data_3OQK # _entry.id 3OQK # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.287 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3OQK RCSB RCSB061448 WWPDB D_1000061448 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 3OOT . unspecified PDB 3OQF . unspecified # _pdbx_database_status.entry_id 3OQK _pdbx_database_status.status_code REL _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.recvd_initial_deposition_date 2010-09-03 _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.methods_development_category ? # _audit_author.name 'Bocskei, Z.' _audit_author.pdbx_ordinal 1 # _citation.id primary _citation.title 'Discovery and optimization of a new class of potent and non-chiral indole-3-carboxamide-based renin inhibitors.' _citation.journal_abbrev Bioorg.Med.Chem.Lett. _citation.journal_volume 20 _citation.page_first 6268 _citation.page_last 6272 _citation.year 2010 _citation.journal_id_ASTM BMCLE8 _citation.country UK _citation.journal_id_ISSN 0960-894X _citation.journal_id_CSD 1127 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 20850300 _citation.pdbx_database_id_DOI 10.1016/j.bmcl.2010.08.092 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Scheiper, B.' 1 primary 'Matter, H.' 2 primary 'Steinhagen, H.' 3 primary 'Stilz, U.' 4 primary 'Bocskei, Z.' 5 primary 'Fleury, V.' 6 primary 'McCort, G.' 7 # _cell.entry_id 3OQK _cell.length_a 141.387 _cell.length_b 141.387 _cell.length_c 141.387 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 24 _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 3OQK _symmetry.space_group_name_H-M 'P 21 3' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 198 _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 Renin 37267.008 2 3.4.23.15 ? 'unp residues 67-406' ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 2 ? ? ? ? 3 non-polymer syn '2-phenoxy-1-phenyl-3-(piperazin-1-ylcarbonyl)-1H-indole' 397.469 2 ? ? ? ? 4 non-polymer syn GLYCEROL 92.094 1 ? ? ? ? 5 water nat water 18.015 144 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name Angiotensinogenase # _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 ;LTLGNTTSSVILTNYMDTQYYGEIGIGTPPQTFKVVFDTGSSNVWVPSSKCSRLYTACVYHKLFDASDSSSYKHNGTELT LRYSTGTVSGFLSQDIITVGGITVTQMFGEVTEMPALPFMLAEFDGVVGMGFIEQAIGRVTPIFDNIISQGVLKEDVFSF YYNRDSENSQSLGGQIVLGGSDPQHYEGNFHYINLIKTGVWQIQMKGVSVGSSTLLCEDGCLALVDTGASYISGSTSSIE KLMEALGAKKRLFDYVVKCNEGPTLPDISFHLGGKEYTLTSADYVFQESYSSKKLCTLAIHAMDIPPPTGPTWALGATFI RKFYTEFDRRNNRIGFALAR ; _entity_poly.pdbx_seq_one_letter_code_can ;LTLGNTTSSVILTNYMDTQYYGEIGIGTPPQTFKVVFDTGSSNVWVPSSKCSRLYTACVYHKLFDASDSSSYKHNGTELT LRYSTGTVSGFLSQDIITVGGITVTQMFGEVTEMPALPFMLAEFDGVVGMGFIEQAIGRVTPIFDNIISQGVLKEDVFSF YYNRDSENSQSLGGQIVLGGSDPQHYEGNFHYINLIKTGVWQIQMKGVSVGSSTLLCEDGCLALVDTGASYISGSTSSIE KLMEALGAKKRLFDYVVKCNEGPTLPDISFHLGGKEYTLTSADYVFQESYSSKKLCTLAIHAMDIPPPTGPTWALGATFI RKFYTEFDRRNNRIGFALAR ; _entity_poly.pdbx_strand_id A,B _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 LEU n 1 2 THR n 1 3 LEU n 1 4 GLY n 1 5 ASN n 1 6 THR n 1 7 THR n 1 8 SER n 1 9 SER n 1 10 VAL n 1 11 ILE n 1 12 LEU n 1 13 THR n 1 14 ASN n 1 15 TYR n 1 16 MET n 1 17 ASP n 1 18 THR n 1 19 GLN n 1 20 TYR n 1 21 TYR n 1 22 GLY n 1 23 GLU n 1 24 ILE n 1 25 GLY n 1 26 ILE n 1 27 GLY n 1 28 THR n 1 29 PRO n 1 30 PRO n 1 31 GLN n 1 32 THR n 1 33 PHE n 1 34 LYS n 1 35 VAL n 1 36 VAL n 1 37 PHE n 1 38 ASP n 1 39 THR n 1 40 GLY n 1 41 SER n 1 42 SER n 1 43 ASN n 1 44 VAL n 1 45 TRP n 1 46 VAL n 1 47 PRO n 1 48 SER n 1 49 SER n 1 50 LYS n 1 51 CYS n 1 52 SER n 1 53 ARG n 1 54 LEU n 1 55 TYR n 1 56 THR n 1 57 ALA n 1 58 CYS n 1 59 VAL n 1 60 TYR n 1 61 HIS n 1 62 LYS n 1 63 LEU n 1 64 PHE n 1 65 ASP n 1 66 ALA n 1 67 SER n 1 68 ASP n 1 69 SER n 1 70 SER n 1 71 SER n 1 72 TYR n 1 73 LYS n 1 74 HIS n 1 75 ASN n 1 76 GLY n 1 77 THR n 1 78 GLU n 1 79 LEU n 1 80 THR n 1 81 LEU n 1 82 ARG n 1 83 TYR n 1 84 SER n 1 85 THR n 1 86 GLY n 1 87 THR n 1 88 VAL n 1 89 SER n 1 90 GLY n 1 91 PHE n 1 92 LEU n 1 93 SER n 1 94 GLN n 1 95 ASP n 1 96 ILE n 1 97 ILE n 1 98 THR n 1 99 VAL n 1 100 GLY n 1 101 GLY n 1 102 ILE n 1 103 THR n 1 104 VAL n 1 105 THR n 1 106 GLN n 1 107 MET n 1 108 PHE n 1 109 GLY n 1 110 GLU n 1 111 VAL n 1 112 THR n 1 113 GLU n 1 114 MET n 1 115 PRO n 1 116 ALA n 1 117 LEU n 1 118 PRO n 1 119 PHE n 1 120 MET n 1 121 LEU n 1 122 ALA n 1 123 GLU n 1 124 PHE n 1 125 ASP n 1 126 GLY n 1 127 VAL n 1 128 VAL n 1 129 GLY n 1 130 MET n 1 131 GLY n 1 132 PHE n 1 133 ILE n 1 134 GLU n 1 135 GLN n 1 136 ALA n 1 137 ILE n 1 138 GLY n 1 139 ARG n 1 140 VAL n 1 141 THR n 1 142 PRO n 1 143 ILE n 1 144 PHE n 1 145 ASP n 1 146 ASN n 1 147 ILE n 1 148 ILE n 1 149 SER n 1 150 GLN n 1 151 GLY n 1 152 VAL n 1 153 LEU n 1 154 LYS n 1 155 GLU n 1 156 ASP n 1 157 VAL n 1 158 PHE n 1 159 SER n 1 160 PHE n 1 161 TYR n 1 162 TYR n 1 163 ASN n 1 164 ARG n 1 165 ASP n 1 166 SER n 1 167 GLU n 1 168 ASN n 1 169 SER n 1 170 GLN n 1 171 SER n 1 172 LEU n 1 173 GLY n 1 174 GLY n 1 175 GLN n 1 176 ILE n 1 177 VAL n 1 178 LEU n 1 179 GLY n 1 180 GLY n 1 181 SER n 1 182 ASP n 1 183 PRO n 1 184 GLN n 1 185 HIS n 1 186 TYR n 1 187 GLU n 1 188 GLY n 1 189 ASN n 1 190 PHE n 1 191 HIS n 1 192 TYR n 1 193 ILE n 1 194 ASN n 1 195 LEU n 1 196 ILE n 1 197 LYS n 1 198 THR n 1 199 GLY n 1 200 VAL n 1 201 TRP n 1 202 GLN n 1 203 ILE n 1 204 GLN n 1 205 MET n 1 206 LYS n 1 207 GLY n 1 208 VAL n 1 209 SER n 1 210 VAL n 1 211 GLY n 1 212 SER n 1 213 SER n 1 214 THR n 1 215 LEU n 1 216 LEU n 1 217 CYS n 1 218 GLU n 1 219 ASP n 1 220 GLY n 1 221 CYS n 1 222 LEU n 1 223 ALA n 1 224 LEU n 1 225 VAL n 1 226 ASP n 1 227 THR n 1 228 GLY n 1 229 ALA n 1 230 SER n 1 231 TYR n 1 232 ILE n 1 233 SER n 1 234 GLY n 1 235 SER n 1 236 THR n 1 237 SER n 1 238 SER n 1 239 ILE n 1 240 GLU n 1 241 LYS n 1 242 LEU n 1 243 MET n 1 244 GLU n 1 245 ALA n 1 246 LEU n 1 247 GLY n 1 248 ALA n 1 249 LYS n 1 250 LYS n 1 251 ARG n 1 252 LEU n 1 253 PHE n 1 254 ASP n 1 255 TYR n 1 256 VAL n 1 257 VAL n 1 258 LYS n 1 259 CYS n 1 260 ASN n 1 261 GLU n 1 262 GLY n 1 263 PRO n 1 