277 40.384 -8.691 1.00 49.12 ? 168 LEU A CA 1 ATOM 1045 C C . LEU A 1 144 ? -28.779 39.200 -9.470 1.00 48.21 ? 168 LEU A C 1 ATOM 1046 O O . LEU A 1 144 ? -29.282 39.340 -10.589 1.00 49.85 ? 168 LEU A O 1 ATOM 1047 C CB . LEU A 1 144 ? -29.475 41.224 -8.263 1.00 48.46 ? 168 LEU A CB 1 ATOM 1048 C CG . LEU A 1 144 ? -29.161 42.695 -8.042 1.00 50.12 ? 168 LEU A CG 1 ATOM 1049 C CD1 . LEU A 1 144 ? -30.431 43.418 -7.660 1.00 50.82 ? 168 LEU A CD1 1 ATOM 1050 C CD2 . LEU A 1 144 ? -28.083 42.846 -6.966 1.00 52.05 ? 168 LEU A CD2 1 ATOM 1051 N N . PRO A 1 145 ? -28.601 38.004 -8.917 1.00 45.91 ? 169 PRO A N 1 ATOM 1052 C CA . PRO A 1 145 ? -27.953 37.758 -7.633 1.00 45.83 ? 169 PRO A CA 1 ATOM 1053 C C . PRO A 1 145 ? -26.416 37.710 -7.756 1.00 45.83 ? 169 PRO A C 1 ATOM 1054 O O . PRO A 1 145 ? -25.842 38.189 -8.732 1.00 45.05 ? 169 PRO A O 1 ATOM 1055 C CB . PRO A 1 145 ? -28.520 36.405 -7.248 1.00 45.74 ? 169 PRO A CB 1 ATOM 1056 C CG . PRO A 1 145 ? -28.587 35.731 -8.579 1.00 44.61 ? 169 PRO A CG 1 ATOM 1057 C CD . PRO A 1 145 ? -29.238 36.774 -9.414 1.00 44.57 ? 169 PRO A CD 1 ATOM 1058 N N . SER A 1 146 ? -25.760 37.127 -6.757 1.00 45.50 ? 170 SER A N 1 ATOM 1059 C CA . SER A 1 146 ? -24.314 37.012 -6.762 1.00 42.62 ? 170 SER A CA 1 ATOM 1060 C C . SER A 1 146 ? -23.988 36.035 -7.877 1.00 39.15 ? 170 SER A C 1 ATOM 1061 O O . SER A 1 146 ? -24.618 34.977 -7.997 1.00 39.11 ? 170 SER A O 1 ATOM 1062 C CB . SER A 1 146 ? -23.823 36.479 -5.414 1.00 45.21 ? 170 SER A CB 1 ATOM 1063 O OG . SER A 1 146 ? -24.396 37.208 -4.333 1.00 47.47 ? 170 SER A OG 1 ATOM 1064 N N . PRO A 1 147 ? -23.005 36.379 -8.719 1.00 36.47 ? 171 PRO A N 1 ATOM 1065 C CA . PRO A 1 147 ? -22.540 35.580 -9.865 1.00 34.56 ? 171 PRO A CA 1 ATOM 1066 C C . PRO A 1 147 ? -21.732 34.341 -9.469 1.00 33.07 ? 171 PRO A C 1 ATOM 1067 O O . PRO A 1 147 ? -21.188 34.299 -8.383 1.00 35.03 ? 171 PRO A O 1 ATOM 1068 C CB . PRO A 1 147 ? -21.693 36.580 -10.635 1.00 34.94 ? 171 PRO A CB 1 ATOM 1069 C CG . PRO A 1 147 ? -21.095 37.401 -9.543 1.00 34.90 ? 171 PRO A CG 1 ATOM 1070 C CD . PRO A 1 147 ? -22.285 37.664 -8.662 1.00 35.49 ? 171 PRO A CD 1 ATOM 1071 N N . VAL A 1 148 ? -21.660 33.329 -10.328 1.00 29.52 ? 172 VAL A N 1 ATOM 1072 C CA . VAL A 1 148 ? -20.879 32.122 -10.031 1.00 24.85 ? 172 VAL A CA 1 ATOM 1073 C C . VAL A 1 148 ? -19.505 32.349 -10.646 1.00 23.74 ? 172 VAL A C 1 ATOM 1074 O O . VAL A 1 148 ? -19.426 32.533 -11.856 1.00 24.15 ? 172 VAL A O 1 ATOM 1075 C CB . VAL A 1 148 ? -21.456 30.937 -10.704 1.00 23.98 ? 172 VAL A CB 1 ATOM 1076 C CG1 . VAL A 1 148 ? -20.818 29.709 -10.169 1.00 26.72 ? 172 VAL A CG1 1 ATOM 1077 C CG2 . VAL A 1 148 ? -22.930 30.924 -10.508 1.00 26.98 ? 172 VAL A CG2 1 ATOM 1078 N N . ILE A 1 149 ? -18.424 32.330 -9.854 1.00 23.75 ? 173 ILE A N 1 ATOM 1079 C CA . ILE A 1 149 ? -17.078 32.604 -10.397 1.00 24.71 ? 173 ILE A CA 1 ATOM 1080 C C . ILE A 1 149 ? -16.234 31.362 -10.648 1.00 25.72 ? 173 ILE A C 1 ATOM 1081 O O . ILE A 1 149 ? -16.195 30.465 -9.815 1.00 26.17 ? 173 ILE A O 1 ATOM 1082 C CB . ILE A 1 149 ? -16.250 33.539 -9.499 1.00 25.75 ? 173 ILE A CB 1 ATOM 1083 C CG1 . ILE A 1 149 ? -16.968 34.864 -9.283 1.00 28.61 ? 173 ILE A CG1 1 ATOM 1084 C CG2 . ILE A 1 149 ? -14.950 33.843 -10.162 1.00 25.35 ? 173 ILE A CG2 1 ATOM 1085 C CD1 . ILE A 1 149 ? -17.911 34.864 -8.103 1.00 34.22 ? 173 ILE A CD1 1 ATOM 1086 N N . PHE A 1 150 ? -15.584 31.301 -11.810 1.00 26.51 ? 174 PHE A N 1 ATOM 1087 C CA . PHE A 1 150 ? -14.728 30.170 -12.163 1.00 28.56 ? 174 PHE A CA 1 ATOM 1088 C C . PHE A 1 150 ? -13.554 30.637 -12.991 1.00 29.45 ? 174 PHE A C 1 ATOM 1089 O O . PHE A 1 150 ? -13.633 31.647 -13.652 1.00 28.73 ? 174 PHE A O 1 ATOM 1090 C CB . PHE A 1 150 ? -15.508 29.068 -12.899 1.00 27.70 ? 174 PHE A CB 1 ATOM 1091 C CG . PHE A 1 150 ? -16.192 29.518 -14.149 1.00 28.05 ? 174 PHE A CG 1 ATOM 1092 C CD1 . PHE A 1 150 ? -15.491 29.633 -15.338 1.00 28.85 ? 174 PHE A CD1 1 ATOM 1093 C CD2 . PHE A 1 150 ? -17.555 29.827 -14.139 1.00 28.63 ? 174 PHE A CD2 1 ATOM 1094 C CE1 . PHE A 1 150 ? -16.142 30.057 -16.521 1.00 31.60 ? 174 PHE A CE1 1 ATOM 1095 C CE2 . PHE A 1 150 ? -18.220 30.252 -15.305 1.00 28.45 ? 174 PHE A CE2 1 ATOM 1096 C CZ . PHE A 1 150 ? -17.515 30.370 -16.504 1.00 29.00 ? 174 PHE A CZ 1 ATOM 1097 N N . TRP A 1 151 ? -12.447 29.907 -12.941 1.00 32.28 ? 175 TRP A N 1 ATOM 1098 C CA . TRP A 1 151 ? -11.261 30.309 -13.685 1.00 34.27 ? 175 TRP A CA 1 ATOM 1099 C C . TRP A 1 151 ? -10.878 29.425 -14.828 1.00 36.94 ? 175 TRP A C 1 ATOM 1100 O O . TRP A 1 151 ? -10.644 28.235 -14.652 1.00 39.45 ? 175 TRP A O 1 ATOM 1101 C CB . TRP A 1 151 ? -10.061 30.403 -12.766 1.00 32.81 ? 175 TRP A CB 1 ATOM 1102 C CG . TRP A 1 151 ? -10.192 31.415 -11.693 1.00 31.83 ? 175 TRP A CG 1 ATOM 1103 C CD1 . TRP A 1 151 ? -10.886 31.294 -10.530 1.00 30.75 ? 175 TRP A CD1 1 ATOM 1104 C CD2 . TRP A 1 151 ? -9.543 32.683 -11.645 1.00 30.48 ? 175 TRP A CD2 1 ATOM 1105 N NE1 . TRP A 1 151 ? -10.697 32.407 -9.751 1.00 31.51 ? 175 TRP A NE1 1 ATOM 1106 C CE2 . TRP A 1 151 ? -9.873 33.275 -10.416 1.00 30.93 ? 175 TRP A CE2 1 ATOM 1107 C CE3 . TRP A 1 151 ? -8.707 33.374 -12.522 1.00 30.24 ? 175 TRP A CE3 1 ATOM 1108 C CZ2 . TRP A 1 151 ? -9.396 34.522 -10.040 1.00 32.35 ? 175 TRP A CZ2 1 ATOM 1109 C CZ3 . TRP A 1 151 ? -8.234 34.605 -12.153 1.00 31.00 ? 175 TRP A CZ3 1 ATOM 1110 C CH2 . TRP A 1 151 ? -8.575 35.171 -10.922 1.00 32.66 ? 175 TRP A CH2 1 ATOM 1111 N N . MET A 1 152 ? -10.779 30.031 -15.998 1.00 38.61 ? 176 MET A N 1 ATOM 1112 C CA . MET A 1 152 ? -10.412 29.319 -17.211 1.00 41.50 ? 176 MET A CA 1 ATOM 1113 C C . MET A 1 152 ? -9.365 30.119 -17.955 1.00 43.02 ? 176 MET A C 1 ATOM 1114 O O . MET A 1 152 ? -9.125 31.264 -17.622 1.00 44.19 ? 176 MET A O 1 ATOM 1115 C CB . MET A 1 152 ? -11.614 29.146 -18.116 1.00 44.22 ? 176 MET A CB 1 ATOM 1116 C CG . MET A 1 152 ? -12.597 28.113 -17.657 1.00 47.91 ? 176 MET A CG 1 ATOM 1117 S SD . MET A 1 152 ? -13.733 27.803 -19.011 1.00 53.93 ? 176 MET A SD 1 ATOM 1118 C CE . MET A 1 152 ? -14.333 29.519 -19.350 1.00 49.75 ? 176 MET A CE 1 ATOM 1119 N N . SER A 1 153 ? -8.748 29.536 -18.973 1.00 45.67 ? 177 SER A N 1 ATOM 1120 C CA . SER A 1 153 ? -7.754 30.258 -19.771 1.00 48.23 ? 177 SER A CA 1 ATOM 1121 C C . SER A 1 153 ? -8.507 31.091 -20.816 1.00 49.18 ? 177 SER A C 1 ATOM 1122 O O . SER A 1 153 ? -9.699 30.849 -21.103 1.00 47.97 ? 177 SER A O 1 ATOM 1123 C CB . SER A 1 153 ? -6.828 29.278 -20.498 1.00 49.63 ? 177 SER A CB 1 ATOM 1124 O OG . SER A 1 153 ? -7.445 28.780 -21.677 1.00 51.86 ? 177 SER A OG 1 ATOM 1125 N N . SER A 1 154 ? -7.807 32.056 -21.403 1.00 51.26 ? 178 SER A N 1 ATOM 1126 C CA . SER A 1 154 ? -8.425 32.907 -22.410 1.00 53.25 ? 178 SER A CA 1 ATOM 1127 C C . SER A 1 154 ? -8.761 32.108 -23.638 1.00 55.41 ? 178 SER A C 1 ATOM 1128 O O . SER A 1 154 ? -9.586 32.524 -24.448 1.00 56.03 ? 178 SER A O 1 ATOM 1129 C CB . SER A 1 154 ? -7.495 34.064 -22.755 1.00 50.59 ? 178 SER A CB 1 ATOM 1130 O OG . SER A 1 154 ? -6.174 33.716 -22.420 1.00 45.48 ? 178 SER A OG 1 ATOM 1131 N N . SER A 1 155 ? -8.122 30.955 -23.778 1.00 57.99 ? 179 SER A N 1 ATOM 1132 C CA . SER A 1 155 ? -8.392 30.116 -24.921 1.00 60.62 ? 179 SER A CA 1 ATOM 1133 C C . SER A 1 155 ? -9.480 29.100 -24.549 1.00 60.47 ? 179 SER A C 1 ATOM 1134 O O . SER A 1 155 ? -9.672 28.098 -25.233 1.00 59.65 ? 179 SER A O 1 ATOM 1135 C CB . SER A 1 155 ? -7.112 29.409 -25.371 1.00 63.33 ? 179 SER A CB 1 ATOM 1136 O OG . SER A 1 155 ? -6.138 30.356 -25.794 1.00 66.80 ? 179 SER A OG 1 ATOM 1137 N N . MET A 1 156 ? -10.189 29.397 -23.456 1.00 61.34 ? 180 MET A N 1 ATOM 1138 C CA . MET A 1 156 ? -11.312 28.610 -22.936 1.00 61.87 ? 180 MET A CA 1 ATOM 1139 C C . MET A 1 156 ? -11.042 27.230 -22.392 1.00 63.12 ? 180 MET A C 1 ATOM 1140 O O . MET A 1 156 ? -11.957 26.403 -22.359 1.00 62.47 ? 180 MET A O 1 ATOM 1141 C CB . MET A 1 156 ? -12.412 28.513 -23.994 1.00 61.85 ? 180 MET A CB 1 ATOM 1142 C CG . MET A 1 156 ? -13.065 29.849 -24.363 1.00 62.26 ? 180 MET A CG 1 ATOM 1143 S SD . MET A 1 156 ? -14.145 30.561 -23.090 1.00 62.82 ? 180 MET A SD 1 ATOM 1144 C CE . MET A 1 156 ? -12.979 31.499 -22.152 1.00 62.71 ? 180 MET A CE 1 ATOM 1145 N N . GLU A 1 157 ? -9.799 26.978 -21.976 1.00 65.13 ? 181 GLU A N 1 ATOM 1146 C CA . GLU A 1 157 ? -9.416 25.681 -21.401 1.00 67.26 ? 181 GLU A CA 1 ATOM 1147 C C . GLU A 1 157 ? -9.581 25.812 -19.887 1.00 66.25 ? 181 GLU A C 1 ATOM 1148 O O . GLU A 1 157 ? -9.103 26.771 -19.293 1.00 65.35 ? 181 GLU A O 1 ATOM 1149 C CB . GLU A 1 157 ? -7.957 25.339 -21.718 1.00 71.88 ? 181 GLU A CB 1 ATOM 1150 C CG . GLU A 1 157 ? -7.745 24.487 -22.974 1.00 78.79 ? 181 GLU A CG 1 ATOM 1151 C CD . GLU A 1 157 ? -7.792 25.289 -24.273 1.00 82.23 ? 181 GLU A CD 1 ATOM 1152 O OE1 . GLU A 1 157 ? -6.937 26.190 -24.452 1.00 83.37 ? 181 GLU A OE1 1 ATOM 1153 O OE2 . GLU A 1 157 ? -8.681 25.010 -25.115 1.00 82.83 ? 181 GLU A OE2 1 ATOM 1154 N N . PRO A 1 158 ? -10.243 24.845 -19.237 1.00 65.57 ? 182 PRO A N 1 ATOM 1155 C CA . PRO A 1 158 ? -10.465 24.879 -17.785 1.00 64.68 ? 182 PRO A CA 1 ATOM 1156 C C . PRO A 1 158 ? -9.200 24.654 -16.993 1.00 63.60 ? 182 PRO A C 1 ATOM 1157 O O . PRO A 1 158 ? -8.349 23.862 -17.402 1.00 64.04 ? 182 PRO A O 1 ATOM 1158 C CB . PRO A 1 158 ? -11.474 23.765 -17.572 1.00 65.46 ? 182 PRO A CB 1 ATOM 1159 C CG . PRO A 1 158 ? -11.021 22.752 -18.568 1.00 66.36 ? 182 PRO A CG 1 ATOM 1160 C CD . PRO A 1 158 ? -10.775 23.597 -19.809 1.00 66.47 ? 182 PRO A CD 1 ATOM 1161 N N . ILE A 1 159 ? -9.077 25.342 -15.862 1.00 61.36 ? 183 ILE A N 1 ATOM 1162 C CA . ILE A 1 159 ? -7.890 25.196 -15.024 1.00 58.22 ? 183 ILE A CA 1 ATOM 1163 C C . ILE A 1 159 ? -8.169 24.169 -13.935 1.00 57.69 ? 183 ILE A C 1 ATOM 1164 O O . ILE A 1 159 ? -9.185 24.271 -13.244 1.00 56.91 ? 183 ILE A O 1 ATOM 1165 C CB . ILE A 1 159 ? -7.516 26.519 -14.311 1.00 56.96 ? 183 ILE A CB 1 ATOM 1166 C CG1 . ILE A 1 159 ? -7.447 27.678 -15.302 1.00 56.74 ? 183 ILE A CG1 1 ATOM 1167 C CG2 . ILE A 1 159 ? -6.172 26.368 -13.634 1.00 56.25 ? 183 ILE A CG2 1 ATOM 1168 C CD1 . ILE A 1 159 ? -6.347 27.546 -16.320 1.00 59.26 ? 183 ILE A CD1 1 ATOM 1169 N N . THR A 1 160 ? -7.276 23.186 -13.782 1.00 57.13 ? 184 THR A N 1 ATOM 1170 C CA . THR A 1 160 ? -7.460 22.141 -12.765 1.00 56.22 ? 184 THR A CA 1 ATOM 1171 C C . THR A 1 160 ? -7.056 22.662 -11.399 1.00 54.61 ? 184 THR A C 1 ATOM 1172 O O . THR A 1 160 ? -6.059 23.341 -11.267 1.00 53.62 ? 184 THR A O 1 ATOM 1173 C CB . THR A 1 160 ? -6.644 20.847 -13.054 1.00 57.45 ? 184 THR A CB 1 ATOM 1174 O OG1 . THR A 1 160 ? -5.251 21.162 -13.143 1.00 59.81 ? 184 THR A OG1 1 ATOM 1175 C CG2 . THR A 1 160 ? -7.117 20.182 -14.346 1.00 58.21 ? 184 THR A CG2 1 ATOM 1176 N N . GLN A 1 161 ? -7.865 22.340 -10.396 1.00 53.30 ? 185 GLN A N 1 ATOM 1177 C CA . GLN A 1 161 ? -7.627 22.744 -9.026 1.00 52.08 ? 185 GLN A CA 1 ATOM 1178 C C . GLN A 1 161 ? -7.297 21.548 -8.119 1.00 51.09 ? 185 GLN A C 1 ATOM 1179 O O . GLN A 1 161 ? -7.748 20.425 -8.340 1.00 51.34 ? 185 GLN A O 1 ATOM 1180 C CB . GLN A 1 161 ? -8.840 23.505 -8.506 1.00 53.91 ? 185 GLN A CB 1 ATOM 1181 C CG . GLN A 1 161 ? -8.931 24.939 -9.021 1.00 55.61 ? 185 GLN A CG 1 ATOM 1182 C CD . GLN A 1 161 ? -10.229 25.623 -8.629 1.00 56.07 ? 185 GLN A CD 1 ATOM 1183 O OE1 . GLN A 1 161 ? -11.275 25.372 -9.230 1.00 56.57 ? 185 GLN A OE1 1 ATOM 1184 N NE2 . GLN A 1 161 ? -10.170 26.479 -7.610 1.00 55.17 ? 185 GLN A NE2 1 ATOM 1185 N N . ASP A 1 162 ? -6.506 21.815 -7.090 1.00 49.84 ? 186 ASP A N 1 ATOM 1186 C CA . ASP A 1 162 ? -6.039 20.800 -6.164 1.00 49.74 ? 186 ASP A CA 1 ATOM 1187 C C . ASP A 1 162 ? -5.737 21.404 -4.791 1.00 48.87 ? 186 ASP A C 1 ATOM 1188 O O . ASP A 1 162 ? -6.070 22.558 -4.496 1.00 47.20 ? 186 ASP A O 1 ATOM 1189 C CB . ASP A 1 162 ? -4.771 20.173 -6.720 1.00 52.96 ? 186 ASP A CB 1 ATOM 1190 C CG . ASP A 1 162 ? -3.660 21.198 -6.934 1.00 55.92 ? 186 ASP A CG 1 ATOM 1191 O OD1 . ASP A 1 162 ? -2.614 20.841 -7.523 1.00 58.43 ? 186 ASP A OD1 1 ATOM 1192 O OD2 . ASP A 1 162 ? -3.829 22.360 -6.505 1.00 57.24 ? 186 ASP A OD2 1 ATOM 1193 N N . LYS A 1 163 ? -5.061 20.622 -3.960 1.00 49.49 ? 187 LYS A N 1 ATOM 1194 C CA . LYS A 1 163 ? -4.696 21.084 -2.634 1.00 50.11 ? 187 LYS A CA 1 ATOM 1195 C C . LYS A 1 163 ? -3.776 22.300 -2.710 1.00 48.82 ? 187 LYS A C 1 ATOM 1196 O O . LYS A 1 163 ? -3.779 23.124 -1.813 1.00 50.16 ? 187 LYS A O 1 ATOM 1197 C CB . LYS A 1 163 ? -4.000 19.975 -1.847 1.00 53.73 ? 187 LYS A CB 1 ATOM 1198 C CG . LYS A 1 163 ? -4.801 18.690 -1.715 1.00 59.27 ? 187 LYS A CG 1 ATOM 1199 C CD . LYS A 1 163 ? -4.202 17.775 -0.652 1.00 62.58 ? 187 LYS A CD 1 ATOM 1200 C CE . LYS A 1 163 ? -4.189 18.472 0.708 1.00 64.59 ? 187 LYS A CE 1 ATOM 1201 N NZ . LYS A 1 163 ? -3.699 17.593 1.803 1.00 67.87 ? 187 LYS A NZ 1 ATOM 1202 N N . ARG A 1 164 ? -2.979 22.409 -3.768 1.00 46.26 ? 188 ARG A N 1 ATOM 1203 C CA . ARG A 1 164 ? -2.037 23.518 -3.899 1.00 43.73 ? 188 ARG A CA 1 ATOM 1204 C C . ARG A 1 164 ? -2.663 24.753 -4.509 1.00 42.83 ? 188 ARG A C 1 ATOM 1205 O O . ARG A 1 164 ? -2.344 25.887 -4.118 1.00 43.15 ? 188 ARG A O 1 ATOM 1206 C CB . ARG A 1 164 ? -0.850 23.099 -4.758 1.00 43.75 ? 188 ARG A CB 1 ATOM 1207 C CG . ARG A 1 164 ? 0.202 24.181 -4.945 1.00 43.10 ? 188 ARG A CG 1 ATOM 1208 C CD . ARG A 1 164 ? 1.286 23.697 -5.882 1.00 42.45 ? 188 ARG A CD 1 ATOM 1209 N NE . ARG A 1 164 ? 0.760 23.448 -7.218 1.00 41.51 ? 188 ARG A NE 1 ATOM 1210 C CZ . ARG A 1 164 ? 0.726 24.365 -8.181 1.00 42.53 ? 188 ARG A CZ 1 ATOM 1211 N NH1 . ARG A 1 164 ? 1.195 25.592 -7.954 1.00 40.66 ? 188 ARG A NH1 1 ATOM 1212 N NH2 . ARG A 1 164 ? 0.224 24.057 -9.375 1.00 42.66 ? 188 ARG A NH2 1 ATOM 1213 N N . VAL A 1 165 ? -3.557 24.537 -5.467 1.00 41.61 ? 189 VAL A N 1 ATOM 1214 C CA . VAL A 1 165 ? -4.229 25.649 -6.127 1.00 39.11 ? 189 VAL A CA 1 ATOM 1215 C C . VAL A 1 165 ? -5.742 25.547 -6.227 1.00 38.19 ? 189 VAL A C 1 ATOM 1216 O O . VAL A 1 165 ? -6.273 24.610 -6.811 1.00 37.05 ? 189 VAL A O 1 ATOM 1217 C CB . VAL A 1 165 ? -3.647 25.868 -7.519 1.00 36.59 ? 189 VAL A CB 1 ATOM 1218 C CG1 . VAL A 1 165 ? -4.450 26.890 -8.263 1.00 36.13 ? 189 VAL A CG1 1 ATOM 1219 C CG2 . VAL A 1 165 ? -2.231 26.337 -7.388 1.00 35.01 ? 189 VAL A CG2 1 ATOM 1220 N N . SER A 1 166 ? -6.433 26.521 -5.648 1.00 38.47 ? 190 SER A N 1 ATOM 1221 C CA . SER A 1 166 ? -7.889 26.537 -5.682 1.00 39.04 ? 190 SER A CA 1 ATOM 1222 C C . SER A 1 166 ? -8.410 27.948 -5.420 1.00 39.17 ? 190 SER A C 1 ATOM 1223 O O . SER A 1 166 ? -7.663 28.828 -5.001 1.00 38.34 ? 190 SER A O 1 ATOM 1224 C CB . SER A 1 166 ? -8.466 25.566 -4.644 1.00 38.23 ? 190 SER A CB 1 ATOM 1225 O OG . SER A 1 166 ? -7.972 25.834 -3.343 1.00 36.71 ? 190 SER A OG 1 ATOM 1226 N N . GLN A 1 167 ? -9.691 28.183 -5.692 1.00 39.29 ? 191 GLN A N 1 ATOM 1227 C CA . GLN A 1 167 ? -10.254 29.516 -5.474 1.00 39.42 ? 191 GLN A CA 1 ATOM 1228 C C . GLN A 1 167 ? -11.069 29.603 -4.214 1.00 40.95 ? 191 GLN A C 1 ATOM 1229 O O . GLN A 1 167 ? -11.568 28.601 -3.722 1.00 43.05 ? 191 GLN A O 1 ATOM 1230 C CB . GLN A 1 167 ? -11.137 29.928 -6.647 1.00 36.30 ? 191 GLN A CB 1 ATOM 1231 C CG . GLN A 1 167 ? -12.411 29.152 -6.721 1.00 32.97 ? 191 GLN A CG 1 ATOM 1232 C CD . GLN A 1 167 ? -13.226 29.478 -7.959 1.00 32.03 ? 191 GLN A CD 1 ATOM 1233 O OE1 . GLN A 1 167 ? -12.854 29.128 -9.079 1.00 31.20 ? 191 GLN A OE1 1 ATOM 1234 N NE2 . GLN A 1 167 ? -14.345 30.152 -7.760 1.00 30.28 ? 191 GLN A NE2 1 ATOM 1235 N N . GLY A 1 168 ? -11.201 30.823 -3.707 1.00 41.99 ? 192 GLY A N 1 ATOM 1236 C CA . GLY A 1 168 ? -11.951 31.064 -2.492 1.00 43.94 ? 192 GLY A CA 1 ATOM 1237 C C . GLY A 1 168 ? -13.397 31.377 -2.808 1.00 46.83 ? 192 GLY A C 1 ATOM 1238 O O . GLY A 1 168 ? -13.830 31.310 -3.965 1.00 49.01 ? 192 GLY A O 1 ATOM 1239 N N . HIS A 1 169 ? -14.171 31.705 -1.786 1.00 47.19 ? 193 HIS A N 1 ATOM 1240 C CA . HIS A 1 169 ? -15.562 32.004 -2.023 1.00 47.09 ? 193 HIS A CA 1 ATOM 1241 C C . HIS A 1 169 ? -15.591 33.365 -2.670 1.00 44.60 ? 193 HIS A C 1 ATOM 1242 O O . HIS A 1 169 ? -16.400 33.613 -3.538 1.00 42.67 ? 193 HIS A O 1 ATOM 1243 C CB . HIS A 1 169 ? -16.336 32.019 -0.715 1.00 52.55 ? 193 HIS A CB 1 ATOM 1244 C CG . HIS A 1 169 ? -17.797 32.272 -0.891 1.00 59.33 ? 193 HIS A CG 1 ATOM 1245 N ND1 . HIS A 1 169 ? -18.330 33.542 -0.967 1.00 62.74 ? 193 HIS A ND1 1 ATOM 1246 C CD2 . HIS A 1 169 ? -18.838 31.417 -1.034 1.00 61.64 ? 193 HIS A CD2 1 ATOM 1247 C CE1 . HIS A 1 169 ? -19.636 33.458 -1.146 1.00 63.40 ? 193 HIS A CE1 1 ATOM 1248 N NE2 . HIS A 1 169 ? -19.969 32.180 -1.191 1.00 64.08 ? 193 HIS A NE2 1 ATOM 1249 N N . ASN A 1 170 ? -14.674 34.241 -2.268 1.00 43.95 ? 194 ASN A N 1 ATOM 1250 C CA . ASN A 1 170 ? -14.623 35.605 -2.808 1.00 43.48 ? 194 ASN A CA 1 ATOM 1251 C C . ASN A 1 170 ? -14.256 35.616 -4.273 1.00 41.99 ? 194 ASN A C 1 ATOM 1252 O O . ASN A 1 170 ? -14.337 36.672 -4.918 1.00 42.41 ? 194 ASN A O 1 ATOM 1253 C CB . ASN A 1 170 ? -13.614 36.445 -2.019 1.00 44.37 ? 194 ASN A CB 1 ATOM 1254 C CG . ASN A 1 170 ? -12.244 35.813 -1.982 1.00 47.23 ? 194 ASN A CG 1 ATOM 1255 O OD1 . ASN A 1 170 ? -12.098 34.616 -1.709 1.00 49.48 ? 194 ASN A OD1 1 ATOM 1256 N ND2 . ASN A 1 170 ? -11.228 36.611 -2.246 1.00 48.22 ? 194 ASN A ND2 1 ATOM 1257 N N . GLY A 1 171 ? -13.883 34.433 -4.780 1.00 40.08 ? 195 GLY A N 1 ATOM 1258 C CA . GLY A 1 171 ? -13.520 34.271 -6.183 1.00 37.29 ? 195 GLY A CA 1 ATOM 1259 C C . GLY A 1 171 ? -12.046 34.386 -6.507 1.00 35.53 ? 195 GLY A C 1 ATOM 1260 O O . GLY A 1 171 ? -11.621 34.038 -7.595 1.00 33.46 ? 195 GLY A O 1 ATOM 1261 N N . ASP A 1 172 ? -11.263 34.876 -5.560 1.00 36.02 ? 196 ASP A N 1 ATOM 1262 C CA . ASP A 1 172 ? -9.841 35.047 -5.783 1.00 37.41 ? 196 ASP A CA 1 ATOM 1263 C C . ASP A 1 172 ? -9.162 33.702 -5.958 1.00 35.81 ? 196 ASP A C 1 ATOM 1264 O O . ASP A 1 172 ? -9.558 32.742 -5.330 1.00 36.15 ? 196 ASP A O 1 ATOM 1265 C CB . ASP A 1 172 ? -9.231 35.795 -4.595 1.00 40.99 ? 196 ASP A CB 1 ATOM 1266 C CG . ASP A 1 172 ? -9.894 37.149 -4.347 1.00 44.78 ? 196 ASP A CG 1 ATOM 1267 O OD1 . ASP A 1 172 ? -9.351 37.944 -3.541 1.00 46.57 ? 196 ASP A OD1 1 ATOM 1268 O OD2 . ASP A 1 172 ? -10.964 37.416 -4.942 1.00 47.53 ? 196 ASP A OD2 1 ATOM 1269 N N . LEU A 1 173 ? -8.150 33.622 -6.815 1.00 33.39 ? 197 LEU A N 1 ATOM 1270 C CA . LEU A 1 173 ? -7.442 32.351 -7.018 1.00 31.78 ? 197 LEU A CA 1 ATOM 1271 C C . LEU A 1 173 ? -6.173 32.281 -6.191 1.00 33.30 ? 197 LEU A C 1 ATOM 1272 O O . LEU A 1 173 ? -5.333 33.159 -6.293 1.00 35.55 ? 197 LEU A O 1 ATOM 1273 C CB . LEU A 1 173 ? -7.061 32.171 -8.475 1.00 27.71 ? 197 LEU A CB 1 ATOM 1274 C CG . LEU A 1 173 ? -6.569 30.762 -8.786 1.00 24.33 ? 197 LEU A CG 1 ATOM 1275 C CD1 . LEU A 1 173 ? -7.616 29.735 -8.360 1.00 19.89 ? 197 LEU A CD1 1 ATOM 1276 C CD2 . LEU A 1 173 ? -6.276 30.651 -10.271 1.00 22.16 ? 197 LEU A CD2 1 ATOM 1277 N N . TYR A 1 174 ? -6.009 31.234 -5.390 1.00 34.42 ? 198 TYR A N 1 ATOM 1278 C CA . TYR A 1 174 ? -4.830 31.126 -4.530 1.00 33.66 ? 198 TYR A CA 1 ATOM 1279 C C . TYR A 1 174 ? -3.796 30.075 -4.885 1.00 34.69 ? 198 TYR A C 1 ATOM 1280 O O . TYR A 1 174 ? -4.121 28.934 -5.238 1.00 35.04 ? 198 TYR A O 1 ATOM 1281 C CB . TYR A 1 174 ? -5.244 30.888 -3.071 1.00 32.51 ? 198 TYR A CB 1 ATOM 1282 C CG . TYR A 1 174 ? -6.084 31.981 -2.471 1.00 31.41 ? 198 TYR A CG 1 ATOM 1283 C CD1 . TYR A 1 174 ? -7.472 31.929 -2.510 1.00 30.51 ? 198 TYR A CD1 1 ATOM 1284 C CD2 . TYR A 1 174 ? -5.488 33.085 -1.886 1.00 32.65 ? 198 TYR A CD2 1 ATOM 1285 C CE1 . TYR A 1 174 ? -8.244 32.958 -1.981 1.00 30.38 ? 198 TYR A CE1 1 ATOM 1286 C CE2 . TYR A 1 174 ? -6.249 34.120 -1.354 1.00 32.52 ? 198 TYR A CE2 1 ATOM 1287 C CZ . TYR A 1 174 ? -7.624 34.050 -1.409 1.00 31.67 ? 198 TYR A CZ 1 ATOM 1288 O OH . TYR A 1 174 ? -8.360 35.100 -0.919 1.00 34.18 ? 198 TYR A OH 1 ATOM 1289 N N . PHE A 1 175 ? -2.531 30.466 -4.766 1.00 36.16 ? 199 PHE A N 1 ATOM 1290 C CA . PHE A 1 175 ? -1.429 29.546 -5.009 1.00 36.40 ? 199 PHE A CA 1 ATOM 1291 C C . PHE A 1 175 ? -0.680 29.341 -3.700 1.00 38.14 ? 199 PHE A C 1 ATOM 1292 O O . PHE A 1 175 ? -0.235 30.293 -3.082 1.00 37.07 ? 199 PHE A O 1 ATOM 1293 C CB . PHE A 1 175 ? -0.498 30.127 -6.050 1.00 34.79 ? 199 PHE A CB 1 ATOM 1294 C CG . PHE A 1 175 ? -1.056 30.095 -7.437 1.00 35.23 ? 199 PHE A CG 1 ATOM 1295 C CD1 . PHE A 1 175 ? -1.737 31.176 -7.958 1.00 35.38 ? 199 PHE A CD1 1 ATOM 1296 C CD2 . PHE A 1 175 ? -0.887 28.980 -8.233 1.00 35.39 ? 199 PHE A CD2 1 ATOM 1297 C CE1 . PHE A 1 175 ? -2.236 31.143 -9.262 1.00 34.28 ? 199 PHE A CE1 1 ATOM 1298 C CE2 . PHE A 1 175 ? -1.381 28.944 -9.524 1.00 34.26 ? 199 PHE A CE2 1 ATOM 1299 C CZ . PHE A 1 175 ? -2.053 30.025 -10.038 1.00 33.71 ? 199 PHE A CZ 1 ATOM 1300 N N . SER A 1 176 ? -0.587 28.105 -3.240 1.00 40.70 ? 200 SER A N 1 ATOM 1301 C CA . SER A 1 176 ? 0.104 27.874 -1.994 1.00 44.42 ? 200 SER A CA 1 ATOM 1302 C C . SER A 1 176 ? 1.557 28.140 -2.286 1.00 45.53 ? 200 SER A C 1 ATOM 1303 O O . SER A 1 176 ? 2.273 28.786 -1.494 1.00 46.67 ? 200 SER A O 1 ATOM 1304 C CB . SER A 1 176 ? -0.106 26.447 -1.525 1.00 46.34 ? 200 SER A CB 1 ATOM 1305 O OG . SER A 1 176 ? -1.493 26.198 -1.401 1.00 50.62 ? 200 SER A OG 1 ATOM 1306 N N . ASN A 1 177 ? 1.990 27.633 -3.434 1.00 46.13 ? 201 ASN A N 1 ATOM 1307 C CA . ASN A 1 177 ? 3.343 27.823 -3.882 1.00 46.83 ? 201 ASN A CA 1 ATOM 1308 C C . ASN A 1 177 ? 3.324 27.631 -5.400 1.00 48.18 ? 201 ASN A C 1 ATOM 1309 O O . ASN A 1 177 ? 2.757 26.665 -5.938 1.00 47.35 ? 201 ASN A O 1 ATOM 1310 C CB . ASN A 1 177 ? 4.325 26.864 -3.172 1.00 47.02 ? 201 ASN A CB 1 ATOM 1311 C CG . ASN A 1 177 ? 3.928 25.405 -3.275 1.00 47.03 ? 201 ASN A CG 1 ATOM 1312 O OD1 . ASN A 1 177 ? 2.976 24.956 -2.630 1.00 47.50 ? 201 ASN A OD1 1 ATOM 1313 N ND2 . ASN A 1 177 ? 4.669 24.649 -4.085 1.00 47.43 ? 201 ASN A ND2 1 ATOM 1314 N N . VAL A 1 178 ? 3.912 28.604 -6.088 1.00 49.95 ? 202 VAL A N 1 ATOM 1315 C CA . VAL A 1 178 ? 3.991 28.619 -7.552 1.00 52.08 ? 202 VAL A CA 1 ATOM 1316 C C . VAL A 1 178 ? 5.060 27.706 -8.149 1.00 54.84 ? 202 VAL A C 1 ATOM 1317 O O . VAL A 1 178 ? 6.215 27.747 -7.737 1.00 54.54 ? 202 VAL A O 1 ATOM 1318 C CB . VAL A 1 178 ? 4.272 30.032 -8.041 1.00 50.20 ? 202 VAL A CB 1 ATOM 1319 C CG1 . VAL A 1 178 ? 4.029 30.119 -9.528 1.00 49.15 ? 202 VAL A CG1 1 ATOM 1320 C CG2 . VAL A 1 178 ? 3.428 31.016 -7.263 1.00 48.91 ? 202 VAL A CG2 1 ATOM 1321 N N . MET A 1 179 ? 4.665 26.890 -9.121 1.00 59.17 ? 203 MET A N 1 ATOM 1322 C CA . MET A 1 179 ? 5.591 25.966 -9.780 1.00 64.12 ? 203 MET A CA 1 ATOM 1323 C C . MET A 1 179 ? 5.925 26.393 -11.212 1.00 66.06 ? 203 MET A C 1 ATOM 1324 O O . MET A 1 179 ? 5.106 26.987 -11.884 1.00 65.42 ? 203 MET A O 1 ATOM 1325 C CB . MET A 1 179 ? 5.003 24.550 -9.795 1.00 65.79 ? 203 MET A CB 1 ATOM 1326 C CG . MET A 1 179 ? 4.875 23.907 -8.418 1.00 68.30 ? 203 MET A CG 1 ATOM 1327 S SD . MET A 1 179 ? 4.278 22.200 -8.487 1.00 70.75 ? 203 MET A SD 1 ATOM 1328 C CE . MET A 1 179 ? 5.855 21.282 -8.320 1.00 72.05 ? 203 MET A CE 1 ATOM 1329 N N . LEU A 1 180 ? 7.123 26.082 -11.697 1.00 70.00 ? 204 LEU A N 1 ATOM 1330 C CA . LEU A 1 180 ? 7.482 26.507 -13.046 1.00 73.44 ? 204 LEU A CA 1 ATOM 1331 C C . LEU A 1 180 ? 6.569 25.932 -14.119 1.00 73.99 ? 204 LEU A C 1 ATOM 1332 O O . LEU A 1 180 ? 6.715 26.275 -15.301 1.00 73.76 ? 204 LEU A O 1 ATOM 1333 C CB . LEU A 1 180 ? 8.956 26.209 -13.362 1.00 76.29 ? 204 LEU A CB 1 ATOM 1334 C CG . LEU A 1 180 ? 9.505 24.782 -13.335 1.00 80.63 ? 204 LEU A CG 1 ATOM 1335 C CD1 . LEU A 1 180 ? 8.859 23.928 -14.443 1.00 81.85 ? 204 LEU A CD1 1 ATOM 1336 C CD2 . LEU A 1 180 ? 11.028 24.853 -13.520 1.00 82.40 ? 204 LEU A CD2 1 ATOM 1337 N N . GLN A 1 181 ? 5.617 25.085 -13.722 1.00 74.10 ? 205 GLN A N 1 ATOM 1338 C CA . GLN A 1 181 ? 4.714 24.498 -14.703 1.00 74.86 ? 205 GLN A CA 1 ATOM 1339 C C . GLN A 1 181 ? 3.360 25.244 -14.743 1.00 73.77 ? 205 GLN A C 1 ATOM 1340 O O . GLN A 1 181 ? 2.409 24.859 -15.433 1.00 73.75 ? 205 GLN A O 1 ATOM 1341 C CB . GLN A 1 181 ? 4.550 22.992 -14.428 1.00 75.92 ? 205 GLN A CB 1 ATOM 1342 C CG . GLN A 1 181 ? 4.065 22.626 -13.049 1.00 78.29 ? 205 GLN A CG 1 ATOM 1343 C CD . GLN A 1 181 ? 2.565 22.416 -13.017 1.00 80.02 ? 205 GLN A CD 1 ATOM 1344 O OE1 . GLN A 1 181 ? 2.032 21.564 -13.729 1.00 80.95 ? 205 GLN A OE1 1 ATOM 1345 N NE2 . GLN A 1 181 ? 1.874 23.192 -12.192 1.00 80.50 ? 205 GLN A NE2 1 ATOM 1346 N N . ASP A 1 182 ? 3.315 26.359 -14.024 1.00 72.57 ? 206 ASP A N 1 ATOM 1347 C CA . ASP A 1 182 ? 2.135 27.214 -13.975 1.00 71.22 ? 206 ASP A CA 1 ATOM 1348 C C . ASP A 1 182 ? 2.148 28.123 -15.205 1.00 72.06 ? 206 ASP A C 1 ATOM 1349 O O . ASP A 1 182 ? 1.144 28.707 -15.560 1.00 72.81 ? 206 ASP A O 1 ATOM 1350 C CB . ASP A 1 182 ? 2.146 28.061 -12.701 1.00 68.35 ? 206 ASP A CB 1 ATOM 1351 C CG . ASP A 1 182 ? 1.835 27.246 -11.457 1.00 67.07 ? 206 ASP A CG 1 ATOM 1352 O OD1 . ASP A 1 182 ? 2.192 27.682 -10.343 1.00 65.67 ? 206 ASP A OD1 1 ATOM 1353 O OD2 . ASP A 1 182 ? 1.222 26.168 -11.588 1.00 66.98 ? 206 ASP A OD2 1 ATOM 1354 N N . MET A 1 183 ? 3.296 28.254 -15.850 1.00 72.75 ? 207 MET A N 1 ATOM 1355 C CA . MET A 1 183 ? 3.394 29.114 -17.001 1.00 73.02 ? 207 MET A CA 1 ATOM 1356 C C . MET A 1 183 ? 2.793 28.487 -18.223 1.00 72.87 ? 207 MET A C 1 ATOM 1357 O O . MET A 1 183 ? 2.956 29.019 -19.325 1.00 72.60 ? 207 MET A O 1 ATOM 1358 C CB . MET A 1 183 ? 4.852 29.471 -17.272 1.00 74.22 ? 207 MET A CB 1 ATOM 1359 C CG . MET A 1 183 ? 5.375 30.570 -16.377 1.00 76.60 ? 207 MET A CG 1 ATOM 1360 S SD . MET A 1 183 ? 7.092 30.981 -16.705 1.00 79.03 ? 207 MET A SD 1 ATOM 1361 C CE . MET A 1 183 ? 6.933 31.992 -18.193 1.00 78.39 ? 207 MET A CE 1 ATOM 1362 N N . GLN A 1 184 ? 2.082 27.375 -18.053 1.00 72.72 ? 208 GLN A N 1 ATOM 1363 C CA . GLN A 1 184 ? 1.487 26.731 -19.219 1.00 73.34 ? 208 GLN A CA 1 ATOM 1364 C C . GLN A 1 184 ? 0.225 27.407 -19.776 1.00 71.69 ? 208 GLN A C 1 ATOM 1365 O O . GLN A 1 184 ? 0.053 27.506 -21.005 1.00 71.30 ? 208 GLN A O 1 ATOM 1366 C CB . GLN A 1 184 ? 1.214 25.255 -18.919 1.00 75.91 ? 208 GLN A CB 1 ATOM 1367 C CG . GLN A 1 184 ? 2.490 24.439 -18.717 1.00 80.63 ? 208 GLN A CG 1 ATOM 1368 C CD . GLN A 1 184 ? 2.271 22.940 -18.867 1.00 82.85 ? 208 GLN A CD 1 ATOM 1369 O OE1 . GLN A 1 184 ? 1.424 22.351 -18.189 1.00 83.30 ? 208 GLN A OE1 1 ATOM 1370 N NE2 . GLN A 1 184 ? 3.041 22.315 -19.758 1.00 83.20 ? 208 GLN A NE2 1 ATOM 1371 N N . THR A 1 185 ? -0.641 27.885 -18.882 1.00 69.62 ? 209 THR A N 1 ATOM 1372 C CA . THR A 1 185 ? -1.878 28.559 -19.290 1.00 66.78 ? 209 THR A CA 1 ATOM 1373 C C . THR A 1 185 ? -2.046 29.859 -18.529 1.00 64.71 ? 