264 THR n 1 265 LEU n 1 266 PRO n 1 267 ASP n 1 268 ILE n 1 269 SER n 1 270 PHE n 1 271 HIS n 1 272 LEU n 1 273 GLY n 1 274 GLY n 1 275 LYS n 1 276 GLU n 1 277 TYR n 1 278 THR n 1 279 LEU n 1 280 THR n 1 281 SER n 1 282 ALA n 1 283 ASP n 1 284 TYR n 1 285 VAL n 1 286 PHE n 1 287 GLN n 1 288 GLU n 1 289 SER n 1 290 TYR n 1 291 SER n 1 292 SER n 1 293 LYS n 1 294 LYS n 1 295 LEU n 1 296 CYS n 1 297 THR n 1 298 LEU n 1 299 ALA n 1 300 ILE n 1 301 HIS n 1 302 ALA n 1 303 MET n 1 304 ASP n 1 305 ILE n 1 306 PRO n 1 307 PRO n 1 308 PRO n 1 309 THR n 1 310 GLY n 1 311 PRO n 1 312 THR n 1 313 TRP n 1 314 ALA n 1 315 LEU n 1 316 GLY n 1 317 ALA n 1 318 THR n 1 319 PHE n 1 320 ILE n 1 321 ARG n 1 322 LYS n 1 323 PHE n 1 324 TYR n 1 325 THR n 1 326 GLU n 1 327 PHE n 1 328 ASP n 1 329 ARG n 1 330 ARG n 1 331 ASN n 1 332 ASN n 1 333 ARG n 1 334 ILE n 1 335 GLY n 1 336 PHE n 1 337 ALA n 1 338 LEU n 1 339 ALA n 1 340 ARG 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 REN _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 human _entity_src_gen.pdbx_host_org_scientific_name 'HOMO SAPIENS' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 9606 _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 'HUMAN EMBRYONIC KIDNEY CELL (CRL-1573)' _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 RENI_HUMAN _struct_ref.pdbx_db_accession P00797 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;LTLGNTTSSVILTNYMDTQYYGEIGIGTPPQTFKVVFDTGSSNVWVPSSKCSRLYTACVYHKLFDASDSSSYKHNGTELT LRYSTGTVSGFLSQDIITVGGITVTQMFGEVTEMPALPFMLAEFDGVVGMGFIEQAIGRVTPIFDNIISQGVLKEDVFSF YYNRDSENSQSLGGQIVLGGSDPQHYEGNFHYINLIKTGVWQIQMKGVSVGSSTLLCEDGCLALVDTGASYISGSTSSIE KLMEALGAKKRLFDYVVKCNEGPTLPDISFHLGGKEYTLTSADYVFQESYSSKKLCTLAIHAMDIPPPTGPTWALGATFI RKFYTEFDRRNNRIGFALAR ; _struct_ref.pdbx_align_begin 67 _struct_ref.pdbx_db_isoform ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 3OQK A 1 ? 340 ? P00797 67 ? 406 ? -5 326 2 1 3OQK B 1 ? 340 ? P00797 67 ? 406 ? -5 326 # 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 GOL non-polymer . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3' 92.094 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 S52 non-polymer . '2-phenoxy-1-phenyl-3-(piperazin-1-ylcarbonyl)-1H-indole' '(2-Phenoxy-1-phenyl-1H-indol-3-yl)-piperazin-1-yl-methanone' 'C25 H23 N3 O2' 397.469 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 3OQK _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.19 _exptl_crystal.density_percent_sol 61.42 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method ? _exptl_crystal_grow.temp 298 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 4.5 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details '0.05M CITRATE PH=4.5, 10-12% PEG3350, 0.6M NACL, 20 MG/ML RENIN, VAPOUR DIFFUSION, HANGING DROP, hanging drop, temperature 298K' # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector 'IMAGE PLATE' _diffrn_detector.type 'RIGAKU RAXIS IV' _diffrn_detector.pdbx_collection_date 2006-02-23 _diffrn_detector.details 'OSMIC BLUEMIRRORS' # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.5418 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source 'ROTATING ANODE' _diffrn_source.type 'RIGAKU RUH3R' _diffrn_source.pdbx_synchrotron_site ? _diffrn_source.pdbx_synchrotron_beamline ? _diffrn_source.pdbx_wavelength 1.5418 _diffrn_source.pdbx_wavelength_list ? # _reflns.entry_id 3OQK _reflns.observed_criterion_sigma_I ? _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 50.000 _reflns.d_resolution_high 2.900 _reflns.number_obs 21155 _reflns.number_all ? _reflns.percent_possible_obs 100.0 _reflns.pdbx_Rmerge_I_obs 0.06300 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 10.4000 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 6.100 _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 2.90 _reflns_shell.d_res_low 3.00 _reflns_shell.percent_possible_all 100.0 _reflns_shell.Rmerge_I_obs 0.69700 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy 6.10 _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_diffrn_id ? _reflns_shell.pdbx_ordinal 1 # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 3OQK _refine.ls_number_reflns_obs 21100 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.000 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 49.99 _refine.ls_d_res_high 2.90 _refine.ls_percent_reflns_obs 99.8 _refine.ls_R_factor_obs 0.224 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.222 _refine.ls_R_factor_R_free 0.253 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.120 _refine.ls_number_reflns_R_free 1081 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min 0.500 _refine.occupancy_max 1.000 _refine.correlation_coeff_Fo_to_Fc 0.914 _refine.correlation_coeff_Fo_to_Fc_free 0.895 _refine.B_iso_mean 78.66 _refine.aniso_B[1][1] 0.00000 _refine.aniso_B[2][2] 0.00000 _refine.aniso_B[3][3] 0.00000 _refine.aniso_B[1][2] 0.00000 _refine.aniso_B[1][3] 0.00000 _refine.aniso_B[2][3] 0.00000 _refine.solvent_model_details ? _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details ;POSITION OF WATER MOLECULES WERE TAKEN FROM A HIGHER RESOLUTION STRUCTURE (2.05 A). WATERS WERE REFINED AND RETAINED ONLY IF THE ISOTROPIC DISPLACEMENT PARAMETER REMAINED BELOW 80 A**2 ; _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct 'FOURIER SYNTHESIS' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ? _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML ? _refine.pdbx_overall_phase_error ? _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.pdbx_overall_ESU_R ? _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_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? # _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_analyze.entry_id 3OQK _refine_analyze.Luzzati_coordinate_error_obs 0.39 _refine_analyze.Luzzati_sigma_a_obs ? _refine_analyze.Luzzati_d_res_low_obs ? _refine_analyze.Luzzati_coordinate_error_free ? _refine_analyze.Luzzati_sigma_a_free ? _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_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 5196 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 94 _refine_hist.number_atoms_solvent 144 _refine_hist.number_atoms_total 5434 _refine_hist.d_res_high 2.90 _refine_hist.d_res_low 49.99 # 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 t_bond_d 0.009 ? 2.000 5425 'X-RAY DIFFRACTION' ? t_angle_deg 1.14 ? 2.000 7367 'X-RAY DIFFRACTION' ? t_dihedral_angle_d ? ? 2.000 1798 'X-RAY DIFFRACTION' ? t_incorr_chiral_ct ? ? ? ? 'X-RAY DIFFRACTION' ? t_pseud_angle ? ? ? ? 'X-RAY DIFFRACTION' ? t_trig_c_planes ? ? 2.000 118 'X-RAY DIFFRACTION' ? t_gen_planes ? ? 5.000 798 'X-RAY DIFFRACTION' ? t_it ? ? 20.000 5425 'X-RAY DIFFRACTION' ? t_nbd ? ? ? ? 'X-RAY DIFFRACTION' ? t_omega_torsion 4.350 ? ? ? 'X-RAY DIFFRACTION' ? t_other_torsion 17.850 ? ? ? 'X-RAY DIFFRACTION' ? t_improper_torsion ? ? ? ? 'X-RAY DIFFRACTION' ? t_chiral_improper_torsion ? ? 5.000 716 'X-RAY DIFFRACTION' ? t_sum_occupancies ? ? ? ? 'X-RAY DIFFRACTION' ? t_utility_distance ? ? ? ? 'X-RAY DIFFRACTION' ? t_utility_angle ? ? ? ? 'X-RAY DIFFRACTION' ? t_utility_torsion ? ? ? ? 'X-RAY DIFFRACTION' ? t_ideal_dist_contact ? ? 4.000 6165 'X-RAY DIFFRACTION' ? # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.pdbx_total_number_of_bins_used 11 _refine_ls_shell.d_res_high 2.90 _refine_ls_shell.d_res_low 3.04 _refine_ls_shell.number_reflns_R_work 2611 _refine_ls_shell.R_factor_R_work 0.2331 _refine_ls_shell.percent_reflns_obs 99.80 _refine_ls_shell.R_factor_R_free 0.2658 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.percent_reflns_R_free 5.36 _refine_ls_shell.number_reflns_R_free 148 _refine_ls_shell.number_reflns_all 2759 _refine_ls_shell.R_factor_all 0.2349 _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.number_reflns_obs ? # _struct.entry_id 3OQK _struct.title 'Crystal Structure Analysis of Renin-indole-piperazin inhibitor complexes' _struct.pdbx_descriptor 'Renin (E.C.3.4.23.15)' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3OQK _struct_keywords.text 'RENIN HUMAN, ASPARTYL PROTEASE, RENIN INHIBITION, HYPERTENSION, HYDROLASE' _struct_keywords.pdbx_keywords HYDROLASE # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 1 ? C N N 2 ? D N N 3 ? E N N 2 ? F N N 3 ? G N N 4 ? H N N 5 ? I N N 5 ? # _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 TYR A 55 ? HIS A 61 ? TYR A 47 HIS A 53 1 ? 7 HELX_P HELX_P2 2 ASP A 65 ? SER A 69 ? ASP A 57 SER A 61 5 ? 5 HELX_P HELX_P3 3 PRO A 115 ? MET A 120 ? PRO A 108 MET A 113 1 ? 6 HELX_P HELX_P4 4 PHE A 132 ? VAL A 140 ? PHE A 125 VAL A 133 5 ? 9 HELX_P HELX_P5 5 PRO A 142 ? GLN A 150 ? PRO A 135 GLN A 143 1 ? 9 HELX_P HELX_P6 6 ASP A 182 ? GLN A 184 ? ASP A 171 GLN A 173 5 ? 3 HELX_P HELX_P7 7 SER A 235 ? GLY A 247 ? SER A 224 GLY A 236 1 ? 13 HELX_P HELX_P8 8 ASN A 260 ? LEU A 265 ? ASN A 250 LEU A 255 5 ? 6 HELX_P HELX_P9 9 THR A 280 ? VAL A 285 ? THR A 270 VAL A 275 1 ? 6 HELX_P HELX_P10 10 GLY A 316 ? LYS A 322 ? GLY A 302 LYS A 308 1 ? 7 HELX_P HELX_P11 11 TYR B 55 ? HIS B 61 ? TYR B 47 HIS B 53 1 ? 7 HELX_P HELX_P12 12 ASP B 65 ? SER B 69 ? ASP B 57 SER B 61 5 ? 5 HELX_P HELX_P13 13 PRO B 115 ? MET B 120 ? PRO B 108 MET B 113 1 ? 6 HELX_P HELX_P14 14 PHE B 132 ? VAL B 140 ? PHE B 125 VAL B 133 5 ? 9 HELX_P HELX_P15 15 PRO B 142 ? GLN B 150 ? PRO B 135 GLN B 143 1 ? 9 HELX_P HELX_P16 16 ASP B 182 ? GLN B 184 ? ASP B 171 GLN B 173 5 ? 3 HELX_P HELX_P17 17 SER B 235 ? GLY B 247 ? SER B 224 GLY B 236 1 ? 13 HELX_P HELX_P18 18 ASN B 260 ? LEU B 265 ? ASN B 250 LEU B 255 5 ? 6 HELX_P HELX_P19 19 THR B 280 ? VAL B 285 ? THR B 270 VAL B 275 1 ? 6 HELX_P HELX_P20 20 GLY B 316 ? LYS B 322 ? GLY B 302 LYS B 308 1 ? 7 # _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 51 SG ? ? ? 1_555 A CYS 58 SG ? ? A CYS 45 A CYS 50 1_555 ? ? ? ? ? ? ? 2.015 ? disulf2 disulf ? ? A CYS 217 SG ? ? ? 1_555 A CYS 221 SG ? ? A CYS 206 A CYS 210 1_555 ? ? ? ? ? ? ? 2.029 ? disulf3 disulf ? ? A CYS 259 SG ? ? ? 1_555 A CYS 296 SG ? ? A CYS 249 A CYS 282 1_555 ? ? ? ? ? ? ? 2.040 ? disulf4 disulf ? ? B CYS 51 SG ? ? ? 1_555 B CYS 58 SG ? ? B CYS 45 B CYS 50 1_555 ? ? ? ? ? ? ? 2.014 ? disulf5 disulf ? ? B CYS 217 SG ? ? ? 1_555 B CYS 221 SG ? ? B CYS 206 B CYS 210 1_555 ? ? ? ? ? ? ? 2.029 ? disulf6 disulf ? ? B CYS 259 SG ? ? ? 1_555 B CYS 296 SG ? ? B CYS 249 B CYS 282 1_555 ? ? ? ? ? ? ? 2.030 ? covale1 covale ? ? B ASN 75 ND2 ? ? ? 1_555 E NAG . C1 ? ? B ASN 67 B NAG 367 1_555 ? ? ? ? ? ? ? 1.472 ? covale2 covale ? ? A ASN 75 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 67 A NAG 367 1_555 ? ? ? ? ? ? ? 1.467 ? # 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 THR 28 A . ? THR 22 A PRO 29 A ? PRO 23 A 1 -3.04 2 LEU 117 A . ? LEU 110 A PRO 118 A ? PRO 111 A 1 6.97 3 PRO 307 A . ? PRO 293 A PRO 308 A ? PRO 294 A 1 3.11 4 GLY 310 A . ? GLY 296 A PRO 311 A ? PRO 297 A 1 -2.83 5 THR 28 B . ? THR 22 B PRO 29 B ? PRO 23 B 1 -2.04 6 LEU 117 B . ? LEU 110 B PRO 118 B ? PRO 111 B 1 4.60 7 PRO 307 B . ? PRO 293 B PRO 308 B ? PRO 294 B 1 2.80 8 GLY 310 B . ? GLY 296 B PRO 311 B ? PRO 297 B 1 -1.04 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 9 ? B ? 13 ? C ? 4 ? D ? 6 ? E ? 3 ? F ? 9 ? G ? 13 ? H ? 5 ? I ? 4 ? J ? 