209 THR A C 1 ATOM 1374 O O . THR A 1 185 ? -1.591 29.967 -17.396 1.00 65.05 ? 209 THR A O 1 ATOM 1375 C CB . THR A 1 185 ? -3.117 27.677 -19.018 1.00 67.70 ? 209 THR A CB 1 ATOM 1376 O OG1 . THR A 1 185 ? -3.184 27.361 -17.619 1.00 67.32 ? 209 THR A OG1 1 ATOM 1377 C CG2 . THR A 1 185 ? -3.044 26.384 -19.840 1.00 68.32 ? 209 THR A CG2 1 ATOM 1378 N N . ASP A 1 186 ? -2.695 30.842 -19.147 1.00 61.74 ? 210 ASP A N 1 ATOM 1379 C CA . ASP A 1 186 ? -2.928 32.118 -18.476 1.00 58.76 ? 210 ASP A CA 1 ATOM 1380 C C . ASP A 1 186 ? -4.191 32.052 -17.625 1.00 54.14 ? 210 ASP A C 1 ATOM 1381 O O . ASP A 1 186 ? -4.938 31.079 -17.664 1.00 54.27 ? 210 ASP A O 1 ATOM 1382 C CB . ASP A 1 186 ? -3.033 33.248 -19.502 1.00 61.60 ? 210 ASP A CB 1 ATOM 1383 C CG . ASP A 1 186 ? -4.163 33.038 -20.496 1.00 64.82 ? 210 ASP A CG 1 ATOM 1384 O OD1 . ASP A 1 186 ? -4.136 33.715 -21.548 1.00 66.29 ? 210 ASP A OD1 1 ATOM 1385 O OD2 . ASP A 1 186 ? -5.071 32.212 -20.232 1.00 65.70 ? 210 ASP A OD2 1 ATOM 1386 N N . TYR A 1 187 ? -4.451 33.111 -16.883 1.00 48.79 ? 211 TYR A N 1 ATOM 1387 C CA . TYR A 1 187 ? -5.595 33.090 -16.015 1.00 43.73 ? 211 TYR A CA 1 ATOM 1388 C C . TYR A 1 187 ? -6.619 34.220 -16.124 1.00 41.92 ? 211 TYR A C 1 ATOM 1389 O O . TYR A 1 187 ? -6.337 35.376 -15.844 1.00 43.05 ? 211 TYR A O 1 ATOM 1390 C CB . TYR A 1 187 ? -5.108 32.989 -14.590 1.00 40.11 ? 211 TYR A CB 1 ATOM 1391 C CG . TYR A 1 187 ? -4.159 31.846 -14.380 1.00 38.01 ? 211 TYR A CG 1 ATOM 1392 C CD1 . TYR A 1 187 ? -2.782 32.009 -14.547 1.00 38.64 ? 211 TYR A CD1 1 ATOM 1393 C CD2 . TYR A 1 187 ? -4.625 30.615 -13.951 1.00 38.45 ? 211 TYR A CD2 1 ATOM 1394 C CE1 . TYR A 1 187 ? -1.885 30.961 -14.272 1.00 37.60 ? 211 TYR A CE1 1 ATOM 1395 C CE2 . TYR A 1 187 ? -3.751 29.570 -13.678 1.00 39.09 ? 211 TYR A CE2 1 ATOM 1396 C CZ . TYR A 1 187 ? -2.384 29.744 -13.836 1.00 37.99 ? 211 TYR A CZ 1 ATOM 1397 O OH . TYR A 1 187 ? -1.542 28.693 -13.548 1.00 37.31 ? 211 TYR A OH 1 ATOM 1398 N N . SER A 1 188 ? -7.832 33.860 -16.510 1.00 39.62 ? 212 SER A N 1 ATOM 1399 C CA . SER A 1 188 ? -8.887 34.834 -16.669 1.00 38.83 ? 212 SER A CA 1 ATOM 1400 C C . SER A 1 188 ? -10.114 34.505 -15.798 1.00 37.63 ? 212 SER A C 1 ATOM 1401 O O . SER A 1 188 ? -10.667 33.407 -15.893 1.00 36.45 ? 212 SER A O 1 ATOM 1402 C CB . SER A 1 188 ? -9.264 34.899 -18.160 1.00 39.01 ? 212 SER A CB 1 ATOM 1403 O OG . SER A 1 188 ? -10.625 34.587 -18.390 1.00 40.18 ? 212 SER A OG 1 ATOM 1404 N N . CYS A 1 189 ? -10.520 35.444 -14.937 1.00 37.41 ? 213 CYS A N 1 ATOM 1405 C CA . CYS A 1 189 ? -11.683 35.227 -14.080 1.00 37.61 ? 213 CYS A CA 1 ATOM 1406 C C . CYS A 1 189 ? -12.976 35.383 -14.848 1.00 35.79 ? 213 CYS A C 1 ATOM 1407 O O . CYS A 1 189 ? -13.143 36.359 -15.566 1.00 37.70 ? 213 CYS A O 1 ATOM 1408 C CB . CYS A 1 189 ? -11.673 36.190 -12.901 1.00 41.16 ? 213 CYS A CB 1 ATOM 1409 S SG . CYS A 1 189 ? -12.672 35.524 -11.531 1.00 50.77 ? 213 CYS A SG 1 ATOM 1410 N N . ASN A 1 190 ? -13.885 34.423 -14.697 1.00 33.74 ? 214 ASN A N 1 ATOM 1411 C CA . ASN A 1 190 ? -15.182 34.454 -15.370 1.00 32.07 ? 214 ASN A CA 1 ATOM 1412 C C . ASN A 1 190 ? -16.341 34.621 -14.400 1.00 31.50 ? 214 ASN A C 1 ATOM 1413 O O . ASN A 1 190 ? -16.387 34.002 -13.328 1.00 33.48 ? 214 ASN A O 1 ATOM 1414 C CB . ASN A 1 190 ? -15.375 33.172 -16.169 1.00 32.00 ? 214 ASN A CB 1 ATOM 1415 C CG . ASN A 1 190 ? -14.422 33.070 -17.333 1.00 32.26 ? 214 ASN A CG 1 ATOM 1416 O OD1 . ASN A 1 190 ? -14.824 33.195 -18.490 1.00 32.43 ? 214 ASN A OD1 1 ATOM 1417 N ND2 . ASN A 1 190 ? -13.145 32.849 -17.038 1.00 33.74 ? 214 ASN A ND2 1 ATOM 1418 N N . ALA A 1 191 ? -17.302 35.437 -14.799 1.00 29.52 ? 215 ALA A N 1 ATOM 1419 C CA . ALA A 1 191 ? -18.447 35.716 -13.955 1.00 28.39 ? 215 ALA A CA 1 ATOM 1420 C C . ALA A 1 191 ? -19.758 35.273 -14.597 1.00 27.50 ? 215 ALA A C 1 ATOM 1421 O O . ALA A 1 191 ? -20.326 35.995 -15.363 1.00 29.05 ? 215 ALA A O 1 ATOM 1422 C CB . ALA A 1 191 ? -18.499 37.211 -13.640 1.00 25.62 ? 215 ALA A CB 1 ATOM 1423 N N . ARG A 1 192 ? -20.249 34.090 -14.281 1.00 28.63 ? 216 ARG A N 1 ATOM 1424 C CA . ARG A 1 192 ? -21.491 33.620 -14.883 1.00 30.94 ? 216 ARG A CA 1 ATOM 1425 C C . ARG A 1 192 ? -22.645 34.081 -14.033 1.00 31.27 ? 216 ARG A C 1 ATOM 1426 O O . ARG A 1 192 ? -22.591 34.021 -12.816 1.00 29.92 ? 216 ARG A O 1 ATOM 1427 C CB . ARG A 1 192 ? -21.498 32.090 -14.989 1.00 33.46 ? 216 ARG A CB 1 ATOM 1428 C CG . ARG A 1 192 ? -22.657 31.512 -15.755 1.00 34.53 ? 216 ARG A CG 1 ATOM 1429 C CD . ARG A 1 192 ? -22.515 30.013 -15.863 1.00 38.95 ? 216 ARG A CD 1 ATOM 1430 N NE . ARG A 1 192 ? -23.799 29.365 -16.117 1.00 47.58 ? 216 ARG A NE 1 ATOM 1431 C CZ . ARG A 1 192 ? -24.862 29.461 -15.305 1.00 52.91 ? 216 ARG A CZ 1 ATOM 1432 N NH1 . ARG A 1 192 ? -24.803 30.184 -14.181 1.00 53.84 ? 216 ARG A NH1 1 ATOM 1433 N NH2 . ARG A 1 192 ? -25.998 28.825 -15.600 1.00 54.75 ? 216 ARG A NH2 1 ATOM 1434 N N . PHE A 1 193 ? -23.694 34.547 -14.696 1.00 34.23 ? 217 PHE A N 1 ATOM 1435 C CA . PHE A 1 193 ? -24.893 35.005 -14.022 1.00 38.57 ? 217 PHE A CA 1 ATOM 1436 C C . PHE A 1 193 ? -26.043 34.025 -14.127 1.00 44.81 ? 217 PHE A C 1 ATOM 1437 O O . PHE A 1 193 ? -26.407 33.571 -15.198 1.00 43.43 ? 217 PHE A O 1 ATOM 1438 C CB . PHE A 1 193 ? -25.276 36.390 -14.517 1.00 33.26 ? 217 PHE A CB 1 ATOM 1439 C CG . PHE A 1 193 ? -24.240 37.431 -14.201 1.00 30.36 ? 217 PHE A CG 1 ATOM 1440 C CD1 . PHE A 1 193 ? -23.066 37.506 -14.927 1.00 28.57 ? 217 PHE A CD1 1 ATOM 1441 C CD2 . PHE A 1 193 ? -24.400 38.291 -13.129 1.00 27.91 ? 217 PHE A CD2 1 ATOM 1442 C CE1 . PHE A 1 193 ? -22.070 38.420 -14.583 1.00 25.95 ? 217 PHE A CE1 1 ATOM 1443 C CE2 . PHE A 1 193 ? -23.399 39.201 -12.790 1.00 25.01 ? 217 PHE A CE2 1 ATOM 1444 C CZ . PHE A 1 193 ? -22.242 39.260 -13.517 1.00 23.18 ? 217 PHE A CZ 1 ATOM 1445 N N . HIS A 1 194 ? -26.610 33.706 -12.975 1.00 54.05 ? 218 HIS A N 1 ATOM 1446 C CA . HIS A 1 194 ? -27.707 32.757 -12.867 1.00 61.37 ? 218 HIS A CA 1 ATOM 1447 C C . HIS A 1 194 ? -28.948 32.996 -13.738 1.00 63.67 ? 218 HIS A C 1 ATOM 1448 O O . HIS A 1 194 ? -29.321 32.126 -14.532 1.00 64.19 ? 218 HIS A O 1 ATOM 1449 C CB . HIS A 1 194 ? -28.143 32.662 -11.398 1.00 65.73 ? 218 HIS A CB 1 ATOM 1450 C CG . HIS A 1 194 ? -28.879 31.403 -11.063 1.00 72.34 ? 218 HIS A CG 1 ATOM 1451 N ND1 . HIS A 1 194 ? -28.314 30.149 -11.205 1.00 75.69 ? 218 HIS A ND1 1 ATOM 1452 C CD2 . HIS A 1 194 ? -30.125 31.197 -10.570 1.00 74.13 ? 218 HIS A CD2 1 ATOM 1453 C CE1 . HIS A 1 194 ? -29.178 29.230 -10.814 1.00 76.65 ? 218 HIS A CE1 1 ATOM 1454 N NE2 . HIS A 1 194 ? -30.287 29.840 -10.423 1.00 76.76 ? 218 HIS A NE2 1 ATOM 1455 N N . PHE A 1 195 ? -29.578 34.161 -13.595 1.00 65.00 ? 219 PHE A N 1 ATOM 1456 C CA . PHE A 1 195 ? -30.788 34.446 -14.349 1.00 66.24 ? 219 PHE A CA 1 ATOM 1457 C C . PHE A 1 195 ? -30.582 34.464 -15.817 1.00 65.84 ? 219 PHE A C 1 ATOM 1458 O O . PHE A 1 195 ? -31.055 33.569 -16.522 1.00 67.47 ? 219 PHE A O 1 ATOM 1459 C CB . PHE A 1 195 ? -31.463 35.729 -13.870 1.00 68.40 ? 219 PHE A CB 1 ATOM 1460 C CG . PHE A 1 195 ? -32.634 35.451 -13.000 1.00 71.41 ? 219 PHE A CG 1 ATOM 1461 C CD1 . PHE A 1 195 ? -32.455 35.162 -11.649 1.00 73.41 ? 219 PHE A CD1 1 ATOM 1462 C CD2 . PHE A 1 195 ? -33.892 35.278 -13.560 1.00 73.11 ? 219 PHE A CD2 1 ATOM 1463 C CE1 . PHE A 1 195 ? -33.505 34.687 -10.870 1.00 74.89 ? 219 PHE A CE1 1 ATOM 1464 C CE2 . PHE A 1 195 ? -34.957 34.803 -12.792 1.00 75.14 ? 219 PHE A CE2 1 ATOM 1465 C CZ . PHE A 1 195 ? -34.767 34.503 -11.449 1.00 75.72 ? 219 PHE A CZ 1 ATOM 1466 N N . THR A 1 196 ? -29.917 35.507 -16.291 1.00 64.54 ? 220 THR A N 1 ATOM 1467 C CA . THR A 1 196 ? -29.623 35.592 -17.706 1.00 60.75 ? 220 THR A CA 1 ATOM 1468 C C . THR A 1 196 ? -28.302 34.893 -17.952 1.00 60.13 ? 220 THR A C 1 ATOM 1469 O O . THR A 1 196 ? -27.288 35.207 -17.331 1.00 62.72 ? 220 THR A O 1 ATOM 1470 C CB . THR A 1 196 ? -29.498 37.033 -18.209 1.00 57.79 ? 220 THR A CB 1 ATOM 1471 O OG1 . THR A 1 196 ? -28.826 37.011 -19.471 1.00 56.03 ? 220 THR A OG1 1 ATOM 1472 C CG2 . THR A 1 196 ? -28.715 37.896 -17.234 1.00 55.01 ? 220 THR A CG2 1 ATOM 1473 N N . HIS A 1 197 ? -28.305 33.944 -18.865 1.00 56.91 ? 221 HIS A N 1 ATOM 1474 C CA . HIS A 1 197 ? -27.088 33.227 -19.145 1.00 55.28 ? 221 HIS A CA 1 ATOM 1475 C C . HIS A 1 197 ? -26.082 34.188 -19.778 1.00 51.09 ? 221 HIS A C 1 ATOM 1476 O O . HIS A 1 197 ? -26.086 34.404 -20.983 1.00 53.75 ? 221 HIS A O 1 ATOM 1477 C CB . HIS A 1 197 ? -27.394 32.045 -20.058 1.00 60.12 ? 221 HIS A CB 1 ATOM 1478 C CG . HIS A 1 197 ? -28.286 31.014 -19.433 1.00 63.34 ? 221 HIS A CG 1 ATOM 1479 N ND1 . HIS A 1 197 ? -27.837 30.109 -18.494 1.00 64.82 ? 221 HIS A ND1 1 ATOM 1480 C CD2 . HIS A 1 197 ? -29.597 30.732 -19.632 1.00 64.25 ? 221 HIS A CD2 1 ATOM 1481 C CE1 . HIS A 1 197 ? -28.831 29.309 -18.147 1.00 65.49 ? 221 HIS A CE1 1 ATOM 1482 N NE2 . HIS A 1 197 ? -29.910 29.665 -18.824 1.00 65.48 ? 221 HIS A NE2 1 ATOM 1483 N N . THR A 1 198 ? -25.208 34.763 -18.969 1.00 43.72 ? 222 THR A N 1 ATOM 1484 C CA . THR A 1 198 ? -24.218 35.710 -19.477 1.00 37.51 ? 222 THR A CA 1 ATOM 1485 C C . THR A 1 198 ? -22.942 35.454 -18.737 1.00 34.85 ? 222 THR A C 1 ATOM 1486 O O . THR A 1 198 ? -22.997 35.324 -17.541 1.00 37.38 ? 222 THR A O 1 ATOM 1487 C CB . THR A 1 198 ? -24.653 37.158 -19.182 1.00 36.62 ? 222 THR A CB 1 ATOM 1488 O OG1 . THR A 1 198 ? -25.503 37.636 -20.223 1.00 34.81 ? 222 THR A OG1 1 ATOM 1489 C CG2 . THR A 1 198 ? -23.456 38.069 -19.032 1.00 36.65 ? 222 THR A CG2 1 ATOM 1490 N N . ILE A 1 199 ? -21.803 35.356 -19.402 1.00 31.34 ? 223 ILE A N 1 ATOM 1491 C CA . ILE A 1 199 ? -20.552 35.188 -18.655 1.00 29.54 ? 223 ILE A CA 1 ATOM 1492 C C . ILE A 1 199 ? -19.741 36.449 -18.923 1.00 29.25 ? 223 ILE A C 1 ATOM 1493 O O . ILE A 1 199 ? -19.672 36.887 -20.061 1.00 32.04 ? 223 ILE A O 1 ATOM 1494 C CB . ILE A 1 199 ? -19.681 34.065 -19.174 1.00 26.39 ? 223 ILE A CB 1 ATOM 1495 C CG1 . ILE A 1 199 ? -20.318 32.714 -18.915 1.00 27.00 ? 223 ILE A CG1 1 ATOM 1496 C CG2 . ILE A 1 199 ? -18.321 34.168 -18.538 1.00 25.21 ? 223 ILE A CG2 1 ATOM 1497 C CD1 . ILE A 1 199 ? -19.518 31.570 -19.536 1.00 27.81 ? 223 ILE A CD1 1 ATOM 1498 N N . GLN A 1 200 ? -19.113 37.028 -17.916 1.00 27.41 ? 224 GLN A N 1 ATOM 1499 C CA . GLN A 1 200 ? -18.333 38.228 -18.134 1.00 27.41 ? 224 GLN A CA 1 ATOM 1500 C C . GLN A 1 200 ? -16.912 37.868 -17.810 1.00 27.83 ? 224 GLN A C 1 ATOM 1501 O O . GLN A 1 200 ? -16.670 37.231 -16.791 1.00 29.61 ? 224 GLN A O 1 ATOM 1502 C CB . GLN A 1 200 ? -18.759 39.307 -17.165 1.00 27.82 ? 224 GLN A CB 1 ATOM 1503 C CG . GLN A 1 200 ? -20.170 39.766 -17.305 1.00 29.29 ? 224 GLN A CG 1 ATOM 1504 C CD . GLN A 1 200 ? -20.322 40.618 -18.513 1.00 30.40 ? 224 GLN A CD 1 ATOM 1505 O OE1 . GLN A 1 200 ? -19.344 41.239 -18.961 1.00 31.62 ? 224 GLN A OE1 1 ATOM 1506 N NE2 . GLN A 1 200 ? -21.540 40.674 -19.062 1.00 29.92 ? 224 GLN A NE2 1 ATOM 1507 N N . GLN A 1 201 ? -15.953 38.282 -18.628 1.00 27.96 ? 225 GLN A N 1 ATOM 1508 C CA . GLN A 1 201 ? -14.554 37.955 -18.335 1.00 29.73 ? 225 GLN A CA 1 ATOM 1509 C C . GLN A 1 201 ? -13.639 39.163 -18.182 1.00 31.24 ? 225 GLN A C 1 ATOM 1510 O O . GLN A 1 201 ? -13.893 40.254 -18.739 1.00 30.57 ? 225 GLN A O 1 ATOM 1511 C CB . GLN A 1 201 ? -13.971 37.082 -19.418 1.00 30.38 ? 225 GLN A CB 1 ATOM 1512 C CG . GLN A 1 201 ? -14.967 36.291 -20.174 1.00 33.25 ? 225 GLN A CG 1 ATOM 1513 C CD . GLN A 1 201 ? -14.285 35.487 -21.234 1.00 36.53 ? 225 GLN A CD 1 ATOM 1514 O OE1 . GLN A 1 201 ? -13.343 34.740 -20.939 1.00 36.01 ? 225 GLN A OE1 1 ATOM 1515 N NE2 . GLN A 1 201 ? -14.735 35.637 -22.485 1.00 38.57 ? 225 GLN A NE2 1 ATOM 1516 N N . LYS A 1 202 ? -12.565 38.974 -17.424 1.00 32.26 ? 226 LYS A N 1 ATOM 1517 C CA . LYS A 1 202 ? -11.624 40.064 -17.244 1.00 34.18 ? 226 LYS A CA 1 ATOM 1518 C C . LYS A 1 202 ? -10.332 39.690 -17.955 1.00 36.70 ? 226 LYS A C 1 ATOM 1519 O O . LYS A 1 202 ? -10.111 38.538 -18.298 1.00 37.65 ? 226 LYS A O 1 ATOM 1520 C CB . LYS A 1 202 ? -11.322 40.283 -15.768 1.00 33.00 ? 226 LYS A CB 1 ATOM 1521 C CG . LYS A 1 202 ? -10.143 39.479 -15.254 1.00 29.85 ? 226 LYS A CG 1 ATOM 1522 C CD . LYS A 1 202 ? -9.957 39.633 -13.749 1.00 26.36 ? 226 LYS A CD 1 ATOM 1523 C CE . LYS A 1 202 ? -9.704 41.050 -13.342 1.00 21.94 ? 226 LYS A CE 1 ATOM 1524 N NZ . LYS A 1 202 ? -9.542 41.106 -11.886 1.00 20.83 ? 226 LYS A NZ 1 ATOM 1525 N N . ASN A 1 203 ? -9.449 40.649 -18.148 1.00 39.85 ? 227 ASN A N 1 ATOM 1526 C CA . ASN A 1 203 ? -8.202 40.338 -18.821 1.00 42.65 ? 227 ASN A CA 1 ATOM 1527 C C . ASN A 1 203 ? -7.385 39.238 -18.109 1.00 42.52 ? 227 ASN A C 1 ATOM 1528 O O . ASN A 1 203 ? -7.386 39.124 -16.896 1.00 41.72 ? 227 ASN A O 1 ATOM 1529 C CB . ASN A 1 203 ? -7.383 41.619 -18.986 1.00 45.26 ? 227 ASN A CB 1 ATOM 1530 C CG . ASN A 1 203 ? -8.157 42.699 -19.726 1.00 49.21 ? 227 ASN A CG 1 ATOM 1531 O OD1 . ASN A 1 203 ? -8.739 42.446 -20.793 1.00 50.77 ? 227 ASN A OD1 1 ATOM 1532 N ND2 . ASN A 1 203 ? -8.172 43.909 -19.166 1.00 51.22 ? 227 ASN A ND2 1 ATOM 1533 N N . PRO A 1 204 ? -6.710 38.383 -18.889 1.00 42.55 ? 228 PRO A N 1 ATOM 1534 C CA . PRO A 1 204 ? -5.898 37.281 -18.386 1.00 41.44 ? 228 PRO A CA 1 ATOM 1535 C C . PRO A 1 204 ? -4.676 37.723 -17.661 1.00 41.56 ? 228 PRO A C 1 ATOM 1536 O O . PRO A 1 204 ? -4.142 38.780 -17.936 1.00 41.09 ? 228 PRO A O 1 ATOM 1537 C CB . PRO A 1 204 ? -5.547 36.514 -19.649 1.00 41.97 ? 228 PRO A CB 1 ATOM 1538 C CG . PRO A 1 204 ? -6.681 36.838 -20.580 1.00 42.26 ? 228 PRO A CG 1 ATOM 1539 C CD . PRO A 1 204 ? -6.825 38.303 -20.355 1.00 42.30 ? 228 PRO A CD 1 ATOM 1540 N N . PHE A 1 205 ? -4.240 36.910 -16.714 1.00 42.39 ? 229 PHE A N 1 ATOM 1541 C CA . PHE A 1 205 ? -3.027 37.197 -15.947 1.00 43.75 ? 229 PHE A CA 1 ATOM 1542 C C . PHE A 1 205 ? -1.961 36.304 -16.588 1.00 47.17 ? 229 PHE A C 1 ATOM 1543 O O . PHE A 1 205 ? -2.250 35.158 -16.934 1.00 48.18 ? 229 PHE A O 1 ATOM 1544 C CB . PHE A 1 205 ? -3.153 36.797 -14.468 1.00 40.10 ? 229 PHE A CB 1 ATOM 1545 C CG . PHE A 1 205 ? -3.961 37.749 -13.631 1.00 37.07 ? 229 PHE A CG 1 ATOM 1546 C CD1 . PHE A 1 205 ? -5.339 37.610 -13.528 1.00 37.38 ? 229 PHE A CD1 1 ATOM 1547 C CD2 . PHE A 1 205 ? -3.340 38.782 -12.932 1.00 34.81 ? 229 PHE A CD2 1 ATOM 1548 C CE1 . PHE A 1 205 ? -6.083 38.484 -12.741 1.00 35.42 ? 229 PHE A CE1 1 ATOM 1549 C CE2 . PHE A 1 205 ? -4.068 39.663 -12.142 1.00 31.35 ? 229 PHE A CE2 1 ATOM 1550 C CZ . PHE A 1 205 ? -5.439 39.517 -12.045 1.00 33.69 ? 229 PHE A CZ 1 ATOM 1551 N N . THR A 1 206 ? -0.751 36.822 -16.777 1.00 50.70 ? 230 THR A N 1 ATOM 1552 C CA . THR A 1 206 ? 0.333 36.027 -17.360 1.00 54.52 ? 230 THR A CA 1 ATOM 1553 C C . THR A 1 206 ? 1.348 35.790 -16.261 1.00 56.01 ? 230 THR A C 1 ATOM 1554 O O . THR A 1 206 ? 1.713 36.714 -15.544 1.00 56.20 ? 230 THR A O 1 ATOM 1555 C CB . THR A 1 206 ? 1.050 36.792 -18.474 1.00 56.52 ? 230 THR A CB 1 ATOM 1556 O OG1 . THR A 1 206 ? 0.101 37.166 -19.481 1.00 60.62 ? 230 THR A OG1 1 ATOM 1557 C CG2 . THR A 1 206 ? 2.141 35.939 -19.094 1.00 57.78 ? 230 THR A CG2 1 ATOM 1558 N N . LEU A 1 207 ? 1.810 34.558 -16.118 1.00 59.19 ? 231 LEU A N 1 ATOM 1559 C CA . LEU A 1 207 ? 2.806 34.272 -15.090 1.00 62.93 ? 231 LEU A CA 1 ATOM 1560 C C . LEU A 1 207 ? 4.241 34.118 -15.605 1.00 65.41 ? 231 LEU A C 1 ATOM 1561 O O . LEU A 1 207 ? 4.494 33.612 -16.707 1.00 65.32 ? 231 LEU A O 1 ATOM 1562 C CB . LEU A 1 207 ? 2.423 33.013 -14.315 1.00 63.09 ? 231 LEU A CB 1 ATOM 1563 C CG . LEU A 1 207 ? 1.339 33.181 -13.251 1.00 63.56 ? 231 LEU A CG 1 ATOM 1564 C CD1 . LEU A 1 207 ? 1.013 31.838 -12.631 1.00 63.72 ? 231 LEU A CD1 1 ATOM 1565 C CD2 . LEU A 1 207 ? 1.821 34.150 -12.192 1.00 64.19 ? 231 LEU A CD2 1 ATOM 1566 N N . LYS A 1 208 ? 5.174 34.577 -14.790 1.00 67.37 ? 232 LYS A N 1 ATOM 1567 C CA . LYS A 1 208 ? 6.576 34.493 -15.108 1.00 70.98 ? 232 LYS A CA 1 ATOM 1568 C C . LYS A 1 208 ? 7.198 33.914 -13.833 1.00 72.59 ? 232 LYS A C 1 ATOM 1569 O O . LYS A 1 208 ? 7.421 34.626 -12.832 1.00 72.46 ? 232 LYS A O 1 ATOM 1570 C CB . LYS A 1 208 ? 7.155 35.886 -15.400 1.00 72.71 ? 232 LYS A CB 1 ATOM 1571 C CG . LYS A 1 208 ? 6.991 36.383 -16.848 1.00 75.78 ? 232 LYS A CG 1 ATOM 1572 C CD . LYS A 1 208 ? 7.821 37.662 -17.112 1.00 77.53 ? 232 LYS A CD 1 ATOM 1573 C CE . LYS A 1 208 ? 7.677 38.200 -18.550 1.00 77.84 ? 232 LYS A CE 1 ATOM 1574 N NZ . LYS A 1 208 ? 8.439 39.472 -18.790 1.00 76.23 ? 232 LYS A NZ 1 ATOM 1575 N N . VAL A 1 209 ? 7.460 32.614 -13.854 1.00 74.50 ? 233 VAL A N 1 ATOM 1576 C CA . VAL A 1 209 ? 8.050 32.000 -12.691 1.00 76.66 ? 233 VAL A CA 1 ATOM 1577 C C . VAL A 1 209 ? 9.570 32.035 -12.775 1.00 79.54 ? 233 VAL A C 1 ATOM 1578 O O . VAL A 1 209 ? 10.170 31.726 -13.809 1.00 79.55 ? 233 VAL A O 1 ATOM 1579 C CB . VAL A 1 209 ? 7.575 30.541 -12.525 1.00 75.47 ? 233 VAL A CB 1 ATOM 1580 C CG1 . VAL A 1 209 ? 7.079 30.322 -11.106 1.00 74.58 ? 233 VAL A CG1 1 ATOM 1581 C CG2 . VAL A 1 209 ? 6.478 30.229 -13.522 1.00 73.63 ? 233 VAL A CG2 1 ATOM 1582 N N . LEU A 1 210 ? 10.177 32.444 -11.667 1.00 82.75 ? 234 LEU A N 1 ATOM 1583 C CA . LEU A 1 210 ? 11.621 32.561 -11.573 1.00 86.45 ? 234 LEU A CA 1 ATOM 1584 C C . LEU A 1 210 ? 12.311 31.407 -10.878 1.00 89.14 ? 234 LEU A C 1 ATOM 1585 O O . LEU A 1 210 ? 11.931 31.038 -9.779 1.00 89.50 ? 234 LEU A O 1 ATOM 1586 C CB . LEU A 1 210 ? 11.988 33.834 -10.820 1.00 86.48 ? 234 LEU A CB 1 ATOM 1587 C CG . LEU A 1 210 ? 11.500 35.167 -11.372 1.00 87.04 ? 234 LEU A CG 1 ATOM 1588 C CD1 . LEU A 1 210 ? 12.156 36.281 -10.569 1.00 86.78 ? 234 LEU A CD1 1 ATOM 1589 C CD2 . LEU A 1 210 ? 11.840 35.289 -12.860 1.00 86.59 ? 234 LEU A CD2 1 ATOM 1590 N N . THR A 1 211 ? 13.347 30.864 -11.506 1.00 92.14 ? 235 THR A N 1 ATOM 1591 C CA . THR A 1 211 ? 14.100 29.769 -10.913 1.00 95.38 ? 235 THR A CA 1 ATOM 1592 C C . THR A 1 211 ? 15.393 30.313 -10.305 1.00 98.77 ? 235 THR A C 1 ATOM 1593 O O . THR A 1 211 ? 16.257 30.804 -11.033 1.00 99.91 ? 235 THR A O 1 ATOM 1594 C CB . THR A 1 211 ? 14.469 28.731 -11.983 1.00 94.51 ? 235 THR A CB 1 ATOM 1595 O OG1 . THR A 1 211 ? 13.309 28.408 -12.757 1.00 93.81 ? 235 THR A OG1 1 ATOM 1596 C CG2 . THR A 1 211 ? 15.002 27.470 -11.336 1.00 94.25 ? 235 THR A CG2 1 ATOM 1597 N N . THR A 1 212 ? 15.523 30.232 -8.981 1.00 101.78 ? 236 THR A N 1 ATOM 1598 C CA . THR A 1 212 ? 16.723 30.709 -8.292 1.00 105.21 ? 236 THR A CA 1 ATOM 1599 C C . THR A 1 212 ? 17.705 29.569 -8.082 1.00 106.40 ? 236 THR A C 1 ATOM 1600 O O . THR A 1 212 ? 18.829 29.587 -8.589 1.00 107.10 ? 236 THR A O 1 ATOM 1601 C CB . THR A 1 212 ? 16.357 31.281 -6.912 1.00 106.16 ? 236 THR A CB 1 ATOM 1602 O OG1 . THR A 1 212 ? 15.603 32.489 -7.079 1.00 107.26 ? 236 THR A OG1 1 ATOM 1603 C CG2 . THR A 1 212 ? 17.616 31.558 -6.093 1.00 106.96 ? 236 THR A CG2 1 ATOM 1604 N N . ARG A 1 213 ? 17.279 28.589 -7.299 1.00 107.14 ? 237 ARG A N 1 ATOM 1605 C CA . ARG A 1 213 ? 18.097 27.416 -7.016 1.00 108.10 ? 237 ARG A CA 1 ATOM 1606 C C . ARG A 1 213 ? 17.196 26.197 -7.217 1.00 106.89 ? 237 ARG A C 1 ATOM 1607 O O . ARG A 1 213 ? 17.532 25.256 -7.949 1.00 106.58 ? 237 ARG A O 1 ATOM 1608 C CB . ARG A 1 213 ? 18.594 27.437 -5.565 1.00 110.80 ? 237 ARG A CB 1 ATOM 1609 C CG . ARG A 1 213 ? 19.694 28.442 -5.245 1.00 113.95 ? 237 ARG A CG 1 ATOM 1610 C CD . ARG A 1 213 ? 20.261 28.167 -3.847 1.00 116.91 ? 237 ARG A CD 1 ATOM 1611 N NE . ARG A 1 213 ? 21.541 28.830 -3.598 1.00 118.75 ? 237 ARG A NE 1 ATOM 1612 C CZ . ARG A 1 213 ? 22.344 28.540 -2.577 1.00 119.41 ? 237 ARG A CZ 1 ATOM 1613 N NH1 . ARG A 1 213 ? 21.999 27.600 -1.707 1.00 119.74 ? 237 ARG A NH1 1 ATOM 1614 N NH2 . ARG A 1 213 ? 23.495 29.182 -2.430 1.00 120.07 ? 237 ARG A NH2 1 ATOM 1615 N N . GLY A 1 214 ? 16.043 26.251 -6.549 1.00 105.38 ? 238 GLY A N 1 ATOM 1616 C CA . GLY A 1 214 ? 15.054 25.190 -6.603 1.00 102.69 ? 238 GLY A CA 1 ATOM 1617 C C . GLY A 1 214 ? 13.795 25.656 -5.892 1.00 100.44 ? 238 GLY A C 1 ATOM 1618 O O . GLY A 1 214 ? 13.151 26.598 -6.341 1.00 101.13 ? 238 GLY A O 1 ATOM 1619 N N . VAL A 1 215 ? 13.442 25.014 -4.783 1.00 97.40 ? 239 VAL A N 1 ATOM 1620 C CA . VAL A 1 215 ? 12.243 25.386 -4.032 1.00 94.17 ? 239 VAL A CA 1 ATOM 1621 C C . VAL A 1 215 ? 12.531 25.363 -2.543 1.00 91.32 ? 239 VAL A C 1 ATOM 1622 O O . VAL A 1 215 ? 12.504 24.317 -1.930 1.00 90.98 ? 239 VAL A O 1 ATOM 1623 C CB . VAL A 1 215 ? 11.088 24.419 -4.316 1.00 94.99 ? 239 VAL A CB 1 ATOM 1624 C CG1 . VAL A 1 215 ? 9.807 24.962 -3.707 1.00 95.53 ? 239 VAL A CG1 1 ATOM 1625 C CG2 . VAL A 1 215 ? 10.937 24.210 -5.818 1.00 95.33 ? 239 VAL A CG2 1 ATOM 1626 N N . ALA A 1 216 ? 12.775 26.516 -1.945 1.00 88.70 ? 240 ALA A N 1 ATOM 1627 C CA . ALA A 1 216 ? 13.093 26.552 -0.512 1.00 86.20 ? 240 ALA A CA 1 ATOM 1628 C C . ALA A 1 216 ? 11.895 26.186 0.318 1.00 84.42 ? 240 ALA A C 1 ATOM 1629 O O . ALA A 1 216 ? 10.799 26.595 -0.004 1.00 83.53 ? 240 ALA A O 1 ATOM 1630 C CB . ALA A 1 216 ? 13.587 27.932 -0.120 1.00 87.50 ? 240 ALA A CB 1 ATOM 1631 N N . GLU A 1 217 ? 12.083 25.420 1.383 1.00 82.94 ? 241 GLU A N 1 ATOM 1632 C CA . GLU A 1 217 ? 10.945 25.031 2.220 1.00 82.09 ? 241 GLU A CA 1 ATOM 1633 C C . GLU A 1 217 ? 10.704 26.018 3.351 1.00 80.20 ? 241 GLU A C 1 ATOM 1634 O O . GLU A 1 217 ? 11.655 26.479 3.975 1.00 80.36 ? 241 GLU A O 1 ATOM 1635 C CB . GLU A 1 217 ? 11.160 23.632 2.799 1.00 84.56 ? 241 GLU A CB 1 ATOM 1636 C CG . GLU A 1 217 ? 10.966 22.493 1.805 1.00 89.45 ? 241 GLU A CG 1 ATOM 1637 C CD . GLU A 1 217 ? 11.073 21.110 2.452 1.00 92.52 ? 241 GLU A CD 1 ATOM 1638 O OE1 . GLU A 1 217 ? 10.890 20.094 1.734 1.00 93.17 ? 241 GLU A OE1 1 ATOM 1639 O OE2 . GLU A 1 217 ? 11.338 21.040 3.676 1.00 93.66 ? 241 GLU A OE2 1 ATOM 1640 N N . ARG A 1 218 ? 9.440 26.357 3.617 1.00 77.51 ? 242 ARG A N 1 ATOM 1641 C CA . ARG A 1 218 ? 9.109 27.295 4.709 1.00 75.95 ? 242 ARG A CA 1 ATOM 1642 C C . ARG A 1 218 ? 7.880 26.890 5.522 1.00 71.44 ? 242 ARG A C 1 ATOM 1643 O O . ARG A 1 218 ? 7.060 26.123 5.040 1.00 69.49 ? 242 ARG A O 1 ATOM 1644 C CB . ARG A 1 218 ? 8.907 28.711 4.159 1.00 80.13 ? 242 ARG A CB 1 ATOM 1645 C CG . ARG A 1 218 ? 10.210 29.438 3.838 1.00 85.64 ? 242 ARG A CG 1 ATOM 1646 C CD . ARG A 1 218 ? 9.936 30.673 3.006 1.00 90.02 ? 242 ARG A CD 1 ATOM 1647 N NE . ARG A 1 218 ? 9.062 30.351 1.877 1.00 93.72 ? 242 ARG A NE 1 ATOM 1648 C CZ . ARG A 1 218 ? 8.750 31.193 0.895 1.00 95.10 ? 242 ARG A CZ 1 ATOM 1649 N NH1 . ARG A 1 218 ? 9.245 32.427 0.891 1.00 96.74 ? 242 ARG A NH1 1 ATOM 1650 N NH2 . ARG A 1 218 ? 7.936 30.801 -0.078 1.00 94.46 ? 242 ARG A NH2 1 ATOM 1651 N N . THR A 1 219 ? 7.755 27.398 6.753 1.00 68.20 ? 243 THR A N 1 ATOM 1652 C CA . THR A 1 219 ? 6.602 27.048 7.585 1.00 65.24 ? 243 THR A CA 1 ATOM 1653 C C . THR A 1 219 ? 5.340 27.603 6.923 1.00 61.91 ? 243 THR A C 1 ATOM 1654 O O . THR A 1 219 ? 5.393 28.564 6.133 1.00 62.68 ? 243 THR A O 1 ATOM 1655 C CB . THR A 1 219 ? 6.688 27.620 9.027 1.00 65.16 ? 243 THR A CB 1 ATOM 1656 O OG1 . THR A 1 219 ? 6.752 29.047 8.974 1.00 67.02 ? 243 THR A OG1 1 ATOM 1657 C CG2 . THR A 1 219 ? 7.913 27.098 9.755 1.00 66.25 ? 243 THR A CG2 1 ATOM 1658 N N . PRO A 1 220 ? 4.175 27.007 7.232 1.00 58.31 ? 244 PRO A N 1 ATOM 1659 C CA . PRO A 1 220 ? 2.892 27.452 6.654 1.00 55.43 ? 244 PRO A CA 1 ATOM 1660 C C . PRO A 1 220 ? 2.419 28.777 7.224 1.00 53.87 ? 244 PRO A C 1 ATOM 1661 O O . PRO A 1 220 ? 2.795 29.161 8.342 1.00 54.49 ? 244 PRO A O 1 ATOM 1662 C CB . PRO A 1 220 ? 1.948 26.320 7.028 1.00 54.13 ? 244 PRO A CB 1 ATOM 1663 C CG . PRO A 1 220 ? 2.461 25.925 8.363 1.00 54.31 ? 244 PRO A CG 1 ATOM 1664 C CD . PRO A 1 220 ? 3.961 25.883 8.160 1.00 56.10 ? 244 PRO A CD 1 ATOM 1665 N N . SER A 1 221 ? 1.599 29.476 6.447 1.00 52.74 ? 245 SER A N 1 ATOM 1666 C CA . SER A 1 221 ? 1.069 30.773 6.845 1.00 51.70 ? 245 SER A CA 1 ATOM 1667 C C . SER A 1 221 ? -0.215 30.985 6.084 1.00 51.02 ? 245 SER A C 1 ATOM 1668 O O . SER A 1 221 ? -0.261 30.750 4.886 1.00 53.33 ? 245 SER A O 1 ATOM 1669 C CB . SER A 1 221 ? 2.061 31.874 6.483 1.00 52.03 ? 245 SER A CB 1 ATOM 1670 O OG . SER A 1 221 ? 1.596 33.134 6.917 1.00 52.67 ? 245 SER A OG 1 ATOM 1671 N N . PHE A 1 222 ? -1.251 31.445 6.770 1.00 48.56 ? 246 PHE A N 1 ATOM 1672 C CA . PHE A 1 222 ? -2.540 31.672 6.133 1.00 46.12 ? 246 PHE A CA 1 ATOM 1673 C C . PHE A 1 222 ? -2.563 32.832 5.170 1.00 45.80 ? 246 PHE A C 1 ATOM 1674 O O . PHE A 1 222 ? -2.108 33.914 5.520 1.00 45.94 ? 246 PHE A O 1 ATOM 1675 C CB . PHE A 1 222 ? -3.609 31.906 7.183 1.00 44.91 ? 246 PHE A CB 1 ATOM 1676 C CG . PHE A 1 222 ? -3.836 30.736 8.078 1.00 42.92 ? 246 PHE A CG 1 ATOM 1677 C CD1 . PHE A 1 222 ? -3.562 30.828 9.435 1.00 41.34 ? 246 PHE A CD1 1 ATOM 1678 C CD2 . PHE A 1 222 ? -4.333 29.543 7.567 1.00 41.48 ? 246 PHE A CD2 1 ATOM 1679 C CE1 . PHE A 1 222 ? -3.784 29.747 10.269 1.00 41.49 ? 246 PHE A CE1 1 ATOM 1680 C CE2 . PHE A 1 222 ? -4.557 28.458 8.394 1.00 39.83 ? 246 PHE A CE2 1 ATOM 1681 C CZ . PHE A 1 222 ? -4.283 28.559 9.745 1.00 40.74 ? 246 PHE A CZ 1 ATOM 1682 N N . MET A 1 223 ? -3.116 32.602 3.977 1.00 45.61 ? 247 MET A N 1 ATOM 1683 C CA . MET A 1 223 ? -3.247 33.623 2.945 1.00 45.97 ? 247 MET A CA 1 ATOM 1684 C C . MET A 1 223 ? -4.561 34.362 2.998 1.00 48.06 ? 247 MET A C 1 ATOM 1685 O O . MET A 1 223 ? -4.560 35.561 3.206 1.00 48.69 ? 247 MET A O 1 ATOM 1686 C CB . MET A 1 223 ? -3.129 32.998 1.565 1.00 44.40 ? 247 MET A CB 1 ATOM 1687 C CG . MET A 1 223 ? -1.965 32.097 1.356 1.00 42.89 ? 247 MET A CG 1 ATOM 1688 S SD . MET A 1 223 ? -2.101 31.397 -0.293 1.00 43.50 ? 247 MET A SD 1 ATOM 1689 C CE . MET A 1 223 ? -1.459 32.718 -1.319 1.00 41.30 ? 247 MET A CE 1 ATOM 1690 N N . TYR A 1 224 ? -5.676 33.657 2.816 1.00 49.82 ? 248 TYR A N 1 ATOM 1691 C CA . TYR A 1 224 ? -6.973 34.316 2.808 1.00 51.47 ? 248 TYR A CA 1 ATOM 1692 C C . TYR A 1 224 ? -7.429 34.932 4.118 1.00 52.68 ? 248 TYR A C 1 ATOM 1693 O O . TYR A 1 224 ? -7.759 36.132 4.181 1.00 56.64 ? 248 TYR A O 1 ATOM 1694 C CB . TYR A 1 224 ? -8.048 33.382 2.222 1.00 50.44 ? 248 TYR A CB 1 ATOM 1695 C CG . TYR A 1 224 ? -9.476 33.799 2.514 1.00 49.99 ? 248 TYR A CG 1 ATOM 1696 C CD1 . TYR A 1 224 ? -9.856 35.143 2.520 1.00 48.91 ? 248 TYR A CD1 1 ATOM 1697 C CD2 . TYR A 1 224 ? -10.431 32.847 2.846 1.00 50.56 ? 248 TYR A CD2 1 ATOM 1698 C CE1 . TYR A 1 224 ? -11.137 35.523 2.866 1.00 50.24 ? 248 TYR A CE1 1 ATOM 1699 C CE2 . TYR A 1 224 ? -11.721 33.213 3.185 1.00 51.60 ? 248 TYR A CE2 1 ATOM 1700 C CZ . TYR A 1 224 ? -12.071 34.552 3.200 1.00 51.24 ? 248 TYR A CZ 1 ATOM 1701 O OH . TYR A 1 224 ? -13.359 34.895 3.560 1.00 51.74 ? 248 TYR A OH 1 ATOM 1702 N N . PRO A 1 225 ? -7.476 34.141 5.182 1.00 50.34 ? 249 PRO A N 1 ATOM 1703 C CA . PRO A 1 225 ? -7.938 34.913 6.337 1.00 50.57 ? 249 PRO A CA 1 ATOM 1704 C C . PRO A 1 225 ? -6.763 35.705 6.939 1.00 53.03 ? 249 PRO A C 1 ATOM 1705 O O . PRO A 1 225 ? -5.729 35.157 7.357 1.00 53.88 ? 249 PRO A O 1 ATOM 1706 C CB . PRO A 1 225 ? -8.522 33.855 7.251 1.00 48.73 ? 249 PRO A CB 1 ATOM 1707 C CG . PRO A 1 225 ? -9.061 32.893 6.292 1.00 48.33 ? 249 PRO A CG 1 ATOM 1708 C CD . PRO A 1 225 ? -7.911 32.748 5.324 1.00 47.95 ? 249 PRO A CD 1 ATOM 1709 N N . GLN A 1 226 ? -6.922 37.024 6.922 1.00 55.90 ? 250 GLN A N 1 ATOM 1710 C CA . GLN A 1 226 ? -5.911 37.961 7.404 1.00 58.37 ? 250 GLN A CA 1 ATOM 1711 C C . GLN A 1 226 ? -5.695 37.954 8.905 1.00 56.90 ? 250 GLN A C 1 ATOM 1712 O O . GLN A 1 226 ? -6.491 38.502 9.664 1.00 57.22 ? 250 GLN A O 1 ATOM 1713 C CB . GLN A 1 226 ? -6.255 39.385 6.938 1.00 62.89 ? 250 GLN A CB 1 ATOM 1714 C CG . GLN A 1 226 ? -6.513 39.519 5.417 1.00 68.69 ? 250 GLN A CG 1 ATOM 1715 C CD . GLN A 1 226 ? -5.250 39.760 4.587 1.00 71.46 ? 250 GLN A CD 1 ATOM 1716 O OE1 . GLN A 1 226 ? -4.216 39.124 4.804 1.00 72.99 ? 250 GLN A OE1 1 ATOM 1717 N NE2 . GLN A 1 226 ? -5.340 40.676 3.620 1.00 71.26 ? 250 GLN A NE2 1 ATOM 1718 N N . GLY A 1 227 ? -4.613 37.320 9.332 1.00 55.01 ? 251 GLY A N 1 ATOM 1719 C CA . GLY A 1 227 ? -4.324 37.287 10.749 1.00 53.43 ? 251 GLY A CA 1 ATOM 1720 C C . GLY A 1 227 ? -4.486 35.932 11.387 1.00 51.46 ? 251 GLY A C 1 ATOM 1721 O O . GLY A 1 227 ? -4.509 34.912 10.720 1.00 51.09 ? 251 GLY A O 1 ATOM 1722 N N . THR A 1 228 ? -4.613 35.928 12.701 1.00 50.80 ? 252 THR A N 1 ATOM 1723 C CA . THR A 1 228 ? -4.769 34.687 13.444 1.00 51.44 ? 252 THR A CA 1 ATOM 1724 C C . THR A 1 228 ? -6.253 34.374 13.651 1.00 49.94 ? 252 THR A C 1 ATOM 1725 O O . THR A 1 228 ? -6.630 33.238 13.943 1.00 49.39 ? 252 THR A O 1 ATOM 1726 C CB . THR A 1 228 ? -4.128 34.820 14.834 1.00 54.19 ? 252 THR A CB 1 ATOM 1727 O OG1 . THR A 1 228 ? -2.943 35.620 14.734 1.00 56.57 ? 252 THR A OG1 1 ATOM 1728 C CG2 . THR A 1 228 ? -3.773 33.452 15.397 1.00 55.53 ? 252 THR A CG2 1 ATOM 1729 N N . ALA A 1 229 ? -7.091 35.393 13.487 1.00 49.07 ? 253 ALA A N 1 ATOM 1730 C CA . ALA A 1 229 ? -8.519 35.248 13.704 1.00 46.66 ? 253 ALA A CA 1 ATOM 1731 C C . ALA A 1 229 ? -9.459 36.098 12.803 1.00 46.29 ? 253 ALA A C 1 ATOM 1732 O O . ALA A 1 229 ? -9.145 37.240 12.406 1.00 45.22 ? 253 ALA A O 1 ATOM 1733 C CB . ALA A 1 229 ? -8.815 35.510 15.153 1.00 44.29 ? 253 ALA A CB 1 ATOM 1734 N N . SER A 1 230 ? -10.619 35.513 12.500 1.00 46.40 ? 254 SER A N 1 ATOM 1735 C CA . SER A 1 230 ? -11.644 36.143 11.668 1.00 46.86 ? 254 SER A CA 1 ATOM 1736 C C . SER A 1 230 ? -13.008 35.927 12.313 1.00 44.56 ? 254 SER A C 1 ATOM 1737 O O . SER A 1 230 ? -13.253 34.879 12.901 1.00 43.55 ? 254 SER A O 1 ATOM 1738 C CB . SER A 1 230 ? -11.634 35.550 10.255 1.00 50.23 ? 254 SER A CB 1 ATOM 1739 O OG . SER A 1 230 ? -11.624 34.135 10.297 1.00 54.78 ? 254 SER A OG 1 ATOM 1740 N N . SER A 1 231 ? -13.883 36.927 12.216 1.00 43.50 ? 255 SER A N 1 ATOM 1741 C CA . SER A 1 231 ? -15.227 36.860 12.798 1.00 41.47 ? 255 SER A CA 1 ATOM 1742 C C . SER A 1 231 ? -16.326 36.790 11.718 1.00 39.76 ? 255 SER A C 1 ATOM 1743 O O . SER A 1 231 ? -16.268 37.480 10.713 1.00 40.08 ? 255 SER A O 1 ATOM 1744 C CB . SER A 1 231 ? -15.413 38.091 13.675 1.00 41.09 ? 255 SER A CB 1 ATOM 1745 O OG . SER A 1 231 ? -16.536 37.959 14.509 1.00 46.29 ? 255 SER A OG 1 ATOM 1746 N N . GLN A 1 232 ? -17.315 35.931 11.917 1.00 38.04 ? 256 GLN A N 1 ATOM 1747 C CA . GLN A 1 232 ? -18.436 35.780 10.980 1.00 35.88 ? 256 GLN A CA 1 ATOM 1748 C C . GLN A 1 232 ? -19.783 35.703 11.694 1.00 34.36 ? 256 GLN A C 1 ATOM 1749 O O . GLN A 1 232 ? -19.907 35.044 12.734 1.00 32.42 ? 256 GLN A O 1 ATOM 1750 C CB . GLN A 1 232 ? -18.315 34.513 10.177 1.00 35.99 ? 256 GLN A CB 1 ATOM 1751 C CG . GLN A 1 232 ? -17.641 34.656 8.887 1.00 38.68 ? 256 GLN A CG 1 ATOM 1752 C CD . GLN A 1 232 ? -17.719 33.373 8.131 1.00 40.83 ? 256 GLN A CD 1 ATOM 1753 O OE1 . GLN A 1 232 ? -18.808 32.882 7.851 1.00 42.80 ? 256 GLN A OE1 1 ATOM 1754 N NE2 . GLN A 1 232 ? -16.566 32.804 7.803 1.00 43.37 ? 256 GLN A NE2 1 ATOM 1755 N N . MET A 1 233 ? -20.787 36.361 11.105 1.00 34.24 ? 257 MET A N 1 ATOM 1756 C CA . MET A 1 233 ? -22.156 36.398 11.624 1.00 34.41 ? 257 MET A CA 1 ATOM 1757 C C . MET A 1 233 ? -22.968 35.692 10.544 1.00 32.31 ? 257 MET A C 1 ATOM 1758 O O . MET A 1 233 ? -22.885 36.074 9.376 1.00 32.97 ? 257 MET A O 1 ATOM 1759 C CB . MET A 1 233 ? -22.611 37.853 11.800 1.00 39.02 ? 257 MET A CB 1 ATOM 1760 C CG . MET A 1 233 ? -23.996 38.046 12.443 1.00 44.86 ? 257 MET A CG 1 ATOM 1761 S SD . MET A 1 233 ? -25.422 37.496 11.435 1.00 51.29 ? 257 MET A SD 1 ATOM 1762 C CE . MET A 1 233 ? -25.424 38.802 10.155 1.00 49.05 ? 257 MET A CE 1 ATOM 1763 N N . VAL A 1 234 ? -23.718 34.663 10.920 1.00 30.59 ? 258 VAL A N 1 ATOM 1764 C CA . VAL A 1 234 ? -24.517 33.920 9.969 1.00 30.69 ? 258 VAL A CA 1 ATOM 1765 C C . VAL A 1 234 ? -25.927 33.752 10.465 1.00 30.86 ? 258 VAL A C 1 ATOM 1766 O O . VAL A 1 234 ? -26.108 33.347 11.602 1.00 34.14 ? 258 VAL A O 1 ATOM 1767 C CB . VAL A 1 234 ? -23.861 32.556 9.729 1.00 29.12 ? 258 VAL A CB 1 ATOM 1768 C CG1 . VAL A 1 234 ? -24.853 31.557 9.190 1.00 28.88 ? 258 VAL A CG1 1 ATOM 1769 C CG2 . VAL A 1 234 ? -22.724 32.731 8.743 1.00 31.51 ? 258 VAL A CG2 1 ATOM 1770 N N . LEU A 1 235 ? -26.924 34.031 9.624 1.00 29.67 ? 259 LEU A N 1 ATOM 1771 C CA . LEU A 1 235 ? -28.322 33.900 10.054 1.00 29.89 ? 259 LEU A CA 1 ATOM 1772 C C . LEU A 1 235 ? -28.830 32.438 10.074 1.00 29.68 ? 259 LEU A C 1 ATOM 1773 O O . LEU A 1 235 ? -28.398 31.630 9.266 1.00 29.46 ? 259 LEU A O 1 ATOM 1774 C CB . LEU A 1 235 ? -29.250 34.704 9.134 1.00 29.48 ? 259 LEU A CB 1 ATOM 1775 C CG . LEU A 1 235 ? -29.124 36.226 9.047 1.00 28.70 ? 259 LEU A CG 1 ATOM 1776 C CD1 . LEU A 1 235 ? -30.092 36.733 8.005 1.00 27.32 ? 259 LEU A CD1 1 ATOM 1777 C CD2 . LEU A 1 235 ? -29.388 36.868 10.391 1.00 27.87 ? 259 LEU A CD2 1 ATOM 1778 N N . ARG A 1 236 ? -29.761 32.119 10.978 1.00 30.95 ? 260 ARG A N 1 ATOM 1779 C CA . ARG A 1 236 ? -30.352 30.780 11.104 1.00 32.35 ? 260 ARG A CA 1 ATOM 1780 C C . ARG A 1 236 ? -30.979 30.298 9.818 1.00 34.28 ? 260 ARG A C 1 ATOM 1781 O O . ARG A 1 236 ? -31.755 31.034 9.206 1.00 35.93 ? 260 ARG A O 1 ATOM 1782 C CB . ARG A 1 236 ? -31.398 30.804 12.205 1.00 33.48 ? 260 ARG A CB 1 ATOM 1783 C CG . ARG A 1 236 ? -32.260 29.572 12.333 1.00 37.67 ? 260 ARG A CG 1 ATOM 1784 C CD . ARG A 1 236 ? -33.333 29.814 13.399 1.00 43.60 ? 260 ARG A CD 1 ATOM 1785 N NE . ARG A 1 236 ? -34.281 28.712 13.514 1.00 50.14 ? 260 ARG A NE 1 ATOM 1786 C CZ . ARG A 1 236 ? -35.197 28.402 12.597 1.00 55.12 ? 260 ARG A CZ 1 ATOM 1787 N NH1 . ARG A 1 236 ? -35.301 29.122 11.482 1.00 56.63 ? 260 ARG A NH1 1 ATOM 1788 N NH2 . ARG A 1 236 ? -35.999 27.356 12.789 1.00 57.59 ? 260 ARG A NH2 1 ATOM 1789 N N . GLY A 1 237 ? -30.668 29.069 9.409 1.00 35.71 ? 261 GLY A N 1 ATOM 1790 C CA . GLY A 1 237 ? -31.237 28.534 8.180 1.00 37.30 ? 261 GLY A CA 1 ATOM 1791 C C . GLY A 1 237 ? -30.290 28.624 6.998 1.00 39.58 ? 261 GLY A C 1 ATOM 1792 O O . GLY A 1 237 ? -30.161 27.697 6.191 1.00 39.96 ? 261 GLY A O 1 ATOM 1793 N N . MET A 1 238 ? -29.630 29.766 6.887 1.00 41.15 ? 262 MET A N 1 ATOM 1794 C CA . MET A 1 238 ? -28.671 29.983 5.824 1.00 42.82 ? 262 MET A CA 1 ATOM 1795 C C . MET A 1 238 ? -27.482 29.080 6.115 1.00 41.00 ? 262 MET A C 1 ATOM 1796 O O . MET A 1 238 ? -27.295 28.674 7.246 1.00 38.08 ? 262 MET A O 1 ATOM 1797 C CB . MET A 1 238 ? -28.198 31.441 5.822 1.00 49.14 ? 262 MET A CB 1 ATOM 1798 C CG . MET A 1 238 ? -29.282 32.466 5.543 1.00 55.98 ? 262 MET A CG 1 ATOM 1799 S SD . MET A 1 238 ? -30.112 32.101 3.983 1.00 67.04 ? 262 MET A SD 1 ATOM 1800 C CE . MET A 1 238 ? -29.332 33.329 2.804 1.00 65.24 ? 262 MET A CE 1 ATOM 1801 N N . ASP A 1 239 ? -26.707 28.764 5.076 1.00 41.72 ? 263 ASP A N 1 ATOM 1802 C CA . ASP A 1 239 ? -25.517 27.912 5.167 1.00 41.04 ? 263 ASP A CA 1 ATOM 1803 C C . ASP A 1 239 ? -24.346 28.719 5.722 1.00 39.45 ? 263 ASP A C 1 ATOM 1804 O O . ASP A 1 239 ? -24.278 29.954 5.587 1.00 39.09 ? 263 ASP A O 1 ATOM 1805 C CB . ASP A 1 239 ? -25.130 27.350 3.795 1.00 45.49 ? 263 ASP A CB 1 ATOM 1806 C CG . ASP A 1 239 ? -26.139 26.339 3.264 1.00 50.04 ? 263 ASP A CG 1 ATOM 1807 O OD1 . ASP A 1 239 ? -26.911 25.781 4.080 1.00 52.55 ? 263 ASP A OD1 1 ATOM 1808 O OD2 . ASP A 1 239 ? -26.146 26.091 2.034 1.00 51.41 ? 263 ASP A OD2 1 ATOM 1809 N N . LEU A 1 240 ? -23.416 28.018 6.353 1.00 37.39 ? 264 LEU A N 1 ATOM 1810 C CA . LEU A 1 240 ? -22.280 28.681 6.988 1.00 35.79 ? 264 LEU A CA 1 ATOM 1811 C C . LEU A 1 240 ? -20.966 28.148 6.470 1.00 35.84 ? 264 LEU A C 1 ATOM 1812 O O . LEU A 1 240 ? -20.642 26.989 6.688 1.00 35.88 ? 264 LEU A O 1 ATOM 1813 C CB . LEU A 1 240 ? -22.397 28.508 8.507 1.00 33.53 ? 264 LEU A CB 1 ATOM 1814 C CG . LEU A 1 240 ? -21.285 28.779 9.520 1.00 32.19 ? 264 LEU A CG 1 ATOM 1815 C CD1 . LEU A 1 240 ? -20.641 27.463 9.967 1.00 31.15 ? 264 LEU A CD1 1 ATOM 1816 C CD2 . LEU A 1 240 ? -20.295 29.738 8.915 1.00 31.66 ? 264 LEU A CD2 1 ATOM 1817 N N . LEU A 1 241 ? -20.216 28.996 5.770 1.00 36.31 ? 265 LEU A N 1 ATOM 1818 C CA . LEU A 1 241 ? -18.923 28.592 5.215 1.00 35.19 ? 265 LEU A CA 1 ATOM 1819 C C . LEU A 1 241 ? -17.748 29.169 5.943 1.00 35.13 ? 265 LEU A C 1 ATOM 1820 O O . LEU A 1 241 ? -17.690 30.358 6.236 1.00 34.22 ? 265 LEU A O 1 ATOM 1821 C CB . LEU A 1 241 ? -18.780 28.966 3.743 1.00 34.43 ? 265 LEU A CB 1 ATOM 1822 C CG . LEU A 1 241 ? -18.831 27.794 2.757 1.00 35.33 ? 265 LEU A CG 1 ATOM 1823 C CD1 . LEU A 1 241 ? -18.131 28.182 1.456 1.00 34.33 ? 265 LEU A CD1 1 ATOM 1824 C CD2 . LEU A 1 241 ? -18.158 26.573 3.370 1.00 35.18 ? 265 LEU A CD2 1 ATOM 1825 N N . LEU A 1 242 ? -16.785 28.299 6.185 1.00 34.71 ? 266 LEU A N 1 ATOM 1826 C CA . LEU A 1 242 ? -15.578 28.659 6.859 1.00 32.57 ? 266 LEU A CA 1 ATOM 1827 C C . LEU A 1 242 ? -14.447 28.318 5.897 1.00 33.53 ? 266 LEU A C 1 ATOM 1828 O O . LEU A 1 242 ? -14.423 27.225 5.344 1.00 33.21 ? 266 LEU A O 1 ATOM 1829 C CB . LEU A 1 242 ? -15.468 27.842 8.132 1.00 31.56 ? 266 LEU A CB 1 ATOM 1830 C CG . LEU A 1 242 ? -16.581 28.164 9.117 1.00 30.92 ? 266 LEU A CG 1 ATOM 1831 C CD1 . LEU A 1 242 ? -16.523 27.235 10.301 1.00 32.66 ? 266 LEU A CD1 1 ATOM 1832 C CD2 . LEU A 1 242 ? -16.419 29.594 9.575 1.00 32.50 ? 266 LEU A CD2 1 ATOM 1833 N N . GLU A 1 243 ? -13.525 29.249 5.669 1.00 35.89 ? 267 GLU A N 1 ATOM 1834 C CA . GLU A 1 243 ? -12.422 28.970 4.759 1.00 38.80 ? 267 GLU A CA 1 ATOM 1835 C C . GLU A 1 243 ? -11.065 29.219 5.350 1.00 39.52 ? 267 GLU A C 1 ATOM 1836 O O . GLU A 1 243 ? -10.847 30.265 5.982 1.00 38.41 ? 267 GLU A O 1 ATOM 1837 C CB . GLU A 1 243 ? -12.561 29.794 3.496 1.00 42.21 ? 267 GLU A CB 1 ATOM 1838 C CG . GLU A 1 243 ? -13.860 29.549 2.796 1.00 50.07 ? 267 GLU A CG 1 ATOM 1839 C CD . GLU A 1 243 ? -14.060 30.470 1.621 1.00 54.53 ? 267 GLU A CD 1 ATOM 1840 O OE1 . GLU A 1 243 ? -14.068 31.710 1.835 1.00 56.51 ? 267 GLU A OE1 1 ATOM 1841 O OE2 . GLU A 1 243 ? -14.210 29.944 0.489 1.00 56.47 ? 267 GLU A OE2 1 ATOM 1842 N N . CYS A 1 244 ? -10.168 28.249 5.140 1.00 40.06 ? 268 CYS A N 1 ATOM 1843 C CA . CYS A 1 244 ? -8.781 28.306 5.613 1.00 41.41 ? 268 CYS A CA 1 ATOM 1844 C C . CYS A 1 244 ? -7.829 28.035 4.456 1.00 40.70 ? 268 CYS A C 1 ATOM 1845 O O . CYS A 1 244 ? -7.675 26.897 4.037 1.00 41.69 ? 268 CYS A O 1 ATOM 1846 C CB . CYS A 1 244 ? -8.577 27.262 6.698 1.00 44.84 ? 268 CYS A CB 1 ATOM 1847 S SG . CYS A 1 244 ? -8.612 27.922 8.394 1.00 53.63 ? 268 CYS A SG 1 ATOM 1848 N N . ILE A 1 245 ? -7.212 29.065 3.894 1.00 39.59 ? 269 ILE A N 1 ATOM 1849 C CA . ILE A 1 245 ? -6.293 28.803 2.797 1.00 38.82 ? 269 ILE A CA 1 ATOM 1850 C C . ILE A 1 245 ? -4.930 29.183 3.335 1.00 40.96 ? 269 ILE A C 1 ATOM 1851 O O . ILE A 1 245 ? -4.792 30.266 3.912 1.00 42.07 ? 269 ILE A O 1 ATOM 1852 C CB . ILE A 1 245 ? -6.570 29.641 1.545 1.00 36.08 ? 269 ILE A CB 1 ATOM 1853 C CG1 . ILE A 1 245 ? -7.841 29.171 0.850 1.00 34.30 ? 269 ILE A CG1 1 ATOM 1854 C CG2 . ILE A 1 245 ? -5.416 29.504 0.581 1.00 35.72 ? 269 ILE A CG2 1 ATOM 1855 C CD1 . ILE A 1 245 ? -9.049 29.969 1.205 1.00 34.90 ? 269 ILE A CD1 1 ATOM 1856 N N . ALA A 1 246 ? -3.938 28.293 3.176 1.00 42.45 ? 270 ALA A N 1 ATOM 1857 C CA . ALA A 1 246 ? -2.579 28.527 3.684 1.00 42.90 ? 270 ALA A CA 1 ATOM 1858 C C . ALA A 1 246 ? -1.494 28.240 2.654 1.00 43.34 ? 270 ALA A C 1 ATOM 1859 O O . ALA A 1 246 ? -1.671 27.364 1.819 1.00 43.08 ? 270 ALA A O 1 ATOM 1860 C CB . ALA A 1 246 ? -2.338 27.673 4.928 1.00 40.95 ? 270 ALA A CB 1 ATOM 1861 N N . SER A 1 247 ? -0.381 28.981 2.717 1.00 45.31 ? 271 SER A N 1 ATOM 1862 C CA . SER A 1 247 ? 0.752 28.788 1.800 1.00 48.00 ? 271 SER A CA 1 ATOM 1863 C C . SER A 1 247 ? 1.913 28.081 2.500 1.00 49.35 ? 271 SER A C 1 ATOM 1864 O O . SER A 1 247 ? 2.390 28.515 3.553 1.00 50.56 ? 271 SER A O 1 ATOM 1865 C CB . SER A 1 247 ? 1.242 30.123 1.249 1.00 48.21 ? 271 SER A CB 1 ATOM 1866 O OG . SER A 1 247 ? 1.721 30.949 2.294 1.00 49.82 ? 271 SER A OG 1 ATOM 1867 N N . GLY A 1 248 ? 2.346 26.965 1.924 1.00 50.35 ? 272 GLY A N 1 ATOM 1868 C CA . GLY A 1 248 ? 3.441 26.195 2.500 1.00 51.79 ? 272 GLY A CA 1 ATOM 1869 C C . GLY A 1 248 ? 4.282 25.628 1.387 1.00 53.57 ? 272 GLY A C 1 ATOM 1870 O O . GLY A 1 248 ? 4.043 25.972 0.232 1.00 53.43 ? 272 GLY A O 1 ATOM 1871 N N . VAL A 1 249 ? 5.255 24.779 1.689 1.00 54.89 ? 273 VAL A N 1 ATOM 1872 C CA . VAL A 1 249 ? 6.065 24.230 0.613 1.00 57.12 ? 273 VAL A CA 1 ATOM 1873 C C . VAL A 1 249 ? 5.589 22.850 0.271 1.00 60.61 ? 273 VAL A C 1 ATOM 1874 O O . VAL A 1 249 ? 5.325 22.519 -0.894 1.00 64.01 ? 273 VAL A O 1 ATOM 1875 C CB . VAL A 1 249 ? 7.520 24.131 0.981 1.00 56.22 ? 273 VAL A CB 1 ATOM 1876 C CG1 . VAL A 1 249 ? 8.322 24.983 0.032 1.00 56.27 ? 273 VAL A CG1 1 ATOM 1877 C CG2 . VAL A 1 249 ? 7.712 24.531 2.431 1.00 57.29 ? 273 VAL A CG2 1 ATOM 1878 N N . PRO A 1 250 ? 5.488 22.001 1.287 1.00 59.54 ? 274 PRO A N 1 ATOM 1879 C CA . PRO A 1 250 ? 5.020 20.658 0.963 1.00 56.79 ? 274 PRO A CA 1 ATOM 1880 C C . PRO A 1 250 ? 3.493 20.774 0.905 1.00 56.85 ? 274 PRO A C 1 ATOM 1881 O O . PRO A 1 250 ? 2.771 19.776 0.866 1.00 59.90 ? 274 PRO A O 1 ATOM 1882 C CB . PRO A 1 250 ? 5.505 19.822 2.153 1.00 56.26 ? 274 PRO A CB 1 ATOM 1883 C CG . PRO A 1 250 ? 6.661 20.604 2.689 1.00 56.74 ? 274 PRO A CG 1 ATOM 1884 C CD . PRO A 1 250 ? 6.143 22.008 2.607 1.00 57.52 ? 274 PRO A CD 1 ATOM 1885 N N . THR A 1 251 ? 3.026 22.023 0.912 1.00 52.05 ? 275 THR A N 1 ATOM 1886 C CA . THR A 1 251 ? 1.610 22.372 0.873 1.00 45.56 ? 275 THR A CA 1 ATOM 1887 C C . THR A 1 251 ? 0.866 21.897 2.128 1.00 45.93 ? 275 THR A C 1 ATOM 1888 O O . THR A 1 251 ? 0.712 20.698 2.388 1.00 43.90 ? 275 THR A O 1 ATOM 1889 C CB . THR A 1 251 ? 0.910 21.805 -0.362 1.00 43.57 ? 275 THR A CB 1 ATOM 1890 O OG1 . THR A 1 251 ? 1.348 22.499 -1.535 1.00 40.24 ? 275 THR A OG1 1 ATOM 1891 C CG2 . THR A 1 251 ? -0.572 21.972 -0.218 1.00 42.30 ? 275 THR A CG2 1 ATOM 1892 N N . PRO A 1 252 ? 0.401 22.843 2.935 1.00 47.17 ? 276 PRO A N 1 ATOM 1893 C CA . PRO A 1 252 ? -0.328 22.599 4.183 1.00 48.05 ? 276 PRO A CA 1 ATOM 1894 C C . PRO A 1 252 ? -1.613 21.802 4.036 1.00 51.17 ? 276 PRO A C 1 ATOM 1895 O O . PRO A 1 252 ? -2.331 21.964 3.066 1.00 51.32 ? 276 PRO A O 1 ATOM 1896 C CB . PRO A 1 252 ? -0.615 24.009 4.680 1.00 48.11 ? 276 PRO A CB 1 ATOM 1897 C CG . PRO A 1 252 ? 0.461 24.831 4.055 1.00 45.56 ? 276 PRO A CG 1 ATOM 1898 C CD . PRO A 1 252 ? 0.512 24.285 2.679 1.00 45.69 ? 276 PRO A CD 1 ATOM 1899 N N . ASP A 1 253 ? -1.880 20.934 5.005 1.00 53.68 ? 277 ASP A N 1 ATOM 1900 C CA . ASP A 1 253 ? -3.076 20.094 5.020 1.00 55.60 ? 277 ASP A CA 1 ATOM 1901 C C . ASP A 1 253 ? -3.992 20.699 6.078 1.00 55.28 ? 277 ASP A C 1 ATOM 1902 O O . ASP A 1 253 ? -3.603 20.862 7.238 1.00 55.09 ? 277 ASP A O 1 ATOM 1903 C CB . ASP A 1 253 ? -2.730 18.657 5.446 1.00 60.03 ? 277 ASP A CB 1 ATOM 1904 C CG . ASP A 1 253 ? -1.565 18.062 4.659 1.00 64.71 ? 277 ASP A CG 1 ATOM 1905 O OD1 . ASP A 1 253 ? -1.710 17.865 3.429 1.00 67.44 ? 277 ASP A OD1 1 ATOM 1906 O OD2 . ASP A 1 253 ? -0.504 17.785 5.276 1.00 67.41 ? 277 ASP A OD2 1 ATOM 1907 N N . ILE A 1 254 ? -5.215 21.039 5.700 1.00 53.33 ? 278 ILE A N 1 ATOM 1908 C CA . ILE A 1 254 ? -6.108 21.650 6.682 1.00 51.78 ? 278 ILE A CA 1 ATOM 1909 C C . ILE A 1 254 ? -6.980 20.646 7.392 1.00 50.54 ? 278 ILE A C 1 ATOM 1910 O O . ILE A 1 254 ? -7.550 19.748 6.764 1.00 50.61 ? 278 ILE A O 1 ATOM 1911 C CB . ILE A 1 254 ? -7.036 22.698 6.025 1.00 52.46 ? 278 ILE A CB 1 ATOM 1912 C CG1 . ILE A 1 254 ? -6.314 23.404 4.875 1.00 54.05 ? 278 ILE A CG1 1 ATOM 1913 C CG2 . ILE A 1 254 ? -7.462 23.733 7.048 1.00 51.21 ? 278 ILE A CG2 1 ATOM 1914 C CD1 . ILE A 1 254 ? -5.211 24.349 5.302 1.00 55.85 ? 278 ILE A CD1 1 ATOM 1915 N N . ALA A 1 255 ? -7.071 20.823 8.706 1.00 48.01 ? 279 ALA A N 1 ATOM 1916 C CA . ALA A 1 255 ? -7.851 19.954 9.564 1.00 45.95 ? 279 ALA A CA 1 ATOM 1917 C C . ALA A 1 255 ? -8.767 20.815 10.383 1.00 44.59 ? 279 ALA A C 1 ATOM 1918 O O . ALA A 1 255 ? -8.316 21.724 11.062 1.00 44.72 ? 279 ALA A O 1 ATOM 1919 C CB . ALA A 1 255 ? -6.926 19.164 10.479 1.00 46.20 ? 279 ALA A CB 1 ATOM 1920 N N . TRP A 1 256 ? -10.058 20.520 10.346 1.00 42.75 ? 280 TRP A N 1 ATOM 1921 C CA . TRP A 1 256 ? -11.022 21.326 11.089 1.00 40.25 ? 280 TRP A CA 1 ATOM 1922 C C . TRP A 1 256 ? -11.400 20.816 12.472 1.00 40.70 ? 280 TRP A C 1 ATOM 1923 O O . TRP A 1 256 ? -11.477 19.604 12.709 1.00 40.03 ? 280 TRP A O 1 ATOM 1924 C CB . TRP A 1 256 ? -12.294 21.489 10.266 1.00 36.17 ? 280 TRP A CB 1 ATOM 1925 C CG . TRP A 1 256 ? -12.070 22.218 9.023 1.00 30.41 ? 280 TRP A CG 1 ATOM 1926 C CD1 . TRP A 1 256 ? -11.866 21.693 7.786 1.00 28.47 ? 280 TRP A CD1 1 ATOM 1927 C CD2 . TRP A 1 256 ? -11.991 23.631 8.884 1.00 27.76 ? 280 TRP A CD2 1 ATOM 1928 N NE1 . TRP A 1 256 ? -11.662 22.698 6.879 1.00 27.86 ? 280 TRP A NE1 1 ATOM 1929 C CE2 . TRP A 1 256 ? -11.730 23.903 7.532 1.00 27.79 ? 280 TRP A CE2 1 ATOM 1930 C CE3 . TRP A 1 256 ? -12.104 24.699 9.778 1.00 25.89 ? 280 TRP A CE3 1 ATOM 1931 C CZ2 . TRP A 1 256 ? -11.593 25.201 7.045 1.00 27.31 ? 280 TRP A CZ2 1 ATOM 1932 C CZ3 . TRP A 1 256 ? -11.969 25.982 9.298 1.00 25.90 ? 280 TRP A CZ3 1 ATOM 1933 C CH2 . TRP A 1 256 ? -11.710 26.224 7.945 1.00 26.06 ? 280 TRP A CH2 1 ATOM 1934 N N . TYR A 1 257 ? -11.646 21.757 13.373 1.00 41.93 ? 281 TYR A N 1 ATOM 1935 C CA . TYR A 1 257 ? -12.020 21.412 14.721 1.00 46.34 ? 281 TYR A CA 1 ATOM 1936 C C . TYR A 1 257 ? -12.924 22.476 15.294 1.00 47.88 ? 281 TYR A C 1 ATOM 1937 O O . TYR A 1 257 ? -12.983 23.580 14.778 1.00 46.69 ? 281 TYR A O 1 ATOM 1938 C CB . TYR A 1 257 ? -10.784 21.280 15.620 1.00 50.75 ? 281 TYR A CB 1 ATOM 1939 C CG . TYR A 1 257 ? -9.757 20.311 15.097 1.00 54.96 ? 281 TYR A CG 1 ATOM 1940 C CD1 . TYR A 1 257 ? -8.801 20.713 14.166 1.00 56.93 ? 281 TYR A CD1 1 ATOM 1941 C CD2 . TYR A 1 257 ? -9.783 18.976 15.478 1.00 56.95 ? 281 TYR A CD2 1 ATOM 1942 C CE1 . TYR A 1 257 ? -7.903 19.808 13.624 1.00 58.84 ? 281 TYR A CE1 1 ATOM 1943 C CE2 . TYR A 1 257 ? -8.893 18.062 14.941 1.00 59.34 ? 281 TYR A CE2 1 ATOM 1944 C CZ . TYR A 1 257 ? -7.959 18.485 14.014 1.00 60.15 ? 281 TYR A CZ 1 ATOM 1945 O OH . TYR A 1 257 ? -7.095 17.573 13.458 1.00 63.80 ? 281 TYR A OH 1 ATOM 1946 N N . LYS A 1 258 ? -13.618 22.135 16.378 1.00 51.27 ? 282 LYS A N 1 ATOM 1947 C CA . LYS A 1 258 ? -14.498 23.061 17.083 1.00 54.50 ? 282 LYS A CA 1 ATOM 1948 C C . LYS A 1 258 ? -14.104 23.022 18.558 1.00 56.17 ? 282 LYS A C 1 ATOM 1949 O O . LYS A 1 258 ? -13.785 21.956 19.107 1.00 57.16 ? 282 LYS A O 1 ATOM 1950 C CB . LYS A 1 258 ? -15.959 22.646 16.918 1.00 56.20 ? 282 LYS A CB 1 ATOM 1951 C CG . LYS A 1 258 ? -16.909 23.599 17.604 1.00 58.64 ? 282 LYS A CG 1 ATOM 1952 C CD . LYS A 1 258 ? -18.363 23.273 17.352 1.00 59.73 ? 282 LYS A CD 1 ATOM 1953 C CE . LYS A 1 258 ? -19.231 24.250 18.133 1.00 61.31 ? 282 LYS A CE 1 ATOM 1954 N NZ . LYS A 1 258 ? -20.687 23.958 18.029 1.00 63.25 ? 282 LYS A NZ 1 ATOM 1955 N N . LYS A 1 259 ? -14.106 24.177 19.206 1.00 57.28 ? 283 LYS A N 1 ATOM 1956 C CA . LYS A 1 259 ? -13.741 24.216 20.611 1.00 59.09 ? 283 LYS A CA 1 ATOM 1957 C C . LYS A 1 259 ? -14.872 23.709 21.523 1.00 61.66 ? 283 LYS A C 1 ATOM 1958 O O . LYS A 1 259 ? -15.971 24.254 21.520 1.00 62.52 ? 283 LYS A O 1 ATOM 1959 C CB . LYS A 1 259 ? -13.396 25.646 21.049 1.00 57.08 ? 283 LYS A CB 1 ATOM 1960 C CG . LYS A 1 259 ? -12.182 26.271 20.414 1.00 54.97 ? 283 LYS A CG 1 ATOM 1961 C CD . LYS A 1 259 ? -11.974 27.659 21.006 1.00 55.41 ? 283 LYS A CD 1 ATOM 1962 C CE . LYS A 1 259 ? -10.710 28.327 20.478 1.00 56.35 ? 283 LYS A CE 1 ATOM 1963 N NZ . LYS A 1 259 ? -10.379 29.584 21.223 1.00 56.99 ? 283 LYS A NZ 1 ATOM 1964 N N . GLY A 1 260 ? -14.593 22.668 22.302 1.00 64.42 ? 284 GLY A N 1 ATOM 1965 C CA . GLY A 1 260 ? -15.589 22.125 23.213 1.00 68.33 ? 284 GLY A CA 1 ATOM 1966 C C . GLY A 1 260 ? -16.663 21.308 22.535 1.00 70.73 ? 284 GLY A C 1 ATOM 1967 O O . GLY A 1 260 ? -17.852 21.604 22.661 1.00 71.34 ? 284 GLY A O 1 ATOM 1968 N N . GLY A 1 261 ? -16.250 20.278 21.808 1.00 72.22 ? 285 GLY A N 1 ATOM 1969 C CA . GLY A 1 261 ? -17.216 19.448 21.120 1.00 73.87 ? 285 GLY A CA 1 ATOM 1970 C C . GLY A 1 261 ? -16.806 19.138 19.700 1.00 74.53 ? 285 GLY A C 1 ATOM 1971 O O . GLY A 1 261 ? -15.990 19.829 19.116 1.00 74.47 ? 285 GLY A O 1 ATOM 1972 N N . ASP A 1 262 ? -17.378 18.082 19.144 1.00 76.29 ? 286 ASP A N 1 ATOM 1973 C CA . ASP A 1 262 ? -17.073 17.672 17.783 1.00 77.90 ? 286 ASP A CA 1 ATOM 1974 C C . ASP A 1 262 ? -18.002 18.424 16.811 1.00 76.78 ? 286 ASP A C 1 ATOM 1975 O O . ASP A 1 262 ? -18.990 19.042 17.219 1.00 77.34 ? 286 ASP A O 1 ATOM 1976 C CB . ASP A 1 262 ? -17.261 16.156 17.651 1.00 81.48 ? 286 ASP A CB 1 ATOM 1977 C CG . ASP A 1 262 ? -16.616 15.382 18.801 1.00 84.91 ? 286 ASP A CG 1 ATOM 1978 O OD1 . ASP A 1 262 ? -15.438 15.665 19.131 1.00 86.09 ? 286 ASP A OD1 1 ATOM 1979 O OD2 . ASP A 1 262 ? -17.286 14.485 19.368 1.00 86.63 ? 286 ASP A OD2 1 ATOM 1980 N N . LEU A 1 263 ? -17.670 18.379 15.527 1.00 75.24 ? 287 LEU A N 1 ATOM 1981 C CA . LEU A 1 263 ? -18.468 19.033 14.494 1.00 74.15 ? 287 LEU A CA 1 ATOM 1982 C C . LEU A 1 263 ? -19.656 18.129 14.144 1.00 74.91 ? 287 LEU A C 1 ATOM 1983 O O . LEU A 1 263 ? -19.516 16.900 14.127 1.00 75.80 ? 287 LEU A O 1 ATOM 1984 C CB . LEU A 1 263 ? -17.633 19.234 13.241 1.00 72.16 ? 287 LEU A CB 1 ATOM 1985 C CG . LEU A 1 263 ? -16.288 19.932 13.377 1.00 70.70 ? 287 LEU A CG 1 ATOM 1986 C CD1 . LEU A 1 263 ? -15.537 19.812 12.068 1.00 70.15 ? 287 LEU A CD1 1 ATOM 1987 C CD2 . LEU A 1 263 ? -16.490 21.384 13.763 1.00 69.86 ? 287 LEU A CD2 1 ATOM 1988 N N . PRO A 1 264 ? -20.826 18.716 13.808 1.00 75.15 ? 288 PRO A N 1 ATOM 1989 C CA . PRO A 1 264 ? -22.031 17.935 13.468 1.00 75.00 ? 288 PRO A CA 1 ATOM 1990 C C . PRO A 1 264 ? -21.769 16.989 12.316 1.00 75.56 ? 288 PRO A C 1 ATOM 1991 O O . PRO A 1 264 ? -21.778 17.424 11.181 1.00 75.24 ? 288 PRO A O 1 ATOM 1992 C CB . PRO A 1 264 ? -23.047 19.010 13.099 1.00 74.75 ? 288 PRO A CB 1 ATOM 1993 C CG . PRO A 1 264 ? -22.591 20.206 13.901 1.00 74.70 ? 288 PRO A CG 1 ATOM 1994 C CD . PRO A 1 264 ? -21.100 20.161 13.729 1.00 74.64 ? 288 PRO A CD 1 ATOM 1995 N N . SER A 1 265 ? -21.560 15.704 12.597 1.00 77.02 ? 289 SER A N 1 ATOM 1996 C CA . SER A 1 265 ? -21.250 14.713 11.552 1.00 78.41 ? 289 SER A CA 1 ATOM 1997 C C . SER A 1 265 ? -22.235 14.624 10.389 1.00 77.50 ? 289 SER A C 1 ATOM 1998 O O . SER A 1 265 ? -21.847 14.349 9.255 1.00 78.29 ? 289 SER A O 1 ATOM 1999 C CB . SER A 1 265 ? -21.062 13.312 12.169 1.00 80.17 ? 289 SER A CB 1 ATOM 2000 O OG . SER A 1 265 ? -22.297 12.658 12.423 1.00 83.23 ? 289 SER A OG 1 ATOM 2001 N N . ASP A 1 266 ? -23.505 14.871 10.674 1.00 75.78 ? 290 ASP A N 1 ATOM 2002 C CA . ASP A 1 266 ? -24.553 14.795 9.666 1.00 73.92 ? 290 ASP A CA 1 ATOM 2003 C C . ASP A 1 266 ? -24.788 16.128 8.961 1.00 70.30 ? 290 ASP A C 1 ATOM 2004 O O . ASP A 1 266 ? -25.206 16.174 7.803 1.00 70.17 ? 290 ASP A O 1 ATOM 2005 C CB . ASP A 1 266 ? -25.858 14.379 10.342 1.00 77.43 ? 290 ASP A CB 1 ATOM 2006 C CG . ASP A 1 266 ? -26.485 15.518 11.148 1.00 80.07 ? 290 ASP A CG 1 ATOM 2007 O OD1 . ASP A 1 266 ? -25.767 16.135 11.969 1.00 81.04 ? 290 ASP A OD1 1 ATOM 2008 O OD2 . ASP A 1 266 ? -27.695 15.791 10.960 1.00 81.05 ? 290 ASP A OD2 1 ATOM 2009 N N . LYS A 1 267 ? -24.490 17.204 9.670 1.00 66.50 ? 291 LYS A N 1 ATOM 2010 C CA . LYS A 1 267 ? -24.728 18.560 9.201 1.00 63.33 ? 291 LYS A CA 1 ATOM 2011 C C . LYS A 1 267 ? -23.524 19.373 8.675 1.00 64.09 ? 291 LYS A C 1 ATOM 2012 O O . LYS A 1 267 ? -23.621 20.585 8.427 1.00 64.87 ? 291 LYS A O 1 ATOM 2013 C CB . LYS A 1 267 ? -25.441 19.303 10.347 1.00 58.51 ? 291 LYS A CB 1 ATOM 2014 C CG . LYS A 1 267 ? -25.681 20.782 10.171 1.00 53.15 ? 291 LYS A CG 1 ATOM 2015 C CD . LYS A 1 267 ? -27.084 21.182 10.633 1.00 48.92 ? 291 LYS A CD 1 ATOM 2016 C CE . LYS A 1 267 ? -27.088 22.198 11.761 1.00 43.61 ? 291 LYS A CE 1 ATOM 2017 N NZ . LYS A 1 267 ? -26.871 21.560 13.087 1.00 42.33 ? 291 LYS A NZ 1 ATOM 2018 N N . ALA A 1 268 ? -22.396 18.695 8.479 1.00 64.47 ? 292 ALA A N 1 ATOM 2019 C CA . ALA A 1 268 ? -21.172 19.346 8.022 1.00 64.40 ? 292 ALA A CA 1 ATOM 2020 C C . ALA A 1 268 ? -20.480 18.593 6.925 1.00 65.40 ? 292 ALA A C 1 ATOM 2021 O O . ALA A 1 268 ? -20.388 17.377 6.954 1.00 65.65 ? 292 ALA A O 1 ATOM 2022 C CB . ALA A 1 268 ? -20.220 19.532 9.177 1.00 63.79 ? 292 ALA A CB 1 ATOM 2023 N N . LYS A 1 269 ? -19.972 19.324 5.954 1.00 66.56 ? 293 LYS A N 1 ATOM 2024 C CA . LYS A 1 269 ? -19.267 18.691 4.863 1.00 68.48 ? 293 LYS A CA 1 ATOM 2025 C C . LYS A 1 269 ? -18.047 19.515 4.469 1.00 67.41 ? 293 LYS A C 1 ATOM 2026 O O . LYS A 1 269 ? -18.046 20.735 4.635 1.00 66.76 ? 293 LYS A O 1 ATOM 2027 C CB . LYS A 1 269 ? -20.195 18.491 3.661 1.00 71.56 ? 293 LYS A CB 1 ATOM 2028 C CG . LYS A 1 269 ? -21.005 17.204 3.754 1.00 76.43 ? 293 LYS A CG 1 ATOM 2029 C CD . LYS A 1 269 ? -21.741 16.858 2.462 1.00 80.66 ? 293 LYS A CD 1 ATOM 2030 C CE . LYS A 1 269 ? -22.321 15.439 2.525 1.00 82.78 ? 293 LYS A CE 1 ATOM 2031 N NZ . LYS A 1 269 ? -23.151 15.209 3.756 1.00 86.04 ? 293 LYS A NZ 1 ATOM 2032 N N . PHE A 1 270 ? -17.002 18.835 3.990 1.00 66.73 ? 294 PHE A N 1 ATOM 2033 C CA . PHE A 1 270 ? -15.761 19.478 3.574 1.00 65.68 ? 