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 A 2 3 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel A 5 6 ? anti-parallel A 6 7 ? anti-parallel A 7 8 ? anti-parallel A 8 9 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? parallel B 4 5 ? anti-parallel B 5 6 ? parallel B 6 7 ? anti-parallel B 7 8 ? anti-parallel B 8 9 ? anti-parallel B 9 10 ? anti-parallel B 10 11 ? anti-parallel B 11 12 ? anti-parallel B 12 13 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? parallel D 4 5 ? anti-parallel D 5 6 ? parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel F 4 5 ? anti-parallel F 5 6 ? anti-parallel F 6 7 ? anti-parallel F 7 8 ? anti-parallel F 8 9 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel G 3 4 ? parallel G 4 5 ? anti-parallel G 5 6 ? parallel G 6 7 ? anti-parallel G 7 8 ? anti-parallel G 8 9 ? anti-parallel G 9 10 ? anti-parallel G 10 11 ? anti-parallel G 11 12 ? anti-parallel G 12 13 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? parallel H 3 4 ? anti-parallel H 4 5 ? parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel J 1 2 ? anti-parallel J 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 73 ? ARG A 82 ? LYS A 65 ARG A 74 A 2 THR A 87 ? VAL A 99 ? THR A 79 VAL A 91 A 3 GLN A 19 ? ILE A 26 ? GLN A 13 ILE A 20 A 4 SER A 8 ? TYR A 15 ? SER A 2 TYR A 9 A 5 GLY A 174 ? LEU A 178 ? GLY A 163 LEU A 167 A 6 VAL A 157 ? TYR A 162 ? VAL A 150 TYR A 155 A 7 PHE A 323 ? ASP A 328 ? PHE A 309 ASP A 314 A 8 ARG A 333 ? ALA A 339 ? ARG A 319 ALA A 325 A 9 TYR A 186 ? ASN A 194 ? TYR A 175 ASN A 183 B 1 LYS A 73 ? ARG A 82 ? LYS A 65 ARG A 74 B 2 THR A 87 ? VAL A 99 ? THR A 79 VAL A 91 B 3 ILE A 102 ? GLU A 113 ? ILE A 94 GLU A 106 B 4 VAL A 44 ? PRO A 47 ? VAL A 38 PRO A 41 B 5 GLY A 126 ? GLY A 129 ? GLY A 119 GLY A 122 B 6 GLN A 31 ? ASP A 38 ? GLN A 25 ASP A 32 B 7 GLN A 19 ? ILE A 26 ? GLN A 13 ILE A 20 B 8 SER A 8 ? TYR A 15 ? SER A 2 TYR A 9 B 9 GLY A 174 ? LEU A 178 ? GLY A 163 LEU A 167 B 10 VAL A 157 ? TYR A 162 ? VAL A 150 TYR A 155 B 11 PHE A 323 ? ASP A 328 ? PHE A 309 ASP A 314 B 12 ARG A 333 ? ALA A 339 ? ARG A 319 ALA A 325 B 13 TYR A 186 ? ASN A 194 ? TYR A 175 ASN A 183 C 1 SER A 213 ? LEU A 216 ? SER A 202 LEU A 205 C 2 GLN A 202 ? VAL A 210 ? GLN A 191 VAL A 199 C 3 ILE A 268 ? LEU A 272 ? ILE A 258 LEU A 262 C 4 LYS A 275 ? LEU A 279 ? LYS A 265 LEU A 269 D 1 SER A 213 ? LEU A 216 ? SER A 202 LEU A 205 D 2 GLN A 202 ? VAL A 210 ? GLN A 191 VAL A 199 D 3 CYS A 221 ? VAL A 225 ? CYS A 210 VAL A 214 D 4 TRP A 313 ? LEU A 315 ? TRP A 299 LEU A 301 D 5 ILE A 232 ? GLY A 234 ? ILE A 221 GLY A 223 D 6 ILE A 300 ? ALA A 302 ? ILE A 286 ALA A 288 E 1 LYS A 249 ? LYS A 250 ? LYS A 238 LYS A 239 E 2 TYR A 255 ? LYS A 258 ? TYR A 245 LYS A 248 E 3 LEU A 295 ? THR A 297 ? LEU A 281 THR A 283 F 1 LYS B 73 ? ARG B 82 ? LYS B 65 ARG B 74 F 2 THR B 87 ? VAL B 99 ? THR B 79 VAL B 91 F 3 GLN B 19 ? ILE B 26 ? GLN B 13 ILE B 20 F 4 SER B 8 ? TYR B 15 ? SER B 2 TYR B 9 F 5 GLY B 174 ? LEU B 178 ? GLY B 163 LEU B 167 F 6 VAL B 157 ? TYR B 162 ? VAL B 150 TYR B 155 F 7 PHE B 323 ? ASP B 328 ? PHE B 309 ASP B 314 F 8 ARG B 333 ? ALA B 339 ? ARG B 319 ALA B 325 F 9 TYR B 186 ? ASN B 194 ? TYR B 175 ASN B 183 G 1 LYS B 73 ? ARG B 82 ? LYS B 65 ARG B 74 G 2 THR B 87 ? VAL B 99 ? THR B 79 VAL B 91 G 3 ILE B 102 ? GLU B 113 ? ILE B 94 GLU B 106 G 4 VAL B 44 ? PRO B 47 ? VAL B 38 PRO B 41 G 5 GLY B 126 ? GLY B 129 ? GLY B 119 GLY B 122 G 6 GLN B 31 ? ASP B 38 ? GLN B 25 ASP B 32 G 7 GLN B 19 ? ILE B 26 ? GLN B 13 ILE B 20 G 8 SER B 8 ? TYR B 15 ? SER B 2 TYR B 9 G 9 GLY B 174 ? LEU B 178 ? GLY B 163 LEU B 167 G 10 VAL B 157 ? TYR B 162 ? VAL B 150 TYR B 155 G 11 PHE B 323 ? ASP B 328 ? PHE B 309 ASP B 314 G 12 ARG B 333 ? ALA B 339 ? ARG B 319 ALA B 325 G 13 TYR B 186 ? ASN B 194 ? TYR B 175 ASN B 183 H 1 GLN B 202 ? MET B 205 ? GLN B 191 MET B 194 H 2 CYS B 221 ? VAL B 225 ? CYS B 210 VAL B 214 H 3 TRP B 313 ? LEU B 315 ? TRP B 299 LEU B 301 H 4 ILE B 232 ? GLY B 234 ? ILE B 221 GLY B 223 H 5 ILE B 300 ? ALA B 302 ? ILE B 286 ALA B 288 I 1 SER B 213 ? LEU B 216 ? SER B 202 LEU B 205 I 2 VAL B 208 ? VAL B 210 ? VAL B 197 VAL B 199 I 3 ILE B 268 ? LEU B 272 ? ILE B 258 LEU B 262 I 4 LYS B 275 ? LEU B 279 ? LYS B 265 LEU B 269 J 1 LYS B 249 ? LYS B 250 ? LYS B 238 LYS B 239 J 2 TYR B 255 ? LYS B 258 ? TYR B 245 LYS B 248 J 3 LEU B 295 ? THR B 297 ? LEU B 281 THR B 283 # 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 LEU A 81 ? N LEU A 73 O VAL A 88 ? O VAL A 80 A 2 3 O THR A 98 ? O THR A 90 N GLY A 25 ? N GLY A 19 A 3 4 O GLN A 19 ? O GLN A 13 N TYR A 15 ? N TYR A 9 A 4 5 N SER A 8 ? N SER A 2 O LEU A 178 ? O LEU A 167 A 5 6 O GLN A 175 ? O GLN A 164 N TYR A 161 ? N TYR A 154 A 6 7 N PHE A 158 ? N PHE A 151 O PHE A 327 ? O PHE A 313 A 7 8 N GLU A 326 ? N GLU A 312 O GLY A 335 ? O GLY A 321 A 8 9 O ILE A 334 ? O ILE A 320 N ILE A 193 ? N ILE A 182 B 1 2 N LEU A 81 ? N LEU A 73 O VAL A 88 ? O VAL A 80 B 2 3 N ILE A 97 ? N ILE A 89 O VAL A 104 ? O VAL A 96 B 3 4 O GLY A 109 ? O GLY A 102 N VAL A 44 ? N VAL A 38 B 4 5 N TRP A 45 ? N TRP A 39 O VAL A 127 ? O VAL A 120 B 5 6 O VAL A 128 ? O VAL A 121 N VAL A 36 ? N VAL A 30 B 6 7 O VAL A 35 ? O VAL A 29 N GLY A 22 ? N GLY A 16 B 7 8 O GLN A 19 ? O GLN A 13 N TYR A 15 ? N TYR A 9 B 8 9 N SER A 8 ? N SER A 2 O LEU A 178 ? O LEU A 167 B 9 10 O GLN A 175 ? O GLN A 164 N TYR A 161 ? N TYR A 154 B 10 11 N PHE A 158 ? N PHE A 151 O PHE A 327 ? O PHE A 313 B 11 12 N GLU A 326 ? N GLU A 312 O GLY A 335 ? O GLY A 321 B 12 13 O ILE A 334 ? O ILE A 320 N ILE A 193 ? N ILE A 182 C 1 2 O LEU A 216 ? O LEU A 205 N VAL A 208 ? N VAL A 197 C 2 3 N LYS A 206 ? N LYS A 195 O HIS A 271 ? O HIS A 261 C 3 4 N PHE A 270 ? N PHE A 260 O TYR A 277 ? O TYR A 267 D 1 2 O LEU A 216 ? O LEU A 205 N VAL A 208 ? N VAL A 197 D 2 3 N MET A 205 ? N MET A 194 O CYS A 221 ? O CYS A 210 D 3 4 N LEU A 224 ? N LEU A 213 O LEU A 315 ? O LEU A 301 D 4 5 O ALA A 314 ? O ALA A 300 N SER A 233 ? N SER A 222 D 5 6 N ILE A 232 ? N ILE A 221 O HIS A 301 ? O HIS A 287 E 1 2 N LYS A 249 ? N LYS A 238 O VAL A 256 ? O VAL A 246 E 2 3 N VAL A 257 ? N VAL A 247 O CYS A 296 ? O CYS A 282 F 1 2 N LEU B 79 ? N LEU B 71 O GLY B 90 ? O GLY B 82 F 2 3 O THR B 98 ? O THR B 90 N GLY B 25 ? N GLY B 19 F 3 4 O GLN B 19 ? O GLN B 13 N TYR B 15 ? N TYR B 9 F 4 5 N SER B 8 ? N SER B 2 O LEU B 178 ? O LEU B 167 F 5 6 O GLN B 175 ? O GLN B 164 N TYR B 161 ? N TYR B 154 F 6 7 N PHE B 158 ? N PHE B 151 O PHE B 327 ? O PHE B 313 F 7 8 N GLU B 326 ? N GLU B 312 O GLY B 335 ? O GLY B 321 F 8 9 O ILE B 334 ? O ILE B 320 N ILE B 193 ? N ILE B 182 G 1 2 N LEU B 79 ? N LEU B 71 O GLY B 90 ? O GLY B 82 G 2 3 N PHE B 91 ? N PHE B 83 O GLU B 110 ? O GLU B 103 G 3 4 O GLY B 109 ? O GLY B 102 N VAL B 44 ? N VAL B 38 G 4 5 N TRP B 45 ? N TRP B 39 O VAL B 127 ? O VAL B 120 G 5 6 O VAL B 