294 PHE A CA 1 ATOM 2034 C C . PHE A 1 270 ? -15.851 19.635 2.089 1.00 65.31 ? 294 PHE A C 1 ATOM 2035 O O . PHE A 1 270 ? -15.684 18.690 1.336 1.00 64.69 ? 294 PHE A O 1 ATOM 2036 C CB . PHE A 1 270 ? -14.572 18.625 3.977 1.00 65.33 ? 294 PHE A CB 1 ATOM 2037 C CG . PHE A 1 270 ? -14.586 18.249 5.426 1.00 64.70 ? 294 PHE A CG 1 ATOM 2038 C CD1 . PHE A 1 270 ? -15.471 17.290 5.892 1.00 65.58 ? 294 PHE A CD1 1 ATOM 2039 C CD2 . PHE A 1 270 ? -13.754 18.885 6.332 1.00 64.45 ? 294 PHE A CD2 1 ATOM 2040 C CE1 . PHE A 1 270 ? -15.530 16.970 7.239 1.00 66.11 ? 294 PHE A CE1 1 ATOM 2041 C CE2 . PHE A 1 270 ? -13.803 18.576 7.674 1.00 64.93 ? 294 PHE A CE2 1 ATOM 2042 C CZ . PHE A 1 270 ? -14.692 17.617 8.134 1.00 65.41 ? 294 PHE A CZ 1 ATOM 2043 N N . GLU A 1 271 ? -16.094 20.871 1.695 1.00 65.92 ? 295 GLU A N 1 ATOM 2044 C CA . GLU A 1 271 ? -16.317 21.252 0.324 1.00 66.01 ? 295 GLU A CA 1 ATOM 2045 C C . GLU A 1 271 ? -15.165 21.289 -0.645 1.00 64.47 ? 295 GLU A C 1 ATOM 2046 O O . GLU A 1 271 ? -15.206 20.626 -1.683 1.00 67.10 ? 295 GLU A O 1 ATOM 2047 C CB . GLU A 1 271 ? -17.018 22.600 0.342 1.00 68.60 ? 295 GLU A CB 1 ATOM 2048 C CG . GLU A 1 271 ? -17.868 22.893 -0.852 1.00 73.42 ? 295 GLU A CG 1 ATOM 2049 C CD . GLU A 1 271 ? -18.851 24.001 -0.562 1.00 76.93 ? 295 GLU A CD 1 ATOM 2050 O OE1 . GLU A 1 271 ? -18.398 25.088 -0.134 1.00 78.58 ? 295 GLU A OE1 1 ATOM 2051 O OE2 . GLU A 1 271 ? -20.070 23.784 -0.756 1.00 78.93 ? 295 GLU A OE2 1 ATOM 2052 N N . ASN A 1 272 ? -14.139 22.059 -0.321 1.00 59.91 ? 296 ASN A N 1 ATOM 2053 C CA . ASN A 1 272 ? -13.005 22.192 -1.228 1.00 56.89 ? 296 ASN A CA 1 ATOM 2054 C C . ASN A 1 272 ? -12.087 20.988 -1.132 1.00 55.30 ? 296 ASN A C 1 ATOM 2055 O O . ASN A 1 272 ? -12.509 19.836 -1.388 1.00 54.99 ? 296 ASN A O 1 ATOM 2056 C CB . ASN A 1 272 ? -12.234 23.463 -0.922 1.00 57.65 ? 296 ASN A CB 1 ATOM 2057 C CG . ASN A 1 272 ? -11.499 23.984 -2.125 1.00 58.32 ? 296 ASN A CG 1 ATOM 2058 O OD1 . ASN A 1 272 ? -10.762 23.245 -2.770 1.00 58.58 ? 296 ASN A OD1 1 ATOM 2059 N ND2 . ASN A 1 272 ? -11.687 25.265 -2.436 1.00 56.95 ? 296 ASN A ND2 1 ATOM 2060 N N . PHE A 1 273 ? -10.819 21.247 -0.810 1.00 53.34 ? 297 PHE A N 1 ATOM 2061 C CA . PHE A 1 273 ? -9.856 20.161 -0.626 1.00 51.16 ? 297 PHE A CA 1 ATOM 2062 C C . PHE A 1 273 ? -9.468 20.319 0.846 1.00 50.01 ? 297 PHE A C 1 ATOM 2063 O O . PHE A 1 273 ? -8.323 20.524 1.227 1.00 49.87 ? 297 PHE A O 1 ATOM 2064 C CB . PHE A 1 273 ? -8.662 20.301 -1.579 1.00 50.36 ? 297 PHE A CB 1 ATOM 2065 C CG . PHE A 1 273 ? -9.019 20.057 -3.021 1.00 49.88 ? 297 PHE A CG 1 ATOM 2066 C CD1 . PHE A 1 273 ? -9.278 21.119 -3.880 1.00 49.41 ? 297 PHE A CD1 1 ATOM 2067 C CD2 . PHE A 1 273 ? -9.156 18.756 -3.509 1.00 51.36 ? 297 PHE A CD2 1 ATOM 2068 C CE1 . PHE A 1 273 ? -9.673 20.894 -5.211 1.00 50.14 ? 297 PHE A CE1 1 ATOM 2069 C CE2 . PHE A 1 273 ? -9.552 18.516 -4.841 1.00 52.01 ? 297 PHE A CE2 1 ATOM 2070 C CZ . PHE A 1 273 ? -9.811 19.591 -5.691 1.00 50.67 ? 297 PHE A CZ 1 ATOM 2071 N N . ASN A 1 274 ? -10.504 20.208 1.663 1.00 49.07 ? 298 ASN A N 1 ATOM 2072 C CA . ASN A 1 274 ? -10.484 20.364 3.111 1.00 48.23 ? 298 ASN A CA 1 ATOM 2073 C C . ASN A 1 274 ? -10.130 21.792 3.491 1.00 46.79 ? 298 ASN A C 1 ATOM 2074 O O . ASN A 1 274 ? -9.977 22.116 4.673 1.00 47.21 ? 298 ASN A O 1 ATOM 2075 C CB . ASN A 1 274 ? -9.534 19.372 3.761 1.00 49.31 ? 298 ASN A CB 1 ATOM 2076 C CG . ASN A 1 274 ? -10.083 17.975 3.744 1.00 51.76 ? 298 ASN A CG 1 ATOM 2077 O OD1 . ASN A 1 274 ? -9.613 17.108 4.477 1.00 55.59 ? 298 ASN A OD1 1 ATOM 2078 N ND2 . ASN A 1 274 ? -11.088 17.740 2.900 1.00 51.24 ? 298 ASN A ND2 1 ATOM 2079 N N . LYS A 1 275 ? -10.056 22.655 2.482 1.00 44.30 ? 299 LYS A N 1 ATOM 2080 C CA . LYS A 1 275 ? -9.731 24.053 2.709 1.00 43.37 ? 299 LYS A CA 1 ATOM 2081 C C . LYS A 1 275 ? -10.944 24.816 3.229 1.00 42.72 ? 299 LYS A C 1 ATOM 2082 O O . LYS A 1 275 ? -10.825 25.863 3.878 1.00 44.43 ? 299 LYS A O 1 ATOM 2083 C CB . LYS A 1 275 ? -9.222 24.719 1.431 1.00 43.57 ? 299 LYS A CB 1 ATOM 2084 C CG . LYS A 1 275 ? -7.825 24.299 0.973 1.00 44.29 ? 299 LYS A CG 1 ATOM 2085 C CD . LYS A 1 275 ? -7.303 25.237 -0.115 1.00 42.84 ? 299 LYS A CD 1 ATOM 2086 C CE . LYS A 1 275 ? -6.080 24.697 -0.829 1.00 44.14 ? 299 LYS A CE 1 ATOM 2087 N NZ . LYS A 1 275 ? -6.401 23.967 -2.100 1.00 43.86 ? 299 LYS A NZ 1 ATOM 2088 N N . ALA A 1 276 ? -12.121 24.290 2.930 1.00 40.80 ? 300 ALA A N 1 ATOM 2089 C CA . ALA A 1 276 ? -13.356 24.923 3.359 1.00 38.30 ? 300 ALA A CA 1 ATOM 2090 C C . ALA A 1 276 ? -14.350 23.950 4.018 1.00 36.91 ? 300 ALA A C 1 ATOM 2091 O O . ALA A 1 276 ? -14.527 22.802 3.591 1.00 38.13 ? 300 ALA A O 1 ATOM 2092 C CB . ALA A 1 276 ? -13.999 25.621 2.179 1.00 38.87 ? 300 ALA A CB 1 ATOM 2093 N N . LEU A 1 277 ? -14.993 24.440 5.070 1.00 34.37 ? 301 LEU A N 1 ATOM 2094 C CA . LEU A 1 277 ? -15.961 23.692 5.859 1.00 31.19 ? 301 LEU A CA 1 ATOM 2095 C C . LEU A 1 277 ? -17.327 24.339 5.704 1.00 30.93 ? 301 LEU A C 1 ATOM 2096 O O . LEU A 1 277 ? -17.476 25.550 5.872 1.00 28.18 ? 301 LEU A O 1 ATOM 2097 C CB . LEU A 1 277 ? -15.570 23.715 7.329 1.00 30.33 ? 301 LEU A CB 1 ATOM 2098 C CG . LEU A 1 277 ? -16.441 22.882 8.262 1.00 28.03 ? 301 LEU A CG 1 ATOM 2099 C CD1 . LEU A 1 277 ? -16.273 21.423 7.905 1.00 30.23 ? 301 LEU A CD1 1 ATOM 2100 C CD2 . LEU A 1 277 ? -16.036 23.117 9.702 1.00 26.34 ? 301 LEU A CD2 1 ATOM 2101 N N . ARG A 1 278 ? -18.338 23.535 5.411 1.00 31.93 ? 302 ARG A N 1 ATOM 2102 C CA . ARG A 1 278 ? -19.692 24.058 5.243 1.00 31.62 ? 302 ARG A CA 1 ATOM 2103 C C . ARG A 1 278 ? -20.694 23.402 6.165 1.00 32.61 ? 302 ARG A C 1 ATOM 2104 O O . ARG A 1 278 ? -20.881 22.201 6.141 1.00 33.72 ? 302 ARG A O 1 ATOM 2105 C CB . ARG A 1 278 ? -20.109 23.876 3.793 1.00 29.07 ? 302 ARG A CB 1 ATOM 2106 C CG . ARG A 1 278 ? -21.595 23.846 3.560 1.00 27.26 ? 302 ARG A CG 1 ATOM 2107 C CD . ARG A 1 278 ? -21.867 23.573 2.083 1.00 26.53 ? 302 ARG A CD 1 ATOM 2108 N NE . ARG A 1 278 ? -21.252 24.603 1.254 1.00 22.24 ? 302 ARG A NE 1 ATOM 2109 C CZ . ARG A 1 278 ? -21.740 25.825 1.117 1.00 21.15 ? 302 ARG A CZ 1 ATOM 2110 N NH1 . ARG A 1 278 ? -22.859 26.164 1.740 1.00 22.56 ? 302 ARG A NH1 1 ATOM 2111 N NH2 . ARG A 1 278 ? -21.092 26.724 0.399 1.00 22.21 ? 302 ARG A NH2 1 ATOM 2112 N N . ILE A 1 279 ? -21.323 24.199 7.002 1.00 34.79 ? 303 ILE A N 1 ATOM 2113 C CA . ILE A 1 279 ? -22.318 23.678 7.901 1.00 37.25 ? 303 ILE A CA 1 ATOM 2114 C C . ILE A 1 279 ? -23.621 24.257 7.385 1.00 38.74 ? 303 ILE A C 1 ATOM 2115 O O . ILE A 1 279 ? -23.804 25.492 7.385 1.00 38.66 ? 303 ILE A O 1 ATOM 2116 C CB . ILE A 1 279 ? -22.107 24.173 9.336 1.00 37.40 ? 303 ILE A CB 1 ATOM 2117 C CG1 . ILE A 1 279 ? -21.040 23.341 10.040 1.00 38.98 ? 303 ILE A CG1 1 ATOM 2118 C CG2 . ILE A 1 279 ? -23.396 24.059 10.111 1.00 37.79 ? 303 ILE A CG2 1 ATOM 2119 C CD1 . ILE A 1 279 ? -19.648 23.607 9.593 1.00 41.93 ? 303 ILE A CD1 1 ATOM 2120 N N . THR A 1 280 ? -24.516 23.373 6.940 1.00 40.15 ? 304 THR A N 1 ATOM 2121 C CA . THR A 1 280 ? -25.804 23.790 6.406 1.00 43.91 ? 304 THR A CA 1 ATOM 2122 C C . THR A 1 280 ? -26.907 23.929 7.420 1.00 45.79 ? 304 THR A C 1 ATOM 2123 O O . THR A 1 280 ? -26.926 23.263 8.416 1.00 45.82 ? 304 THR A O 1 ATOM 2124 C CB . THR A 1 280 ? -26.293 22.800 5.374 1.00 44.14 ? 304 THR A CB 1 ATOM 2125 O OG1 . THR A 1 280 ? -26.099 21.475 5.881 1.00 45.65 ? 304 THR A OG1 1 ATOM 2126 C CG2 . THR A 1 280 ? -25.548 22.981 4.063 1.00 45.28 ? 304 THR A CG2 1 ATOM 2127 N N . ASN A 1 281 ? -27.850 24.804 7.148 1.00 49.68 ? 305 ASN A N 1 ATOM 2128 C CA . ASN A 1 281 ? -28.968 24.965 8.052 1.00 53.68 ? 305 ASN A CA 1 ATOM 2129 C C . ASN A 1 281 ? -28.437 25.129 9.475 1.00 54.02 ? 305 ASN A C 1 ATOM 2130 O O . ASN A 1 281 ? -28.563 24.228 10.294 1.00 54.31 ? 305 ASN A O 1 ATOM 2131 C CB . ASN A 1 281 ? -29.869 23.720 7.960 1.00 56.45 ? 305 ASN A CB 1 ATOM 2132 C CG . ASN A 1 281 ? -31.301 23.992 8.399 1.00 58.55 ? 305 ASN A CG 1 ATOM 2133 O OD1 . ASN A 1 281 ? -31.932 23.151 9.047 1.00 59.18 ? 305 ASN A OD1 1 ATOM 2134 N ND2 . ASN A 1 281 ? -31.826 25.163 8.034 1.00 60.04 ? 305 ASN A ND2 1 ATOM 2135 N N . VAL A 1 282 ? -27.849 26.277 9.776 1.00 54.07 ? 306 VAL A N 1 ATOM 2136 C CA . VAL A 1 282 ? -27.334 26.482 11.124 1.00 56.39 ? 306 VAL A CA 1 ATOM 2137 C C . VAL A 1 282 ? -28.424 26.823 12.111 1.00 58.33 ? 306 VAL A C 1 ATOM 2138 O O . VAL A 1 282 ? -29.516 27.204 11.696 1.00 59.12 ? 306 VAL A O 1 ATOM 2139 C CB . VAL A 1 282 ? -26.297 27.619 11.187 1.00 55.54 ? 306 VAL A CB 1 ATOM 2140 C CG1 . VAL A 1 282 ? -25.130 27.299 10.307 1.00 55.60 ? 306 VAL A CG1 1 ATOM 2141 C CG2 . VAL A 1 282 ? -26.928 28.918 10.781 1.00 55.34 ? 306 VAL A CG2 1 ATOM 2142 N N . SER A 1 283 ? -28.116 26.671 13.404 1.00 61.47 ? 307 SER A N 1 ATOM 2143 C CA . SER A 1 283 ? -29.028 27.004 14.506 1.00 66.07 ? 307 SER A CA 1 ATOM 2144 C C . SER A 1 283 ? -28.227 27.741 15.588 1.00 68.49 ? 307 SER A C 1 ATOM 2145 O O . SER A 1 283 ? -27.049 28.018 15.407 1.00 69.91 ? 307 SER A O 1 ATOM 2146 C CB . SER A 1 283 ? -29.644 25.738 15.101 1.00 66.69 ? 307 SER A CB 1 ATOM 2147 O OG . SER A 1 283 ? -28.669 24.967 15.779 1.00 68.21 ? 307 SER A OG 1 ATOM 2148 N N . GLU A 1 284 ? -28.850 28.070 16.710 1.00 70.91 ? 308 GLU A N 1 ATOM 2149 C CA . GLU A 1 284 ? -28.123 28.775 17.761 1.00 72.98 ? 308 GLU A CA 1 ATOM 2150 C C . GLU A 1 284 ? -27.114 27.882 18.467 1.00 72.74 ? 308 GLU A C 1 ATOM 2151 O O . GLU A 1 284 ? -26.272 28.347 19.239 1.00 72.87 ? 308 GLU A O 1 ATOM 2152 C CB . GLU A 1 284 ? -29.094 29.358 18.779 1.00 75.82 ? 308 GLU A CB 1 ATOM 2153 C CG . GLU A 1 284 ? -29.630 30.725 18.387 1.00 79.56 ? 308 GLU A CG 1 ATOM 2154 C CD . GLU A 1 284 ? -30.502 30.695 17.143 1.00 81.26 ? 308 GLU A CD 1 ATOM 2155 O OE1 . GLU A 1 284 ? -30.915 31.785 16.688 1.00 80.24 ? 308 GLU A OE1 1 ATOM 2156 O OE2 . GLU A 1 284 ? -30.780 29.589 16.623 1.00 82.25 ? 308 GLU A OE2 1 ATOM 2157 N N . GLU A 1 285 ? -27.208 26.591 18.200 1.00 71.74 ? 309 GLU A N 1 ATOM 2158 C CA . GLU A 1 285 ? -26.326 25.625 18.828 1.00 70.76 ? 309 GLU A CA 1 ATOM 2159 C C . GLU A 1 285 ? -25.001 25.537 18.096 1.00 67.87 ? 309 GLU A C 1 ATOM 2160 O O . GLU A 1 285 ? -24.029 25.016 18.642 1.00 67.28 ? 309 GLU A O 1 ATOM 2161 C CB . GLU A 1 285 ? -26.991 24.243 18.844 1.00 74.69 ? 309 GLU A CB 1 ATOM 2162 C CG . GLU A 1 285 ? -28.320 24.164 19.600 1.00 77.80 ? 309 GLU A CG 1 ATOM 2163 C CD . GLU A 1 285 ? -28.913 22.754 19.605 1.00 78.97 ? 309 GLU A CD 1 ATOM 2164 O OE1 . GLU A 1 285 ? -28.247 21.820 20.110 1.00 78.07 ? 309 GLU A OE1 1 ATOM 2165 O OE2 . GLU A 1 285 ? -30.046 22.583 19.104 1.00 79.62 ? 309 GLU A OE2 1 ATOM 2166 N N . ASP A 1 286 ? -24.958 26.030 16.863 1.00 64.31 ? 310 ASP A N 1 ATOM 2167 C CA . ASP A 1 286 ? -23.723 25.962 16.096 1.00 61.90 ? 310 ASP A CA 1 ATOM 2168 C C . ASP A 1 286 ? -22.821 27.159 16.298 1.00 59.30 ? 310 ASP A C 1 ATOM 2169 O O . ASP A 1 286 ? -21.702 27.215 15.811 1.00 58.79 ? 310 ASP A O 1 ATOM 2170 C CB . ASP A 1 286 ? -24.035 25.774 14.627 1.00 63.17 ? 310 ASP A CB 1 ATOM 2171 C CG . ASP A 1 286 ? -24.598 24.411 14.347 1.00 65.31 ? 310 ASP A CG 1 ATOM 2172 O OD1 . ASP A 1 286 ? -23.995 23.421 14.822 1.00 66.46 ? 310 ASP A OD1 1 ATOM 2173 O OD2 . ASP A 1 286 ? -25.637 24.328 13.661 1.00 67.03 ? 310 ASP A OD2 1 ATOM 2174 N N . SER A 1 287 ? -23.323 28.116 17.052 1.00 56.58 ? 311 SER A N 1 ATOM 2175 C CA . SER A 1 287 ? -22.588 29.310 17.370 1.00 54.02 ? 311 SER A CA 1 ATOM 2176 C C . SER A 1 287 ? -21.452 28.904 18.309 1.00 52.86 ? 311 SER A C 1 ATOM 2177 O O . SER A 1 287 ? -21.656 28.167 19.283 1.00 53.48 ? 311 SER A O 1 ATOM 2178 C CB . SER A 1 287 ? -23.530 30.308 18.055 1.00 53.09 ? 311 SER A CB 1 ATOM 2179 O OG . SER A 1 287 ? -22.850 31.437 18.562 1.00 51.20 ? 311 SER A OG 1 ATOM 2180 N N . GLY A 1 288 ? -20.245 29.369 18.007 1.00 52.59 ? 312 GLY A N 1 ATOM 2181 C CA . GLY A 1 288 ? -19.105 29.063 18.860 1.00 50.79 ? 312 GLY A CA 1 ATOM 2182 C C . GLY A 1 288 ? -17.788 29.511 18.266 1.00 48.79 ? 312 GLY A C 1 ATOM 2183 O O . GLY A 1 288 ? -17.752 30.508 17.551 1.00 48.77 ? 312 GLY A O 1 ATOM 2184 N N . GLU A 1 289 ? -16.708 28.795 18.580 1.00 47.12 ? 313 GLU A N 1 ATOM 2185 C CA . GLU A 1 289 ? -15.411 29.117 18.013 1.00 44.30 ? 313 GLU A CA 1 ATOM 2186 C C . GLU A 1 289 ? -14.883 27.896 17.278 1.00 41.32 ? 313 GLU A C 1 ATOM 2187 O O . GLU A 1 289 ? -14.848 26.832 17.817 1.00 40.58 ? 313 GLU A O 1 ATOM 2188 C CB . GLU A 1 289 ? -14.447 29.554 19.103 1.00 46.00 ? 313 GLU A CB 1 ATOM 2189 C CG . GLU A 1 289 ? -14.918 30.819 19.797 1.00 52.76 ? 313 GLU A CG 1 ATOM 2190 C CD . GLU A 1 289 ? -13.900 31.406 20.769 1.00 56.96 ? 313 GLU A CD 1 ATOM 2191 O OE1 . GLU A 1 289 ? -13.487 30.696 21.715 1.00 59.71 ? 313 GLU A OE1 1 ATOM 2192 O OE2 . GLU A 1 289 ? -13.526 32.588 20.590 1.00 58.56 ? 313 GLU A OE2 1 ATOM 2193 N N . TYR A 1 290 ? -14.547 28.043 16.008 1.00 39.40 ? 314 TYR A N 1 ATOM 2194 C CA . TYR A 1 290 ? -14.026 26.942 15.200 1.00 39.05 ? 314 TYR A CA 1 ATOM 2195 C C . TYR A 1 290 ? -12.617 27.334 14.811 1.00 39.52 ? 314 TYR A C 1 ATOM 2196 O O . TYR A 1 290 ? -12.287 28.506 14.777 1.00 40.22 ? 314 TYR A O 1 ATOM 2197 C CB . TYR A 1 290 ? -14.813 26.780 13.900 1.00 37.90 ? 314 TYR A CB 1 ATOM 2198 C CG . TYR A 1 290 ? -16.266 26.455 14.039 1.00 35.97 ? 314 TYR A CG 1 ATOM 2199 C CD1 . TYR A 1 290 ? -17.130 27.315 14.702 1.00 36.78 ? 314 TYR A CD1 1 ATOM 2200 C CD2 . TYR A 1 290 ? -16.792 25.309 13.460 1.00 35.46 ? 314 TYR A CD2 1 ATOM 2201 C CE1 . TYR A 1 290 ? -18.490 27.051 14.787 1.00 36.02 ? 314 TYR A CE1 1 ATOM 2202 C CE2 . TYR A 1 290 ? -18.150 25.029 13.535 1.00 36.19 ? 314 TYR A CE2 1 ATOM 2203 C CZ . TYR A 1 290 ? -18.995 25.908 14.204 1.00 36.02 ? 314 TYR A CZ 1 ATOM 2204 O OH . TYR A 1 290 ? -20.340 25.647 14.299 1.00 35.05 ? 314 TYR A OH 1 ATOM 2205 N N . PHE A 1 291 ? -11.788 26.364 14.478 1.00 40.29 ? 315 PHE A N 1 ATOM 2206 C CA . PHE A 1 291 ? -10.431 26.697 14.098 1.00 41.21 ? 315 PHE A CA 1 ATOM 2207 C C . PHE A 1 291 ? -9.851 25.647 13.178 1.00 41.04 ? 315 PHE A C 1 ATOM 2208 O O . PHE A 1 291 ? -10.282 24.494 13.155 1.00 41.27 ? 315 PHE A O 1 ATOM 2209 C CB . PHE A 1 291 ? -9.535 26.896 15.333 1.00 42.52 ? 315 PHE A CB 1 ATOM 2210 C CG . PHE A 1 291 ? -9.310 25.649 16.147 1.00 43.93 ? 315 PHE A CG 1 ATOM 2211 C CD1 . PHE A 1 291 ? -8.477 24.635 15.691 1.00 45.02 ? 315 PHE A CD1 1 ATOM 2212 C CD2 . PHE A 1 291 ? -9.937 25.488 17.368 1.00 43.65 ? 315 PHE A CD2 1 ATOM 2213 C CE1 . PHE A 1 291 ? -8.281 23.479 16.442 1.00 44.12 ? 315 PHE A CE1 1 ATOM 2214 C CE2 . PHE A 1 291 ? -9.744 24.334 18.122 1.00 44.36 ? 315 PHE A CE2 1 ATOM 2215 C CZ . PHE A 1 291 ? -8.914 23.330 17.653 1.00 44.30 ? 315 PHE A CZ 1 ATOM 2216 N N . CYS A 1 292 ? -8.892 26.044 12.367 1.00 41.41 ? 316 CYS A N 1 ATOM 2217 C CA . CYS A 1 292 ? -8.286 25.059 11.497 1.00 43.35 ? 316 CYS A CA 1 ATOM 2218 C C . CYS A 1 292 ? -6.772 25.093 11.736 1.00 44.38 ? 316 CYS A C 1 ATOM 2219 O O . CYS A 1 292 ? -6.215 26.111 12.203 1.00 44.47 ? 316 CYS A O 1 ATOM 2220 C CB . CYS A 1 292 ? -8.590 25.362 10.042 1.00 43.89 ? 316 CYS A CB 1 ATOM 2221 S SG . CYS A 1 292 ? -7.443 26.604 9.406 1.00 46.11 ? 316 CYS A SG 1 ATOM 2222 N N . LEU A 1 293 ? -6.116 23.974 11.437 1.00 44.56 ? 317 LEU A N 1 ATOM 2223 C CA . LEU A 1 293 ? -4.680 23.844 11.628 1.00 44.92 ? 317 LEU A CA 1 ATOM 2224 C C . LEU A 1 293 ? -4.028 23.592 10.296 1.00 45.92 ? 317 LEU A C 1 ATOM 2225 O O . LEU A 1 293 ? -4.445 22.702 9.541 1.00 46.28 ? 317 LEU A O 1 ATOM 2226 C CB . LEU A 1 293 ? -4.364 22.676 12.558 1.00 45.72 ? 317 LEU A CB 1 ATOM 2227 C CG . LEU A 1 293 ? -4.509 22.856 14.067 1.00 46.64 ? 317 LEU A CG 1 ATOM 2228 C CD1 . LEU A 1 293 ? -5.855 23.444 14.405 1.00 47.26 ? 317 LEU A CD1 1 ATOM 2229 C CD2 . LEU A 1 293 ? -4.338 21.501 14.739 1.00 47.87 ? 317 LEU A CD2 1 ATOM 2230 N N . ALA A 1 294 ? -2.998 24.357 9.985 1.00 46.63 ? 318 ALA A N 1 ATOM 2231 C CA . ALA A 1 294 ? -2.338 24.115 8.720 1.00 49.01 ? 318 ALA A CA 1 ATOM 2232 C C . ALA A 1 294 ? -1.056 23.298 8.971 1.00 50.56 ? 318 ALA A C 1 ATOM 2233 O O . ALA A 1 294 ? -0.002 23.861 9.248 1.00 49.70 ? 318 ALA A O 1 ATOM 2234 C CB . ALA A 1 294 ? -2.022 25.426 8.056 1.00 48.63 ? 318 ALA A CB 1 ATOM 2235 N N . SER A 1 295 ? -1.153 21.972 8.887 1.00 52.91 ? 319 SER A N 1 ATOM 2236 C CA . SER A 1 295 ? -0.001 21.115 9.123 1.00 55.21 ? 319 SER A CA 1 ATOM 2237 C C . SER A 1 295 ? 0.917 21.031 7.880 1.00 56.65 ? 319 SER A C 1 ATOM 2238 O O . SER A 1 295 ? 0.479 20.765 6.747 1.00 55.61 ? 319 SER A O 1 ATOM 2239 C CB . SER A 1 295 ? -0.437 19.696 9.532 1.00 57.51 ? 319 SER A CB 1 ATOM 2240 O OG . SER A 1 295 ? -0.593 18.828 8.415 1.00 59.84 ? 319 SER A OG 1 ATOM 2241 N N . ASN A 1 296 ? 2.209 21.258 8.127 1.00 59.49 ? 320 ASN A N 1 ATOM 2242 C CA . ASN A 1 296 ? 3.253 21.264 7.106 1.00 61.78 ? 320 ASN A CA 1 ATOM 2243 C C . ASN A 1 296 ? 4.314 20.193 7.371 1.00 63.69 ? 320 ASN A C 1 ATOM 2244 O O . ASN A 1 296 ? 4.120 19.016 7.093 1.00 64.36 ? 320 ASN A O 1 ATOM 2245 C CB . ASN A 1 296 ? 3.889 22.651 7.079 1.00 61.88 ? 320 ASN A CB 1 ATOM 2246 C CG . ASN A 1 296 ? 4.590 22.935 5.785 1.00 63.01 ? 320 ASN A CG 1 ATOM 2247 O OD1 . ASN A 1 296 ? 4.403 22.214 4.808 1.00 64.55 ? 320 ASN A OD1 1 ATOM 2248 N ND2 . ASN A 1 296 ? 5.393 23.997 5.756 1.00 63.96 ? 320 ASN A ND2 1 ATOM 2249 N N . LYS A 1 297 ? 5.464 20.617 7.865 1.00 66.32 ? 321 LYS A N 1 ATOM 2250 C CA . LYS A 1 297 ? 6.533 19.687 8.191 1.00 69.07 ? 321 LYS A CA 1 ATOM 2251 C C . LYS A 1 297 ? 7.440 20.415 9.131 1.00 69.58 ? 321 LYS A C 1 ATOM 2252 O O . LYS A 1 297 ? 7.907 19.820 10.096 1.00 70.51 ? 321 LYS A O 1 ATOM 2253 C CB . LYS A 1 297 ? 7.347 19.251 6.978 1.00 71.49 ? 321 LYS A CB 1 ATOM 2254 C CG . LYS A 1 297 ? 8.388 18.193 7.362 1.00 74.11 ? 321 LYS A CG 1 ATOM 2255 C CD . LYS A 1 297 ? 9.358 17.856 6.239 1.00 75.82 ? 321 LYS A CD 1 ATOM 2256 C CE . LYS A 1 297 ? 10.388 18.955 6.040 1.00 76.38 ? 321 LYS A CE 1 ATOM 2257 N NZ . LYS A 1 297 ? 11.349 18.620 4.952 1.00 77.83 ? 321 LYS A NZ 1 ATOM 2258 N N . MET A 1 298 ? 7.696 21.694 8.849 1.00 69.97 ? 322 MET A N 1 ATOM 2259 C CA . MET A 1 298 ? 8.543 22.503 9.725 1.00 71.83 ? 322 MET A CA 1 ATOM 2260 C C . MET A 1 298 ? 7.718 23.054 10.890 1.00 70.97 ? 322 MET A C 1 ATOM 2261 O O . MET A 1 298 ? 8.175 23.108 12.042 1.00 70.39 ? 322 MET A O 1 ATOM 2262 C CB . MET A 1 298 ? 9.161 23.688 8.979 1.00 73.83 ? 322 MET A CB 1 ATOM 2263 C CG . MET A 1 298 ? 10.496 23.408 8.335 1.00 76.84 ? 322 MET A CG 1 ATOM 2264 S SD . MET A 1 298 ? 10.288 22.504 6.811 1.00 79.69 ? 322 MET A SD 1 ATOM 2265 C CE . MET A 1 298 ? 9.867 23.857 5.734 1.00 80.01 ? 322 MET A CE 1 ATOM 2266 N N . GLY A 1 299 ? 6.498 23.470 10.570 1.00 70.98 ? 323 GLY A N 1 ATOM 2267 C CA . GLY A 1 299 ? 5.631 24.040 11.580 1.00 69.99 ? 323 GLY A CA 1 ATOM 2268 C C . GLY A 1 299 ? 4.164 23.810 11.301 1.00 68.21 ? 323 GLY A C 1 ATOM 2269 O O . GLY A 1 299 ? 3.802 23.196 10.298 1.00 67.51 ? 323 GLY A O 1 ATOM 2270 N N . SER A 1 300 ? 3.330 24.333 12.198 1.00 67.16 ? 324 SER A N 1 ATOM 2271 C CA . SER A 1 300 ? 1.878 24.178 12.125 1.00 64.99 ? 324 SER A CA 1 ATOM 2272 C C . SER A 1 300 ? 1.166 25.311 12.890 1.00 63.50 ? 324 SER A C 1 ATOM 2273 O O . SER A 1 300 ? 1.248 25.371 14.120 1.00 63.19 ? 324 SER A O 1 ATOM 2274 C CB . SER A 1 300 ? 1.487 22.828 12.726 1.00 64.47 ? 324 SER A CB 1 ATOM 2275 O OG . SER A 1 300 ? 0.102 22.592 12.613 1.00 64.01 ? 324 SER A OG 1 ATOM 2276 N N . ILE A 1 301 ? 0.498 26.218 12.173 1.00 62.32 ? 325 ILE A N 1 ATOM 2277 C CA . ILE A 1 301 ? -0.200 27.320 12.836 1.00 61.41 ? 325 ILE A CA 1 ATOM 2278 C C . ILE A 1 301 ? -1.698 27.084 12.875 1.00 60.17 ? 325 ILE A C 1 ATOM 2279 O O . ILE A 1 301 ? -2.239 26.226 12.167 1.00 59.88 ? 325 ILE A O 1 ATOM 2280 C CB . ILE A 1 301 ? 0.059 28.711 12.166 1.00 60.33 ? 325 ILE A CB 1 ATOM 2281 C CG1 . ILE A 1 301 ? -0.743 28.846 10.876 1.00 60.10 ? 325 ILE A CG1 1 ATOM 2282 C CG2 . ILE A 1 301 ? 1.541 28.898 11.897 1.00 61.39 ? 325 ILE A CG2 1 ATOM 2283 C CD1 . ILE A 1 301 ? -0.406 27.824 9.831 1.00 61.12 ? 325 ILE A CD1 1 ATOM 2284 N N . ARG A 1 302 ? -2.364 27.904 13.673 1.00 58.52 ? 326 ARG A N 1 ATOM 2285 C CA . ARG A 1 302 ? -3.786 27.770 13.915 1.00 56.20 ? 326 ARG A CA 1 ATOM 2286 C C . ARG A 1 302 ? -4.590 29.026 13.608 1.00 53.20 ? 326 ARG A C 1 ATOM 2287 O O . ARG A 1 302 ? -4.108 30.146 13.818 1.00 52.99 ? 326 ARG A O 1 ATOM 2288 C CB . ARG A 1 302 ? -3.955 27.382 15.387 1.00 59.91 ? 326 ARG A CB 1 ATOM 2289 C CG . ARG A 1 302 ? -5.343 27.135 15.924 1.00 62.05 ? 326 ARG A CG 1 ATOM 2290 C CD . ARG A 1 302 ? -5.175 26.929 17.418 1.00 65.78 ? 326 ARG A CD 1 ATOM 2291 N NE . ARG A 1 302 ? -6.364 26.443 18.106 1.00 71.16 ? 326 ARG A NE 1 ATOM 2292 C CZ . ARG A 1 302 ? -6.447 26.292 19.428 1.00 74.39 ? 326 ARG A CZ 1 ATOM 2293 N NH1 . ARG A 1 302 ? -5.409 26.593 20.202 1.00 75.29 ? 326 ARG A NH1 1 ATOM 2294 N NH2 . ARG A 1 302 ? -7.568 25.837 19.979 1.00 75.30 ? 326 ARG A NH2 1 ATOM 2295 N N . HIS A 1 303 ? -5.809 28.841 13.098 1.00 49.54 ? 327 HIS A N 1 ATOM 2296 C CA . HIS A 1 303 ? -6.693 29.978 12.839 1.00 45.43 ? 327 HIS A CA 1 ATOM 2297 C C . HIS A 1 303 ? -8.027 29.833 13.553 1.00 43.66 ? 327 HIS A C 1 ATOM 2298 O O . HIS A 1 303 ? -8.760 28.876 13.272 1.00 41.77 ? 327 HIS A O 1 ATOM 2299 C CB . HIS A 1 303 ? -6.995 30.147 11.349 1.00 43.75 ? 327 HIS A CB 1 ATOM 2300 C CG . HIS A 1 303 ? -7.616 31.472 11.033 1.00 43.61 ? 327 HIS A CG 1 ATOM 2301 N ND1 . HIS A 1 303 ? -8.810 31.880 11.591 1.00 44.21 ? 327 HIS A ND1 1 ATOM 2302 C CD2 . HIS A 1 303 ? -7.140 32.540 10.352 1.00 42.20 ? 327 HIS A CD2 1 ATOM 2303 C CE1 . HIS A 1 303 ? -9.035 33.142 11.278 1.00 42.25 ? 327 HIS A CE1 1 ATOM 2304 N NE2 . HIS A 1 303 ? -8.035 33.567 10.528 1.00 42.24 ? 327 HIS A NE2 1 ATOM 2305 N N . THR A 1 304 ? -8.339 30.758 14.466 1.00 41.71 ? 328 THR A N 1 ATOM 2306 C CA . THR A 1 304 ? -9.613 30.705 15.167 1.00 42.11 ? 328 THR A CA 1 ATOM 2307 C C . THR A 1 304 ? -10.668 31.652 14.571 1.00 40.36 ? 328 THR A C 1 ATOM 2308 O O . THR A 1 304 ? -10.467 32.872 14.455 1.00 41.58 ? 328 THR A O 1 ATOM 2309 C CB . THR A 1 304 ? -9.447 31.035 16.658 1.00 45.03 ? 328 THR A CB 1 ATOM 2310 O OG1 . THR A 1 304 ? -9.550 29.823 17.414 1.00 50.15 ? 328 THR A OG1 1 ATOM 2311 C CG2 . THR A 1 304 ? -10.517 32.033 17.135 1.00 44.10 ? 328 THR A CG2 1 ATOM 2312 N N . ILE A 1 305 ? -11.793 31.055 14.173 1.00 37.80 ? 329 ILE A N 1 ATOM 2313 C CA . ILE A 1 305 ? -12.928 31.775 13.626 1.00 34.74 ? 329 ILE A CA 1 ATOM 2314 C C . ILE A 1 305 ? -14.071 31.839 14.653 1.00 32.58 ? 329 ILE A C 1 ATOM 2315 O O . ILE A 1 305 ? -14.578 30.830 15.109 1.00 30.56 ? 329 ILE A O 1 ATOM 2316 C CB . ILE A 1 305 ? -13.473 31.117 12.355 1.00 36.39 ? 329 ILE A CB 1 ATOM 2317 C CG1 . ILE A 1 305 ? -12.426 31.195 11.250 1.00 38.26 ? 329 ILE A CG1 1 ATOM 2318 C CG2 . ILE A 1 305 ? -14.756 31.830 11.896 1.00 36.10 ? 329 ILE A CG2 1 ATOM 2319 C CD1 . ILE A 1 305 ? -12.837 30.459 9.977 1.00 40.31 ? 329 ILE A CD1 1 ATOM 2320 N N . SER A 1 306 ? -14.461 33.045 15.024 1.00 32.15 ? 330 SER A N 1 ATOM 2321 C CA . SER A 1 306 ? -15.561 33.239 15.951 1.00 31.86 ? 330 SER A CA 1 ATOM 2322 C C . SER A 1 306 ? -16.829 33.391 15.120 1.00 31.95 ? 330 SER A C 1 ATOM 2323 O O . SER A 1 306 ? -16.969 34.334 14.359 1.00 32.54 ? 330 SER A O 1 ATOM 2324 C CB . SER A 1 306 ? -15.360 34.510 16.783 1.00 32.64 ? 330 SER A CB 1 ATOM 2325 O OG . SER A 1 306 ? -14.174 34.464 17.558 1.00 33.63 ? 330 SER A OG 1 ATOM 2326 N N . VAL A 1 307 ? -17.752 32.452 15.287 1.00 29.87 ? 331 VAL A N 1 ATOM 2327 C CA . VAL A 1 307 ? -19.014 32.427 14.565 1.00 26.70 ? 331 VAL A CA 1 ATOM 2328 C C . VAL A 1 307 ? -20.209 32.670 15.475 1.00 27.90 ? 331 VAL A C 1 ATOM 2329 O O . VAL A 1 307 ? -20.508 31.829 16.316 1.00 29.12 ? 331 VAL A O 1 ATOM 2330 C CB . VAL A 1 307 ? -19.201 31.055 13.918 1.00 23.35 ? 331 VAL A CB 1 ATOM 2331 C CG1 . VAL A 1 307 ? -20.499 31.009 13.182 1.00 23.47 ? 331 VAL A CG1 1 ATOM 2332 C CG2 . VAL A 1 307 ? -18.065 30.761 12.992 1.00 20.70 ? 331 VAL A CG2 1 ATOM 2333 N N . ARG A 1 308 ? -20.883 33.806 15.324 1.00 28.56 ? 332 ARG A N 1 ATOM 2334 C CA . ARG A 1 308 ? -22.067 34.072 16.119 1.00 30.26 ? 332 ARG A CA 1 ATOM 2335 C C . ARG A 1 308 ? -23.261 33.946 15.159 1.00 30.45 ? 332 ARG A C 1 ATOM 2336 O O . ARG A 1 308 ? -23.176 34.337 14.000 1.00 30.64 ? 332 ARG A O 1 ATOM 2337 C CB . ARG A 1 308 ? -21.984 35.450 16.751 1.00 31.45 ? 332 ARG A CB 1 ATOM 2338 C CG . ARG A 1 308 ? -21.391 36.495 15.880 1.00 34.68 ? 332 ARG A CG 1 ATOM 2339 C CD . ARG A 1 308 ? -21.327 37.808 16.639 1.00 40.15 ? 332 ARG A CD 1 ATOM 2340 N NE . ARG A 1 308 ? -21.508 38.948 15.736 1.00 45.23 ? 332 ARG A NE 1 ATOM 2341 C CZ . ARG A 1 308 ? -20.586 39.421 14.900 1.00 45.90 ? 332 ARG A CZ 1 ATOM 2342 N NH1 . ARG A 1 308 ? -19.374 38.874 14.836 1.00 45.53 ? 332 ARG A NH1 1 ATOM 2343 N NH2 . ARG A 1 308 ? -20.897 40.426 14.097 1.00 45.43 ? 332 ARG A NH2 1 ATOM 2344 N N . VAL A 1 309 ? -24.361 33.364 15.641 1.00 30.19 ? 333 VAL A N 1 ATOM 2345 C CA . VAL A 1 309 ? -25.563 33.117 14.835 1.00 28.14 ? 333 VAL A CA 1 ATOM 2346 C C . VAL A 1 309 ? -26.784 33.889 15.280 1.00 30.74 ? 333 VAL A C 1 ATOM 2347 O O . VAL A 1 309 ? -27.166 33.824 16.434 1.00 34.58 ? 333 VAL A O 1 ATOM 2348 C CB . VAL A 1 309 ? -25.893 31.601 14.866 1.00 24.46 ? 333 VAL A CB 1 ATOM 2349 C CG1 . VAL A 1 309 ? -27.258 31.324 14.333 1.00 22.03 ? 333 VAL A CG1 1 ATOM 2350 C CG2 . VAL A 1 309 ? -24.866 30.855 14.076 1.00 23.53 ? 333 VAL A CG2 1 ATOM 2351 N N . LYS A 1 310 ? -27.377 34.649 14.372 1.00 30.77 ? 334 LYS A N 1 ATOM 2352 C CA . LYS A 1 310 ? -28.564 35.418 14.708 1.00 31.08 ? 334 LYS A CA 1 ATOM 2353 C C . LYS A 1 310 ? -29.685 34.721 14.007 1.00 32.18 ? 334 LYS A C 1 ATOM 2354 O O . LYS A 1 310 ? -29.448 33.697 13.340 1.00 33.09 ? 334 LYS A O 1 ATOM 2355 C CB . LYS A 1 310 ? -28.441 36.849 14.207 1.00 31.93 ? 334 LYS A CB 1 ATOM 2356 C CG . LYS A 1 310 ? -27.270 37.593 14.821 1.00 32.84 ? 334 LYS A CG 1 ATOM 2357 C CD . LYS A 1 310 ? -27.039 37.174 16.262 1.00 33.05 ? 334 LYS A CD 1 ATOM 2358 C CE . LYS A 1 310 ? -26.266 38.237 17.024 1.00 36.27 ? 334 LYS A CE 1 ATOM 2359 N NZ . LYS A 1 310 ? -27.043 39.526 17.157 1.00 37.70 ? 334 LYS A NZ 1 ATOM 2360 N N . ALA A 1 311 ? -30.902 35.253 14.140 1.00 31.47 ? 335 ALA A N 1 ATOM 2361 C CA . ALA A 1 311 ? -32.030 34.615 13.469 1.00 31.23 ? 335 ALA A CA 1 ATOM 2362 C C . ALA A 1 311 ? -33.146 35.551 13.015 1.00 32.16 ? 335 ALA A C 1 ATOM 2363 O O . ALA A 1 311 ? -33.552 36.473 13.737 1.00 32.29 ? 335 ALA A O 1 ATOM 2364 C CB . ALA A 1 311 ? -32.611 33.528 14.350 1.00 28.61 ? 