128 ? O VAL B 121 N VAL B 36 ? N VAL B 30 G 6 7 O VAL B 35 ? O VAL B 29 N GLY B 22 ? N GLY B 16 G 7 8 O GLN B 19 ? O GLN B 13 N TYR B 15 ? N TYR B 9 G 8 9 N SER B 8 ? N SER B 2 O LEU B 178 ? O LEU B 167 G 9 10 O GLN B 175 ? O GLN B 164 N TYR B 161 ? N TYR B 154 G 10 11 N PHE B 158 ? N PHE B 151 O PHE B 327 ? O PHE B 313 G 11 12 N GLU B 326 ? N GLU B 312 O GLY B 335 ? O GLY B 321 G 12 13 O ILE B 334 ? O ILE B 320 N ILE B 193 ? N ILE B 182 H 1 2 N MET B 205 ? N MET B 194 O CYS B 221 ? O CYS B 210 H 2 3 N LEU B 224 ? N LEU B 213 O LEU B 315 ? O LEU B 301 H 3 4 O ALA B 314 ? O ALA B 300 N SER B 233 ? N SER B 222 H 4 5 N ILE B 232 ? N ILE B 221 O HIS B 301 ? O HIS B 287 I 1 2 O LEU B 216 ? O LEU B 205 N VAL B 208 ? N VAL B 197 I 2 3 N SER B 209 ? N SER B 198 O SER B 269 ? O SER B 259 I 3 4 N PHE B 270 ? N PHE B 260 O TYR B 277 ? O TYR B 267 J 1 2 N LYS B 249 ? N LYS B 238 O VAL B 256 ? O VAL B 246 J 2 3 N VAL B 257 ? N VAL B 247 O CYS B 296 ? O CYS B 282 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 367' AC2 Software ? ? ? ? 10 'BINDING SITE FOR RESIDUE S52 A 327' AC3 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG B 367' AC4 Software ? ? ? ? 10 'BINDING SITE FOR RESIDUE S52 B 327' AC5 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE GOL B 328' # 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 2 ASN A 75 ? ASN A 67 . ? 1_555 ? 2 AC1 2 MET A 107 ? MET A 100 . ? 1_555 ? 3 AC2 10 GLN A 19 ? GLN A 13 . ? 1_555 ? 4 AC2 10 ASP A 38 ? ASP A 32 . ? 1_555 ? 5 AC2 10 TYR A 83 ? TYR A 75 . ? 1_555 ? 6 AC2 10 THR A 85 ? THR A 77 . ? 1_555 ? 7 AC2 10 VAL A 127 ? VAL A 120 . ? 1_555 ? 8 AC2 10 ASP A 226 ? ASP A 215 . ? 1_555 ? 9 AC2 10 GLY A 228 ? GLY A 217 . ? 1_555 ? 10 AC2 10 ALA A 229 ? ALA A 218 . ? 1_555 ? 11 AC2 10 SER A 230 ? SER A 219 . ? 1_555 ? 12 AC2 10 MET A 303 ? MET A 289 . ? 1_555 ? 13 AC3 2 ASN B 75 ? ASN B 67 . ? 1_555 ? 14 AC3 2 MET B 107 ? MET B 100 . ? 1_555 ? 15 AC4 10 GLN B 19 ? GLN B 13 . ? 1_555 ? 16 AC4 10 ASP B 38 ? ASP B 32 . ? 1_555 ? 17 AC4 10 TYR B 83 ? TYR B 75 . ? 1_555 ? 18 AC4 10 SER B 84 ? SER B 76 . ? 1_555 ? 19 AC4 10 THR B 85 ? THR B 77 . ? 1_555 ? 20 AC4 10 VAL B 127 ? VAL B 120 . ? 1_555 ? 21 AC4 10 ASP B 226 ? ASP B 215 . ? 1_555 ? 22 AC4 10 GLY B 228 ? GLY B 217 . ? 1_555 ? 23 AC4 10 SER B 230 ? SER B 219 . ? 1_555 ? 24 AC4 10 GOL G . ? GOL B 328 . ? 1_555 ? 25 AC5 9 THR B 18 ? THR B 12 . ? 1_555 ? 26 AC5 9 GLN B 19 ? GLN B 13 . ? 1_555 ? 27 AC5 9 TYR B 20 ? TYR B 14 . ? 1_555 ? 28 AC5 9 VAL B 36 ? VAL B 30 . ? 1_555 ? 29 AC5 9 THR B 227 ? THR B 216 . ? 1_555 ? 30 AC5 9 GLY B 228 ? GLY B 217 . ? 1_555 ? 31 AC5 9 ALA B 229 ? ALA B 218 . ? 1_555 ? 32 AC5 9 SER B 230 ? SER B 219 . ? 1_555 ? 33 AC5 9 S52 F . ? S52 B 327 . ? 1_555 ? # _atom_sites.entry_id 3OQK _atom_sites.fract_transf_matrix[1][1] 0.007073 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.007073 _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] 0.007073 _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 . GLY A 1 4 ? -15.513 -36.523 29.339 1.00 127.48 ? -2 GLY A N 1 ATOM 2 C CA . GLY A 1 4 ? -16.708 -35.781 28.948 1.00 127.04 ? -2 GLY A CA 1 ATOM 3 C C . GLY A 1 4 ? -17.883 -36.661 28.577 1.00 129.34 ? -2 GLY A C 1 ATOM 4 O O . GLY A 1 4 ? -17.740 -37.885 28.439 1.00 128.32 ? -2 GLY A O 1 ATOM 5 N N . ASN A 1 5 ? -19.050 -36.027 28.378 1.00 124.92 ? -1 ASN A N 1 ATOM 6 C CA . ASN A 1 5 ? -20.289 -36.750 28.098 1.00 124.48 ? -1 ASN A CA 1 ATOM 7 C C . ASN A 1 5 ? -21.013 -36.370 26.795 1.00 125.98 ? -1 ASN A C 1 ATOM 8 O O . ASN A 1 5 ? -21.726 -37.204 26.226 1.00 125.82 ? -1 ASN A O 1 ATOM 9 C CB . ASN A 1 5 ? -21.245 -36.600 29.298 1.00 128.40 ? -1 ASN A CB 1 ATOM 10 C CG . ASN A 1 5 ? -20.610 -36.882 30.648 1.00 161.15 ? -1 ASN A CG 1 ATOM 11 O OD1 . ASN A 1 5 ? -20.294 -38.028 30.989 1.00 157.32 ? -1 ASN A OD1 1 ATOM 12 N ND2 . ASN A 1 5 ? -20.401 -35.838 31.444 1.00 153.76 ? -1 ASN A ND2 1 ATOM 13 N N . THR A 1 6 ? -20.843 -35.120 26.332 1.00 119.93 ? 0 THR A N 1 ATOM 14 C CA . THR A 1 6 ? -21.585 -34.577 25.185 1.00 117.81 ? 0 THR A CA 1 ATOM 15 C C . THR A 1 6 ? -21.003 -34.774 23.788 1.00 115.89 ? 0 THR A C 1 ATOM 16 O O . THR A 1 6 ? -19.786 -34.808 23.597 1.00 115.25 ? 0 THR A O 1 ATOM 17 C CB . THR A 1 6 ? -21.915 -33.090 25.412 1.00 126.30 ? 0 THR A CB 1 ATOM 18 O OG1 . THR A 1 6 ? -20.696 -32.356 25.542 1.00 127.59 ? 0 THR A OG1 1 ATOM 19 C CG2 . THR A 1 6 ? -22.809 -32.860 26.634 1.00 123.99 ? 0 THR A CG2 1 ATOM 20 N N . THR A 1 7 ? -21.907 -34.878 22.808 1.00 107.35 ? 1 THR A N 1 ATOM 21 C CA . THR A 1 7 ? -21.608 -34.897 21.382 1.00 104.45 ? 1 THR A CA 1 ATOM 22 C C . THR A 1 7 ? -22.226 -33.608 20.821 1.00 101.26 ? 1 THR A C 1 ATOM 23 O O . THR A 1 7 ? -23.260 -33.172 21.329 1.00 99.70 ? 1 THR A O 1 ATOM 24 C CB . THR A 1 7 ? -22.094 -36.187 20.701 1.00 114.85 ? 1 THR A CB 1 ATOM 25 O OG1 . THR A 1 7 ? -21.384 -36.353 19.480 1.00 119.92 ? 1 THR A OG1 1 ATOM 26 C CG2 . THR A 1 7 ? -23.599 -36.208 20.430 1.00 112.19 ? 1 THR A CG2 1 ATOM 27 N N . SER A 1 8 ? -21.586 -32.973 19.820 1.00 93.69 ? 2 SER A N 1 ATOM 28 C CA . SER A 1 8 ? -22.125 -31.735 19.253 1.00 91.31 ? 2 SER A CA 1 ATOM 29 C C . SER A 1 8 ? -22.002 -31.760 17.729 1.00 89.90 ? 2 SER A C 1 ATOM 30 O O . SER A 1 8 ? -20.977 -32.195 17.200 1.00 89.78 ? 2 SER A O 1 ATOM 31 C CB . SER A 1 8 ? -21.428 -30.523 19.859 1.00 95.55 ? 2 SER A CB 1 ATOM 32 O OG . SER A 1 8 ? -21.850 -29.314 19.258 1.00 109.38 ? 2 SER A OG 1 ATOM 33 N N . SER A 1 9 ? -23.036 -31.292 17.026 1.00 81.53 ? 3 SER A N 1 ATOM 34 C CA . SER A 1 9 ? -22.989 -31.299 15.569 1.00 79.12 ? 3 SER A CA 1 ATOM 35 C C . SER A 1 9 ? -23.109 -29.924 14.956 1.00 78.58 ? 3 SER A C 1 ATOM 36 O O . SER A 1 9 ? -23.785 -29.048 15.504 1.00 78.70 ? 3 SER A O 1 ATOM 37 C CB . SER A 1 9 ? -24.013 -32.270 14.983 1.00 80.79 ? 3 SER A CB 1 ATOM 38 O OG . SER A 1 9 ? -25.334 -31.894 15.325 1.00 86.27 ? 3 SER A OG 1 ATOM 39 N N . VAL A 1 10 ? -22.438 -29.737 13.815 1.00 71.58 ? 4 VAL A N 1 ATOM 40 C CA . VAL A 1 10 ? -22.524 -28.490 13.041 1.00 70.17 ? 4 VAL A CA 1 ATOM 41 C C . VAL A 1 10 ? -23.140 -28.854 11.711 1.00 69.91 ? 4 VAL A C 1 ATOM 42 O O . VAL A 1 10 ? -22.596 -29.711 11.012 1.00 70.33 ? 4 VAL A O 1 ATOM 43 C CB . VAL A 1 10 ? -21.164 -27.761 12.858 1.00 73.54 ? 4 VAL A CB 1 ATOM 44 C CG1 . VAL A 1 10 ? -21.358 -26.431 12.129 1.00 73.48 ? 4 VAL A CG1 1 ATOM 45 C CG2 . VAL A 1 10 ? -20.472 -27.539 14.203 1.00 73.01 ? 4 VAL A CG2 1 ATOM 46 N N . ILE A 1 11 ? -24.289 -28.264 11.386 1.00 63.23 ? 5 ILE A N 1 ATOM 47 C CA . ILE A 1 11 ? -24.920 -28.533 10.089 1.00 62.99 ? 5 ILE A CA 1 ATOM 48 C C . ILE A 1 11 ? -24.176 -27.727 9.023 1.00 64.29 ? 5 ILE A C 1 ATOM 49 O O . ILE A 1 11 ? -23.866 -26.539 9.224 1.00 64.51 ? 5 ILE A O 1 ATOM 50 C CB . ILE A 1 11 ? -26.456 -28.245 10.075 1.00 66.07 ? 5 ILE A CB 1 ATOM 51 C CG1 . ILE A 1 11 ? -27.207 -29.043 11.142 1.00 66.22 ? 5 ILE A CG1 1 ATOM 52 C CG2 . ILE A 1 11 ? -27.071 -28.453 8.688 1.00 66.30 ? 5 ILE A CG2 1 ATOM 53 C CD1 . ILE A 1 11 ? -26.961 -30.548 11.149 1.00 73.43 ? 5 ILE A CD1 1 ATOM 54 N N . LEU A 1 12 ? -23.875 -28.381 7.909 1.00 56.58 ? 6 LEU A N 1 ATOM 55 C CA . LEU A 1 12 ? -23.160 -27.725 6.831 1.00 54.08 ? 6 LEU A CA 1 ATOM 56 C C . LEU A 1 12 ? -24.025 -27.532 5.612 1.00 58.09 ? 6 LEU A C 1 ATOM 57 O O . LEU A 1 12 ? -24.928 -28.329 5.333 1.00 59.15 ? 6 LEU A O 1 ATOM 58 C CB . LEU A 1 12 ? -21.905 -28.522 6.429 1.00 52.37 ? 6 LEU A CB 1 ATOM 59 C CG . LEU A 1 12 ? -20.869 -28.892 7.488 1.00 52.09 ? 6 LEU A CG 1 ATOM 60 C CD1 . LEU A 1 12 ? -19.788 -29.737 6.879 1.00 49.11 ? 6 LEU A CD1 1 ATOM 61 C CD2 . LEU A 1 12 ? -20.298 -27.667 8.176 1.00 51.69 ? 6 LEU A CD2 1 ATOM 62 N N . THR A 1 13 ? -23.726 -26.467 4.883 1.00 54.17 ? 7 THR A N 1 ATOM 63 C CA . THR A 1 13 ? -24.353 -26.171 3.605 1.00 54.03 ? 7 THR A CA 1 ATOM 64 C C . THR A 1 13 ? -23.390 -26.655 2.548 1.00 57.44 ? 7 THR A C 1 ATOM 65 O O . THR A 1 13 ? -22.177 -26.460 2.683 1.00 56.98 ? 7 THR A O 1 ATOM 66 C CB . THR A 1 13 ? -24.674 -24.683 3.473 1.00 58.29 ? 7 THR A CB 1 ATOM 67 O OG1 . THR A 1 13 ? -25.627 -24.359 4.477 1.00 58.90 ? 7 THR A OG1 1 ATOM 68 C CG2 . THR A 1 13 ? -25.233 -24.327 2.129 1.00 55.34 ? 7 THR A CG2 1 ATOM 69 N N . ASN A 1 14 ? -23.930 -27.314 1.520 1.00 54.04 ? 8 ASN A N 1 ATOM 70 C CA . ASN A 1 14 ? -23.175 -27.804 0.380 1.00 53.68 ? 8 ASN A CA 1 ATOM 71 C C . ASN A 1 14 ? -23.438 -26.893 -0.776 1.00 60.79 ? 8 ASN A C 1 ATOM 72 O O . ASN A 1 14 ? -24.517 -26.946 -1.375 1.00 60.57 ? 8 ASN A O 1 ATOM 73 C CB . ASN A 1 14 ? -23.544 -29.240 -0.006 1.00 49.08 ? 8 ASN A CB 1 ATOM 74 C CG . ASN A 1 14 ? -22.890 -29.754 -1.287 1.00 61.90 ? 8 ASN A CG 1 ATOM 75 O OD1 . ASN A 1 14 ? -23.026 -30.924 -1.661 1.00 57.03 ? 8 ASN A OD1 1 ATOM 76 N ND2 . ASN A 1 14 ? -22.139 -28.919 -1.985 1.00 43.51 ? 8 ASN A ND2 1 ATOM 77 N N . TYR A 1 15 ? -22.429 -26.081 -1.110 1.00 59.34 ? 9 TYR A N 1 ATOM 78 C CA . TYR A 1 15 ? -22.501 -25.203 -2.252 1.00 59.08 ? 9 TYR A CA 1 ATOM 79 C C . TYR A 1 15 ? -21.769 -25.854 -3.437 1.00 64.75 ? 9 TYR A C 1 ATOM 80 O O . TYR A 1 15 ? -20.537 -25.985 -3.400 1.00 63.47 ? 9 TYR A O 1 ATOM 81 C CB . TYR A 1 15 ? -21.951 -23.810 -1.915 1.00 59.76 ? 9 TYR A CB 1 ATOM 82 C CG . TYR A 1 15 ? -21.878 -22.910 -3.119 1.00 62.48 ? 9 TYR A CG 1 ATOM 83 C CD1 . TYR A 1 15 ? -23.005 -22.235 -3.578 1.00 65.51 ? 9 TYR A CD1 1 ATOM 84 C CD2 . TYR A 1 15 ? -20.671 -22.705 -3.791 1.00 63.11 ? 9 TYR A CD2 1 ATOM 85 C CE1 . TYR A 1 15 ? -22.954 -21.428 -4.712 1.00 67.93 ? 9 TYR A CE1 1 ATOM 86 C CE2 . TYR A 1 15 ? -20.602 -21.878 -4.912 1.00 63.71 ? 9 TYR A CE2 1 ATOM 87 C CZ . TYR A 1 15 ? -21.752 -21.250 -5.375 1.00 75.24 ? 9 TYR A CZ 1 ATOM 88 O OH . TYR A 1 15 ? -21.746 -20.437 -6.486 1.00 81.23 ? 9 TYR A OH 1 ATOM 89 N N . MET A 1 16 ? -22.545 -26.304 -4.462 1.00 61.80 ? 10 MET A N 1 ATOM 90 C CA . MET A 1 16 ? -22.075 -26.848 -5.738 1.00 62.24 ? 10 MET A CA 1 ATOM 91 C C . MET A 1 16 ? -21.082 -27.965 -5.642 1.00 62.07 ? 10 MET A C 1 ATOM 92 O O . MET A 1 16 ? -20.271 -28.105 -6.550 1.00 63.17 ? 10 MET A O 1 ATOM 93 C CB . MET A 1 16 ? -21.472 -25.724 -6.585 1.00 67.27 ? 10 MET A CB 1 ATOM 94 C CG . MET A 1 16 ? -22.386 -24.535 -6.705 1.00 76.28 ? 10 MET A CG 1 ATOM 95 S SD . MET A 1 16 ? -22.997 -24.045 -8.327 1.00 85.18 ? 10 MET A SD 1 ATOM 96 C CE . MET A 1 16 ? -24.557 -23.106 -7.816 1.00 82.16 ? 10 MET A CE 1 ATOM 97 N N . ASP A 1 17 ? -21.110 -28.750 -4.561 1.00 56.59 ? 11 ASP A N 1 ATOM 98 C CA . ASP A 1 17 ? -20.139 -29.820 -4.287 1.00 55.61 ? 11 ASP A CA 1 ATOM 99 C C . ASP A 1 17 ? -18.684 -29.311 -4.090 1.00 56.87 ? 11 ASP A C 1 ATOM 100 O O . ASP A 1 17 ? -17.755 -30.115 -4.040 1.00 55.84 ? 11 ASP A O 1 ATOM 101 C CB . ASP A 1 17 ? -20.192 -30.923 -5.362 1.00 56.97 ? 11 ASP A CB 1 ATOM 102 C CG . ASP A 1 17 ? -21.248 -31.978 -5.130 1.00 70.16 ? 11 ASP A CG 1 ATOM 103 O OD1 . ASP A 1 17 ? -21.982 -31.888 -4.112 1.00 72.42 ? 11 ASP A OD1 1 ATOM 104 O OD2 . ASP A 1 17 ? -21.330 -32.908 -5.937 1.00 77.92 ? 11 ASP A OD2 1 ATOM 105 N N . THR A 1 18 ? -18.480 -27.992 -3.997 1.00 50.99 ? 12 THR A N 1 ATOM 106 C CA . THR A 1 18 ? -17.133 -27.454 -3.862 1.00 49.66 ? 12 THR A CA 1 ATOM 107 C C . THR A 1 18 ? -16.871 -26.761 -2.526 1.00 50.56 ? 12 THR A C 1 ATOM 108 O O . THR A 1 18 ? -15.729 -26.633 -2.125 1.00 49.96 ? 12 THR A O 1 ATOM 109 C CB . THR A 1 18 ? -16.785 -26.533 -5.033 1.00 59.63 ? 12 THR A CB 1 ATOM 110 O OG1 . THR A 1 18 ? -17.715 -25.437 -5.106 1.00 62.08 ? 12 THR A OG1 1 ATOM 111 C CG2 . THR A 1 18 ? -16.702 -27.268 -6.335 1.00 56.28 ? 12 THR A CG2 1 ATOM 112 N N . GLN A 1 19 ? -17.895 -26.236 -1.893 1.00 46.62 ? 13 GLN A N 1 ATOM 113 C CA . GLN A 1 19 ? -17.726 -25.510 -0.647 1.00 46.18 ? 13 GLN A CA 1 ATOM 114 C C . GLN A 1 19 ? -18.717 -26.036 0.370 1.00 53.12 ? 13 GLN A C 1 ATOM 115 O O . GLN A 1 19 ? -19.925 -26.064 0.124 1.00 52.78 ? 13 GLN A O 1 ATOM 116 C CB . GLN A 1 19 ? -17.929 -23.998 -0.854 1.00 46.90 ? 13 GLN A CB 1 ATOM 117 C CG . GLN A 1 19 ? -17.013 -23.404 -1.910 1.00 52.29 ? 13 GLN A CG 1 ATOM 118 C CD . GLN A 1 19 ? -17.246 -21.946 -2.113 1.00 64.30 ? 