335 ALA A CB 1 ATOM 2365 N N . ALA A 1 312 ? -33.626 35.306 11.795 1.00 33.08 ? 336 ALA A N 1 ATOM 2366 C CA . ALA A 1 312 ? -34.716 36.087 11.225 1.00 32.83 ? 336 ALA A CA 1 ATOM 2367 C C . ALA A 1 312 ? -35.946 35.473 11.894 1.00 31.83 ? 336 ALA A C 1 ATOM 2368 O O . ALA A 1 312 ? -36.037 34.247 12.068 1.00 34.13 ? 336 ALA A O 1 ATOM 2369 C CB . ALA A 1 312 ? -34.772 35.894 9.715 1.00 34.74 ? 336 ALA A CB 1 ATOM 2370 N N . PRO A 1 313 ? -36.925 36.291 12.257 1.00 28.68 ? 337 PRO A N 1 ATOM 2371 C CA . PRO A 1 313 ? -38.101 35.735 12.921 1.00 28.09 ? 337 PRO A CA 1 ATOM 2372 C C . PRO A 1 313 ? -38.694 34.494 12.352 1.00 30.25 ? 337 PRO A C 1 ATOM 2373 O O . PRO A 1 313 ? -38.828 34.383 11.135 1.00 31.82 ? 337 PRO A O 1 ATOM 2374 C CB . PRO A 1 313 ? -39.080 36.897 12.903 1.00 25.81 ? 337 PRO A CB 1 ATOM 2375 C CG . PRO A 1 313 ? -38.208 38.054 13.024 1.00 25.12 ? 337 PRO A CG 1 ATOM 2376 C CD . PRO A 1 313 ? -37.088 37.735 12.056 1.00 26.91 ? 337 PRO A CD 1 ATOM 2377 N N . TYR A 1 314 ? -39.001 33.540 13.219 1.00 31.75 ? 338 TYR A N 1 ATOM 2378 C CA . TYR A 1 314 ? -39.652 32.322 12.771 1.00 36.02 ? 338 TYR A CA 1 ATOM 2379 C C . TYR A 1 314 ? -40.794 32.056 13.755 1.00 37.45 ? 338 TYR A C 1 ATOM 2380 O O . TYR A 1 314 ? -40.684 32.343 14.953 1.00 38.05 ? 338 TYR A O 1 ATOM 2381 C CB . TYR A 1 314 ? -38.673 31.150 12.698 1.00 39.13 ? 338 TYR A CB 1 ATOM 2382 C CG . TYR A 1 314 ? -37.914 30.832 13.963 1.00 42.56 ? 338 TYR A CG 1 ATOM 2383 C CD1 . TYR A 1 314 ? -37.681 29.508 14.324 1.00 43.66 ? 338 TYR A CD1 1 ATOM 2384 C CD2 . TYR A 1 314 ? -37.366 31.838 14.759 1.00 43.70 ? 338 TYR A CD2 1 ATOM 2385 C CE1 . TYR A 1 314 ? -36.917 29.186 15.442 1.00 45.80 ? 338 TYR A CE1 1 ATOM 2386 C CE2 . TYR A 1 314 ? -36.598 31.529 15.884 1.00 44.96 ? 338 TYR A CE2 1 ATOM 2387 C CZ . TYR A 1 314 ? -36.377 30.198 16.218 1.00 45.99 ? 338 TYR A CZ 1 ATOM 2388 O OH . TYR A 1 314 ? -35.610 29.858 17.313 1.00 47.59 ? 338 TYR A OH 1 ATOM 2389 N N . TRP A 1 315 ? -41.912 31.539 13.260 1.00 38.58 ? 339 TRP A N 1 ATOM 2390 C CA . TRP A 1 315 ? -43.066 31.271 14.134 1.00 39.10 ? 339 TRP A CA 1 ATOM 2391 C C . TRP A 1 315 ? -42.897 30.208 15.210 1.00 41.55 ? 339 TRP A C 1 ATOM 2392 O O . TRP A 1 315 ? -42.375 29.120 14.960 1.00 41.27 ? 339 TRP A O 1 ATOM 2393 C CB . TRP A 1 315 ? -44.317 30.916 13.314 1.00 34.26 ? 339 TRP A CB 1 ATOM 2394 C CG . TRP A 1 315 ? -44.845 32.031 12.501 1.00 28.26 ? 339 TRP A CG 1 ATOM 2395 C CD1 . TRP A 1 315 ? -44.976 32.058 11.147 1.00 28.66 ? 339 TRP A CD1 1 ATOM 2396 C CD2 . TRP A 1 315 ? -45.255 33.315 12.971 1.00 25.75 ? 339 TRP A CD2 1 ATOM 2397 N NE1 . TRP A 1 315 ? -45.435 33.287 10.739 1.00 28.03 ? 339 TRP A NE1 1 ATOM 2398 C CE2 . TRP A 1 315 ? -45.617 34.076 11.839 1.00 26.01 ? 339 TRP A CE2 1 ATOM 2399 C CE3 . TRP A 1 315 ? -45.358 33.896 14.233 1.00 25.43 ? 339 TRP A CE3 1 ATOM 2400 C CZ2 . TRP A 1 315 ? -46.064 35.397 11.934 1.00 24.71 ? 339 TRP A CZ2 1 ATOM 2401 C CZ3 . TRP A 1 315 ? -45.806 35.213 14.325 1.00 25.67 ? 339 TRP A CZ3 1 ATOM 2402 C CH2 . TRP A 1 315 ? -46.155 35.946 13.178 1.00 24.22 ? 339 TRP A CH2 1 ATOM 2403 N N . LEU A 1 316 ? -43.348 30.557 16.406 1.00 46.84 ? 340 LEU A N 1 ATOM 2404 C CA . LEU A 1 316 ? -43.328 29.654 17.544 1.00 54.29 ? 340 LEU A CA 1 ATOM 2405 C C . LEU A 1 316 ? -44.801 29.249 17.618 1.00 58.99 ? 340 LEU A C 1 ATOM 2406 O O . LEU A 1 316 ? -45.143 28.097 17.899 1.00 60.47 ? 340 LEU A O 1 ATOM 2407 C CB . LEU A 1 316 ? -42.973 30.410 18.816 1.00 53.91 ? 340 LEU A CB 1 ATOM 2408 C CG . LEU A 1 316 ? -42.265 29.589 19.880 1.00 54.69 ? 340 LEU A CG 1 ATOM 2409 C CD1 . LEU A 1 316 ? -40.761 29.662 19.613 1.00 55.26 ? 340 LEU A CD1 1 ATOM 2410 C CD2 . LEU A 1 316 ? -42.599 30.123 21.264 1.00 54.49 ? 340 LEU A CD2 1 ATOM 2411 N N . ASP A 1 317 ? -45.664 30.233 17.363 1.00 64.00 ? 341 ASP A N 1 ATOM 2412 C CA . ASP A 1 317 ? -47.113 30.060 17.350 1.00 67.51 ? 341 ASP A CA 1 ATOM 2413 C C . ASP A 1 317 ? -47.735 31.150 16.464 1.00 68.43 ? 341 ASP A C 1 ATOM 2414 O O . ASP A 1 317 ? -47.915 32.285 16.903 1.00 68.00 ? 341 ASP A O 1 ATOM 2415 C CB . ASP A 1 317 ? -47.658 30.155 18.769 1.00 70.07 ? 341 ASP A CB 1 ATOM 2416 C CG . ASP A 1 317 ? -49.059 29.622 18.875 1.00 74.53 ? 341 ASP A CG 1 ATOM 2417 O OD1 . ASP A 1 317 ? -49.269 28.438 18.513 1.00 77.00 ? 341 ASP A OD1 1 ATOM 2418 O OD2 . ASP A 1 317 ? -49.949 30.384 19.312 1.00 77.04 ? 341 ASP A OD2 1 ATOM 2419 N N . GLU A 1 318 ? -48.042 30.797 15.214 1.00 69.34 ? 342 GLU A N 1 ATOM 2420 C CA . GLU A 1 318 ? -48.627 31.740 14.252 1.00 70.01 ? 342 GLU A CA 1 ATOM 2421 C C . GLU A 1 318 ? -50.084 32.006 14.519 1.00 68.66 ? 342 GLU A C 1 ATOM 2422 O O . GLU A 1 318 ? -50.847 31.080 14.748 1.00 67.94 ? 342 GLU A O 1 ATOM 2423 C CB . GLU A 1 318 ? -48.469 31.227 12.820 1.00 73.51 ? 342 GLU A CB 1 ATOM 2424 C CG . GLU A 1 318 ? -49.328 31.989 11.810 1.00 78.78 ? 342 GLU A CG 1 ATOM 2425 C CD . GLU A 1 318 ? -48.981 31.674 10.359 1.00 81.23 ? 342 GLU A CD 1 ATOM 2426 O OE1 . GLU A 1 318 ? -48.882 30.475 10.006 1.00 81.28 ? 342 GLU A OE1 1 ATOM 2427 O OE2 . GLU A 1 318 ? -48.816 32.633 9.571 1.00 82.09 ? 342 GLU A OE2 1 ATOM 2428 N N . PRO A 1 319 ? -50.498 33.279 14.453 1.00 68.01 ? 343 PRO A N 1 ATOM 2429 C CA . PRO A 1 319 ? -51.887 33.674 14.698 1.00 67.75 ? 343 PRO A CA 1 ATOM 2430 C C . PRO A 1 319 ? -52.843 32.969 13.751 1.00 67.93 ? 343 PRO A C 1 ATOM 2431 O O . PRO A 1 319 ? -52.606 32.940 12.547 1.00 67.33 ? 343 PRO A O 1 ATOM 2432 C CB . PRO A 1 319 ? -51.847 35.184 14.494 1.00 66.87 ? 343 PRO A CB 1 ATOM 2433 C CG . PRO A 1 319 ? -50.771 35.358 13.499 1.00 66.91 ? 343 PRO A CG 1 ATOM 2434 C CD . PRO A 1 319 ? -49.708 34.439 14.017 1.00 67.90 ? 343 PRO A CD 1 ATOM 2435 N N . LYS A 1 320 ? -53.906 32.394 14.324 1.00 68.76 ? 344 LYS A N 1 ATOM 2436 C CA . LYS A 1 320 ? -54.910 31.630 13.582 1.00 70.38 ? 344 LYS A CA 1 ATOM 2437 C C . LYS A 1 320 ? -56.218 32.380 13.454 1.00 70.72 ? 344 LYS A C 1 ATOM 2438 O O . LYS A 1 320 ? -56.510 33.281 14.244 1.00 70.87 ? 344 LYS A O 1 ATOM 2439 C CB . LYS A 1 320 ? -55.151 30.284 14.270 1.00 71.46 ? 344 LYS A CB 1 ATOM 2440 C CG . LYS A 1 320 ? -53.881 29.459 14.469 1.00 72.47 ? 344 LYS A CG 1 ATOM 2441 C CD . LYS A 1 320 ? -54.120 28.263 15.374 1.00 73.62 ? 344 LYS A CD 1 ATOM 2442 C CE . LYS A 1 320 ? -52.813 27.554 15.699 1.00 75.31 ? 344 LYS A CE 1 ATOM 2443 N NZ . LYS A 1 320 ? -52.113 27.060 14.478 1.00 76.12 ? 344 LYS A NZ 1 ATOM 2444 N N . ASN A 1 321 ? -57.003 31.987 12.457 1.00 71.44 ? 345 ASN A N 1 ATOM 2445 C CA . ASN A 1 321 ? -58.286 32.611 12.179 1.00 71.92 ? 345 ASN A CA 1 ATOM 2446 C C . ASN A 1 321 ? -59.333 32.291 13.219 1.00 72.14 ? 345 ASN A C 1 ATOM 2447 O O . ASN A 1 321 ? -59.350 31.203 13.803 1.00 72.92 ? 345 ASN A O 1 ATOM 2448 C CB . ASN A 1 321 ? -58.778 32.161 10.809 1.00 72.54 ? 345 ASN A CB 1 ATOM 2449 C CG . ASN A 1 321 ? -57.913 32.684 9.681 1.00 73.46 ? 345 ASN A CG 1 ATOM 2450 O OD1 . ASN A 1 321 ? -57.686 31.991 8.685 1.00 73.02 ? 345 ASN A OD1 1 ATOM 2451 N ND2 . ASN A 1 321 ? -57.433 33.919 9.825 1.00 73.51 ? 345 ASN A ND2 1 ATOM 2452 N N . LEU A 1 322 ? -60.216 33.255 13.438 1.00 71.92 ? 346 LEU A N 1 ATOM 2453 C CA . LEU A 1 322 ? -61.312 33.107 14.392 1.00 70.88 ? 346 LEU A CA 1 ATOM 2454 C C . LEU A 1 322 ? -62.668 32.975 13.704 1.00 71.43 ? 346 LEU A C 1 ATOM 2455 O O . LEU A 1 322 ? -63.083 33.849 12.949 1.00 71.58 ? 346 LEU A O 1 ATOM 2456 C CB . LEU A 1 322 ? -61.364 34.309 15.334 1.00 68.75 ? 346 LEU A CB 1 ATOM 2457 C CG . LEU A 1 322 ? -60.615 34.179 16.652 1.00 67.29 ? 346 LEU A CG 1 ATOM 2458 C CD1 . LEU A 1 322 ? -60.823 35.440 17.465 1.00 66.86 ? 346 LEU A CD1 1 ATOM 2459 C CD2 . LEU A 1 322 ? -61.120 32.964 17.412 1.00 66.07 ? 346 LEU A CD2 1 ATOM 2460 N N . ILE A 1 323 ? -63.352 31.874 13.953 1.00 72.35 ? 347 ILE A N 1 ATOM 2461 C CA . ILE A 1 323 ? -64.676 31.683 13.397 1.00 74.30 ? 347 ILE A CA 1 ATOM 2462 C C . ILE A 1 323 ? -65.571 31.476 14.635 1.00 75.44 ? 347 ILE A C 1 ATOM 2463 O O . ILE A 1 323 ? -65.811 30.336 15.069 1.00 76.49 ? 347 ILE A O 1 ATOM 2464 C CB . ILE A 1 323 ? -64.745 30.441 12.493 1.00 74.82 ? 347 ILE A CB 1 ATOM 2465 C CG1 . ILE A 1 323 ? -63.494 30.347 11.623 1.00 74.98 ? 347 ILE A CG1 1 ATOM 2466 C CG2 . ILE A 1 323 ? -65.956 30.533 11.592 1.00 75.61 ? 347 ILE A CG2 1 ATOM 2467 C CD1 . ILE A 1 323 ? -62.309 29.727 12.328 1.00 76.34 ? 347 ILE A CD1 1 ATOM 2468 N N . LEU A 1 324 ? -66.057 32.586 15.194 1.00 76.45 ? 348 LEU A N 1 ATOM 2469 C CA . LEU A 1 324 ? -66.889 32.580 16.396 1.00 78.03 ? 348 LEU A CA 1 ATOM 2470 C C . LEU A 1 324 ? -68.387 32.792 16.211 1.00 77.54 ? 348 LEU A C 1 ATOM 2471 O O . LEU A 1 324 ? -68.842 33.214 15.148 1.00 79.04 ? 348 LEU A O 1 ATOM 2472 C CB . LEU A 1 324 ? -66.406 33.657 17.372 1.00 79.31 ? 348 LEU A CB 1 ATOM 2473 C CG . LEU A 1 324 ? -64.969 33.653 17.881 1.00 80.82 ? 348 LEU A CG 1 ATOM 2474 C CD1 . LEU A 1 324 ? -64.791 34.798 18.884 1.00 80.09 ? 348 LEU A CD1 1 ATOM 2475 C CD2 . LEU A 1 324 ? -64.660 32.305 18.526 1.00 81.81 ? 348 LEU A CD2 1 ATOM 2476 N N . ALA A 1 325 ? -69.135 32.517 17.282 1.00 76.23 ? 349 ALA A N 1 ATOM 2477 C CA . ALA A 1 325 ? -70.583 32.708 17.315 1.00 74.34 ? 349 ALA A CA 1 ATOM 2478 C C . ALA A 1 325 ? -70.755 34.018 18.088 1.00 71.99 ? 349 ALA A C 1 ATOM 2479 O O . ALA A 1 325 ? -69.998 34.313 19.008 1.00 73.33 ? 349 ALA A O 1 ATOM 2480 C CB . ALA A 1 325 ? -71.255 31.570 18.065 1.00 73.74 ? 349 ALA A CB 1 ATOM 2481 N N . PRO A 1 326 ? -71.759 34.819 17.737 1.00 70.16 ? 350 PRO A N 1 ATOM 2482 C CA . PRO A 1 326 ? -71.993 36.097 18.416 1.00 69.47 ? 350 PRO A CA 1 ATOM 2483 C C . PRO A 1 326 ? -72.222 35.968 19.916 1.00 69.29 ? 350 PRO A C 1 ATOM 2484 O O . PRO A 1 326 ? -73.254 35.497 20.368 1.00 69.53 ? 350 PRO A O 1 ATOM 2485 C CB . PRO A 1 326 ? -73.201 36.655 17.678 1.00 68.19 ? 350 PRO A CB 1 ATOM 2486 C CG . PRO A 1 326 ? -73.937 35.432 17.308 1.00 68.78 ? 350 PRO A CG 1 ATOM 2487 C CD . PRO A 1 326 ? -72.845 34.541 16.787 1.00 69.68 ? 350 PRO A CD 1 ATOM 2488 N N . GLY A 1 327 ? -71.239 36.392 20.691 1.00 69.35 ? 351 GLY A N 1 ATOM 2489 C CA . GLY A 1 327 ? -71.371 36.297 22.128 1.00 69.76 ? 351 GLY A CA 1 ATOM 2490 C C . GLY A 1 327 ? -70.249 35.480 22.735 1.00 70.10 ? 351 GLY A C 1 ATOM 2491 O O . GLY A 1 327 ? -69.962 35.640 23.922 1.00 71.02 ? 351 GLY A O 1 ATOM 2492 N N . GLU A 1 328 ? -69.612 34.621 21.935 1.00 70.19 ? 352 GLU A N 1 ATOM 2493 C CA . GLU A 1 328 ? -68.522 33.775 22.417 1.00 69.88 ? 352 GLU A CA 1 ATOM 2494 C C . GLU A 1 328 ? -67.201 34.489 22.309 1.00 66.75 ? 352 GLU A C 1 ATOM 2495 O O . GLU A 1 328 ? -67.040 35.366 21.493 1.00 65.56 ? 352 GLU A O 1 ATOM 2496 C CB . GLU A 1 328 ? -68.477 32.460 21.652 1.00 74.40 ? 352 GLU A CB 1 ATOM 2497 C CG . GLU A 1 328 ? -67.999 31.307 22.512 1.00 80.68 ? 352 GLU A CG 1 ATOM 2498 C CD . GLU A 1 328 ? -67.920 30.005 21.743 1.00 84.52 ? 352 GLU A CD 1 ATOM 2499 O OE1 . GLU A 1 328 ? -68.973 29.552 21.232 1.00 85.44 ? 352 GLU A OE1 1 ATOM 2500 O OE2 . GLU A 1 328 ? -66.802 29.439 21.650 1.00 86.52 ? 352 GLU A OE2 1 ATOM 2501 N N . ASP A 1 329 ? -66.257 34.089 23.149 1.00 64.79 ? 353 ASP A N 1 ATOM 2502 C CA . ASP A 1 329 ? -64.920 34.679 23.214 1.00 62.77 ? 353 ASP A CA 1 ATOM 2503 C C . ASP A 1 329 ? -63.823 33.969 22.379 1.00 60.43 ? 353 ASP A C 1 ATOM 2504 O O . ASP A 1 329 ? -63.827 32.740 22.185 1.00 59.74 ? 353 ASP A O 1 ATOM 2505 C CB . ASP A 1 329 ? -64.470 34.737 24.675 1.00 65.57 ? 353 ASP A CB 1 ATOM 2506 C CG . ASP A 1 329 ? -65.382 35.601 25.533 1.00 68.99 ? 353 ASP A CG 1 ATOM 2507 O OD1 . ASP A 1 329 ? -66.527 35.853 25.103 1.00 71.76 ? 353 ASP A OD1 1 ATOM 2508 O OD2 . ASP A 1 329 ? -64.965 36.023 26.638 1.00 70.50 ? 353 ASP A OD2 1 ATOM 2509 N N . GLY A 1 330 ? -62.875 34.764 21.893 1.00 58.21 ? 354 GLY A N 1 ATOM 2510 C CA . GLY A 1 330 ? -61.770 34.233 21.098 1.00 55.41 ? 354 GLY A CA 1 ATOM 2511 C C . GLY A 1 330 ? -60.495 35.062 21.212 1.00 53.41 ? 354 GLY A C 1 ATOM 2512 O O . GLY A 1 330 ? -60.521 36.225 21.602 1.00 52.39 ? 354 GLY A O 1 ATOM 2513 N N . ARG A 1 331 ? -59.364 34.486 20.845 1.00 52.64 ? 355 ARG A N 1 ATOM 2514 C CA . ARG A 1 331 ? -58.101 35.209 20.969 1.00 52.84 ? 355 ARG A CA 1 ATOM 2515 C C . ARG A 1 331 ? -57.222 35.177 19.717 1.00 50.26 ? 355 ARG A C 1 ATOM 2516 O O . ARG A 1 331 ? -57.271 34.233 18.914 1.00 48.64 ? 355 ARG A O 1 ATOM 2517 C CB . ARG A 1 331 ? -57.288 34.642 22.143 1.00 57.79 ? 355 ARG A CB 1 ATOM 2518 C CG . ARG A 1 331 ? -56.652 33.256 21.875 1.00 65.53 ? 355 ARG A CG 1 ATOM 2519 C CD . ARG A 1 331 ? -57.683 32.103 21.791 1.00 71.25 ? 355 ARG A CD 1 ATOM 2520 N NE . ARG A 1 331 ? -57.190 30.899 21.097 1.00 74.81 ? 355 ARG A NE 1 ATOM 2521 C CZ . ARG A 1 331 ? -56.238 30.076 21.546 1.00 75.55 ? 355 ARG A CZ 1 ATOM 2522 N NH1 . ARG A 1 331 ? -55.643 30.301 22.711 1.00 76.70 ? 355 ARG A NH1 1 ATOM 2523 N NH2 . ARG A 1 331 ? -55.879 29.021 20.822 1.00 74.51 ? 355 ARG A NH2 1 ATOM 2524 N N . LEU A 1 332 ? -56.416 36.217 19.539 1.00 47.75 ? 356 LEU A N 1 ATOM 2525 C CA . LEU A 1 332 ? -55.471 36.256 18.417 1.00 45.56 ? 356 LEU A CA 1 ATOM 2526 C C . LEU A 1 332 ? -54.092 36.344 19.035 1.00 46.19 ? 356 LEU A C 1 ATOM 2527 O O . LEU A 1 332 ? -53.700 37.420 19.494 1.00 46.33 ? 356 LEU A O 1 ATOM 2528 C CB . LEU A 1 332 ? -55.692 37.475 17.528 1.00 42.51 ? 356 LEU A CB 1 ATOM 2529 C CG . LEU A 1 332 ? -56.621 37.365 16.326 1.00 39.08 ? 356 LEU A CG 1 ATOM 2530 C CD1 . LEU A 1 332 ? -56.357 38.555 15.441 1.00 38.30 ? 356 LEU A CD1 1 ATOM 2531 C CD2 . LEU A 1 332 ? -56.373 36.078 15.552 1.00 38.47 ? 356 LEU A CD2 1 ATOM 2532 N N . VAL A 1 333 ? -53.359 35.230 19.079 1.00 47.77 ? 357 VAL A N 1 ATOM 2533 C CA . VAL A 1 333 ? -52.023 35.266 19.670 1.00 49.27 ? 357 VAL A CA 1 ATOM 2534 C C . VAL A 1 333 ? -50.991 35.179 18.560 1.00 49.72 ? 357 VAL A C 1 ATOM 2535 O O . VAL A 1 333 ? -51.074 34.331 17.683 1.00 48.90 ? 357 VAL A O 1 ATOM 2536 C CB . VAL A 1 333 ? -51.779 34.116 20.650 1.00 49.71 ? 357 VAL A CB 1 ATOM 2537 C CG1 . VAL A 1 333 ? -50.568 34.430 21.499 1.00 50.85 ? 357 VAL A CG1 1 ATOM 2538 C CG2 . VAL A 1 333 ? -52.990 33.913 21.531 1.00 52.40 ? 357 VAL A CG2 1 ATOM 2539 N N . CYS A 1 334 ? -50.043 36.106 18.595 1.00 51.33 ? 358 CYS A N 1 ATOM 2540 C CA . CYS A 1 334 ? -48.984 36.186 17.604 1.00 54.43 ? 358 CYS A CA 1 ATOM 2541 C C . CYS A 1 334 ? -47.610 36.284 18.257 1.00 54.29 ? 358 CYS A C 1 ATOM 2542 O O . CYS A 1 334 ? -47.187 37.347 18.716 1.00 52.55 ? 358 CYS A O 1 ATOM 2543 C CB . CYS A 1 334 ? -49.226 37.401 16.712 1.00 57.82 ? 358 CYS A CB 1 ATOM 2544 S SG . CYS A 1 334 ? -47.824 37.936 15.679 1.00 63.30 ? 358 CYS A SG 1 ATOM 2545 N N . ARG A 1 335 ? -46.904 35.163 18.303 1.00 56.23 ? 359 ARG A N 1 ATOM 2546 C CA . ARG A 1 335 ? -45.561 35.155 18.897 1.00 58.45 ? 359 ARG A CA 1 ATOM 2547 C C . ARG A 1 335 ? -44.522 34.364 18.050 1.00 57.01 ? 359 ARG A C 1 ATOM 2548 O O . ARG A 1 335 ? -44.815 33.301 17.503 1.00 55.69 ? 359 ARG A O 1 ATOM 2549 C CB . ARG A 1 335 ? -45.624 34.610 20.339 1.00 62.13 ? 359 ARG A CB 1 ATOM 2550 C CG . ARG A 1 335 ? -46.128 33.169 20.491 1.00 67.18 ? 359 ARG A CG 1 ATOM 2551 C CD . ARG A 1 335 ? -46.999 33.003 21.744 1.00 69.90 ? 359 ARG A CD 1 ATOM 2552 N NE . ARG A 1 335 ? -46.449 33.709 22.900 1.00 74.59 ? 359 ARG A NE 1 ATOM 2553 C CZ . ARG A 1 335 ? -47.084 33.869 24.060 1.00 77.19 ? 359 ARG A CZ 1 ATOM 2554 N NH1 . ARG A 1 335 ? -48.302 33.368 24.226 1.00 78.53 ? 359 ARG A NH1 1 ATOM 2555 N NH2 . ARG A 1 335 ? -46.507 34.542 25.052 1.00 78.33 ? 359 ARG A NH2 1 ATOM 2556 N N . ALA A 1 336 ? -43.321 34.921 17.916 1.00 55.34 ? 360 ALA A N 1 ATOM 2557 C CA . ALA A 1 336 ? -42.260 34.296 17.138 1.00 55.40 ? 360 ALA A CA 1 ATOM 2558 C C . ALA A 1 336 ? -40.902 34.484 17.817 1.00 55.89 ? 360 ALA A C 1 ATOM 2559 O O . ALA A 1 336 ? -40.641 35.510 18.452 1.00 56.53 ? 360 ALA A O 1 ATOM 2560 C CB . ALA A 1 336 ? -42.221 34.900 15.754 1.00 54.90 ? 360 ALA A CB 1 ATOM 2561 N N . ASN A 1 337 ? -40.030 33.493 17.688 1.00 55.85 ? 361 ASN A N 1 ATOM 2562 C CA . ASN A 1 337 ? -38.718 33.599 18.297 1.00 55.59 ? 361 ASN A CA 1 ATOM 2563 C C . ASN A 1 337 ? -37.790 34.272 17.300 1.00 52.49 ? 361 ASN A C 1 ATOM 2564 O O . ASN A 1 337 ? -37.970 34.141 16.103 1.00 52.11 ? 361 ASN A O 1 ATOM 2565 C CB . ASN A 1 337 ? -38.187 32.215 18.664 1.00 60.60 ? 361 ASN A CB 1 ATOM 2566 C CG . ASN A 1 337 ? -36.933 32.290 19.509 1.00 65.88 ? 361 ASN A CG 1 ATOM 2567 O OD1 . ASN A 1 337 ? -36.949 32.860 20.605 1.00 69.55 ? 361 ASN A OD1 1 ATOM 2568 N ND2 . ASN A 1 337 ? -35.835 31.723 19.006 1.00 68.33 ? 361 ASN A ND2 1 ATOM 2569 N N . GLY A 1 338 ? -36.814 35.013 17.792 1.00 48.67 ? 362 GLY A N 1 ATOM 2570 C CA . GLY A 1 338 ? -35.890 35.656 16.892 1.00 45.85 ? 362 GLY A CA 1 ATOM 2571 C C . GLY A 1 338 ? -34.724 36.247 17.634 1.00 44.80 ? 362 GLY A C 1 ATOM 2572 O O . GLY A 1 338 ? -34.852 36.527 18.815 1.00 45.75 ? 362 GLY A O 1 ATOM 2573 N N . ASN A 1 339 ? -33.603 36.459 16.946 1.00 42.78 ? 363 ASN A N 1 ATOM 2574 C CA . ASN A 1 339 ? -32.401 37.031 17.561 1.00 40.12 ? 363 ASN A CA 1 ATOM 2575 C C . ASN A 1 339 ? -31.810 38.178 16.727 1.00 39.38 ? 363 ASN A C 1 ATOM 2576 O O . ASN A 1 339 ? -31.268 37.952 15.640 1.00 41.58 ? 363 ASN A O 1 ATOM 2577 C CB . ASN A 1 339 ? -31.345 35.952 17.751 1.00 40.21 ? 363 ASN A CB 1 ATOM 2578 C CG . ASN A 1 339 ? -30.180 36.423 18.580 1.00 40.01 ? 363 ASN A CG 1 ATOM 2579 O OD1 . ASN A 1 339 ? -30.178 37.536 19.114 1.00 38.59 ? 363 ASN A OD1 1 ATOM 2580 N ND2 . ASN A 1 339 ? -29.175 35.570 18.701 1.00 41.54 ? 363 ASN A ND2 1 ATOM 2581 N N . PRO A 1 340 ? -31.903 39.428 17.215 1.00 36.56 ? 364 PRO A N 1 ATOM 2582 C CA . PRO A 1 340 ? -32.504 39.852 18.491 1.00 37.53 ? 364 PRO A CA 1 ATOM 2583 C C . PRO A 1 340 ? -34.054 39.707 18.597 1.00 40.45 ? 364 PRO A C 1 ATOM 2584 O O . PRO A 1 340 ? -34.728 39.397 17.608 1.00 40.93 ? 364 PRO A O 1 ATOM 2585 C CB . PRO A 1 340 ? -32.036 41.304 18.610 1.00 33.80 ? 364 PRO A CB 1 ATOM 2586 C CG . PRO A 1 340 ? -31.966 41.736 17.212 1.00 31.30 ? 364 PRO A CG 1 ATOM 2587 C CD . PRO A 1 340 ? -31.315 40.582 16.516 1.00 31.97 ? 364 PRO A CD 1 ATOM 2588 N N . LYS A 1 341 ? -34.607 39.916 19.798 1.00 43.47 ? 365 LYS A N 1 ATOM 2589 C CA . LYS A 1 341 ? -36.054 39.823 20.000 1.00 45.65 ? 365 LYS A CA 1 ATOM 2590 C C . LYS A 1 341 ? -36.845 40.715 19.083 1.00 46.61 ? 365 LYS A C 1 ATOM 2591 O O . LYS A 1 341 ? -36.635 41.934 19.013 1.00 46.66 ? 365 LYS A O 1 ATOM 2592 C CB . LYS A 1 341 ? -36.431 40.170 21.439 1.00 47.60 ? 365 LYS A CB 1 ATOM 2593 C CG . LYS A 1 341 ? -36.607 38.967 22.336 1.00 51.56 ? 365 LYS A CG 1 ATOM 2594 C CD . LYS A 1 341 ? -37.646 38.014 21.770 1.00 54.81 ? 365 LYS A CD 1 ATOM 2595 C CE . LYS A 1 341 ? -39.058 38.596 21.826 1.00 58.30 ? 365 LYS A CE 1 ATOM 2596 N NZ . LYS A 1 341 ? -40.099 37.626 21.312 1.00 58.83 ? 365 LYS A NZ 1 ATOM 2597 N N . PRO A 1 342 ? -37.776 40.103 18.362 1.00 46.53 ? 366 PRO A N 1 ATOM 2598 C CA . PRO A 1 342 ? -38.655 40.774 17.409 1.00 46.88 ? 366 PRO A CA 1 ATOM 2599 C C . PRO A 1 342 ? -39.774 41.625 18.015 1.00 46.98 ? 366 PRO A C 1 ATOM 2600 O O . PRO A 1 342 ? -40.389 41.224 18.988 1.00 46.60 ? 366 PRO A O 1 ATOM 2601 C CB . PRO A 1 342 ? -39.173 39.612 16.556 1.00 47.11 ? 366 PRO A CB 1 ATOM 2602 C CG . PRO A 1 342 ? -39.157 38.463 17.490 1.00 45.37 ? 366 PRO A CG 1 ATOM 2603 C CD . PRO A 1 342 ? -37.864 38.639 18.219 1.00 46.48 ? 366 PRO A CD 1 ATOM 2604 N N . THR A 1 343 ? -40.011 42.795 17.412 1.00 48.33 ? 367 THR A N 1 ATOM 2605 C CA . THR A 1 343 ? -41.024 43.775 17.806 1.00 49.96 ? 367 THR A CA 1 ATOM 2606 C C . THR A 1 343 ? -42.364 43.322 17.225 1.00 50.04 ? 367 THR A C 1 ATOM 2607 O O . THR A 1 343 ? -42.399 42.731 16.137 1.00 51.20 ? 367 THR A O 1 ATOM 2608 C CB . THR A 1 343 ? -40.706 45.157 17.197 1.00 51.06 ? 367 THR A CB 1 ATOM 2609 O OG1 . THR A 1 343 ? -39.321 45.462 17.392 1.00 53.08 ? 367 THR A OG1 1 ATOM 2610 C CG2 . THR A 1 343 ? -41.558 46.245 17.841 1.00 52.85 ? 367 THR A CG2 1 ATOM 2611 N N . VAL A 1 344 ? -43.468 43.586 17.926 1.00 49.20 ? 368 VAL A N 1 ATOM 2612 C CA . VAL A 1 344 ? -44.774 43.229 17.378 1.00 48.22 ? 368 VAL A CA 1 ATOM 2613 C C . VAL A 1 344 ? -45.560 44.500 17.068 1.00 49.21 ? 368 VAL A C 1 ATOM 2614 O O . VAL A 1 344 ? -45.536 45.448 17.860 1.00 49.34 ? 368 VAL A O 1 ATOM 2615 C CB . VAL A 1 344 ? -45.589 42.358 18.334 1.00 47.27 ? 368 VAL A CB 1 ATOM 2616 C CG1 . VAL A 1 344 ? -46.922 42.014 17.693 1.00 45.90 ? 368 VAL A CG1 1 ATOM 2617 C CG2 . VAL A 1 344 ? -44.827 41.090 18.655 1.00 48.08 ? 368 VAL A CG2 1 ATOM 2618 N N . GLN A 1 345 ? -46.216 44.532 15.902 1.00 49.87 ? 369 GLN A N 1 ATOM 2619 C CA . GLN A 1 345 ? -47.042 45.671 15.470 1.00 50.64 ? 369 GLN A CA 1 ATOM 2620 C C . GLN A 1 345 ? -48.326 45.169 14.825 1.00 48.65 ? 369 GLN A C 1 ATOM 2621 O O . GLN A 1 345 ? -48.281 44.437 13.828 1.00 47.73 ? 369 GLN A O 1 ATOM 2622 C CB . GLN A 1 345 ? -46.317 46.528 14.435 1.00 55.65 ? 369 GLN A CB 1 ATOM 2623 C CG . GLN A 1 345 ? -45.332 47.556 14.968 1.00 62.48 ? 369 GLN A CG 1 ATOM 2624 C CD . GLN A 1 345 ? -44.665 48.332 13.830 1.00 66.42 ? 369 GLN A CD 1 ATOM 2625 O OE1 . GLN A 1 345 ? -45.341 48.999 13.041 1.00 68.79 ? 369 GLN A OE1 1 ATOM 2626 N NE2 . GLN A 1 345 ? -43.337 48.236 13.733 1.00 67.34 ? 369 GLN A NE2 1 ATOM 2627 N N . TRP A 1 346 ? -49.470 45.563 15.381 1.00 46.49 ? 370 TRP A N 1 ATOM 2628 C CA . TRP A 1 346 ? -50.756 45.146 14.815 1.00 44.28 ? 370 TRP A CA 1 ATOM 2629 C C . TRP A 1 346 ? -51.379 46.199 13.916 1.00 48.04 ? 370 TRP A C 1 ATOM 2630 O O . TRP A 1 346 ? -51.276 47.399 14.156 1.00 49.31 ? 370 TRP A O 1 ATOM 2631 C CB . TRP A 1 346 ? -51.769 44.805 15.908 1.00 35.16 ? 370 TRP A CB 1 ATOM 2632 C CG . TRP A 1 346 ? -51.415 43.660 16.783 1.00 24.24 ? 370 TRP A CG 1 ATOM 2633 C CD1 . TRP A 1 346 ? -50.777 43.717 17.987 1.00 22.20 ? 370 TRP A CD1 1 ATOM 2634 C CD2 . TRP A 1 346 ? -51.691 42.276 16.540 1.00 19.01 ? 370 TRP A CD2 1 ATOM 2635 N NE1 . TRP A 1 346 ? -50.648 42.451 18.513 1.00 19.63 ? 370 TRP A NE1 1 ATOM 2636 C CE2 . TRP A 1 346 ? -51.203 41.551 17.642 1.00 17.83 ? 370 TRP A CE2 1 ATOM 2637 C CE3 . TRP A 1 346 ? -52.312 41.577 15.501 1.00 16.63 ? 370 TRP A CE3 1 ATOM 2638 C CZ2 . TRP A 1 346 ? -51.305 40.164 17.727 1.00 14.63 ? 370 TRP A CZ2 1 ATOM 2639 C CZ3 . TRP A 1 346 ? -52.412 40.200 15.594 1.00 13.78 ? 370 TRP A CZ3 1 ATOM 2640 C CH2 . TRP A 1 346 ? -51.917 39.512 16.699 1.00 12.34 ? 370 TRP A CH2 1 ATOM 2641 N N . MET A 1 347 ? -52.048 45.740 12.879 1.00 52.34 ? 371 MET A N 1 ATOM 2642 C CA . MET A 1 347 ? -52.670 46.661 11.956 1.00 58.44 ? 371 MET A CA 1 ATOM 2643 C C . MET A 1 347 ? -54.047 46.148 11.626 1.00 59.87 ? 371 MET A C 1 ATOM 2644 O O . MET A 1 347 ? -54.231 44.952 11.392 1.00 59.48 ? 371 MET A O 1 ATOM 2645 C CB . MET A 1 347 ? -51.883 46.746 10.662 1.00 63.02 ? 371 MET A CB 1 ATOM 2646 C CG . MET A 1 347 ? -50.451 47.123 10.823 1.00 68.64 ? 371 MET A CG 1 ATOM 2647 S SD . MET A 1 347 ? -49.699 47.050 9.202 1.00 75.77 ? 371 MET A SD 1 ATOM 2648 C CE . MET A 1 347 ? -49.737 48.858 8.741 1.00 75.25 ? 371 MET A CE 1 ATOM 2649 N N . VAL A 1 348 ? -55.026 47.045 11.604 1.00 61.82 ? 372 VAL A N 1 ATOM 2650 C CA . VAL A 1 348 ? -56.377 46.632 11.237 1.00 62.19 ? 372 VAL A CA 1 ATOM 2651 C C . VAL A 1 348 ? -56.658 47.119 9.839 1.00 63.51 ? 372 VAL A C 1 ATOM 2652 O O . VAL A 1 348 ? -56.686 48.315 9.567 1.00 64.01 ? 372 VAL A O 1 ATOM 2653 C CB . VAL A 1 348 ? -57.471 47.262 12.149 1.00 60.28 ? 372 VAL A CB 1 ATOM 2654 C CG1 . VAL A 1 348 ? -58.618 46.295 12.338 1.00 58.97 ? 372 VAL A CG1 1 ATOM 2655 C CG2 . VAL A 1 348 ? -56.896 47.652 13.475 1.00 60.05 ? 372 VAL A CG2 1 ATOM 2656 N N . ASN A 1 349 ? -56.853 46.177 8.941 1.00 64.46 ? 373 ASN A N 1 ATOM 2657 C CA . ASN A 1 349 ? -57.118 46.536 7.579 1.00 66.49 ? 373 ASN A CA 1 ATOM 2658 C C . ASN A 1 349 ? -56.025 47.420 7.026 1.00 68.25 ? 373 ASN A C 1 ATOM 2659 O O . ASN A 1 349 ? -56.279 48.266 6.184 1.00 69.73 ? 373 ASN A O 1 ATOM 2660 C CB . ASN A 1 349 ? -58.470 47.228 7.475 1.00 66.66 ? 373 ASN A CB 1 ATOM 2661 C CG . ASN A 1 349 ? -59.560 46.452 8.163 1.00 67.08 ? 373 ASN A CG 1 ATOM 2662 O OD1 . ASN A 1 349 ? -59.558 45.214 8.166 1.00 65.93 ? 373 ASN A OD1 1 ATOM 2663 N ND2 . ASN A 1 349 ? -60.512 47.173 8.747 1.00 67.73 ? 373 ASN A ND2 1 ATOM 2664 N N . GLY A 1 350 ? -54.807 47.237 7.497 1.00 69.14 ? 374 GLY A N 1 ATOM 2665 C CA . GLY A 1 350 ? -53.739 48.034 6.952 1.00 72.10 ? 374 GLY A CA 1 ATOM 2666 C C . GLY A 1 350 ? -53.555 49.345 7.688 1.00 75.07 ? 374 GLY A C 1 ATOM 2667 O O . GLY A 1 350 ? -52.546 50.068 7.499 1.00 75.32 ? 374 GLY A O 1 ATOM 2668 N N . GLU A 1 351 ? -54.525 49.684 8.529 1.00 77.23 ? 375 GLU A N 1 ATOM 2669 C CA . GLU A 1 351 ? -54.408 50.933 9.268 1.00 79.90 ? 375 GLU A CA 1 ATOM 2670 C C . GLU A 1 351 ? -53.835 50.604 10.638 1.00 79.28 ? 375 GLU A C 1 ATOM 2671 O O . GLU A 1 351 ? -54.216 49.629 11.277 1.00 77.52 ? 375 GLU A O 1 ATOM 2672 C CB . GLU A 1 351 ? -55.777 51.612 9.407 1.00 85.03 ? 375 GLU A CB 1 ATOM 2673 C CG . GLU A 1 351 ? -55.708 53.071 9.883 1.00 90.58 ? 375 GLU A CG 1 ATOM 2674 C CD . GLU A 1 351 ? -57.047 53.808 9.788 1.00 92.94 ? 375 GLU A CD 1 ATOM 2675 O OE1 . GLU A 1 351 ? -58.000 53.439 10.518 1.00 92.97 ? 375 GLU A OE1 1 ATOM 2676 O OE2 . GLU A 1 351 ? -57.137 54.760 8.975 1.00 92.89 ? 375 GLU A OE2 1 ATOM 2677 N N . PRO A 1 352 ? -52.871 51.400 11.093 1.00 79.65 ? 376 PRO A N 1 ATOM 2678 C CA . PRO A 1 352 ? -52.246 51.181 12.400 1.00 79.26 ? 376 PRO A CA 1 ATOM 2679 C C . PRO A 1 352 ? -53.294 50.976 13.491 1.00 79.19 ? 376 PRO A C 1 ATOM 2680 O O . PRO A 1 352 ? -54.345 51.607 13.462 1.00 79.46 ? 376 PRO A O 1 ATOM 2681 C CB . PRO A 1 352 ? -51.432 52.456 12.601 1.00 79.15 ? 376 PRO A CB 1 ATOM 2682 C CG . PRO A 1 352 ? -50.994 52.780 11.205 1.00 79.26 ? 376 PRO A CG 1 ATOM 2683 C CD . PRO A 1 352 ? -52.257 52.548 10.399 1.00 79.37 ? 376 PRO A CD 1 ATOM 2684 N N . LEU A 1 353 ? -53.016 50.120 14.467 1.00 78.25 ? 377 LEU A N 1 ATOM 2685 C CA . LEU A 1 353 ? -54.003 49.911 15.516 1.00 76.74 ? 377 LEU A CA 1 ATOM 2686 C C . LEU A 1 353 ? -54.093 51.074 16.479 1.00 77.95 ? 377 LEU A C 1 ATOM 2687 O O . LEU A 1 353 ? -55.070 51.203 17.190 1.00 78.35 ? 377 LEU A O 1 ATOM 2688 C CB . LEU A 1 353 ? -53.746 48.621 16.287 1.00 74.84 ? 377 LEU A CB 1 ATOM 2689 C CG . LEU A 1 353 ? -55.040 48.038 16.870 1.00 73.88 ? 377 LEU A CG 1 ATOM 2690 C CD1 . LEU A 1 353 ? -55.429 46.793 16.120 1.00 72.15 ? 377 LEU A CD1 1 ATOM 2691 C CD2 . LEU A 1 353 ? -54.856 47.708 18.331 1.00 75.10 ? 