13 GLN A CD 1 ATOM 119 O OE1 . GLN A 1 19 ? -17.582 -21.221 -1.172 1.00 49.87 ? 13 GLN A OE1 1 ATOM 120 N NE2 . GLN A 1 19 ? -17.027 -21.488 -3.346 1.00 61.46 ? 13 GLN A NE2 1 ATOM 121 N N . TYR A 1 20 ? -18.204 -26.488 1.504 1.00 50.75 ? 14 TYR A N 1 ATOM 122 C CA . TYR A 1 20 ? -19.023 -26.987 2.604 1.00 49.58 ? 14 TYR A CA 1 ATOM 123 C C . TYR A 1 20 ? -18.726 -26.107 3.789 1.00 54.46 ? 14 TYR A C 1 ATOM 124 O O . TYR A 1 20 ? -17.573 -26.007 4.224 1.00 59.03 ? 14 TYR A O 1 ATOM 125 C CB . TYR A 1 20 ? -18.718 -28.465 2.908 1.00 49.60 ? 14 TYR A CB 1 ATOM 126 C CG . TYR A 1 20 ? -19.069 -29.441 1.794 1.00 48.88 ? 14 TYR A CG 1 ATOM 127 C CD1 . TYR A 1 20 ? -20.242 -30.192 1.837 1.00 49.36 ? 14 TYR A CD1 1 ATOM 128 C CD2 . TYR A 1 20 ? -18.212 -29.633 0.707 1.00 48.14 ? 14 TYR A CD2 1 ATOM 129 C CE1 . TYR A 1 20 ? -20.555 -31.105 0.823 1.00 46.93 ? 14 TYR A CE1 1 ATOM 130 C CE2 . TYR A 1 20 ? -18.532 -30.521 -0.323 1.00 48.42 ? 14 TYR A CE2 1 ATOM 131 C CZ . TYR A 1 20 ? -19.703 -31.255 -0.259 1.00 54.16 ? 14 TYR A CZ 1 ATOM 132 O OH . TYR A 1 20 ? -19.993 -32.163 -1.248 1.00 59.41 ? 14 TYR A OH 1 ATOM 133 N N . TYR A 1 21 ? -19.739 -25.418 4.277 1.00 48.58 ? 15 TYR A N 1 ATOM 134 C CA . TYR A 1 21 ? -19.545 -24.467 5.386 1.00 50.25 ? 15 TYR A CA 1 ATOM 135 C C . TYR A 1 21 ? -20.684 -24.478 6.379 1.00 56.33 ? 15 TYR A C 1 ATOM 136 O O . TYR A 1 21 ? -21.824 -24.810 6.029 1.00 56.46 ? 15 TYR A O 1 ATOM 137 C CB . TYR A 1 21 ? -19.351 -23.027 4.870 1.00 52.54 ? 15 TYR A CB 1 ATOM 138 C CG . TYR A 1 21 ? -20.401 -22.608 3.860 1.00 55.43 ? 15 TYR A CG 1 ATOM 139 C CD1 . TYR A 1 21 ? -20.212 -22.843 2.502 1.00 58.13 ? 15 TYR A CD1 1 ATOM 140 C CD2 . TYR A 1 21 ? -21.577 -21.967 4.259 1.00 55.67 ? 15 TYR A CD2 1 ATOM 141 C CE1 . TYR A 1 21 ? -21.166 -22.481 1.563 1.00 59.95 ? 15 TYR A CE1 1 ATOM 142 C CE2 . TYR A 1 21 ? -22.552 -21.603 3.326 1.00 56.48 ? 15 TYR A CE2 1 ATOM 143 C CZ . TYR A 1 21 ? -22.347 -21.871 1.977 1.00 69.53 ? 15 TYR A CZ 1 ATOM 144 O OH . TYR A 1 21 ? -23.298 -21.488 1.046 1.00 73.76 ? 15 TYR A OH 1 ATOM 145 N N . GLY A 1 22 ? -20.366 -24.118 7.614 1.00 53.63 ? 16 GLY A N 1 ATOM 146 C CA . GLY A 1 22 ? -21.339 -24.054 8.699 1.00 52.92 ? 16 GLY A CA 1 ATOM 147 C C . GLY A 1 22 ? -21.314 -22.676 9.314 1.00 56.00 ? 16 GLY A C 1 ATOM 148 O O . GLY A 1 22 ? -20.580 -21.799 8.856 1.00 57.47 ? 16 GLY A O 1 ATOM 149 N N . GLU A 1 23 ? -22.109 -22.464 10.347 1.00 52.42 ? 17 GLU A N 1 ATOM 150 C CA . GLU A 1 23 ? -22.129 -21.160 11.018 1.00 52.71 ? 17 GLU A CA 1 ATOM 151 C C . GLU A 1 23 ? -21.535 -21.248 12.394 1.00 59.28 ? 17 GLU A C 1 ATOM 152 O O . GLU A 1 23 ? -21.686 -22.271 13.079 1.00 59.18 ? 17 GLU A O 1 ATOM 153 C CB . GLU A 1 23 ? -23.542 -20.564 11.092 1.00 53.76 ? 17 GLU A CB 1 ATOM 154 C CG . GLU A 1 23 ? -24.103 -20.179 9.723 1.00 57.59 ? 17 GLU A CG 1 ATOM 155 C CD . GLU A 1 23 ? -25.395 -19.396 9.723 1.00 84.53 ? 17 GLU A CD 1 ATOM 156 O OE1 . GLU A 1 23 ? -25.967 -19.151 10.809 1.00 99.44 ? 17 GLU A OE1 1 ATOM 157 O OE2 . GLU A 1 23 ? -25.851 -19.034 8.617 1.00 88.65 ? 17 GLU A OE2 1 ATOM 158 N N . ILE A 1 24 ? -20.798 -20.191 12.776 1.00 55.68 ? 18 ILE A N 1 ATOM 159 C CA . ILE A 1 24 ? -20.257 -20.000 14.125 1.00 53.26 ? 18 ILE A CA 1 ATOM 160 C C . ILE A 1 24 ? -20.669 -18.593 14.568 1.00 56.19 ? 18 ILE A C 1 ATOM 161 O O . ILE A 1 24 ? -20.946 -17.725 13.729 1.00 56.17 ? 18 ILE A O 1 ATOM 162 C CB . ILE A 1 24 ? -18.733 -20.199 14.245 1.00 54.60 ? 18 ILE A CB 1 ATOM 163 C CG1 . ILE A 1 24 ? -17.954 -19.154 13.411 1.00 54.77 ? 18 ILE A CG1 1 ATOM 164 C CG2 . ILE A 1 24 ? -18.348 -21.638 13.941 1.00 53.16 ? 18 ILE A CG2 1 ATOM 165 C CD1 . ILE A 1 24 ? -16.476 -19.033 13.695 1.00 54.89 ? 18 ILE A CD1 1 ATOM 166 N N . GLY A 1 25 ? -20.702 -18.379 15.869 1.00 50.82 ? 19 GLY A N 1 ATOM 167 C CA . GLY A 1 25 ? -20.986 -17.068 16.444 1.00 49.58 ? 19 GLY A CA 1 ATOM 168 C C . GLY A 1 25 ? -19.735 -16.583 17.117 1.00 52.67 ? 19 GLY A C 1 ATOM 169 O O . GLY A 1 25 ? -19.022 -17.384 17.710 1.00 53.60 ? 19 GLY A O 1 ATOM 170 N N . ILE A 1 26 ? -19.416 -15.296 16.979 1.00 49.06 ? 20 ILE A N 1 ATOM 171 C CA . ILE A 1 26 ? -18.250 -14.691 17.629 1.00 49.24 ? 20 ILE A CA 1 ATOM 172 C C . ILE A 1 26 ? -18.697 -13.413 18.363 1.00 56.88 ? 20 ILE A C 1 ATOM 173 O O . ILE A 1 26 ? -19.336 -12.532 17.753 1.00 56.10 ? 20 ILE A O 1 ATOM 174 C CB . ILE A 1 26 ? -17.065 -14.354 16.647 1.00 51.03 ? 20 ILE A CB 1 ATOM 175 C CG1 . ILE A 1 26 ? -16.687 -15.543 15.757 1.00 49.46 ? 20 ILE A CG1 1 ATOM 176 C CG2 . ILE A 1 26 ? -15.833 -13.796 17.431 1.00 49.39 ? 20 ILE A CG2 1 ATOM 177 C CD1 . ILE A 1 26 ? -15.583 -15.233 14.802 1.00 51.76 ? 20 ILE A CD1 1 ATOM 178 N N . GLY A 1 27 ? -18.326 -13.316 19.639 1.00 54.14 ? 21 GLY A N 1 ATOM 179 C CA . GLY A 1 27 ? -18.594 -12.141 20.464 1.00 53.96 ? 21 GLY A CA 1 ATOM 180 C C . GLY A 1 27 ? -19.891 -12.159 21.243 1.00 58.49 ? 21 GLY A C 1 ATOM 181 O O . GLY A 1 27 ? -20.658 -13.128 21.188 1.00 58.22 ? 21 GLY A O 1 ATOM 182 N N . THR A 1 28 ? -20.136 -11.071 21.976 1.00 55.29 ? 22 THR A N 1 ATOM 183 C CA . THR A 1 28 ? -21.341 -10.870 22.781 1.00 54.83 ? 22 THR A CA 1 ATOM 184 C C . THR A 1 28 ? -21.960 -9.505 22.421 1.00 55.83 ? 22 THR A C 1 ATOM 185 O O . THR A 1 28 ? -21.363 -8.458 22.699 1.00 54.63 ? 22 THR A O 1 ATOM 186 C CB . THR A 1 28 ? -21.056 -11.005 24.283 1.00 65.51 ? 22 THR A CB 1 ATOM 187 O OG1 . THR A 1 28 ? -20.260 -12.174 24.530 1.00 66.88 ? 22 THR A OG1 1 ATOM 188 C CG2 . THR A 1 28 ? -22.338 -11.067 25.094 1.00 62.03 ? 22 THR A CG2 1 ATOM 189 N N . PRO A 1 29 ? -23.149 -9.489 21.783 1.00 50.38 ? 23 PRO A N 1 ATOM 190 C CA . PRO A 1 29 ? -23.927 -10.652 21.319 1.00 49.68 ? 23 PRO A CA 1 ATOM 191 C C . PRO A 1 29 ? -23.209 -11.329 20.133 1.00 55.78 ? 23 PRO A C 1 ATOM 192 O O . PRO A 1 29 ? -22.296 -10.722 19.522 1.00 53.15 ? 23 PRO A O 1 ATOM 193 C CB . PRO A 1 29 ? -25.281 -10.036 20.957 1.00 49.71 ? 23 PRO A CB 1 ATOM 194 C CG . PRO A 1 29 ? -24.949 -8.660 20.511 1.00 53.02 ? 