377 LEU A CD2 1 ATOM 2692 N N . GLN A 1 354 ? -53.079 51.921 16.519 1.00 79.94 ? 378 GLN A N 1 ATOM 2693 C CA . GLN A 1 354 ? -53.113 53.073 17.410 1.00 81.48 ? 378 GLN A CA 1 ATOM 2694 C C . GLN A 1 354 ? -54.108 54.125 16.878 1.00 80.22 ? 378 GLN A C 1 ATOM 2695 O O . GLN A 1 354 ? -54.689 54.884 17.645 1.00 80.25 ? 378 GLN A O 1 ATOM 2696 C CB . GLN A 1 354 ? -51.709 53.674 17.523 1.00 86.35 ? 378 GLN A CB 1 ATOM 2697 C CG . GLN A 1 354 ? -51.521 54.687 18.648 1.00 91.71 ? 378 GLN A CG 1 ATOM 2698 C CD . GLN A 1 354 ? -50.154 55.370 18.589 1.00 94.46 ? 378 GLN A CD 1 ATOM 2699 O OE1 . GLN A 1 354 ? -49.116 54.706 18.518 1.00 95.47 ? 378 GLN A OE1 1 ATOM 2700 N NE2 . GLN A 1 354 ? -50.153 56.703 18.621 1.00 94.97 ? 378 GLN A NE2 1 ATOM 2701 N N . SER A 1 355 ? -54.326 54.142 15.568 1.00 78.74 ? 379 SER A N 1 ATOM 2702 C CA . SER A 1 355 ? -55.216 55.118 14.942 1.00 77.45 ? 379 SER A CA 1 ATOM 2703 C C . SER A 1 355 ? -56.504 54.481 14.398 1.00 75.98 ? 379 SER A C 1 ATOM 2704 O O . SER A 1 355 ? -57.319 55.137 13.747 1.00 76.31 ? 379 SER A O 1 ATOM 2705 C CB . SER A 1 355 ? -54.468 55.805 13.798 1.00 77.97 ? 379 SER A CB 1 ATOM 2706 O OG . SER A 1 355 ? -53.087 55.916 14.101 1.00 78.58 ? 379 SER A OG 1 ATOM 2707 N N . ALA A 1 356 ? -56.692 53.201 14.671 1.00 73.09 ? 380 ALA A N 1 ATOM 2708 C CA . ALA A 1 356 ? -57.868 52.508 14.168 1.00 71.11 ? 380 ALA A CA 1 ATOM 2709 C C . ALA A 1 356 ? -59.158 52.883 14.886 1.00 69.05 ? 380 ALA A C 1 ATOM 2710 O O . ALA A 1 356 ? -59.135 53.373 16.027 1.00 67.42 ? 380 ALA A O 1 ATOM 2711 C CB . ALA A 1 356 ? -57.656 51.009 14.256 1.00 72.96 ? 380 ALA A CB 1 ATOM 2712 N N . PRO A 1 357 ? -60.306 52.657 14.215 1.00 67.39 ? 381 PRO A N 1 ATOM 2713 C CA . PRO A 1 357 ? -61.623 52.957 14.776 1.00 65.69 ? 381 PRO A CA 1 ATOM 2714 C C . PRO A 1 357 ? -61.852 52.096 16.022 1.00 62.66 ? 381 PRO A C 1 ATOM 2715 O O . PRO A 1 357 ? -61.590 50.886 16.016 1.00 63.89 ? 381 PRO A O 1 ATOM 2716 C CB . PRO A 1 357 ? -62.571 52.599 13.635 1.00 65.83 ? 381 PRO A CB 1 ATOM 2717 C CG . PRO A 1 357 ? -61.747 52.886 12.415 1.00 66.27 ? 381 PRO A CG 1 ATOM 2718 C CD . PRO A 1 357 ? -60.426 52.270 12.797 1.00 66.77 ? 381 PRO A CD 1 ATOM 2719 N N . PRO A 1 358 ? -62.328 52.710 17.114 1.00 58.56 ? 382 PRO A N 1 ATOM 2720 C CA . PRO A 1 358 ? -62.595 52.008 18.377 1.00 55.71 ? 382 PRO A CA 1 ATOM 2721 C C . PRO A 1 358 ? -63.546 50.799 18.281 1.00 53.20 ? 382 PRO A C 1 ATOM 2722 O O . PRO A 1 358 ? -64.362 50.683 17.362 1.00 54.97 ? 382 PRO A O 1 ATOM 2723 C CB . PRO A 1 358 ? -63.133 53.116 19.270 1.00 55.20 ? 382 PRO A CB 1 ATOM 2724 C CG . PRO A 1 358 ? -62.340 54.292 18.824 1.00 56.40 ? 382 PRO A CG 1 ATOM 2725 C CD . PRO A 1 358 ? -62.409 54.168 17.311 1.00 57.64 ? 382 PRO A CD 1 ATOM 2726 N N . ASN A 1 359 ? -63.411 49.875 19.223 1.00 49.35 ? 383 ASN A N 1 ATOM 2727 C CA . ASN A 1 359 ? -64.229 48.663 19.261 1.00 46.01 ? 383 ASN A CA 1 ATOM 2728 C C . ASN A 1 359 ? -64.227 48.239 20.719 1.00 45.62 ? 383 ASN A C 1 ATOM 2729 O O . ASN A 1 359 ? -63.176 47.953 21.299 1.00 44.91 ? 383 ASN A O 1 ATOM 2730 C CB . ASN A 1 359 ? -63.569 47.614 18.383 1.00 42.82 ? 383 ASN A CB 1 ATOM 2731 C CG . ASN A 1 359 ? -64.156 46.264 18.560 1.00 41.29 ? 383 ASN A CG 1 ATOM 2732 O OD1 . ASN A 1 359 ? -64.394 45.833 19.677 1.00 41.47 ? 383 ASN A OD1 1 ATOM 2733 N ND2 . ASN A 1 359 ? -64.373 45.561 17.458 1.00 40.58 ? 383 ASN A ND2 1 ATOM 2734 N N . PRO A 1 360 ? -65.410 48.208 21.337 1.00 45.86 ? 384 PRO A N 1 ATOM 2735 C CA . PRO A 1 360 ? -65.579 47.839 22.735 1.00 45.67 ? 384 PRO A CA 1 ATOM 2736 C C . PRO A 1 360 ? -65.409 46.357 22.983 1.00 45.37 ? 384 PRO A C 1 ATOM 2737 O O . PRO A 1 360 ? -65.205 45.955 24.131 1.00 46.09 ? 384 PRO A O 1 ATOM 2738 C CB . PRO A 1 360 ? -66.978 48.343 23.076 1.00 47.05 ? 384 PRO A CB 1 ATOM 2739 C CG . PRO A 1 360 ? -67.264 49.374 21.998 1.00 49.08 ? 384 PRO A CG 1 ATOM 2740 C CD . PRO A 1 360 ? -66.680 48.699 20.787 1.00 47.76 ? 384 PRO A CD 1 ATOM 2741 N N . ASN A 1 361 ? -65.459 45.542 21.931 1.00 44.46 ? 385 ASN A N 1 ATOM 2742 C CA . ASN A 1 361 ? -65.295 44.092 22.092 1.00 45.00 ? 385 ASN A CA 1 ATOM 2743 C C . ASN A 1 361 ? -63.859 43.632 21.943 1.00 44.12 ? 385 ASN A C 1 ATOM 2744 O O . ASN A 1 361 ? -63.568 42.445 22.103 1.00 43.25 ? 385 ASN A O 1 ATOM 2745 C CB . ASN A 1 361 ? -66.147 43.342 21.076 1.00 48.03 ? 385 ASN A CB 1 ATOM 2746 C CG . ASN A 1 361 ? -67.490 43.986 20.864 1.00 51.78 ? 385 ASN A CG 1 ATOM 2747 O OD1 . ASN A 1 361 ? -67.594 45.064 20.262 1.00 53.73 ? 385 ASN A OD1 1 ATOM 2748 N ND2 . ASN A 1 361 ? -68.536 43.339 21.369 1.00 54.12 ? 385 ASN A ND2 1 ATOM 2749 N N . ARG A 1 362 ? -62.970 44.571 21.629 1.00 43.67 ? 386 ARG A N 1 ATOM 2750 C CA . ARG A 1 362 ? -61.559 44.284 21.398 1.00 42.64 ? 386 ARG A CA 1 ATOM 2751 C C . ARG A 1 362 ? -60.639 44.702 22.523 1.00 44.94 ? 386 ARG A C 1 ATOM 2752 O O . ARG A 1 362 ? -60.756 45.818 23.050 1.00 43.27 ? 386 ARG A O 1 ATOM 2753 C CB . ARG A 1 362 ? -61.113 44.988 20.120 1.00 38.94 ? 386 ARG A CB 1 ATOM 2754 C CG . ARG A 1 362 ? -59.793 44.544 19.548 1.00 35.74 ? 386 ARG A CG 1 ATOM 2755 C CD . ARG A 1 362 ? -59.568 45.189 18.203 1.00 32.89 ? 386 ARG A CD 1 ATOM 2756 N NE . ARG A 1 362 ? -59.424 46.628 18.354 1.00 34.07 ? 386 ARG A NE 1 ATOM 2757 C CZ . ARG A 1 362 ? -59.533 47.507 17.361 1.00 35.78 ? 386 ARG A CZ 1 ATOM 2758 N NH1 . ARG A 1 362 ? -59.789 47.082 16.131 1.00 35.34 ? 386 ARG A NH1 1 ATOM 2759 N NH2 . ARG A 1 362 ? -59.396 48.815 17.598 1.00 35.77 ? 386 ARG A NH2 1 ATOM 2760 N N . GLU A 1 363 ? -59.706 43.804 22.854 1.00 48.77 ? 387 GLU A N 1 ATOM 2761 C CA . GLU A 1 363 ? -58.695 44.006 23.898 1.00 51.61 ? 387 GLU A CA 1 ATOM 2762 C C . GLU A 1 363 ? -57.274 43.715 23.367 1.00 52.01 ? 387 GLU A C 1 ATOM 2763 O O . GLU A 1 363 ? -57.007 42.596 22.892 1.00 51.67 ? 387 GLU A O 1 ATOM 2764 C CB . GLU A 1 363 ? -58.956 43.055 25.054 1.00 55.31 ? 387 GLU A CB 1 ATOM 2765 C CG . GLU A 1 363 ? -59.982 43.519 26.037 1.00 62.57 ? 387 GLU A CG 1 ATOM 2766 C CD . GLU A 1 363 ? -59.350 44.095 27.291 1.00 67.32 ? 387 GLU A CD 1 ATOM 2767 O OE1 . GLU A 1 363 ? -59.774 45.202 27.690 1.00 70.10 ? 387 GLU A OE1 1 ATOM 2768 O OE2 . GLU A 1 363 ? -58.442 43.444 27.872 1.00 68.46 ? 387 GLU A OE2 1 ATOM 2769 N N . VAL A 1 364 ? -56.369 44.700 23.437 1.00 52.44 ? 388 VAL A N 1 ATOM 2770 C CA . VAL A 1 364 ? -54.984 44.492 22.979 1.00 54.78 ? 388 VAL A CA 1 ATOM 2771 C C . VAL A 1 364 ? -54.002 44.407 24.118 1.00 57.36 ? 388 VAL A C 1 ATOM 2772 O O . VAL A 1 364 ? -53.801 45.377 24.842 1.00 59.38 ? 388 VAL A O 1 ATOM 2773 C CB . VAL A 1 364 ? -54.504 45.615 22.040 1.00 53.08 ? 388 VAL A CB 1 ATOM 2774 C CG1 . VAL A 1 364 ? -55.194 45.511 20.707 1.00 51.82 ? 388 VAL A CG1 1 ATOM 2775 C CG2 . VAL A 1 364 ? -54.777 46.961 22.667 1.00 53.60 ? 388 VAL A CG2 1 ATOM 2776 N N . ALA A 1 365 ? -53.372 43.250 24.263 1.00 59.75 ? 389 ALA A N 1 ATOM 2777 C CA . ALA A 1 365 ? -52.404 43.053 25.327 1.00 61.66 ? 389 ALA A CA 1 ATOM 2778 C C . ALA A 1 365 ? -51.003 42.992 24.744 1.00 62.87 ? 389 ALA A C 1 ATOM 2779 O O . ALA A 1 365 ? -50.177 42.176 25.167 1.00 64.74 ? 389 ALA A O 1 ATOM 2780 C CB . ALA A 1 365 ? -52.725 41.765 26.097 1.00 62.28 ? 389 ALA A CB 1 ATOM 2781 N N . GLY A 1 366 ? -50.747 43.852 23.762 1.00 62.72 ? 390 GLY A N 1 ATOM 2782 C CA . GLY A 1 366 ? -49.441 43.881 23.134 1.00 60.91 ? 390 GLY A CA 1 ATOM 2783 C C . GLY A 1 366 ? -49.251 42.795 22.095 1.00 59.84 ? 390 GLY A C 1 ATOM 2784 O O . GLY A 1 366 ? -49.364 43.059 20.904 1.00 60.40 ? 390 GLY A O 1 ATOM 2785 N N . ASP A 1 367 ? -48.968 41.576 22.548 1.00 58.76 ? 391 ASP A N 1 ATOM 2786 C CA . ASP A 1 367 ? -48.729 40.434 21.670 1.00 58.58 ? 391 ASP A CA 1 ATOM 2787 C C . ASP A 1 367 ? -49.989 39.646 21.430 1.00 57.01 ? 391 ASP A C 1 ATOM 2788 O O . ASP A 1 367 ? -50.020 38.778 20.563 1.00 56.00 ? 391 ASP A O 1 ATOM 2789 C CB . ASP A 1 367 ? -47.713 39.494 22.315 1.00 62.19 ? 391 ASP A CB 1 ATOM 2790 C CG . ASP A 1 367 ? -48.263 38.805 23.572 1.00 65.34 ? 391 ASP A CG 1 ATOM 2791 O OD1 . ASP A 1 367 ? -48.556 39.504 24.573 1.00 67.72 ? 391 ASP A OD1 1 ATOM 2792 O OD2 . ASP A 1 367 ? -48.404 37.560 23.558 1.00 65.72 ? 391 ASP A OD2 1 ATOM 2793 N N . THR A 1 368 ? -51.021 39.923 22.222 1.00 56.16 ? 392 THR A N 1 ATOM 2794 C CA . THR A 1 368 ? -52.295 39.226 22.077 1.00 55.14 ? 392 THR A CA 1 ATOM 2795 C C . THR A 1 368 ? -53.536 40.101 22.022 1.00 53.86 ? 392 THR A C 1 ATOM 2796 O O . THR A 1 368 ? -53.688 41.028 22.782 1.00 55.47 ? 392 THR A O 1 ATOM 2797 C CB . THR A 1 368 ? -52.471 38.179 23.186 1.00 55.43 ? 392 THR A CB 1 ATOM 2798 O OG1 . THR A 1 368 ? -51.647 37.046 22.888 1.00 57.09 ? 392 THR A OG1 1 ATOM 2799 C CG2 . THR A 1 368 ? -53.915 37.722 23.281 1.00 55.50 ? 392 THR A CG2 1 ATOM 2800 N N . ILE A 1 369 ? -54.414 39.813 21.084 1.00 50.95 ? 393 ILE A N 1 ATOM 2801 C CA . ILE A 1 369 ? -55.649 40.560 20.972 1.00 49.68 ? 393 ILE A CA 1 ATOM 2802 C C . ILE A 1 369 ? -56.790 39.615 21.362 1.00 50.06 ? 393 ILE A C 1 ATOM 2803 O O . ILE A 1 369 ? -57.117 38.685 20.615 1.00 48.89 ? 393 ILE A O 1 ATOM 2804 C CB . ILE A 1 369 ? -55.908 41.009 19.545 1.00 49.88 ? 393 ILE A CB 1 ATOM 2805 C CG1 . ILE A 1 369 ? -54.815 41.957 19.086 1.00 50.31 ? 393 ILE A CG1 1 ATOM 2806 C CG2 . ILE A 1 369 ? -57.247 41.698 19.460 1.00 49.81 ? 393 ILE A CG2 1 ATOM 2807 C CD1 . ILE A 1 369 ? -55.026 42.423 17.660 1.00 51.39 ? 393 ILE A CD1 1 ATOM 2808 N N . ILE A 1 370 ? -57.405 39.841 22.519 1.00 51.75 ? 394 ILE A N 1 ATOM 2809 C CA . ILE A 1 370 ? -58.474 38.956 22.979 1.00 54.05 ? 394 ILE A CA 1 ATOM 2810 C C . ILE A 1 370 ? -59.823 39.596 22.768 1.00 54.04 ? 394 ILE A C 1 ATOM 2811 O O . ILE A 1 370 ? -59.991 40.776 23.011 1.00 52.43 ? 394 ILE A O 1 ATOM 2812 C CB . ILE A 1 370 ? -58.272 38.586 24.486 1.00 56.18 ? 394 ILE A CB 1 ATOM 2813 C CG1 . ILE A 1 370 ? -59.274 37.504 24.898 1.00 59.69 ? 394 ILE A CG1 1 ATOM 2814 C CG2 . ILE A 1 370 ? -58.410 39.818 25.374 1.00 56.17 ? 394 ILE A CG2 1 ATOM 2815 C CD1 . ILE A 1 370 ? -58.804 36.627 26.103 1.00 61.81 ? 394 ILE A CD1 1 ATOM 2816 N N . PHE A 1 371 ? -60.774 38.818 22.280 1.00 55.46 ? 395 PHE A N 1 ATOM 2817 C CA . PHE A 1 371 ? -62.113 39.319 22.016 1.00 57.73 ? 395 PHE A CA 1 ATOM 2818 C C . PHE A 1 371 ? -63.137 38.748 22.979 1.00 60.13 ? 395 PHE A C 1 ATOM 2819 O O . PHE A 1 371 ? -63.237 37.534 23.096 1.00 60.52 ? 395 PHE A O 1 ATOM 2820 C CB . PHE A 1 371 ? -62.559 38.930 20.617 1.00 56.51 ? 395 PHE A CB 1 ATOM 2821 C CG . PHE A 1 371 ? -61.843 39.642 19.529 1.00 56.34 ? 395 PHE A CG 1 ATOM 2822 C CD1 . PHE A 1 371 ? -60.821 39.023 18.836 1.00 56.87 ? 395 PHE A CD1 1 ATOM 2823 C CD2 . PHE A 1 371 ? -62.215 40.929 19.167 1.00 56.09 ? 395 PHE A CD2 1 ATOM 2824 C CE1 . PHE A 1 371 ? -60.179 39.682 17.786 1.00 57.29 ? 395 PHE A CE1 1 ATOM 2825 C CE2 . PHE A 1 371 ? -61.582 41.594 18.122 1.00 56.09 ? 395 PHE A CE2 1 ATOM 2826 C CZ . PHE A 1 371 ? -60.564 40.973 17.429 1.00 55.86 ? 395 PHE A CZ 1 ATOM 2827 N N . ARG A 1 372 ? -63.925 39.607 23.629 1.00 62.67 ? 396 ARG A N 1 ATOM 2828 C CA . ARG A 1 372 ? -64.969 39.161 24.566 1.00 65.69 ? 396 ARG A CA 1 ATOM 2829 C C . ARG A 1 372 ? -66.377 39.599 24.067 1.00 67.18 ? 396 ARG A C 1 ATOM 2830 O O . ARG A 1 372 ? -66.579 40.752 23.725 1.00 66.92 ? 396 ARG A O 1 ATOM 2831 C CB . ARG A 1 372 ? -64.674 39.689 25.973 1.00 67.48 ? 396 ARG A CB 1 ATOM 2832 C CG . ARG A 1 372 ? -63.391 39.118 26.566 1.00 70.62 ? 396 ARG A CG 1 ATOM 2833 C CD . ARG A 1 372 ? -63.059 39.735 27.907 1.00 74.53 ? 396 ARG A CD 1 ATOM 2834 N NE . ARG A 1 372 ? -61.681 39.459 28.313 1.00 77.73 ? 396 ARG A NE 1 ATOM 2835 C CZ . ARG A 1 372 ? -61.043 40.101 29.293 1.00 79.38 ? 396 ARG A CZ 1 ATOM 2836 N NH1 . ARG A 1 372 ? -61.661 41.061 29.975 1.00 80.20 ? 396 ARG A NH1 1 ATOM 2837 N NH2 . ARG A 1 372 ? -59.778 39.803 29.581 1.00 79.29 ? 396 ARG A NH2 1 ATOM 2838 N N . ASP A 1 373 ? -67.331 38.666 24.005 1.00 69.30 ? 397 ASP A N 1 ATOM 2839 C CA . ASP A 1 373 ? -68.692 38.932 23.505 1.00 71.69 ? 397 ASP A CA 1 ATOM 2840 C C . ASP A 1 373 ? -68.630 39.515 22.096 1.00 71.92 ? 397 ASP A C 1 ATOM 2841 O O . ASP A 1 373 ? -69.221 40.576 21.807 1.00 70.29 ? 397 ASP A O 1 ATOM 2842 C CB . ASP A 1 373 ? -69.447 39.902 24.422 1.00 75.45 ? 397 ASP A CB 1 ATOM 2843 C CG . ASP A 1 373 ? -70.842 40.262 23.885 1.00 78.43 ? 397 ASP A CG 1 ATOM 2844 O OD1 . ASP A 1 373 ? -70.949 41.154 23.011 1.00 78.96 ? 397 ASP A OD1 1 ATOM 2845 O OD2 . ASP A 1 373 ? -71.835 39.645 24.335 1.00 80.57 ? 397 ASP A OD2 1 ATOM 2846 N N . THR A 1 374 ? -67.946 38.800 21.208 1.00 73.24 ? 398 THR A N 1 ATOM 2847 C CA . THR A 1 374 ? -67.778 39.291 19.856 1.00 75.35 ? 398 THR A CA 1 ATOM 2848 C C . THR A 1 374 ? -69.086 39.428 19.131 1.00 76.52 ? 398 THR A C 1 ATOM 2849 O O . THR A 1 374 ? -69.912 38.525 19.214 1.00 75.36 ? 398 THR A O 1 ATOM 2850 C CB . THR A 1 374 ? -66.838 38.402 19.037 1.00 75.55 ? 398 THR A CB 1 ATOM 2851 O OG1 . THR A 1 374 ? -65.729 37.996 19.851 1.00 76.78 ? 398 THR A OG1 1 ATOM 2852 C CG2 . THR A 1 374 ? -66.299 39.185 17.837 1.00 75.44 ? 398 THR A CG2 1 ATOM 2853 N N . GLN A 1 375 ? -69.248 40.559 18.429 1.00 79.23 ? 399 GLN A N 1 ATOM 2854 C CA . GLN A 1 375 ? -70.460 40.883 17.670 1.00 81.48 ? 399 GLN A CA 1 ATOM 2855 C C . GLN A 1 375 ? -70.197 41.212 16.192 1.00 81.79 ? 399 GLN A C 1 ATOM 2856 O O . GLN A 1 375 ? -69.051 41.264 15.746 1.00 82.99 ? 399 GLN A O 1 ATOM 2857 C CB . GLN A 1 375 ? -71.185 42.060 18.333 1.00 82.34 ? 399 GLN A CB 1 ATOM 2858 C CG . GLN A 1 375 ? -72.710 41.953 18.335 1.00 83.93 ? 399 GLN A CG 1 ATOM 2859 C CD . GLN A 1 375 ? -73.222 40.792 19.180 1.00 84.91 ? 399 GLN A CD 1 ATOM 2860 O OE1 . GLN A 1 375 ? -72.885 40.668 20.359 1.00 85.02 ? 399 GLN A OE1 1 ATOM 2861 N NE2 . GLN A 1 375 ? -74.048 39.940 18.578 1.00 85.18 ? 399 GLN A NE2 1 ATOM 2862 N N . ILE A 1 376 ? -71.269 41.443 15.440 1.00 81.17 ? 400 ILE A N 1 ATOM 2863 C CA . ILE A 1 376 ? -71.141 41.754 14.024 1.00 80.72 ? 400 ILE A CA 1 ATOM 2864 C C . ILE A 1 376 ? -70.648 43.178 13.853 1.00 79.35 ? 400 ILE A C 1 ATOM 2865 O O . ILE A 1 376 ? -71.367 44.051 13.372 1.00 81.00 ? 400 ILE A O 1 ATOM 2866 C CB . ILE A 1 376 ? -72.480 41.580 13.266 1.00 82.05 ? 400 ILE A CB 1 ATOM 2867 C CG1 . ILE A 1 376 ? -73.069 40.194 13.532 1.00 83.32 ? 400 ILE A CG1 1 ATOM 2868 C CG2 . ILE A 1 376 ? -72.252 41.718 11.774 1.00 82.56 ? 400 ILE A CG2 1 ATOM 2869 C CD1 . ILE A 1 376 ? -73.725 40.049 14.889 1.00 84.58 ? 400 ILE A CD1 1 ATOM 2870 N N . SER A 1 377 ? -69.417 43.425 14.257 1.00 76.13 ? 401 SER A N 1 ATOM 2871 C CA . SER A 1 377 ? -68.880 44.766 14.139 1.00 73.61 ? 401 SER A CA 1 ATOM 2872 C C . SER A 1 377 ? -67.396 44.658 14.336 1.00 71.98 ? 401 SER A C 1 ATOM 2873 O O . SER A 1 377 ? -66.645 45.580 13.990 1.00 71.68 ? 401 SER A O 1 ATOM 2874 C CB . SER A 1 377 ? -69.477 45.699 15.202 1.00 74.49 ? 401 SER A CB 1 ATOM 2875 O OG . SER A 1 377 ? -68.914 45.472 16.486 1.00 75.62 ? 401 SER A OG 1 ATOM 2876 N N . SER A 1 378 ? -66.972 43.527 14.897 1.00 69.37 ? 402 SER A N 1 ATOM 2877 C CA . SER A 1 378 ? -65.553 43.288 15.146 1.00 66.56 ? 402 SER A CA 1 ATOM 2878 C C . SER A 1 378 ? -64.942 42.492 13.989 1.00 65.45 ? 402 SER A C 1 ATOM 2879 O O . SER A 1 378 ? -63.786 42.090 14.029 1.00 66.30 ? 402 SER A O 1 ATOM 2880 C CB . SER A 1 378 ? -65.421 42.493 16.435 1.00 66.28 ? 402 SER A CB 1 ATOM 2881 O OG . SER A 1 378 ? -66.643 42.533 17.151 1.00 65.90 ? 402 SER A OG 1 ATOM 2882 N N . ARG A 1 379 ? -65.725 42.299 12.941 1.00 62.96 ? 403 ARG A N 1 ATOM 2883 C CA . ARG A 1 379 ? -65.278 41.552 11.787 1.00 60.70 ? 403 ARG A CA 1 ATOM 2884 C C . ARG A 1 379 ? -64.268 42.421 11.029 1.00 58.57 ? 403 ARG A C 1 ATOM 2885 O O . ARG A 1 379 ? -64.500 43.619 10.699 1.00 56.77 ? 403 ARG A O 1 ATOM 2886 C CB . ARG A 1 379 ? -66.481 41.193 10.918 1.00 62.87 ? 403 ARG A CB 1 ATOM 2887 C CG . ARG A 1 379 ? -67.722 40.938 11.767 1.00 65.60 ? 403 ARG A CG 1 ATOM 2888 C CD . ARG A 1 379 ? -68.956 40.693 10.934 1.00 68.72 ? 403 ARG A CD 1 ATOM 2889 N NE . ARG A 1 379 ? -69.055 39.304 10.497 1.00 71.73 ? 403 ARG A NE 1 ATOM 2890 C CZ . ARG A 1 379 ? -70.020 38.839 9.712 1.00 72.77 ? 403 ARG A CZ 1 ATOM 2891 N NH1 . ARG A 1 379 ? -70.970 39.654 9.275 1.00 71.95 ? 403 ARG A NH1 1 ATOM 2892 N NH2 . ARG A 1 379 ? -70.036 37.560 9.370 1.00 73.76 ? 403 ARG A NH2 1 ATOM 2893 N N . ALA A 1 380 ? -63.122 41.790 10.782 1.00 57.02 ? 404 ALA A N 1 ATOM 2894 C CA . ALA A 1 380 ? -62.011 42.430 10.101 1.00 54.62 ? 404 ALA A CA 1 ATOM 2895 C C . ALA A 1 380 ? -60.814 41.483 10.071 1.00 52.65 ? 404 ALA A C 1 ATOM 2896 O O . ALA A 1 380 ? -60.843 40.418 10.688 1.00 53.49 ? 404 ALA A O 1 ATOM 2897 C CB . ALA A 1 380 ? -61.634 43.710 10.829 1.00 52.70 ? 404 ALA A CB 1 ATOM 2898 N N . VAL A 1 381 ? -59.776 41.863 9.330 1.00 50.52 ? 405 VAL A N 1 ATOM 2899 C CA . VAL A 1 381 ? -58.548 41.076 9.292 1.00 46.97 ? 405 VAL A CA 1 ATOM 2900 C C . VAL A 1 381 ? -57.484 41.875 9.982 1.00 45.55 ? 405 VAL A C 1 ATOM 2901 O O . VAL A 1 381 ? -57.313 43.078 9.733 1.00 46.13 ? 405 VAL A O 1 ATOM 2902 C CB . VAL A 1 381 ? -58.092 40.794 7.889 1.00 45.12 ? 405 VAL A CB 1 ATOM 2903 C CG1 . VAL A 1 381 ? -58.356 39.336 7.563 1.00 44.88 ? 405 VAL A CG1 1 ATOM 2904 C CG2 . VAL A 1 381 ? -58.811 41.715 6.938 1.00 44.49 ? 405 VAL A CG2 1 ATOM 2905 N N . TYR A 1 382 ? -56.774 41.195 10.866 1.00 43.26 ? 406 TYR A N 1 ATOM 2906 C CA . TYR A 1 382 ? -55.720 41.834 11.609 1.00 41.11 ? 406 TYR A CA 1 ATOM 2907 C C . TYR A 1 382 ? -54.351 41.329 11.112 1.00 41.44 ? 406 TYR A C 1 ATOM 2908 O O . TYR A 1 382 ? -54.191 40.152 10.688 1.00 39.84 ? 406 TYR A O 1 ATOM 2909 C CB . TYR A 1 382 ? -55.876 41.534 13.101 1.00 40.11 ? 406 TYR A CB 1 ATOM 2910 C CG . TYR A 1 382 ? -57.108 42.127 13.759 1.00 39.19 ? 406 TYR A CG 1 ATOM 2911 C CD1 . TYR A 1 382 ? -58.379 41.598 13.532 1.00 38.32 ? 406 TYR A CD1 1 ATOM 2912 C CD2 . TYR A 1 382 ? -56.993 43.214 14.630 1.00 39.15 ? 406 TYR A CD2 1 ATOM 2913 C CE1 . TYR A 1 382 ? -59.508 42.138 14.168 1.00 39.53 ? 406 TYR A CE1 1 ATOM 2914 C CE2 . TYR A 1 382 ? -58.110 43.764 15.269 1.00 39.59 ? 406 TYR A CE2 1 ATOM 2915 C CZ . TYR A 1 382 ? -59.365 43.225 15.043 1.00 40.20 ? 406 TYR A CZ 1 ATOM 2916 O OH . TYR A 1 382 ? -60.450 43.758 15.724 1.00 39.46 ? 406 TYR A OH 1 ATOM 2917 N N . GLN A 1 383 ? -53.398 42.260 11.107 1.00 42.51 ? 407 GLN A N 1 ATOM 2918 C CA . GLN A 1 383 ? -52.044 42.020 10.669 1.00 44.23 ? 407 GLN A CA 1 ATOM 2919 C C . GLN A 1 383 ? -51.115 42.098 11.827 1.00 45.60 ? 407 GLN A C 1 ATOM 2920 O O . GLN A 1 383 ? -51.243 43.006 12.655 1.00 43.80 ? 407 GLN A O 1 ATOM 2921 C CB . GLN A 1 383 ? -51.606 43.052 9.636 1.00 44.21 ? 407 GLN A CB 1 ATOM 2922 C CG . GLN A 1 383 ? -52.090 42.743 8.263 1.00 45.11 ? 407 GLN A CG 1 ATOM 2923 C CD . GLN A 1 383 ? -53.576 42.933 8.131 1.00 45.49 ? 407 GLN A CD 1 ATOM 2924 O OE1 . GLN A 1 383 ? -54.257 42.161 7.451 1.00 46.15 ? 407 GLN A OE1 1 ATOM 2925 N NE2 . GLN A 1 383 ? -54.093 43.976 8.768 1.00 45.12 ? 407 GLN A NE2 1 ATOM 2926 N N . CYS A 1 384 ? -50.160 41.167 11.851 1.00 48.36 ? 408 CYS A N 1 ATOM 2927 C CA . CYS A 1 384 ? -49.127 41.108 12.880 1.00 50.42 ? 408 CYS A CA 1 ATOM 2928 C C . CYS A 1 384 ? -47.770 41.172 12.170 1.00 49.96 ? 408 CYS A C 1 ATOM 2929 O O . CYS A 1 384 ? -47.421 40.264 11.424 1.00 51.46 ? 408 CYS A O 1 ATOM 2930 C CB . CYS A 1 384 ? -49.224 39.794 13.646 1.00 53.22 ? 408 CYS A CB 1 ATOM 2931 S SG . CYS A 1 384 ? -48.287 39.871 15.203 1.00 62.84 ? 408 CYS A SG 1 ATOM 2932 N N . ASN A 1 385 ? -47.015 42.247 12.373 1.00 49.32 ? 409 ASN A N 1 ATOM 2933 C CA . ASN A 1 385 ? -45.695 42.418 11.724 1.00 48.96 ? 409 ASN A CA 1 ATOM 2934 C C . ASN A 1 385 ? -44.594 42.304 12.804 1.00 47.33 ? 409 ASN A C 1 ATOM 2935 O O . ASN A 1 385 ? -44.379 43.252 13.579 1.00 44.23 ? 409 ASN A O 1 ATOM 2936 C CB . ASN A 1 385 ? -45.626 43.812 11.061 1.00 52.57 ? 409 ASN A CB 1 ATOM 2937 C CG . ASN A 1 385 ? -44.379 44.005 10.217 1.00 56.73 ? 409 ASN A CG 1 ATOM 2938 O OD1 . ASN A 1 385 ? -44.025 43.106 9.453 1.00 59.95 ? 409 ASN A OD1 1 ATOM 2939 N ND2 . ASN A 1 385 ? -43.725 45.165 10.315 1.00 59.25 ? 409 ASN A ND2 1 ATOM 2940 N N . THR A 1 386 ? -43.934 41.139 12.879 1.00 47.70 ? 410 THR A N 1 ATOM 2941 C CA . THR A 1 386 ? -42.842 40.893 13.840 1.00 48.18 ? 410 THR A CA 1 ATOM 2942 C C . THR A 1 386 ? -41.551 41.467 13.230 1.00 47.80 ? 410 THR A C 1 ATOM 2943 O O . THR A 1 386 ? -40.797 40.787 12.542 1.00 46.42 ? 410 THR A O 1 ATOM 2944 C CB . THR A 1 386 ? -42.664 39.397 14.104 1.00 49.77 ? 410 THR A CB 1 ATOM 2945 O OG1 . THR A 1 386 ? -42.537 38.710 12.857 1.00 52.52 ? 410 THR A OG1 1 ATOM 2946 C CG2 . THR A 1 386 ? -43.863 38.841 14.856 1.00 51.06 ? 410 THR A CG2 1 ATOM 2947 N N . SER A 1 387 ? -41.324 42.747 13.485 1.00 49.79 ? 411 SER A N 1 ATOM 2948 C CA . SER A 1 387 ? -40.181 43.497 12.985 1.00 49.74 ? 411 SER A CA 1 ATOM 2949 C C . SER A 1 387 ? -38.861 43.149 13.679 1.00 48.62 ? 411 SER A C 1 ATOM 2950 O O . SER A 1 387 ? -38.723 43.268 14.877 1.00 47.78 ? 411 SER A O 1 ATOM 2951 C CB . SER A 1 387 ? -40.461 45.000 13.078 1.00 51.07 ? 411 SER A CB 1 ATOM 2952 O OG . SER A 1 387 ? -39.421 45.750 12.478 1.00 54.09 ? 411 SER A OG 1 ATOM 2953 N N . ASN A 1 388 ? -37.883 42.741 12.889 1.00 47.17 ? 412 ASN A N 1 ATOM 2954 C CA . ASN A 1 388 ? -36.579 42.357 13.388 1.00 45.13 ? 412 ASN A CA 1 ATOM 2955 C C . ASN A 1 388 ? -35.521 42.983 12.532 1.00 46.07 ? 412 ASN A C 1 ATOM 2956 O O . ASN A 1 388 ? -35.765 43.300 11.372 1.00 47.46 ? 412 ASN A O 1 ATOM 2957 C CB . ASN A 1 388 ? -36.454 40.846 13.344 1.00 43.14 ? 412 ASN A CB 1 ATOM 2958 C CG . ASN A 1 388 ? -35.145 40.366 13.870 1.00 41.00 ? 412 ASN A CG 1 ATOM 2959 O OD1 . ASN A 1 388 ? -34.644 40.909 14.840 1.00 39.47 ? 412 ASN A OD1 1 ATOM 2960 N ND2 . ASN A 1 388 ? -34.587 39.328 13.251 1.00 40.59 ? 412 ASN A ND2 1 ATOM 2961 N N . GLU A 1 389 ? -34.331 43.139 13.079 1.00 46.86 ? 413 GLU A N 1 ATOM 2962 C CA . GLU A 1 389 ? -33.244 43.714 12.298 1.00 48.40 ? 413 GLU A CA 1 ATOM 2963 C C . GLU A 1 389 ? -32.856 42.812 11.103 1.00 46.18 ? 413 GLU A C 1 ATOM 2964 O O . GLU A 1 389 ? -32.267 43.278 10.137 1.00 46.10 ? 413 GLU A O 1 ATOM 2965 C CB . GLU A 1 389 ? -32.018 43.940 13.183 1.00 52.05 ? 413 GLU A CB 1 ATOM 2966 C CG . GLU A 1 389 ? -30.854 44.605 12.467 1.00 56.89 ? 413 GLU A CG 1 ATOM 2967 C CD . GLU A 1 389 ? -29.539 44.442 13.209 1.00 59.99 ? 413 GLU A CD 1 ATOM 2968 O OE1 . GLU A 1 389 ? -28.531 45.039 12.761 1.00 62.55 ? 413 GLU A OE1 1 ATOM 2969 O OE2 . GLU A 1 389 ? -29.510 43.713 14.232 1.00 59.39 ? 413 GLU A OE2 1 ATOM 2970 N N . HIS A 1 390 ? -33.199 41.533 11.147 1.00 43.51 ? 414 HIS A N 1 ATOM 2971 C CA . HIS A 1 390 ? -32.830 40.650 10.047 1.00 41.43 ? 414 HIS A CA 1 ATOM 2972 C C . HIS A 1 390 ? -33.958 40.218 9.142 1.00 40.36 ? 414 HIS A C 1 ATOM 2973 O O . HIS A 1 390 ? -33.756 39.417 8.199 1.00 39.33 ? 414 HIS A O 1 ATOM 2974 C CB . HIS A 1 390 ? -32.141 39.410 10.599 1.00 41.27 ? 414 HIS A CB 1 ATOM 2975 C CG . HIS A 1 390 ? -30.870 39.712 11.319 1.00 41.57 ? 414 HIS A CG 1 ATOM 2976 N ND1 . HIS A 1 390 ? -30.785 39.748 12.694 1.00 41.90 ? 414 HIS A ND1 1 ATOM 2977 C CD2 . HIS A 1 390 ? -29.645 40.048 10.854 1.00 41.83 ? 414 HIS A CD2 1 ATOM 2978 C CE1 . HIS A 1 390 ? -29.560 40.096 13.046 1.00 42.94 ? 414 HIS A CE1 1 ATOM 2979 N NE2 . HIS A 1 390 ? -28.850 40.284 11.948 1.00 43.91 ? 414 HIS A NE2 1 ATOM 2980 N N . GLY A 1 391 ? -35.151 40.723 9.434 1.00 39.40 ? 415 GLY A N 1 ATOM 2981 C CA . GLY A 1 391 ? -36.291 40.352 8.625 1.00 38.41 ? 415 GLY A CA 1 ATOM 2982 C C . GLY A 1 391 ? -37.580 40.470 9.377 1.00 36.84 ? 415 GLY A C 1 ATOM 2983 O O . GLY A 1 391 ? -37.589 40.987 10.484 1.00 37.42 ? 415 GLY A O 1 ATOM 2984 N N . TYR A 1 392 ? -38.659 39.980 8.773 1.00 35.62 ? 416 TYR A N 1 ATOM 2985 C CA . TYR A 1 392 ? -39.986 40.066 9.384 1.00 34.80 ? 416 TYR A CA 1 ATOM 2986 C C . TYR A 1 392 ? -40.893 38.910 8.958 1.00 33.84 ? 416 TYR A C 1 ATOM 2987 O O . TYR A 1 392 ? -40.536 38.102 8.097 1.00 34.86 ? 416 TYR A O 1 ATOM 2988 C CB . TYR A 1 392 ? -40.663 41.403 9.013 1.00 33.87 ? 416 TYR A CB 1 ATOM 2989 C CG . TYR A 1 392 ? -41.102 41.471 7.567 1.00 33.94 ? 416 TYR A CG 1 ATOM 2990 C CD1 . TYR A 1 392 ? -42.148 40.668 7.090 1.00 34.17 ? 416 TYR A CD1 1 ATOM 2991 C CD2 . TYR A 1 392 ? -40.425 42.266 6.655 1.00 34.99 ? 416 TYR A CD2 1 ATOM 2992 C CE1 . TYR A 1 392 ? -42.497 40.647 5.741 1.00 34.33 ? 416 TYR A CE1 1 ATOM 2993 C CE2 . TYR A 1 392 ? -40.768 42.255 5.295 1.00 35.84 ? 416 TYR A CE2 1 ATOM 2994 C CZ . TYR A 1 392 ? -41.798 41.439 4.848 1.00 35.38 ? 416 TYR A CZ 1 ATOM 2995 O OH . TYR A 1 392 ? -42.082 41.379 3.501 1.00 36.05 ? 416 TYR A OH 1 ATOM 2996 N N . LEU A 1 393 ? -42.063 38.839 9.578 1.00 32.38 ? 417 LEU A N 1 ATOM 2997 C CA . LEU A 1 393 ? -43.061 37.841 9.219 1.00 31.39 ? 417 LEU A CA 1 ATOM 2998 C C . LEU A 1 393 ? -44.406 38.560 9.259 1.00 33.62 ? 417 LEU A C 1 ATOM 2999 O O . LEU A 1 393 ? -44.911 38.859 10.345 1.00 35.78 ? 417 LEU A O 1 ATOM 3000 C CB . LEU A 1 393 ? -43.129 36.697 10.219 1.00 25.61 ? 417 LEU A CB 1 ATOM 3001 C CG . LEU A 1 393 ? -41.991 35.716 10.337 1.00 21.30 ? 417 LEU A CG 1 ATOM 3002 C CD1 . LEU A 1 393 ? -42.358 34.682 11.369 1.00 21.37 ? 417 LEU A CD1 1 ATOM 3003 C CD2 . LEU A 1 393 ? -41.746 35.076 9.017 1.00 21.53 ? 417 LEU A CD2 1 ATOM 3004 N N . LEU A 1 394 ? -44.992 38.854 8.099 1.00 33.92 ? 418 LEU A N 1 ATOM 3005 C CA . LEU A 1 394 ? -46.275 39.543 8.088 1.00 33.98 ? 418 LEU A CA 1 ATOM 3006 C C . LEU A 1 394 ? -47.350 38.463 8.202 1.00 34.66 ? 418 LEU A C 1 ATOM 3007 O O . LEU A 1 394 ? -47.331 37.472 7.468 1.00 35.50 ? 418 LEU A O 1 ATOM 3008 C CB . LEU A 1 394 ? -46.403 40.325 6.785 1.00 35.58 ? 418 LEU A CB 1 ATOM 3009 C CG . LEU A 1 394 ? -47.570 41.293 6.557 1.00 37.80 ? 418 LEU A CG 1 ATOM 3010 C CD1 . LEU A 1 394 ? -48.871 40.516 6.412 1.00 37.97 ? 418 LEU A CD1 1 ATOM 3011 C CD2 . LEU A 1 394 ? -47.641 42.285 7.696 1.00 38.51 ? 418 LEU A CD2 1 ATOM 3012 N N . ALA A 1 395 ? -48.273 38.640 9.135 1.00 34.96 ? 419 ALA A N 1 ATOM 3013 C CA . ALA A 1 395 ? -49.335 37.658 9.320 1.00 37.54 ? 419 ALA A CA 1 ATOM 3014 C C . ALA A 1 395 ? -50.750 38.186 9.040 1.00 39.44 ? 419 ALA A C 1 ATOM 3015 O O . ALA A 1 395 ? -51.032 39.400 9.214 1.00 40.08 ? 419 ALA A O 1 ATOM 3016 C CB . ALA A 1 395 ? -49.279 37.113 10.738 1.00 38.10 ? 419 ALA A CB 1 ATOM 3017 N N . ASN A 1 396 ? -51.633 37.270 8.612 1.00 39.49 ? 420 ASN A N 1 ATOM 3018 C CA . ASN A 1 396 ? -53.029 37.613 8.343 1.00 39.20 ? 420 ASN A CA 1 ATOM 3019 C C . ASN A 1 396 ? -53.951 36.710 9.112 1.00 39.37 ? 420 ASN A C 1 ATOM 3020 O O . ASN A 1 396 ? -53.865 35.481 9.008 1.00 37.64 ? 420 ASN A O 1 ATOM 3021 C CB . ASN A 1 396 ? -53.368 37.514 6.854 1.00 39.73 ? 420 ASN A CB 1 ATOM 3022 C CG . ASN A 1 396 ? -53.026 38.779 6.095 1.00 38.92 ? 420 ASN A CG 1 ATOM 3023 O OD1 . ASN A 1 396 ? -53.333 39.890 6.540 1.00 37.20 ? 420 ASN A OD1 1 ATOM 3024 N ND2 . ASN A 1 396 ? -52.393 38.617 4.937 1.00 39.65 ? 420 ASN A ND2 1 ATOM 3025 N N . ALA A 1 397 ? -54.842 37.323 9.874 1.00 40.46 ? 421 ALA A N 1 ATOM 3026 C CA . ALA A 1 397 ? -55.790 36.558 10.641 1.00 42.99 ? 421 ALA A CA 1 ATOM 3027 C C . ALA A 1 397 ? -57.077 37.338 10.646 1.00 44.96 ? 421 ALA A C 1 ATOM 3028 O O . ALA A 1 397 ? -57.063 38.527 10.941 1.00 45.02 ? 421 ALA A O 1 ATOM 3029 C CB . ALA A 1 397 ? -55.292 36.393 12.047 1.00 43.67 ? 421 ALA A CB 1 ATOM 3030 N N . PHE A 1 398 ? -58.190 36.685 10.328 1.00 47.66 ? 422 PHE A N 1 ATOM 3031 C CA . PHE A 1 398 ? -59.473 37.376 10.326 1.00 50.05 ? 422 PHE A CA 1 ATOM 3032 C C . PHE A 1 398 ? -60.383 36.970 11.479 1.00 52.78 ? 422 PHE A C 1 ATOM 3033 O O . PHE A 1 398 ? -60.212 35.897 12.075 1.00 55.09 ? 422 PHE A O 1 ATOM 3034 C CB . PHE A 1 398 ? -60.215 37.138 9.001 1.00 46.55 ? 422 PHE A CB 1 ATOM 3035 C CG . PHE A 1 398 ? -60.497 35.678 8.692 1.00 44.43 ? 422 PHE A CG 1 ATOM 3036 C CD1 . PHE A 1 398 ? -60.840 34.782 9.696 1.00 43.06 ? 422 PHE A CD1 1 ATOM 3037 C CD2 . PHE A 1 398 ? -60.495 35.221 7.377 1.00 43.31 ? 422 PHE A CD2 1 ATOM 3038 C CE1 . PHE A 1 398 ? -61.184 33.472 9.402 1.00 43.09 ? 422 PHE A CE1 1 ATOM 3039 C CE2 . PHE A 1 398 ? -60.837 33.904 7.074 1.00 42.14 ? 422 PHE A CE2 1 ATOM 3040 C CZ . PHE A 1 398 ? -61.184 33.030 8.090 1.00 42.42 ? 422 PHE A CZ 1 ATOM 3041 N N . VAL A 1 399 ? -61.356 37.835 11.775 1.00 55.37 ? 423 VAL A N 1 ATOM 3042 C CA . VAL A 1 399 ? -62.349 37.593 12.826 1.00 57.76 ? 423 VAL A CA 1 ATOM 3043 C C . VAL A 1 399 ? -63.708 37.608 12.125 1.00 60.38 ? 423 VAL A C 1 ATOM 3044 O O . VAL A 1 399 ? -64.109 38.636 11.559 1.00 60.82 ? 423 VAL A O 1 ATOM 3045 C CB . VAL A 1 399 ? -62.369 38.727 13.878 1.00 56.71 ? 423 VAL A CB 1 ATOM 3046 C CG1 . VAL A 1 399 ? -63.087 38.266 15.120 1.00 56.86 ? 423 VAL A CG1 1 ATOM 3047 C CG2 . VAL A 1 399 ? -60.963 39.173 14.206 1.00 56.67 ? 423 VAL A CG2 1 ATOM 3048 N N . SER A 1 400 ? -64.412 36.481 12.134 1.00 62.79 ? 424 SER A N 1 ATOM 3049 C CA . SER A 1 400 ? -65.733 36.439 11.511 1.00 64.34 ? 424 SER A CA 1 ATOM 3050 C C . SER A 1 400 ? -66.780 35.817 12.449 1.00 66.73 ? 424 SER A C 1 ATOM 3051 O O . SER A 1 400 ? -66.552 34.773 13.084 1.00 67.36 ? 424 SER A O 1 ATOM 3052 C CB . SER A 1 400 ? -65.705 35.631 10.204 1.00 62.78 ? 424 SER A CB 1 ATOM 3053 O OG . SER A 1 400 ? -66.082 34.278 10.406 1.00 59.07 ? 424 SER A OG 1 ATOM 3054 N N . VAL A 1 401 ? -67.926 36.484 12.538 1.00 68.39 ? 425 VAL A N 1 ATOM 3055 C CA . VAL A 1 401 ? -69.015 36.028 13.373 1.00 71.14 ? 425 VAL A CA 1 ATOM 3056 C C . VAL A 1 401 ? -70.245 35.695 12.525 1.00 72.13 ? 425 VAL A C 1 ATOM 3057 O O . VAL A 1 401 ? -70.451 36.252 11.448 1.00 71.70 ? 425 VAL A O 1 ATOM 3058 C CB . VAL A 1 401 ? -69.336 37.096 14.425 1.00 72.26 ? 425 VAL A CB 1 ATOM 3059 C CG1 . VAL A 1 401 ? -68.289 37.051 15.523 1.00 73.10 ? 425 VAL A CG1 1 ATOM 3060 C CG2 . VAL A 1 401 ? -69.328 38.478 13.782 1.00 72.18 ? 425 VAL A CG2 1 ATOM 3061 N N . LEU A 1 402 ? -71.066 34.792 13.037 1.00 74.79 ? 426 LEU A N 1 ATOM 3062 C CA . LEU A 1 402 ? -72.257 34.300 12.347 1.00 76.53 ? 426 LEU A CA 1 ATOM 3063 C C . LEU A 1 402 ? -73.482 35.212 12.394 1.00 77.79 ? 426 LEU A C 1 ATOM 3064 O O . LEU A 1 402 ? -73.505 36.075 13.297 1.00 78.35 ? 426 LEU A O 1 ATOM 3065 C CB . LEU A 1 402 ? -72.546 32.925 12.933 1.00 76.18 ? 426 LEU A CB 1 ATOM 3066 C CG . LEU A 1 402 ? -71.158 32.279 13.093 1.00 72.94 ? 426 LEU A CG 1 ATOM 3067 C CD1 . LEU A 1 402 ? -71.143 31.246 14.198 1.00 72.63 ? 426 LEU A CD1 1 ATOM 3068 C CD2 . LEU A 1 402 ? -70.729 31.702 11.759 1.00 72.38 ? 426 LEU A CD2 1 HETATM 3069 C C1 . NAG B 2 . ? -42.538 45.396 9.495 1.00 60.81 ? 1 NAG A C1 1 HETATM 3070 C C2 . NAG B 2 . ? -42.900 45.686 8.031 1.00 61.01 ? 1 NAG A C2 1 HETATM 3071 C C3 . NAG B 2 . ? -41.621 45.844 7.208 1.00 61.85 ? 1 NAG A C3 1 HETATM 3072 C C4 . NAG B 2 . ? -40.722 46.922 7.822 1.00 62.00 ? 1 NAG A C4 1 HETATM 3073 C C5 . NAG B 2 . ? -40.494 46.657 9.320 1.00 62.38 ? 1 NAG A C5 1 HETATM 3074 C C6 . NAG B 2 . ? -39.747 47.805 10.008 1.00 63.71 ? 1 NAG A C6 1 HETATM 3075 C C7 . NAG B 2 . ? -44.579 44.839 6.512 1.00 62.53 ? 1 NAG A C7 1 HETATM 3076 C C8 . NAG B 2 . ? -44.296 44.169 5.176 1.00 62.08 ? 1 NAG A C8 1 HETATM 3077 N N2 . NAG B 2 . ? -43.706 44.609 7.491 1.00 61.78 ? 1 NAG A N2 1 HETATM 3078 O O3 . NAG B 2 . ? -41.958 46.201 5.871 1.00 62.46 ? 1 NAG A O3 1 HETATM 3079 O O4 . NAG B 2 . ? -39.473 46.921 7.147 1.00 61.29 ? 1 NAG A O4 1 HETATM 3080 O O5 . NAG B 2 . ? -41.763 46.485 10.008 1.00 62.40 ? 1 NAG A O5 1 HETATM 3081 O O6 . NAG B 2 . ? -40.478 49.024 9.932 1.00 64.98 ? 1 NAG A O6 1 HETATM 3082 O O7 . NAG B 2 . ? -45.571 45.570 6.642 1.00 62.63 ? 1 NAG A O7 1 HETATM 3083 O O . HOH C 3 . ? -55.389 48.695 -16.251 1.00 33.04 ? 2 HOH A O 1 HETATM 3084 O O . HOH C 3 . ? -25.150 31.707 -12.374 1.00 57.39 ? 3 HOH A O 1 HETATM 3085 O O . HOH C 3 . ? -36.516 48.035 -5.545 1.00 41.41 ? 4 HOH A O 1 HETATM 3086 O O . HOH C 3 . ? -57.999 46.997 -3.166 1.00 95.72 ? 5 HOH A O 1 HETATM 3087 O O . HOH C 3 . ? -22.863 27.786 -17.645 1.00 47.05 ? 6 HOH A O 1 HETATM 3088 O O . HOH C 3 . ? 15.152 26.885 -3.952 1.00 55.60 ? 7 HOH A O 1 HETATM 3089 O O . HOH C 3 . ? 17.424 26.646 -9.930 1.00 70.66 ? 8 HOH A O 1 HETATM 3090 O O . HOH C 3 . ? -58.776 35.340 -13.318 1.00 67.43 ? 9 HOH A O 1 HETATM 3091 O O . HOH C 3 . ? -55.967 58.031 -17.189 1.00 29.85 ? 10 HOH A O 1 HETATM 3092 O O . HOH C 3 . ? 5.878 31.607 7.012 1.00 36.55 ? 11 HOH A O 1 HETATM 3093 O O . HOH C 3 . ? -26.474 33.790 6.808 1.00 45.36 ? 12 HOH A O 1 HETATM 3094 O O . HOH C 3 . ? -62.645 39.590 9.704 1.00 62.29 ? 13 HOH A O 1 HETATM 3095 O O . HOH C 3 . ? -1.953 25.618 -13.376 1.00 65.55 ? 14 HOH A O 1 HETATM 3096 O O . HOH C 3 . ? -13.534 21.681 1.720 1.00 53.46 ? 15 HOH A O 1 HETATM 3097 O O . HOH C 3 . ? 5.988 30.267 1.625 1.00 21.04 ? 16 HOH A O 1 HETATM 3098 O O . HOH C 3 . ? -36.446 47.735 7.405 1.00 45.92 ? 17 HOH A O 1 HETATM 3099 O O . HOH C 3 . ? -49.538 51.625 16.721 1.00 77.98 ? 18 HOH A O 1 HETATM 3100 O O . HOH C 3 . ? 4.143 20.343 10.071 1.00 48.89 ? 19 HOH A O 1 HETATM 3101 O O . HOH C 3 . ? -21.026 26.358 18.191 1.00 79.47 ? 20 HOH A O 1 HETATM 3102 O O . HOH C 3 . ? -45.919 55.143 -14.526 1.00 59.40 ? 21 HOH A O 1 HETATM 3103 O O . HOH C 3 . ? -50.637 55.629 -9.279 1.00 69.03 ? 22 HOH A O 1 HETATM 3104 O O . HOH C 3 . ? -76.866 35.221 12.638 1.00 39.30 ? 23 HOH A O 1 HETATM 3105 O O . HOH C 3 . ? -4.195 42.212 -19.088 1.00 53.89 ? 24 HOH A O 1 HETATM 3106 O O . HOH C 3 . ? -64.583 37.342 0.527 1.00 19.75 ? 429 HOH A O 1 HETATM 3107 O O . HOH C 3 . ? -17.107 42.085 -19.068 1.00 59.94 ? 430 HOH A O 1 HETATM 3108 O O . HOH C 3 . ? -10.803 46.876 -18.831 1.00 73.77 ? 431 HOH A O 1 HETATM 3109 O O . HOH C 3 . ? -53.189 58.343 -18.088 1.00 69.21 ? 432 HOH A O 1 HETATM 3110 O O . HOH C 3 . ? -57.702 47.265 23.678 1.00 51.38 ? 433 HOH A O 1 HETATM 3111 O O . HOH C 3 . ? -6.247 21.044 2.471 1.00 37.70 ? 434 HOH A O 1 HETATM 3112 O O . HOH C 3 . ? -45.478 48.095 -1.369 1.00 90.42 ? 435 HOH A O 1 HETATM 3113 O O . HOH C 3 . ? -36.303 33.917 -19.913 1.00 51.65 ? 436 HOH A O 1 HETATM 3114 O O . HOH C 3 . ? -61.295 35.623 2.524 1.00 52.68 ? 437 HOH A O 1 HETATM 3115 O O . HOH C 3 . ? -37.517 37.025 -14.717 1.00 44.36 ? 438 HOH A O 1 HETATM 3116 O O . HOH C 3 . ? -16.864 26.182 19.425 1.00 98.63 ? 439 HOH A O 1 HETATM 3117 O O . HOH C 3 . ? -30.697 16.771 10.182 1.00 64.13 ? 440 HOH A O 1 HETATM 3118 O O . HOH C 3 . ? 0.353 30.334 -22.669 1.00 83.93 ? 441 HOH A O 1 HETATM 3119 O O . HOH C 3 . ? -40.776 35.526 -0.055 1.00 60.46 ? 442 HOH A O 1 HETATM 3120 O O . HOH C 3 . ? -8.829 38.789 4.044 1.00 63.53 ? 443 HOH A O 1 HETATM 3121 O O . HOH C 3 . ? -19.748 34.150 -5.335 1.00 36.36 ? 444 HOH A O 1 HETATM 3122 O O . HOH C 3 . ? -8.313 36.891 -14.711 1.00 99.49 ? 445 HOH A O 1 HETATM 3123 O O . HOH C 3 . ? -6.543 31.619 3.637 1.00 62.49 ? 446 HOH A O 1 HETATM 3124 O O . HOH C 3 . ? -11.290 27.665 -11.182 1.00 60.24 ? 447 HOH A O 1 HETATM 3125 O O . HOH C 3 . ? -54.103 33.409 17.348 1.00 49.91 ? 448 HOH A O 1 HETATM 3126 O O . HOH C 3 . ? -15.678 35.577 0.638 1.00 40.45 ? 449 HOH A O 1 HETATM 3127 O O . HOH C 3 . ? -43.689 40.923 10.353 1.00 99.38 ? 450 HOH A O 1 HETATM 3128 O O . HOH C 3 . ? -58.675 53.260 18.509 1.00 82.54 ? 451 HOH A O 1 HETATM 3129 O O . HOH C 3 . ? -1.838 22.094 -10.220 1.00 67.35 ? 452 HOH A O 1 HETATM 3130 O O . HOH C 3 . ? -43.074 50.826 7.866 1.00 78.42 ? 453 HOH A O 1 HETATM 3131 O O . HOH C 3 . ? -27.619 21.502 16.076 1.00 31.02 ? 454 HOH A O 1 HETATM 3132 O O . HOH C 3 . ? -37.109 45.951 14.984 1.00 63.23 ? 455 HOH A O 1 HETATM 3133 O O . HOH C 3 . ? -55.854 33.046 -3.809 1.00 87.36 ? 456 HOH A O 1 HETATM 3134 O O . HOH C 3 . ? -13.322 19.041 23.015 1.00 46.85 ? 457 HOH A O 1 HETATM 3135 O O . HOH C 3 . ? -5.967 50.594 -19.603 1.00 60.02 ? 458 HOH A O 1 HETATM 3136 O O . HOH C 3 . ? -33.806 37.553 6.565 1.00 30.93 ? 459 HOH A O 1 HETATM 3137 O O . HOH C 3 . ? 3.588 23.318 2.755 1.00 88.95 ? 460 HOH A O 1 HETATM 3138 O O . HOH C 3 . ? -47.957 26.597 -6.361 1.00 65.12 ? 461 HOH A O 1 HETATM 3139 O O . HOH C 3 . ? -36.804 27.911 19.759 1.00 63.23 ? 462 HOH A O 1 HETATM 3140 O O . HOH C 3 . ? 6.368 26.139 -5.613 1.00 48.58 ? 463 HOH A O 1 HETATM 3141 O O . HOH C 3 . ? -31.597 21.169 11.450 1.00 63.59 ? 464 HOH A O 1 HETATM 3142 O O . HOH C 3 . ? -59.379 47.681 20.474 1.00 78.40 ? 465 HOH A O 1 HETATM 3143 O O . HOH C 3 . ? -60.327 31.222 20.767 1.00 44.61 ? 466 HOH A O 1 HETATM 3144 O O . HOH C 3 . ? -15.708 39.144 16.883 1.00 47.89 ? 467 HOH A O 1 HETATM 3145 O O . HOH C 3 . ? -26.827 36.457 -11.773 1.00 38.08 ? 468 HOH A O 1 HETATM 3146 O O . HOH C 3 . ? 0.968 20.348 -3.212 1.00 68.71 ? 469 HOH A O 1 HETATM 3147 O O . HOH C 3 . ? -46.504 36.334 22.522 1.00 83.49 ? 470 HOH A O 1 HETATM 3148 O O . HOH C 3 . ? -26.750 32.729 -8.718 1.00 70.65 ? 471 HOH A O 1 HETATM 3149 O O . HOH C 3 . ? -62.832 45.578 15.298 1.00 31.80 ? 472 HOH A O 1 HETATM 3150 O O . HOH C 3 . ? -14.917 42.252 -4.666 1.00 55.97 ? 473 HOH A O 1 HETATM 3151 O O . HOH C 3 . ? -31.680 45.449 -10.108 1.00 42.87 ? 474 HOH A O 1 HETATM 3152 O O . HOH C 3 . ? -5.118 41.138 9.026 1.00 62.11 ? 475 HOH A O 1 HETATM 3153 O O . HOH C 3 . ? -40.784 29.329 11.967 1.00 63.23 ? 476 HOH A O 1 HETATM 3154 O O . HOH C 3 . ? -28.409 18.650 13.872 1.00 66.26 ? 477 HOH A O 1 HETATM 3155 O O . HOH C 3 . ? -16.022 44.446 -9.302 1.00 100.15 ? 478 HOH A O 1 HETATM 3156 O O . HOH C 3 . ? -27.724 30.604 -15.293 1.00 76.06 ? 479 HOH A O 1 HETATM 3157 O O . HOH C 3 . ? -19.198 36.696 -0.698 1.00 51.03 ? 480 HOH A O 1 HETATM 3158 O O . HOH C 3 . ? -19.588 46.404 -13.288 1.00 91.63 ? 481 HOH A O 1 HETATM 3159 O O . HOH C 3 . ? -33.780 42.606 -22.640 1.00 34.38 ? 482 HOH A O 1 HETATM 3160 O O . HOH C 3 . ? 13.788 25.300 -9.154 1.00 82.52 ? 483 HOH A O 1 HETATM 3161 O O . HOH C 3 . ? 8.732 35.221 1.906 1.00 64.66 ? 484 HOH A O 1 HETATM 3162 O O . HOH C 3 . ? -33.789 33.792 -17.329 1.00 55.92 ? 485 HOH A O 1 HETATM 3163 O O . HOH C 3 . ? -22.501 41.934 13.240 1.00 98.66 ? 486 HOH A O 1 HETATM 3164 O O . HOH C 3 . ? -32.890 33.191 19.065 1.00 71.04 ? 487 HOH A O 1 HETATM 3165 O O . HOH C 3 . ? -51.884 58.780 17.099 1.00 32.15 ? 488 HOH A O 1 HETATM 3166 O O . HOH C 3 . ? -43.879 36.424 4.907 1.00 36.68 ? 489 HOH A O 1 HETATM 3167 O O . HOH C 3 . ? -31.266 29.423 3.480 1.00 43.94 ? 490 HOH A O 1 HETATM 3168 O O . HOH C 3 . ? -32.761 52.203 -12.889 1.00 67.45 ? 491 HOH A O 1 HETATM 3169 O O . HOH C 3 . ? -37.357 43.822 9.337 1.00 27.65 ? 492 HOH A O 1 HETATM 3170 O O . HOH C 3 . ? -14.695 36.623 -7.977 1.00 86.19 ? 493 HOH A O 1 HETATM 3171 O O . HOH C 3 . ? -8.691 44.577 -4.907 1.00 78.59 ? 494 HOH A O 1 HETATM 3172 O O . HOH C 3 . ? -54.379 39.396 -18.724 1.00 76.50 ? 495 HOH A O 1 HETATM 3173 O O . HOH C 3 . ? -1.290 40.386 -7.964 1.00 63.18 ? 496 HOH A O 1 HETATM 3174 O O . HOH C 3 . ? -32.937 38.876 22.369 1.00 73.46 ? 497 HOH A O 1 HETATM 3175 O O . HOH C 3 . ? -0.001 33.187 9.210 1.00 73.35 ? 498 HOH A O 1 HETATM 3176 O O . HOH C 3 . ? -12.318 20.436 20.493 1.00 48.46 ? 499 HOH A O 1 HETATM 3177 O O . HOH C 3 . ? -63.712 46.285 9.834 1.00 47.88 ? 500 HOH A O 1 HETATM 3178 O O . HOH C 3 . ? -50.478 44.183 -19.912 1.00 36.28 ? 501 HOH A O 1 HETATM 3179 O O . HOH C 3 . ? 20.538 32.386 -7.126 1.00 63.47 ? 502 HOH A O 1 HETATM 3180 O O . HOH C 3 . ? -62.855 28.056 -10.138 1.00 55.27 ? 503 HOH A O 1 HETATM 3181 O O . HOH C 3 . ? -40.200 38.825 -15.049 1.00 65.17 ? 504 HOH A O 1 HETATM 3182 O O . HOH C 3 . ? -43.196 42.398 -22.112 1.00 31.93 ? 505 HOH A O 1 HETATM 3183 O O . HOH C 3 . ? 0.482 37.063 -4.072 1.00 59.57 ? 506 HOH A O 1 HETATM 3184 O O . HOH C 3 . ? -38.727 31.721 9.075 1.00 37.72 ? 507 HOH A O 1 HETATM 3185 O O . HOH C 3 . ? 11.044 33.463 -3.279 1.00 74.78 ? 508 HOH A O 1 HETATM 3186 O O . HOH C 3 . ? -57.112 44.219 11.564 1.00 79.10 ? 509 HOH A O 1 HETATM 3187 O O . HOH C 3 . ? -11.940 17.552 -2.217 1.00 53.37 ? 510 HOH A O 1 HETATM 3188 O O . HOH C 3 . ? 7.351 41.206 -11.038 1.00 68.90 ? 511 HOH A O 1 HETATM 3189 O O . HOH C 3 . ? -69.667 38.185 -4.685 1.00 46.60 ? 512 HOH A O 1 HETATM 3190 O O . HOH C 3 . ? -57.061 30.526 -8.181 1.00 74.33 ? 513 HOH A O 1 HETATM 3191 O O . HOH C 3 . ? -72.634 35.475 -9.354 1.00 65.58 ? 514 HOH A O 1 HETATM 3192 O O . HOH C 3 . ? -42.337 46.119 15.058 1.00 87.46 ? 515 HOH A O 1 HETATM 3193 O O . HOH C 3 . ? -0.761 35.918 -0.676 1.00 32.70 ? 516 HOH A O 1 HETATM 3194 O O . HOH C 3 . ? -40.528 53.773 -6.822 1.00 81.46 ? 517 HOH A O 1 HETATM 3195 O O . HOH C 3 . ? -36.666 36.667 0.088 1.00 38.12 ? 518 HOH A O 1 HETATM 3196 O O . HOH C 3 . ? -3.528 20.216 9.969 1.00 55.65 ? 519 HOH A O 1 HETATM 3197 O O . HOH C 3 . ? -30.632 33.434 -20.126 1.00 77.07 ? 520 HOH A O 1 HETATM 3198 O O . HOH C 3 . ? -0.653 19.350 12.324 1.00 45.14 ? 521 HOH A O 1 HETATM 3199 O O . HOH C 3 . ? -60.609 36.428 -3.764 1.00 73.27 ? 522 HOH A O 1 HETATM 3200 O O . HOH C 3 . ? -48.193 43.517 27.643 1.00 47.14 ? 523 HOH A O 1 HETATM 3201 O O . HOH C 3 . ? -12.439 45.159 -14.811 1.00 110.52 ? 524 HOH A O 1 HETATM 3202 O O . HOH C 3 . ? -6.798 22.937 9.483 1.00 95.00 ? 525 HOH A O 1 HETATM 3203 O O . HOH C 3 . ? -60.479 31.425 2.208 1.00 82.59 ? 526 HOH A O 1 HETATM 3204 O O . HOH C 3 . ? -14.207 18.517 16.732 1.00 42.03 ? 527 HOH A O 1 HETATM 3205 O O . HOH C 3 . ? -4.968 38.587 13.271 1.00 56.21 ? 528 HOH A O 1 HETATM 3206 O O . HOH C 3 . ? -51.186 29.280 -2.813 1.00 78.92 ? 529 HOH A O 1 HETATM 3207 O O . HOH C 3 . ? 24.775 29.333 -4.877 1.00 110.13 ? 530 HOH A O 1 HETATM 3208 O O . HOH C 3 . ? -20.461 28.129 21.899 1.00 59.27 ? 531 HOH A O 1 HETATM 3209 O O . HOH C 3 . ? -48.419 50.320 -17.833 1.00 108.63 ? 532 HOH A O 1 HETATM 3210 O O . HOH C 3 . ? -35.454 42.430 -4.866 1.00 63.86 ? 533 HOH A O 1 HETATM 3211 O O . HOH C 3 . ? -30.227 33.382 18.527 1.00 65.40 ? 534 HOH A O 1 HETATM 3212 O O . HOH C 3 . ? -73.151 32.520 10.105 1.00 88.86 ? 535 HOH A O 1 HETATM 3213 O O . HOH C 3 . ? -26.521 43.576 -17.984 1.00 64.82 ? 536 HOH A O 1 HETATM 3214 O O . HOH C 3 . ? -1.744 42.486 -13.850 1.00 90.74 ? 537 HOH A O 1 HETATM 3215 O O . HOH C 3 . ? -67.019 37.597 8.829 1.00 87.03 ? 538 HOH A O 1 HETATM 3216 O O . HOH C 3 . ? 3.184 32.739 -19.241 1.00 60.22 ? 539 HOH A O 1 HETATM 3217 O O . HOH C 3 . ? -10.721 40.711 -20.257 1.00 57.69 ? 540 HOH A O 1 HETATM 3218 O O . HOH C 3 . ? -30.106 28.904 -14.040 1.00 65.04 ? 541 HOH A O 1 HETATM 3219 O O . HOH C 3 . ? -64.332 43.456 18.647 1.00 102.73 ? 542 HOH A O 1 HETATM 3220 O O . HOH C 3 . ? -25.186 47.441 -15.586 1.00 55.83 ? 543 HOH A O 1 HETATM 3221 O O . HOH C 3 . ? -47.269 45.848 -20.000 1.00 85.67 ? 544 HOH A O 1 HETATM 3222 O O . HOH C 3 . ? -35.676 45.186 -20.395 1.00 84.90 ? 545 HOH A O 1 HETATM 3223 O O . HOH C 3 . ? -65.502 33.265 2.122 1.00 60.12 ? 546 HOH A O 1 HETATM 3224 O O . HOH C 3 . ? -48.077 47.606 -4.151 1.00 100.70 ? 547 HOH A O 1 HETATM 3225 O O . HOH C 3 . ? 11.741 29.503 -2.199 1.00 84.95 ? 548 HOH A O 1 HETATM 3226 O O . HOH C 3 . ? -3.199 37.328 6.136 1.00 70.75 ? 549 HOH A O 1 HETATM 3227 O O . HOH C 3 . ? -53.675 48.422 13.246 1.00 93.60 ? 550 HOH A O 1 HETATM 3228 O O . HOH C 3 . ? -16.970 11.401 18.553 1.00 56.62 ? 551 HOH A O 1 HETATM 3229 O O . HOH C 3 . ? -55.977 33.596 -17.107 1.00 75.88 ? 552 HOH A O 1 HETATM 3230 O O . HOH C 3 . ? 23.862 27.653 0.069 1.00 95.43 ? 553 HOH A O 1 HETATM 3231 O O . HOH C 3 . ? -19.172 41.577 -7.053 1.00 76.60 ? 554 HOH A O 1 HETATM 3232 O O . HOH C 3 . ? -13.408 18.267 0.655 1.00 93.26 ? 555 HOH A O 1 HETATM 3233 O O . HOH C 3 . ? -11.553 31.676 -19.770 1.00 108.84 ? 556 HOH A O 1 HETATM 3234 O O . HOH C 3 . ? -21.776 38.484 8.212 1.00 76.20 ? 557 HOH A O 1 HETATM 3235 O O . HOH C 3 . ? -68.674 30.802 19.136 1.00 87.72 ? 558 HOH A O 1 HETATM 3236 O O . HOH C 3 . ? -68.680 36.577 20.160 1.00 115.63 ? 559 HOH A O 1 HETATM 3237 O O . HOH C 3 . ? -43.719 53.119 -15.127 1.00 67.80 ? 560 HOH A O 1 HETATM 3238 O O . HOH C 3 . ? 22.520 30.911 -8.965 1.00 56.86 ? 561 HOH A O 1 HETATM 3239 O O . HOH C 3 . ? -18.402 14.852 8.514 1.00 26.69 ? 562 HOH A O 1 HETATM 3240 O O . HOH C 3 . ? -37.562 45.529 -22.859 1.00 33.42 ? 563 HOH A O 1 HETATM 3241 O O . HOH C 3 . ? -58.185 32.842 -12.899 1.00 81.12 ? 564 HOH A O 1 HETATM 3242 O O . HOH C 3 . ? -3.324 23.574 -13.592 1.00 74.37 ? 565 HOH A O 1 HETATM 3243 O O . HOH C 3 . ? -60.982 43.194 -8.110 1.00 17.33 ? 566 HOH A O 1 HETATM 3244 O O . HOH C 3 . ? -24.517 33.794 5.230 1.00 34.68 ? 567 HOH A O 1 HETATM 3245 O O . HOH C 3 . ? -0.448 33.090 -22.864 1.00 58.74 ? 568 HOH A O 1 HETATM 3246 O O . HOH C 3 . ? -52.086 59.623 20.210 1.00 43.81 ? 569 HOH A O 1 HETATM 3247 O O . HOH C 3 . ? -10.594 36.624 -21.630 1.00 53.93 ? 570 HOH A O 1 HETATM 3248 O O . HOH C 3 . ? -4.349 51.473 -17.584 1.00 72.60 ? 571 HOH A O 1 HETATM 3249 O O . HOH C 3 . ? -21.262 23.297 15.361 1.00 57.38 ? 572 HOH A O 1 HETATM 3250 O O . HOH C 3 . ? -26.901 26.156 -15.639 1.00 72.80 ? 573 HOH A O 1 HETATM 3251 O O . HOH C 3 . ? -50.867 56.909 -12.125 1.00 85.65 ? 574 HOH A O 1 HETATM 3252 O O . HOH C 3 . ? -5.197 26.458 -21.679 1.00 94.43 ? 575 HOH A O 1 HETATM 3253 O O . HOH C 3 . ? 9.317 35.916 5.143 1.00 44.34 ? 576 HOH A O 1 HETATM 3254 O O . HOH C 3 . ? 6.090 30.181 3.955 1.00 62.01 ? 577 HOH A O 1 HETATM 3255 O O . HOH C 3 . ? 6.392 23.281 7.938 1.00 104.63 ? 578 HOH A O 1 HETATM 3256 O O . HOH C 3 . ? -1.383 18.963 0.197 1.00 62.02 ? 579 HOH A O 1 HETATM 3257 O O . HOH C 3 . ? -27.990 16.148 13.550 1.00 123.36 ? 580 HOH A O 1 HETATM 3258 O O . HOH C 3 . ? -54.682 50.402 -17.989 1.00 97.77 ? 581 HOH A O 1 HETATM 3259 O O . HOH C 3 . ? -38.610 49.180 6.328 1.00 33.41 ? 582 HOH A O 1 HETATM 3260 O O . HOH C 3 . ? 5.032 28.837 -0.485 1.00 95.08 ? 583 HOH A O 1 HETATM 3261 O O . HOH C 3 . ? -33.472 34.358 21.592 1.00 63.01 ? 584 HOH A O 1 HETATM 3262 O O . HOH C 3 . ? -55.092 47.051 -18.897 1.00 63.22 ? 585 HOH A O 1 HETATM 3263 O O . HOH C 3 . ? -69.104 44.297 10.639 1.00 52.43 ? 586 HOH A O 1 HETATM 3264 O O . HOH C 3 . ? -29.277 28.751 1.059 1.00 45.11 ? 587 HOH A O 1 HETATM 3265 O O . HOH C 3 . ? 5.546 29.912 -5.470 1.00 94.90 ? 588 HOH A O 1 HETATM 3266 O O . HOH C 3 . ? 3.608 31.050 9.449 1.00 42.75 ? 589 HOH A O 1 HETATM 3267 O O . HOH C 3 . ? -17.753 38.406 -2.236 1.00 42.55 ? 590 HOH A O 1 HETATM 3268 O O . HOH C 3 . ? -65.598 30.719 -12.798 1.00 64.84 ? 591 HOH A O 1 HETATM 3269 O O . HOH C 3 . ? -12.373 24.906 18.104 1.00 117.46 ? 592 HOH A O 1 HETATM 3270 O O . HOH C 3 . ? -48.290 45.787 20.820 1.00 58.83 ? 593 HOH A O 1 HETATM 3271 O O . HOH C 3 . ? 1.231 33.696 2.224 1.00 46.61 ? 594 HOH A O 1 HETATM 3272 O O . HOH C 3 . ? -37.314 34.588 -4.862 1.00 43.34 ? 595 HOH A O 1 HETATM 3273 O O . HOH C 3 . ? -59.010 51.828 0.563 1.00 58.96 ? 596 HOH A O 1 HETATM 3274 O O . HOH C 3 . ? -5.486 43.814 -5.295 1.00 59.09 ? 597 HOH A O 1 HETATM 3275 O O . HOH C 3 . ? -71.359 36.449 -6.909 1.00 42.72 ? 598 HOH A O 1 HETATM 3276 O O . HOH C 3 . ? -60.018 40.509 -9.723 1.00 80.06 ? 599 HOH A O 1 HETATM 3277 O O . HOH C 3 . ? -33.845 31.660 17.376 1.00 73.70 ? 600 HOH A O 1 HETATM 3278 O O . HOH C 3 . ? -6.586 32.489 17.037 1.00 66.30 ? 601 HOH A O 1 HETATM 3279 O O . HOH C 3 . ? -20.573 40.492 6.489 1.00 48.58 ? 602 HOH A O 1 HETATM 3280 O O . HOH C 3 . ? -50.737 32.041 24.919 1.00 33.06 ? 603 HOH A O 1 HETATM 3281 O O . HOH C 3 . ? -46.934 27.798 -8.350 1.00 60.64 ? 604 HOH A O 1 HETATM 3282 O O . HOH C 3 . ? -11.453 45.482 -3.264 1.00 53.26 ? 605 HOH A O 1 HETATM 3283 O O . HOH C 3 . ? -19.714 25.892 20.577 1.00 87.46 ? 606 HOH A O 1 HETATM 3284 O O . HOH C 3 . ? -13.755 33.965 0.542 1.00 91.10 ? 607 HOH A O 1 HETATM 3285 O O . HOH C 3 . ? -4.789 22.392 0.702 1.00 56.53 ? 608 HOH A O 1 HETATM 3286 O O . HOH C 3 . ? -37.425 33.766 -1.281 1.00 62.69 ? 609 HOH A O 1 HETATM 3287 O O . HOH C 3 . ? -51.826 31.034 17.182 1.00 95.14 ? 610 HOH A O 1 HETATM 3288 O O . HOH C 3 . ? -40.957 31.661 10.183 1.00 74.93 ? 611 HOH A O 1 HETATM 3289 O O . HOH C 3 . ? -28.444 38.700 -12.788 1.00 64.22 ? 612 HOH A O 1 HETATM 3290 O O . HOH C 3 . ? -56.734 53.731 17.005 1.00 114.17 ? 613 HOH A O 1 HETATM 3291 O O . HOH C 3 . ? -9.335 22.992 -0.852 1.00 113.88 ? 614 HOH A O 1 HETATM 3292 O O . HOH C 3 . ? -25.922 14.466 3.597 1.00 59.69 ? 615 HOH A O 1 HETATM 3293 O O . HOH C 3 . ? -57.802 37.216 -12.146 1.00 116.92 ? 616 HOH A O 1 HETATM 3294 O O . HOH C 3 . ? 7.863 33.337 7.399 1.00 90.96 ? 617 HOH A O 1 HETATM 3295 O O . HOH C 3 . ? -34.976 26.908 16.327 1.00 67.41 ? 618 HOH A O 1 HETATM 3296 O O . HOH C 3 . ? -38.504 53.496 -9.895 1.00 68.26 ? 619 HOH A O 1 HETATM 3297 O O . HOH C 3 . ? -63.524 40.318 -0.598 1.00 95.07 ? 620 HOH A O 1 HETATM 3298 O O . HOH C 3 . ? 5.670 36.242 3.351 1.00 68.65 ? 621 HOH A O 1 HETATM 3299 O O . HOH C 3 . ? -25.719 37.569 -16.814 1.00 114.93 ? 622 HOH A O 1 HETATM 3300 O O . HOH C 3 . ? -34.198 42.998 -1.335 1.00 53.12 ? 623 HOH A O 1 HETATM 3301 O O . HOH C 3 . ? -56.911 36.708 -6.132 1.00 90.50 ? 624 HOH A O 1 HETATM 3302 O O . HOH C 3 . ? -28.015 35.354 -14.823 1.00 109.92 ? 625 HOH A O 1 HETATM 3303 O O . HOH C 3 . ? -60.242 55.769 15.162 1.00 76.88 ? 626 HOH A O 1 HETATM 3304 O O . HOH C 3 . ? -33.656 50.155 -19.609 1.00 83.57 ? 627 HOH A O 1 HETATM 3305 O O . HOH C 3 . ? -4.804 29.877 -23.445 1.00 45.37 ? 628 HOH A O 1 HETATM 3306 O O . HOH C 3 . ? -56.508 59.867 -13.829 1.00 85.99 ? 629 HOH A O 1 HETATM 3307 O O . HOH C 3 . ? -5.317 18.767 3.749 1.00 55.29 ? 630 HOH A O 1 HETATM 3308 O O . HOH C 3 . ? -66.636 31.878 4.211 1.00 81.19 ? 631 HOH A O 1 HETATM 3309 O O . HOH C 3 . ? -3.605 32.350 12.724 1.00 70.82 ? 632 HOH A O 1 HETATM 3310 O O . HOH C 3 . ? -64.497 36.342 -4.565 1.00 60.21 ? 633 HOH A O 1 HETATM 3311 O O . HOH C 3 . ? -65.423 44.141 25.669 1.00 87.84 ? 634 HOH A O 1 HETATM 3312 O O . HOH C 3 . ? -9.852 17.436 0.579 1.00 105.26 ? 635 HOH A O 1 HETATM 3313 O O . HOH C 3 . ? 4.734 32.783 2.462 1.00 60.90 ? 636 HOH A O 1 HETATM 3314 O O . HOH C 3 . ? 9.058 38.165 1.537 1.00 91.20 ? 637 HOH A O 1 HETATM 3315 O O . HOH C 3 . ? -11.385 18.396 18.969 1.00 80.73 ? 638 HOH A O 1 HETATM 3316 O O . HOH C 3 . ? -56.829 62.658 -14.304 1.00 82.34 ? 639 HOH A O 1 HETATM 3317 O O . HOH C 3 . ? -33.931 51.371 -1.445 1.00 47.90 ? 640 HOH A O 1 HETATM 3318 O O . HOH C 3 . ? -60.594 42.763 32.091 1.00 45.59 ? 641 HOH A O 1 HETATM 3319 O O . HOH C 3 . ? -56.562 40.122 -20.883 1.00 76.49 ? 642 HOH A O 1 HETATM 3320 O O . HOH C 3 . ? -52.665 54.680 -1.249 1.00 108.45 ? 643 HOH A O 1 HETATM 3321 O O . HOH C 3 . ? -17.075 45.415 -11.834 1.00 94.66 ? 644 HOH A O 1 HETATM 3322 O O . HOH C 3 . ? -30.713 37.534 22.880 1.00 77.38 ? 645 HOH A O 1 HETATM 3323 O O . HOH C 3 . ? -10.683 17.562 9.796 1.00 88.48 ? 646 HOH A O 1 HETATM 3324 O O . HOH C 3 . ? -67.713 34.913 2.436 1.00 80.91 ? 647 HOH A O 1 HETATM 3325 O O . HOH C 3 . ? -6.102 17.703 5.777 1.00 72.30 ? 648 HOH A O 1 HETATM 3326 O O . HOH C 3 . ? -49.013 58.212 20.384 1.00 45.78 ? 649 HOH A O 1 HETATM 3327 O O . HOH C 3 . ? 1.021 23.590 7.027 1.00 124.71 ? 650 HOH A O 1 HETATM 3328 O O . HOH C 3 . ? -42.082 47.441 -25.608 1.00 89.70 ? 651 HOH A O 1 HETATM 3329 O O . HOH C 3 . ? -0.980 29.449 -25.090 1.00 75.08 ? 652 HOH A O 1 HETATM 3330 O O . HOH C 3 . ? -52.286 40.880 -20.135 1.00 67.20 ? 653 HOH A O 1 HETATM 3331 O O . HOH C 3 . ? -43.886 55.570 -18.909 1.00 77.45 ? 654 HOH A O 1 HETATM 3332 O O . HOH C 3 . ? -51.188 56.729 15.614 1.00 68.11 ? 655 HOH A O 1 HETATM 3333 O O . HOH C 3 . ? -48.822 33.281 18.790 1.00 124.50 ? 656 HOH A O 1 HETATM 3334 O O . HOH C 3 . ? -76.388 34.252 20.715 1.00 55.80 ? 657 HOH A O 1 HETATM 3335 O O . HOH C 3 . ? -56.933 27.250 1.833 1.00 101.04 ? 658 HOH A O 1 HETATM 3336 O O . HOH C 3 . ? 9.123 32.132 -1.711 1.00 91.42 ? 659 HOH A O 1 HETATM 3337 O O . HOH C 3 . ? -63.005 35.631 10.599 1.00 71.66 ? 660 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 ILE 1 25 ? ? ? A . n A 1 2 GLU 2 26 ? ? ? A . n A 1 3 ILE 3 27 ? ? ? A . n A 1 4 PRO 4 28 ? ? ? A . n A 1 5 MET 5 29 ? ? ? A . n A 1 6 ASP 6 30 ? ? ? A . n A 1 7 PRO 7 31 ? ? ? A . n A 1 8 SER 8 32 ? ? ? A . n A 1 9 ILE 9 33 ? ? ? A . n A 1 10 GLN 10 34 ? ? ? A . n A 1 11 ASN 11 35 ? ? ? A . n A 1 12 GLU 12 36 ? ? ? A . n A 1 13 LEU 13 37 37 LEU LEU A . n A 1 14 THR 14 38 38 THR THR A . n A 1 15 GLN 15 39 39 GLN GLN A . n A 1 16 PRO 16 40 40 PRO PRO A . n A 1 17 PRO 17 41 41 PRO PRO A . n A 1 18 THR 18 42 42 THR THR A . n A 1 19 ILE 19 43 43 ILE ILE A . n A 1 20 THR 20 44 44 THR THR A . n A 1 21 LYS 21 45 45 LYS LYS A . n A 1 22 GLN 22 46 46 GLN GLN A . n A 1 23 SER 23 47 47 SER SER A . n A 1 24 ALA 24 48 48 ALA ALA A . n A 1 25 LYS 25 49 49 LYS LYS A . n A 1 26 ASP 26 50 50 ASP ASP A . n A 1 27 HIS 27 51 51 HIS HIS A . n A 1 28 ILE 28 52 52 ILE ILE A . n A 1 29 VAL 29 53 53 VAL VAL A . n A 1 30 ASP 30 54 54 ASP ASP A . n A 1 31 PRO 31 55 55 PRO PRO A . n A 1 32 ARG 32 56 56 ARG ARG A . n A 1 33 ASP 33 57 57 ASP ASP A . n A 1 34 ASN 34 58 58 ASN ASN A . n A 1 35 ILE 35 59 59 ILE ILE A . n A 1 36 LEU 36 60 60 LEU LEU A . n A 1 37 ILE 37 61 61 ILE ILE A . n A 1 38 GLU 38 62 62 GLU GLU A . n A 1 39 CYS 39 63 63 CYS CYS A . n A 1 40 GLU 40 64 64 GLU GLU A . n A 1 41 ALA 41 65 65 ALA ALA A . n A 1 42 LYS 42 66 66 LYS LYS A . n A 1 43 GLY 43 67 67 GLY GLY A . n A 1 44 ASN 44 68 68 ASN ASN A . n A 1 45 PRO 45 69 69 PRO PRO A . n A 1 46 ALA 46 70 70 ALA ALA A . n A 1 47 PRO 47 71 71 PRO PRO A . n A 1 48 SER 48 72 72 SER SER A . n A 1 49 PHE 49 73 73 PHE PHE A . n A 1 50 HIS 50 74 74 HIS HIS A . n A 1 51 TRP 51 75 75 TRP TRP A . n A 1 52 THR 52 76 76 THR THR A . n A 1 53 ARG 53 77 77 ARG ARG A . n A 1 54 ASN 54 78 78 ASN ASN A . n A 1 55 SER 55 79 79 SER SER A . n A 1 56 ARG 56 80 80 ARG ARG A . n A 1 57 PHE 57 81 81 PHE PHE A . n A 1 58 PHE 58 82 82 PHE PHE A . n A 1 59 ASN 59 83 83 ASN ASN A . n A 1 60 ILE 60 84 84 ILE ILE A . n A 1 61 ALA 61 85 85 ALA ALA A . n A 1 62 LYS 62 86 86 LYS LYS A . n A 1 63 ASP 63 87 87 ASP ASP A . n A 1 64 PRO 64 88 88 PRO PRO A . n A 1 65 ARG 65 89 89 ARG ARG A . n A 1 66 VAL 66 90 90 VAL VAL A . n A 1 67 SER 67 91 91 SER SER A . n A 1 68 MET 68 92 92 MET MET A . n A 1 69 ARG 69 93 93 ARG ARG A . n A 1 70 ARG 70 94 94 ARG ARG A . n A 1 71 ARG 71 95 95 ARG ARG A . n A 1 72 SER 72 96 96 SER SER A . n A 1 73 GLY 73 97 97 GLY GLY A . n A 1 74 THR 74 98 98 THR THR A . n A 1 75 LEU 75 99 99 LEU LEU A . n A 1 76 VAL 76 100 100 VAL VAL A . n A 1 77 ILE 77 101 101 ILE ILE A . n A 1 78 ASP 78 102 102 ASP ASP A . n A 1 79 PHE 79 103 103 PHE PHE A . n A 1 80 ARG 80 104 104 ARG ARG A . n A 1 81 SER 81 105 105 SER SER A . n A 1 82 GLY 82 106 106 GLY GLY A . n A 1 83 GLY 83 107 107 GLY GLY A . n A 1 84 ARG 84 108 108 ARG ARG A . n A 1 85 PRO 85 109 109 PRO PRO A . n A 1 86 GLU 86 110 110 GLU GLU A . n A 1 87 GLU 87 111 111 GLU GLU A . n A 1 88 TYR 88 112 112 TYR TYR A . n A 1 89 GLU 89 113 113 GLU GLU A . n A 1 90 GLY 90 114 114 GLY GLY A . n A 1 91 GLU 91 115 115 GLU GLU A . n A 1 92 TYR 92 116 116 TYR TYR A . n A 1 93 GLN 93 117 117 GLN GLN A . n A 1 94 CYS 94 118 118 CYS CYS A . n A 1 95 PHE 95 119 119 PHE PHE A . n A 1 96 ALA 96 120 120 ALA ALA A . n A 1 97 ARG 97 121 121 ARG ARG A . n A 1 98 ASN 98 122 122 ASN ASN A . n A 1 99 LYS 99 123 123 LYS LYS A . n A 1 100 PHE 100 124 124 PHE PHE A . n A 1 101 GLY 101 125 125 GLY GLY A . n A 1 102 THR 102 126 126 THR THR A . n A 1 103 ALA 103 127 127 ALA ALA A . n A 1 104 LEU 104 128 128 LEU LEU A . n A 1 105 SER 105 129 129 SER SER A . n A 1 106 ASN 106 130 130 ASN ASN A . n A 1 107 ARG 107 131 131 ARG ARG A . n A 1 108 ILE 108 132 132 ILE ILE A . n A 1 109 ARG 109 133 133 ARG ARG A . n A 1 110 LEU 110 134 134 LEU LEU A . n A 1 111 GLN 111 135 135 GLN GLN A . n A 1 112 VAL 112 136 136 VAL VAL A . n A 1 113 SER 113 137 137 SER SER A . n A 1 114 LYS 114 138 138 LYS LYS A . n A 1 115 SER 115 139 139 SER SER A . n A 1 116 PRO 116 140 140 PRO PRO A . n A 1 117 LEU 117 141 141 LEU LEU A . n A 1 118 TRP 118 142 142 TRP TRP A . n A 1 119 PRO 119 143 143 PRO PRO A . n A 1 120 LYS 120 144 144 LYS LYS A . n A 1 121 GLU 121 145 145 GLU GLU A . n A 1 122 ASN 122 146 146 ASN ASN A . n A 1 123 LEU 123 147 147 LEU LEU A . n A 1 124 ASP 124 148 148 ASP ASP A . n A 1 125 PRO 125 149 149 PRO PRO A . n A 1 126 VAL 126 150 150 VAL VAL A . n A 1 127 VAL 127 151 151 VAL VAL A . n A 1 128 VAL 128 152 152 VAL VAL A . n A 1 129 GLN 129 153 153 GLN GLN A . n A 1 130 GLU 130 154 154 GLU GLU A . n A 1 131 GLY 131 155 155 GLY GLY A . n A 1 132 ALA 132 156 156 ALA ALA A . n A 1 133 PRO 133 157 157 PRO PRO A . n A 1 134 LEU 134 158 158 LEU LEU A . n A 1 135 THR 135 159 159 THR THR A . n A 1 136 LEU 136 160 160 LEU LEU A . n A 1 137 GLN 137 161 161 GLN GLN A . n A 1 138 CYS 138 162 162 CYS CYS A . n A 1 139 ASN 139 163 163 ASN ASN A . n A 1 140 PRO 140 164 164 PRO PRO A . n A 1 141 PRO 141 165 165 PRO PRO A . n A 1 142 PRO 142 166 166 PRO PRO A . n A 1 143 GLY 143 167 167 GLY GLY A . n A 1 144 LEU 144 168 168 LEU LEU A . n A 1 145 PRO 145 169 169 PRO PRO A . n A 1 146 SER 146 170 170 SER SER A . n A 1 147 PRO 147 171 171 PRO PRO A . n A 1 148 VAL 148 172 172 VAL VAL A . n A 1 149 ILE 149 173 173 ILE ILE A . n A 1 150 PHE 150 174 174 PHE PHE A . n A 1 151 TRP 151 175 175 TRP TRP A . n A 1 152 MET 152 176 176 MET MET A . n A 1 153 SER 153 177 177 SER SER A . n A 1 154 SER 154 178 178 SER SER A . n A 1 155 SER 155 179 179 SER SER A . n A 1 156 MET 156 180 180 MET MET A . n A 1 157 GLU 157 181 181 GLU GLU A . n A 1 158 PRO 158 182 182 PRO PRO A . n A 1 159 ILE 159 183 183 ILE ILE A . n A 1 160 THR 160 184 184 THR THR A . n A 1 161 GLN 161 185 185 GLN GLN A . n A 1 162 ASP 162 186 186 ASP ASP A . n A 1 163 LYS 163 187 187 LYS LYS A . n A 1 164 ARG 164 188 188 ARG ARG A . n A 1 165 VAL 165 189 189 VAL VAL A . n A 1 166 SER 166 190 190 SER SER A . n A 1 167 GLN 167 191 191 GLN GLN A . n A 1 168 GLY 168 192 192 GLY GLY A . n A 1 169 HIS 169 193 193 HIS HIS A . n A 1 170 ASN 170 194 194 ASN ASN A . n A 1 171 GLY 171 195 195 GLY GLY A . n A 1 172 ASP 172 196 196 ASP ASP A . n A 1 173 LEU 173 197 197 LEU LEU A . n A 1 174 TYR 174 198 198 TYR TYR A . n A 1 175 PHE 175 199 199 PHE PHE A . n A 1 176 SER 176 200 200 SER SER A . n A 1 177 ASN 177 201 201 ASN ASN A . n A 1 178 VAL 178 202 202 VAL VAL A . n A 1 179 MET 179 203 203 MET MET A . n A 1 180 LEU 180 204 204 LEU LEU A . n A 1 181 GLN 181 205 205 GLN GLN A . n A 1 182 ASP 182 206 206 ASP ASP A . n A 1 183 MET 183 207 207 MET MET A . n A 1 184 GLN 184 208 208 GLN GLN A . n A 1 185 THR 185 209 209 THR THR A . n A 1 186 ASP 186 210 210 ASP ASP A . n A 1 187 TYR 187 211 211 TYR TYR A . n A 1 188 SER 188 212 212 SER SER A . n A 1 189 CYS 189 213 213 CYS CYS A . n A 1 190 ASN 190 214 214 ASN ASN A . n A 1 191 ALA 191 215 215 ALA ALA A . n A 1 192 ARG 192 216 216 ARG ARG A . n A 1 193 PHE 193 217 217 PHE PHE A . n A 1 194 HIS 194 218 218 HIS HIS A . n A 1 195 PHE 195 219 219 PHE PHE A . n A 1 196 THR 196 220 220 THR THR A . n A 1 197 HIS 197 221 221 HIS HIS A . n A 1 198 THR 198 222 222 THR THR A . n A 1 199 ILE 199 223 223 ILE ILE A . n A 1 200 GLN 200 224 224 GLN GLN A . n A 1 201 GLN 201 225 225 GLN GLN A . n A 1 202 LYS 202 226 226 LYS LYS A . n A 1 203 ASN 203 227 227 ASN ASN A . n A 1 204 PRO 204 228 228 PRO PRO A . n A 1 205 PHE 205 229 229 PHE PHE A . n A 1 206 THR 206 230 230 THR THR A . n A 1 207 LEU 207 231 231 LEU LEU A . n A 1 208 LYS 208 232 232 LYS LYS A . n A 1 209 VAL 209 233 233 VAL VAL A . n A 1 210 LEU 210 234 234 LEU LEU A . n A 1 211 THR 211 235 235 THR THR A . n A 1 212 THR 212 236 236 THR THR A . n A 1 213 ARG 213 237 237 ARG ARG A . n A 1 214 GLY 214 238 238 GLY GLY A . n A 1 215 VAL 215 239 239 VAL VAL A . n A 1 216 ALA 216 240 240 ALA ALA A . n A 1 217 GLU 217 241 241 GLU GLU A . n A 1 218 ARG 218 242 242 ARG ARG A . n A 1 219 THR 219 243 243 THR THR A . n A 1 220 PRO 220 244 244 PRO PRO A . n A 1 221 SER 221 245 245 SER SER A . n A 1 222 PHE 222 246 246 PHE PHE A . n A 1 223 MET 223 247 247 MET MET A . n A 1 224 TYR 224 248 248 TYR TYR A . n A 1 225 PRO 225 249 249 PRO PRO A . n A 1 226 GLN 226 250 250 GLN GLN A . n A 1 227 GLY 227 251 251 GLY GLY A . n A 1 228 THR 228 252 252 THR THR A . n A 1 229 ALA 229 253 253 ALA ALA A . n A 1 230 SER 230 254 254 SER SER A . n A 1 231 SER 231 255 255 SER SER A . n A 1 232 GLN 232 256 256 GLN GLN A . n A 1 233 MET 233 257 257 MET MET A . n A 1 234 VAL 234 258 258 VAL VAL A . n A 1 235 LEU 235 259 259 LEU LEU A . n A 1 236 ARG 236 260 260 ARG ARG A . n A 1 237 GLY 237 261 261 GLY GLY A . n A 1 238 MET 238 262 262 MET MET A . n A 1 239 ASP 239 263 263 ASP ASP A . n A 1 240 LEU 240 264 264 LEU LEU A . n A 1 241 LEU 241 265 265 LEU LEU A . n A 1 242 LEU 242 266 266 LEU LEU A . n A 1 243 GLU 243 267 267 GLU GLU A . n A 1 244 CYS 244 268 268 CYS CYS A . n A 1 245 ILE 245 269 269 ILE ILE A . n A 1 246 ALA 246 270 270 ALA ALA A . n A 1 247 SER 247 271 271 SER SER A . n A 1 248 GLY 248 272 272 GLY GLY A . n A 1 249 VAL 249 273 273 VAL VAL A . n A 1 250 PRO 250 274 274 PRO PRO A . n A 1 251 THR 251 275 275 THR THR A . n A 1 252 PRO 252 276 276 PRO PRO A . n A 1 253 ASP 253 277 277 ASP ASP A . n A 1 254 ILE 254 278 278 ILE ILE A . n A 1 255 ALA 255 279 279 ALA ALA A . n A 1 256 TRP 256 280 280 TRP TRP A . n A 1 257 TYR 257 281 281 TYR TYR A . n A 1 258 LYS 258 282 282 LYS LYS A . n A 1 259 LYS 259 283 283 LYS LYS A . n A 1 260 GLY 260 284 284 GLY GLY A . n A 1 261 GLY 261 285 285 GLY GLY A . n A 1 262 ASP 262 286 286 ASP ASP A . n A 1 263 LEU 263 287 287 LEU LEU A . n A 1 264 PRO 264 288 288 PRO PRO A . n A 1 265 SER 265 289 289 SER SER A . n A 1 266 ASP 266 290 290 ASP ASP A . n A 1 267 LYS 267 291 291 LYS LYS A . n A 1 268 ALA 268 292 292 ALA ALA A . n A 1 269 LYS 269 293 293 LYS LYS A . n A 1 270 PHE 270 294 294 PHE PHE A . n A 1 271 GLU 271 295 295 GLU GLU A . n A 1 272 ASN 272 296 296 ASN ASN A . n A 1 273 PHE 273 297 297 PHE PHE A . n A 1 274 ASN 274 298 298 ASN ASN A . n A 1 275 LYS 275 299 299 LYS LYS A . n A 1 276 ALA 276 300 300 ALA ALA A . n A 1 277 LEU 277 301 301 LEU LEU A . n A 1 278 ARG 278 302 302 ARG ARG A . n A 1 279 ILE 279 303 303 ILE ILE A . n A 1 280 THR 280 304 304 THR THR A . n A 1 281 ASN 281 305 305 ASN ASN A . n A 1 282 VAL 282 306 306 VAL VAL A . n A 1 283 SER 283 307 307 SER SER A . n A 1 284 GLU 284 308 308 GLU GLU A . n A 1 285 GLU 285 309 309 GLU GLU A . n A 1 286 ASP 286 310 310 ASP ASP A . n A 1 287 SER 287 311 311 SER SER A . n A 1 288 GLY 288 312 312 GLY GLY A . n A 1 289 GLU 289 313 313 GLU GLU A . n A 1 290 TYR 290 314 314 TYR TYR A . n A 1 291 PHE 291 315 315 PHE PHE A . n A 1 292 CYS 292 316 316 CYS CYS A . n A 1 293 LEU 293 317 317 LEU LEU A . n A 1 294 ALA 294 318 318 ALA ALA A . n A 1 295 SER 295 319 319 SER SER A . n A 1 296 ASN 296 320 320 ASN ASN A . n A 1 297 LYS 297 321 321 LYS LYS A . n A 1 298 MET 298 322 322 MET MET A . n A 1 299 GLY 299 323 323 GLY GLY A . n A 1 300 SER 300 324 324 SER SER A . n A 1 301 ILE 301 325 325 ILE ILE A . n A 1 302 ARG 302 326 326 ARG ARG A . n A 1 303 HIS 303 327 327 HIS HIS A . n A 1 304 THR 304 328 328 THR THR A . n A 1 305 ILE 305 329 329 ILE ILE A . n A 1 306 SER 306 330 330 SER SER A . n A 1 307 VAL 307 331 331 VAL VAL A . n A 1 308 ARG 308 332 332 ARG ARG A . n A 1 309 VAL 309 333 333 VAL VAL A . n A 1 310 LYS 310 334 334 LYS LYS A . n A 1 311 ALA 311 335 335 ALA ALA A . n A 1 312 ALA 312 336 336 ALA ALA A . n A 1 313 PRO 313 337 337 PRO PRO A . n A 1 314 TYR 314 338 338 TYR TYR A . n A 1 315 TRP 315 339 339 TRP TRP A . n A 1 316 LEU 316 340 340 LEU LEU A . n A 1 317 ASP 317 341 341 ASP ASP A . n A 1 318 GLU 318 342 342 GLU GLU A . n A 1 319 PRO 319 343 343 PRO PRO A . n A 1 320 LYS 320 344 344 LYS LYS A . n A 1 321 ASN 321 345 345 ASN ASN A . n A 1 322 LEU 322 346 346 LEU LEU A . n A 1 323 ILE 323 347 347 ILE ILE A . n A 1 324 LEU 324 348 348 LEU LEU A . n A 1 325 ALA 325 349 349 ALA ALA A . n A 1 326 PRO 326 350 350 PRO PRO A . n A 1 327 GLY 327 351 351 GLY GLY A . n A 1 328 GLU 328 352 352 GLU GLU A . n A 1 329 ASP 329 353 353 ASP ASP A . n A 1 330 GLY 330 354 354 GLY GLY A . n A 1 331 ARG 331 355 355 ARG ARG A . n A 1 332 LEU 332 356 356 LEU LEU A . n A 1 333 VAL 333 357 357 VAL VAL A . n A 1 334 CYS 334 358 358 CYS CYS A . n A 1 335 ARG 335 359 359 ARG ARG A . n A 1 336 ALA 336 360 360 ALA ALA A . n A 1 337 ASN 337 361 361 ASN ASN A . n A 1 338 GLY 338 362 362 GLY GLY A . n A 1 339 ASN 339 363 363 ASN ASN A . n A 1 340 PRO 340 364 364 PRO PRO A . n A 1 341 LYS 341 365 365 LYS LYS A . n A 1 342 PRO 342 366 366 PRO PRO A . n A 1 343 THR 343 367 367 THR THR A . n A 1 344 VAL 344 368 368 VAL VAL A . n A 1 345 GLN 345 369 369 GLN GLN A . n A 1 346 TRP 346 370 370 TRP TRP A . n A 1 347 MET 347 371 371 MET MET A . n A 1 348 VAL 348 372 372 VAL VAL A . n A 1 349 ASN 349 373 373 ASN ASN A . n A 1 350 GLY 350 374 374 GLY GLY A . n A 1 351 GLU 351 375 375 GLU GLU A . n A 1 352 PRO 352 376 376 PRO PRO A . n A 1 353 LEU 353 377 377 LEU LEU A . n A 1 354 GLN 354 378 378 GLN GLN A . n A 1 355 SER 355 379 379 SER SER A . n A 1 356 ALA 356 380 380 ALA ALA A . n A 1 357 PRO 357 381 381 PRO PRO A . n A 1 358 PRO 358 382 382 PRO PRO A . n A 1 359 ASN 359 383 383 ASN ASN A . n A 1 360 PRO 360 384 384 PRO PRO A . n A 1 361 ASN 361 385 385 ASN ASN A . n A 1 362 ARG 362 386 386 ARG ARG A . n A 1 363 GLU 363 387 387 GLU GLU A . n A 1 364 VAL 364 388 388 VAL VAL A . n A 1 365 ALA 365 389 389 ALA ALA A . n A 1 366 GLY 366 390 390 GLY GLY A . n A 1 367 ASP 367 391 391 ASP ASP A . n A 1 368 THR 368 392 392 THR THR A . n A 1 369 ILE 369 393 393 ILE ILE A . n A 1 370 ILE 370 394 394 ILE ILE A . n A 1 371 PHE 371 395 395 PHE PHE A . n A 1 372 ARG 372 396 396 ARG ARG A . n A 1 373 ASP 373 397 397 ASP ASP A . n A 1 374 THR 374 398 398 THR THR A . n A 1 375 GLN 375 399 399 GLN GLN A . n A 1 376 ILE 376 400 400 ILE ILE A . n A 1 377 SER 377 401 401 SER SER A . n A 1 378 SER 378 402 402 SER SER A . n A 1 379 ARG 379 403 403 ARG ARG A . n A 1 380 ALA 380 404 404 ALA ALA A . n A 1 381 VAL 381 405 405 VAL VAL A . n A 1 382 TYR 382 406 406 TYR TYR A . n A 1 383 GLN 383 407 407 GLN GLN A . n A 1 384 CYS 384 408 408 CYS CYS A . n A 1 385 ASN 385 409 409 ASN ASN A . n A 1 386 THR 386 410 410 THR THR A . n A 1 387 SER 387 411 411 SER SER A . n A 1 388 ASN 388 412 412 ASN ASN A . n A 1 389 GLU 389 413 413 GLU GLU A . n A 1 390 HIS 390 414 414 HIS HIS A . n A 1 391 GLY 391 415 415 GLY GLY A . n A 1 392 TYR 392 416 416 TYR TYR A . n A 1 393 LEU 393 417 417 LEU LEU A . n A 1 394 LEU 394 418 418 LEU LEU A . n A 1 395 ALA 395 419 419 ALA ALA A . n A 1 396 ASN 396 420 420 ASN ASN A . n A 1 397 ALA 397 421 421 ALA ALA A . n A 1 398 PHE 398 422 422 PHE PHE A . n A 1 399 VAL 399 423 423 VAL VAL A . n A 1 400 SER 400 424 424 SER SER A . n A 1 401 VAL 401 425 425 VAL VAL A . n A 1 402 LEU 402 426 426 LEU LEU A . n A 1 403 ASP 403 427 ? ? ? A . n A 1 404 VAL 404 428 ? ? ? A . n # _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 385 _pdbx_struct_mod_residue.auth_asym_id A _pdbx_struct_mod_residue.auth_comp_id ASN _pdbx_struct_mod_residue.auth_seq_id 409 _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 PISA _pdbx_struct_assembly.oligomeric_details dimeric _pdbx_struct_assembly.oligomeric_count 2 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1,2 _pdbx_struct_assembly_gen.asym_id_list A,B,C # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 2510 ? 1 MORE 1 ? 1 'SSA (A^2)' 40790 ? # loop_ _pdbx_struct_oper_list.id _pdbx_struct_oper_list.type _pdbx_struct_oper_list.name _pdbx_struct_oper_list.symmetry_operation _pdbx_struct_oper_list.matrix[1][1] _pdbx_struct_oper_list.matrix[1][2] _pdbx_struct_oper_list.matrix[1][3] _pdbx_struct_oper_list.vector[1] _pdbx_struct_oper_list.matrix[2][1] _pdbx_struct_oper_list.matrix[2][2] _pdbx_struct_oper_list.matrix[2][3] _pdbx_struct_oper_list.vector[2] _pdbx_struct_oper_list.matrix[3][1] _pdbx_struct_oper_list.matrix[3][2] _pdbx_struct_oper_list.matrix[3][3] _pdbx_struct_oper_list.vector[3] 1 'identity operation' 1_555 x,y,z 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 2 'crystal symmetry operation' 6_554 -x,-x+y,-z-1/3 -0.5000000000 -0.8660254038 0.0000000000 0.0000000000 -0.8660254038 0.5000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 -1.0000000000 -42.2410000000 # 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 2010-11-03 2 'Structure model' 1 1 2011-07-13 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Version format compliance' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal HKL-2000 'data collection' . ? 1 PHASER phasing . ? 2 CNS refinement 1.1 ? 3 HKL-2000 'data reduction' . ? 4 HKL-2000 'data scaling' . ? 5 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 O A LYS 66 ? ? O A HOH 437 ? ? 1.94 2 1 N A ASN 296 ? ? O A HOH 15 ? ? 2.16 3 1 O A VAL 405 ? ? O A HOH 509 ? ? 2.17 4 1 N A LYS 283 ? ? O A HOH 592 ? ? 2.18 5 1 N A VAL 202 ? ? O A HOH 588 ? ? 2.18 6 1 O A PRO 143 ? ? O A HOH 524 ? ? 2.19 7 1 N A LEU 377 ? ? O A HOH 550 ? ? 2.19 # _pdbx_validate_rmsd_angle.id 1 _pdbx_validate_rmsd_angle.PDB_model_num 1 _pdbx_validate_rmsd_angle.auth_atom_id_1 C _pdbx_validate_rmsd_angle.auth_asym_id_1 A _pdbx_validate_rmsd_angle.auth_comp_id_1 TYR _pdbx_validate_rmsd_angle.auth_seq_id_1 248 _pdbx_validate_rmsd_angle.PDB_ins_code_1 ? _pdbx_validate_rmsd_angle.label_alt_id_1 ? _pdbx_validate_rmsd_angle.auth_atom_id_2 N _pdbx_validate_rmsd_angle.auth_asym_id_2 A _pdbx_validate_rmsd_angle.auth_comp_id_2 PRO _pdbx_validate_rmsd_angle.auth_seq_id_2 249 _pdbx_validate_rmsd_angle.PDB_ins_code_2 ? _pdbx_validate_rmsd_angle.label_alt_id_2 ? _pdbx_validate_rmsd_angle.auth_atom_id_3 CA _pdbx_validate_rmsd_angle.auth_asym_id_3 A _pdbx_validate_rmsd_angle.auth_comp_id_3 PRO _pdbx_validate_rmsd_angle.auth_seq_id_3 249 _pdbx_validate_rmsd_angle.PDB_ins_code_3 ? _pdbx_validate_rmsd_angle.label_alt_id_3 ? _pdbx_validate_rmsd_angle.angle_value 109.24 _pdbx_validate_rmsd_angle.angle_target_value 119.30 _pdbx_validate_rmsd_angle.angle_deviation -10.06 _pdbx_validate_rmsd_angle.angle_standard_deviation 1.50 _pdbx_validate_rmsd_angle.linker_flag 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 THR A 38 ? ? 39.84 73.38 2 1 CYS A 63 ? ? -177.91 87.90 3 1 ALA A 65 ? ? -109.87 -163.76 4 1 LYS A 66 ? ? -176.87 134.89 5 1 ALA A 70 ? ? -22.22 110.52 6 1 THR A 76 ? ? -152.43 82.14 7 1 ASN A 78 ? ? 69.54 -149.01 8 1 SER A 79 ? ? -89.21 31.98 9 1 MET A 92 ? ? -74.12 -160.12 10 1 ARG A 94 ? ? -52.85 -93.12 11 1 ARG A 95 ? ? -79.41 42.88 12 1 SER A 96 ? ? -178.72 -175.76 13 1 THR A 98 ? ? -47.70 168.18 14 1 SER A 105 ? ? -75.80 -75.13 15 1 ARG A 131 ? ? -64.40 94.77 16 1 PRO A 166 ? ? -51.53 -107.30 17 1 PHE A 219 ? ? -62.41 -72.27 18 1 HIS A 221 ? ? -66.64 95.16 19 1 THR A 236 ? ? -94.40 -63.55 20 1 ARG A 237 ? ? -132.61 -52.00 21 1 MET A 247 ? ? -92.03 -61.86 22 1 THR A 275 ? ? 64.71 113.21 23 1 PRO A 288 ? ? -57.14 101.41 24 1 ASN A 296 ? ? -78.70 -122.43 25 1 PHE A 297 ? ? -117.31 59.56 26 1 ASN A 305 ? ? 49.43 72.40 27 1 ASN A 320 ? ? -119.23 -103.72 28 1 LYS A 321 ? ? -160.77 -41.45 29 1 PRO A 350 ? ? -58.27 108.04 30 1 ALA A 389 ? ? -108.57 40.10 31 1 SER A 401 ? ? -165.76 -16.83 32 1 ALA A 404 ? ? 175.56 171.66 # 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 ILE 25 ? A ILE 1 2 1 Y 1 A GLU 26 ? A GLU 2 3 1 Y 1 A ILE 27 ? A ILE 3 4 1 Y 1 A PRO 28 ? A PRO 4 5 1 Y 1 A MET 29 ? A MET 5 6 1 Y 1 A ASP 30 ? A ASP 6 7 1 Y 1 A PRO 31 ? A PRO 7 8 1 Y 1 A SER 32 ? A SER 8 9 1 Y 1 A ILE 33 ? A ILE 9 10 1 Y 1 A GLN 34 ? A GLN 10 11 1 Y 1 A ASN 35 ? A ASN 11 12 1 Y 1 A GLU 36 ? A GLU 12 13 1 Y 1 A ASP 427 ? A ASP 403 14 1 Y 1 A VAL 428 ? A VAL 404 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 water HOH # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code B 2 NAG 1 1 1 NAG NAG A . C 3 HOH 1 2 2 HOH WAT A . C 3 HOH 2 3 3 HOH WAT A . C 3 HOH 3 4 4 HOH WAT A . C 3 HOH 4 5 5 HOH WAT A . C 3 HOH 5 6 6 HOH WAT A . C 3 HOH 6 7 7 HOH WAT A . C 3 HOH 7 8 8 HOH WAT A . C 3 HOH 8 9 9 HOH WAT A . C 3 HOH 9 10 10 HOH WAT A . C 3 HOH 10 11 11 HOH WAT A . C 3 HOH 11 12 12 HOH WAT A . C 3 HOH 12 13 13 HOH WAT A . C 3 HOH 13 14 14 HOH WAT A . C 3 HOH 14 15 15 HOH WAT A . C 3 HOH 15 16 16 HOH WAT A . C 3 HOH 16 17 17 HOH WAT A . C 3 HOH 17 18 18 HOH WAT A . C 3 HOH 18 19 19 HOH WAT A . C 3 HOH 19 20 20 HOH WAT A . C 3 HOH 20 21 21 HOH WAT A . C 3 HOH 21 22 22 HOH WAT A . C 3 HOH 22 23 23 HOH WAT A . C 3 HOH 23 24 24 HOH WAT A . C 3 HOH 24 429 1 HOH WAT A . C 3 HOH 25 430 25 HOH WAT A . C 3 HOH 26 431 26 HOH WAT A . C 3 HOH 27 432 27 HOH WAT A . C 3 HOH 28 433 28 HOH WAT A . C 3 HOH 29 434 29 HOH WAT A . C 3 HOH 30 435 30 HOH WAT A . C 3 HOH 31 436 31 HOH WAT A . C 3 HOH 32 437 32 HOH WAT A . C 3 HOH 33 438 33 HOH WAT A . C 3 HOH 34 439 34 HOH WAT A . C 3 HOH 35 440 35 HOH WAT A . C 3 HOH 36 441 36 HOH WAT A . C 3 HOH 37 442 37 HOH WAT A . C 3 HOH 38 443 38 HOH WAT A . C 3 HOH 39 444 39 HOH WAT A . C 3 HOH 40 445 40 HOH WAT A . C 3 HOH 41 446 41 HOH WAT A . C 3 HOH 42 447 42 HOH WAT A . C 3 HOH 43 448 43 HOH WAT A . C 3 HOH 44 449 44 HOH WAT A . C 3 HOH 45 450 45 HOH WAT A . C 3 HOH 46 451 46 HOH WAT A . C 3 HOH 47 452 47 HOH WAT A . C 3 HOH 48 453 48 HOH WAT A . C 3 HOH 49 454 49 HOH WAT A . C 3 HOH 50 455 50 HOH WAT A . C 3 HOH 51 456 51 HOH WAT A . C 3 HOH 52 457 52 HOH WAT A . C 3 HOH 53 458 53 HOH WAT A . C 3 HOH 54 459 54 HOH WAT A . C 3 HOH 55 460 55 HOH WAT A . C 3 HOH 56 461 56 HOH WAT A . C 3 HOH 57 462 57 HOH WAT A . C 3 HOH 58 463 58 HOH WAT A . C 3 HOH 59 464 59 HOH WAT A . C 3 HOH 60 465 60 HOH WAT A . C 3 HOH 61 466 61 HOH WAT A . C 3 HOH 62 467 62 HOH WAT A . C 3 HOH 63 468 63 HOH WAT A . C 3 HOH 64 469 64 HOH WAT A . C 3 HOH 65 470 65 HOH WAT A . C 3 HOH 66 471 66 HOH WAT A . C 3 HOH 67 472 67 HOH WAT A . C 3 HOH 68 473 68 HOH WAT A . C 3 HOH 69 474 69 HOH WAT A . C 3 HOH 70 475 70 HOH WAT A . C 3 HOH 71 476 71 HOH WAT A . C 3 HOH 72 477 72 HOH WAT A . C 3 HOH 73 478 73 HOH WAT A . C 3 HOH 74 479 74 HOH WAT A . C 3 HOH 75 480 75 HOH WAT A . C 3 HOH 76 481 76 HOH WAT A . C 3 HOH 77 482 77 HOH WAT A . C 3 HOH 78 483 78 HOH WAT A . C 3 HOH 79 484 79 HOH WAT A . C 3 HOH 80 485 80 HOH WAT A . C 3 HOH 81 486 81 HOH WAT A . C 3 HOH 82 487 82 HOH WAT A . C 3 HOH 83 488 83 HOH WAT A . C 3 HOH 84 489 84 HOH WAT A . C 3 HOH 85 490 85 HOH WAT A . C 3 HOH 86 491 86 HOH WAT A . C 3 HOH 87 492 87 HOH WAT A . C 3 HOH 88 493 88 HOH WAT A . C 3 HOH 89 494 89 HOH WAT A . C 3 HOH 90 495 90 HOH WAT A . C 3 HOH 91 496 91 HOH WAT A . C 3 HOH 92 497 92 HOH WAT A . C 3 HOH 93 498 93 HOH WAT A . C 3 HOH 94 499 94 HOH WAT A . C 3 HOH 95 500 95 HOH WAT A . C 3 HOH 96 501 96 HOH WAT A . C 3 HOH 97 502 97 HOH WAT A . C 3 HOH 98 503 98 HOH WAT A . C 3 HOH 99 504 99 HOH WAT A . C 3 HOH 100 505 100 HOH WAT A . C 3 HOH 101 506 101 HOH WAT A . C 3 HOH 102 507 102 HOH WAT A . C 3 HOH 103 508 103 HOH WAT A . C 3 HOH 104 509 104 HOH WAT A . C 3 HOH 105 510 105 HOH WAT A . C 3 HOH 106 511 106 HOH WAT A . C 3 HOH 107 512 107 HOH WAT A . C 3 HOH 108 513 108 HOH WAT A . C 3 HOH 109 514 109 HOH WAT A . C 3 HOH 110 515 110 HOH WAT A . C 3 HOH 111 516 111 HOH WAT A . C 3 HOH 112 517 112 HOH WAT A . C 3 HOH 113 518 113 HOH WAT A . C 3 HOH 114 519 114 HOH WAT A . C 3 HOH 115 520 115 HOH WAT A . C 3 HOH 116 521 116 HOH WAT A . C 3 HOH 117 522 117 HOH WAT A . C 3 HOH 118 523 118 HOH WAT A . C 3 HOH 119 524 119 HOH WAT A . C 3 HOH 120 525 120 HOH WAT A . C 3 HOH 121 526 121 HOH WAT A . C 3 HOH 122 527 122 HOH WAT A . C 3 HOH 123 528 123 HOH WAT A . C 3 HOH 124 529 124 HOH WAT A . C 3 HOH 125 530 125 HOH WAT A . C 3 HOH 126 531 126 HOH WAT A . C 3 HOH 127 532 127 HOH WAT A . C 3 HOH 128 533 128 HOH WAT A . C 3 HOH 129 534 129 HOH WAT A . C 3 HOH 130 535 130 HOH WAT A . C 3 HOH 131 536 131 HOH WAT A . C 3 HOH 132 537 132 HOH WAT A . C 3 HOH 133 538 133 HOH WAT A . C 3 HOH 134 539 134 HOH WAT A . C 3 HOH 135 540 135 HOH WAT A . C 3 HOH 136 541 136 HOH WAT A . C 3 HOH 137 542 137 HOH WAT A . C 3 HOH 138 543 138 HOH WAT A . C 3 HOH 139 544 139 HOH WAT A . C 3 HOH 140 545 140 HOH WAT A . C 3 HOH 141 546 141 HOH WAT A . C 3 HOH 142 547 142 HOH WAT A . C 3 HOH 143 548 143 HOH WAT A . C 3 HOH 144 549 144 HOH WAT A . C 3 HOH 145 550 145 HOH WAT A . C 3 HOH 146 551 146 HOH WAT A . C 3 HOH 147 552 147 HOH WAT A . C 3 HOH 148 553 148 HOH WAT A . C 3 HOH 149 554 149 HOH WAT A . C 3 HOH 150 555 150 HOH WAT A . C 3 HOH 151 556 151 HOH WAT A . C 3 HOH 152 557 152 HOH WAT A . C 3 HOH 153 558 153 HOH WAT A . C 3 HOH 154 559 154 HOH WAT A . C 3 HOH 155 560 155 HOH WAT A . C 3 HOH 156 561 156 HOH WAT A . C 3 HOH 157 562 157 HOH WAT A . C 3 HOH 158 563 158 HOH WAT A . C 3 HOH 159 564 159 HOH WAT A . C 3 HOH 160 565 160 HOH WAT A . C 3 HOH 161 566 161 HOH WAT A . C 3 HOH 162 567 162 HOH WAT A . C 3 HOH 163 568 163 HOH WAT A . C 3 HOH 164 569 164 HOH WAT A . C 3 HOH 165 570 165 HOH WAT A . C 3 HOH 166 571 166 HOH WAT A . C 3 HOH 167 572 167 HOH WAT A . C 3 HOH 168 573 168 HOH WAT A . C 3 HOH 169 574 169 HOH WAT A . C 3 HOH 170 575 170 HOH WAT A . C 3 HOH 171 576 171 HOH WAT A . C 3 HOH 172 577 172 HOH WAT A . C 3 HOH 173 578 173 HOH WAT A . C 3 HOH 174 579 174 HOH WAT A . C 3 HOH 175 580 175 HOH WAT A . C 3 HOH 176 581 176 HOH WAT A . C 3 HOH 177 582 177 HOH WAT A . C 3 HOH 178 583 178 HOH WAT A . C 3 HOH 179 584 179 HOH WAT A . C 3 HOH 180 585 180 HOH WAT A . C 3 HOH 181 586 181 HOH WAT A . C 3 HOH 182 587 182 HOH WAT A . C 3 HOH 183 588 183 HOH WAT A . C 3 HOH 184 589 184 HOH WAT A . C 3 HOH 185 590 185 HOH WAT A . C 3 HOH 186 591 186 HOH WAT A . C 3 HOH 187 592 187 HOH WAT A . C 3 HOH 188 593 188 HOH WAT A . C 3 HOH 189 594 189 HOH WAT A . C 3 HOH 190 595 190 HOH WAT A . C 3 HOH 191 596 191 HOH WAT A . C 3 HOH 192 597 192 HOH WAT A . C 3 HOH 193 598 193 HOH WAT A . C 3 HOH 194 599 194 HOH WAT A . C 3 HOH 195 600 195 HOH WAT A . C 3 HOH 196 601 196 HOH WAT A . C 3 HOH 197 602 197 HOH WAT A . C 3 HOH 198 603 198 HOH WAT A . C 3 HOH 199 604 199 HOH WAT A . C 3 HOH 200 605 200 HOH WAT A . C 3 HOH 201 606 201 HOH WAT A . C 3 HOH 202 607 202 HOH WAT A . C 3 HOH 203 608 203 HOH WAT A . C 3 HOH 204 609 204 HOH WAT A . C 3 HOH 205 610 205 HOH WAT A . C 3 HOH 206 611 206 HOH WAT A . C 3 HOH 207 612 207 HOH WAT A . C 3 HOH 208 613 208 HOH WAT A . C 3 HOH 209 614 209 HOH WAT A . C 3 HOH 210 615 210 HOH WAT A . C 3 HOH 211 616 211 HOH WAT A . C 3 HOH 212 617 212 HOH WAT A . C 3 HOH 213 618 213 HOH WAT A . C 3 HOH 214 619 214 HOH WAT A . C 3 HOH 215 620 215 HOH WAT A . C 3 HOH 216 621 216 HOH WAT A . C 3 HOH 217 622 217 HOH WAT A . C 3 HOH 218 623 218 HOH WAT A . C 3 HOH 219 624 219 HOH WAT A . C 3 HOH 220 625 220 HOH WAT A . C 3 HOH 221 626 221 HOH WAT A . C 3 HOH 222 627 222 HOH WAT A . C 3 HOH 223 628 223 HOH WAT A . C 3 HOH 224 629 224 HOH WAT A . C 3 HOH 225 630 225 HOH WAT A . C 3 HOH 226 631 226 HOH WAT A . C 3 HOH 227 632 227 HOH WAT A . C 3 HOH 228 633 228 HOH WAT A . C 3 HOH 229 634 229 HOH WAT A . C 3 HOH 230 635 230 HOH WAT A . C 3 HOH 231 636 231 HOH WAT A . C 3 HOH 232 637 232 HOH WAT A . C 3 HOH 233 638 233 HOH WAT A . C 3 HOH 234 639 234 HOH WAT A . C 3 HOH 235 640 235 HOH WAT A . C 3 HOH 236 641 236 HOH WAT A . C 3 HOH 237 642 237 HOH WAT A . C 3 HOH 238 643 238 HOH WAT A . C 3 HOH 239 644 239 HOH WAT A . C 3 HOH 240 645 240 HOH WAT A . C 3 HOH 241 646 241 HOH WAT A . C 3 HOH 242 647 242 HOH WAT A . C 3 HOH 243 648 243 HOH WAT A . C 3 HOH 244 649 244 HOH WAT A . C 3 HOH 245 650 245 HOH WAT A . C 3 HOH 246 651 246 HOH WAT A . C 3 HOH 247 652 247 HOH WAT A . C 3 HOH 248 653 248 HOH WAT A . C 3 HOH 249 654 249 HOH WAT A . C 3 HOH 250 655 250 HOH WAT A . C 3 HOH 251 656 251 HOH WAT A . C 3 HOH 252 657 252 HOH WAT A . C 3 HOH 253 658 253 HOH WAT A . C 3 HOH 254 659 254 HOH WAT A . C 3 HOH 255 660 255 HOH WAT A . #