23 PRO A CG 1 ATOM 195 C CD . PRO A 1 29 ? -23.777 -8.219 21.362 1.00 49.50 ? 23 PRO A CD 1 ATOM 196 N N . PRO A 1 30 ? -23.573 -12.589 19.811 1.00 54.08 ? 24 PRO A N 1 ATOM 197 C CA . PRO A 1 30 ? -22.879 -13.295 18.723 1.00 54.42 ? 24 PRO A CA 1 ATOM 198 C C . PRO A 1 30 ? -23.037 -12.657 17.353 1.00 58.29 ? 24 PRO A C 1 ATOM 199 O O . PRO A 1 30 ? -24.140 -12.265 16.948 1.00 58.05 ? 24 PRO A O 1 ATOM 200 C CB . PRO A 1 30 ? -23.509 -14.697 18.749 1.00 55.77 ? 24 PRO A CB 1 ATOM 201 C CG . PRO A 1 30 ? -24.097 -14.821 20.092 1.00 59.29 ? 24 PRO A CG 1 ATOM 202 C CD . PRO A 1 30 ? -24.614 -13.445 20.394 1.00 54.52 ? 24 PRO A CD 1 ATOM 203 N N . GLN A 1 31 ? -21.907 -12.519 16.656 1.00 53.87 ? 25 GLN A N 1 ATOM 204 C CA . GLN A 1 31 ? -21.884 -12.076 15.264 1.00 52.18 ? 25 GLN A CA 1 ATOM 205 C C . GLN A 1 31 ? -21.669 -13.397 14.501 1.00 55.82 ? 25 GLN A C 1 ATOM 206 O O . GLN A 1 31 ? -20.725 -14.135 14.793 1.00 55.54 ? 25 GLN A O 1 ATOM 207 C CB . GLN A 1 31 ? -20.754 -11.062 15.029 1.00 52.87 ? 25 GLN A CB 1 ATOM 208 C CG . GLN A 1 31 ? -20.944 -9.758 15.795 1.00 52.57 ? 25 GLN A CG 1 ATOM 209 C CD . GLN A 1 31 ? -19.768 -8.836 15.735 1.00 67.67 ? 25 GLN A CD 1 ATOM 210 O OE1 . GLN A 1 31 ? -19.328 -8.314 16.760 1.00 67.34 ? 25 GLN A OE1 1 ATOM 211 N NE2 . GLN A 1 31 ? -19.276 -8.574 14.557 1.00 60.43 ? 25 GLN A NE2 1 ATOM 212 N N . THR A 1 32 ? -22.591 -13.733 13.596 1.00 52.36 ? 26 THR A N 1 ATOM 213 C CA . THR A 1 32 ? -22.549 -15.016 12.890 1.00 52.99 ? 26 THR A CA 1 ATOM 214 C C . THR A 1 32 ? -21.762 -14.989 11.573 1.00 55.10 ? 26 THR A C 1 ATOM 215 O O . THR A 1 32 ? -21.899 -14.068 10.769 1.00 54.45 ? 26 THR A O 1 ATOM 216 C CB . THR A 1 32 ? -23.952 -15.601 12.746 1.00 65.90 ? 26 THR A CB 1 ATOM 217 O OG1 . THR A 1 32 ? -24.710 -14.717 11.953 1.00 76.44 ? 26 THR A OG1 1 ATOM 218 C CG2 . THR A 1 32 ? -24.612 -15.872 14.115 1.00 61.59 ? 26 THR A CG2 1 ATOM 219 N N . PHE A 1 33 ? -20.942 -16.012 11.359 1.00 48.80 ? 27 PHE A N 1 ATOM 220 C CA . PHE A 1 33 ? -20.112 -16.142 10.161 1.00 46.21 ? 27 PHE A CA 1 ATOM 221 C C . PHE A 1 33 ? -20.272 -17.525 9.560 1.00 50.58 ? 27 PHE A C 1 ATOM 222 O O . PHE A 1 33 ? -20.456 -18.520 10.281 1.00 49.77 ? 27 PHE A O 1 ATOM 223 C CB . PHE A 1 33 ? -18.617 -15.904 10.493 1.00 46.68 ? 27 PHE A CB 1 ATOM 224 C CG . PHE A 1 33 ? -18.356 -14.515 11.022 1.00 48.34 ? 27 PHE A CG 1 ATOM 225 C CD1 . PHE A 1 33 ? -18.058 -13.465 10.153 1.00 52.98 ? 27 PHE A CD1 1 ATOM 226 C CD2 . PHE A 1 33 ? -18.508 -14.223 12.380 1.00 48.31 ? 27 PHE A CD2 1 ATOM 227 C CE1 . PHE A 1 33 ? -17.877 -12.157 10.639 1.00 53.19 ? 27 PHE A CE1 1 ATOM 228 C CE2 . PHE A 1 33 ? -18.327 -12.922 12.861 1.00 50.57 ? 27 PHE A CE2 1 ATOM 229 C CZ . PHE A 1 33 ? -18.012 -11.901 11.990 1.00 49.94 ? 27 PHE A CZ 1 ATOM 230 N N . LYS A 1 34 ? -20.205 -17.583 8.233 1.00 47.01 ? 28 LYS A N 1 ATOM 231 C CA . LYS A 1 34 ? -20.169 -18.835 7.473 1.00 45.74 ? 28 LYS A CA 1 ATOM 232 C C . LYS A 1 34 ? -18.685 -19.193 7.403 1.00 47.53 ? 28 LYS A C 1 ATOM 233 O O . LYS A 1 34 ? -17.853 -18.342 7.035 1.00 45.19 ? 28 LYS A O 1 ATOM 234 C CB . LYS A 1 34 ? -20.759 -18.658 6.070 1.00 48.40 ? 28 LYS A CB 1 ATOM 235 C CG . LYS A 1 34 ? -22.238 -18.303 6.080 1.00 52.81 ? 28 LYS A CG 1 ATOM 236 C CD . LYS A 1 34 ? -22.750 -17.824 4.712 1.00 44.33 ? 28 LYS A CD 1 ATOM 237 C CE . LYS A 1 34 ? -24.219 -17.420 4.819 1.00 58.62 ? 28 LYS A CE 1 ATOM 238 N NZ . LYS A 1 34 ? -24.677 -16.493 3.748 1.00 62.54 ? 28 LYS A NZ 1 ATOM 239 N N . VAL A 1 35 ? -18.338 -20.415 7.852 1.00 45.43 ? 29 VAL A N 1 ATOM 240 C CA . VAL A 1 35 ? -16.941 -20.850 7.905 1.00 45.92 ? 29 VAL A CA 1 ATOM 241 C C . VAL A 1 35 ? -16.743 -22.233 7.351 1.00 52.51 ? 29 VAL A C 1 ATOM 242 O O . VAL A 1 35 ? -17.610 -23.092 7.485 1.00 53.87 ? 29 VAL A O 1 ATOM 243 C CB . VAL A 1 35 ? -16.322 -20.737 9.333 1.00 49.33 ? 29 VAL A CB 1 ATOM 244 C CG1 . VAL A 1 35 ? -16.183 -19.283 9.787 1.00 48.40 ? 29 VAL A CG1 1 ATOM 245 C CG2 . VAL A 1 35 ? -17.124 -21.550 10.353 1.00 48.88 ? 29 VAL A CG2 1 ATOM 246 N N . VAL A 1 36 ? -15.576 -22.450 6.763 1.00 50.69 ? 30 VAL A N 1 ATOM 247 C CA . VAL A 1 36 ? -15.133 -23.770 6.326 1.00 51.25 ? 30 VAL A CA 1 ATOM 248 C C . VAL A 1 36 ? -14.370 -24.334 7.525 1.00 54.96 ? 30 VAL A C 1 ATOM 249 O O . VAL A 1 36 ? -13.598 -23.604 8.177 1.00 55.17 ? 30 VAL A O 1 ATOM 250 C CB . VAL A 1 36 ? -14.212 -23.670 5.097 1.00 55.64 ? 30 VAL A CB 1 ATOM 251 C CG1 . VAL A 1 36 ? -13.408 -24.945 4.893 1.00 55.69 ? 30 VAL A CG1 1 ATOM 252 C CG2 . VAL A 1 36 ? -15.047 -23.383 3.870 1.00 56.06 ? 30 VAL A CG2 1 ATOM 253 N N . PHE A 1 37 ? -14.595 -25.624 7.820 1.00 48.46 ? 31 PHE A N 1 ATOM 254 C CA . PHE A 1 37 ? -13.877 -26.327 8.876 1.00 48.22 ? 31 PHE A CA 1 ATOM 255 C C . PHE A 1 37 ? -12.796 -27.144 8.172 1.00 53.41 ? 31 PHE A C 1 ATOM 256 O O . PHE A 1 37 ? -13.085 -28.110 7.448 1.00 54.02 ? 31 PHE A O 1 ATOM 257 C CB . PHE A 1 37 ? -14.840 -27.186 9.678 1.00 50.80 ? 31 PHE A CB 1 ATOM 258 C CG . PHE A 1 37 ? -15.841 -26.368 10.463 1.00 52.81 ? 31 PHE A CG 1 ATOM 259 C CD1 . PHE A 1 37 ? -17.034 -25.937 9.875 1.00 54.51 ? 31 PHE A CD1 1 ATOM 260 C CD2 . PHE A 1 37 ? -15.599 -26.035 11.793 1.00 54.71 ? 31 PHE A CD2 1 ATOM 261 C CE1 . PHE A 1 37 ? -17.966 -25.191 10.608 1.00 54.84 ? 31 PHE A CE1 1 ATOM 262 C CE2 . PHE A 1 37 ? -16.521 -25.267 12.514 1.00 57.06 ? 31 PHE A CE2 1 ATOM 263 C CZ . PHE A 1 37 ? -17.702 -24.863 11.924 1.00 54.57 ? 31 PHE A CZ 1 ATOM 264 N N . ASP A 1 38 ? -11.553 -26.695 8.324 1.00 49.62 ? 32 ASP A N 1 ATOM 265 C CA . ASP A 1 38 ? -10.411 -27.131 7.538 1.00 49.97 ? 32 ASP A CA 1 ATOM 266 C C . ASP A 1 38 ? -9.334 -27.903 8.311 1.00 59.64 ? 32 ASP A C 1 ATOM 267 O O . ASP A 1 38 ? -8.601 -27.308 9.104 1.00 63.15 ? 32 ASP A O 1 ATOM 268 C CB . ASP A 1 38 ? -9.813 -25.881 6.855 1.00 50.39 ? 32 ASP A CB 1 ATOM 269 C CG . ASP A 1 38 ? -8.559 -26.131 6.066 1.00 57.77 ? 32 ASP A CG 1 ATOM 270 O OD1 . ASP A 1 38 ? -8.400 -27.241 5.559 1.00 60.14 ? 32 ASP A OD1 1 ATOM 271 O OD2 . ASP A 1 38 ? -7.747 -25.192 5.927 1.00 61.29 ? 32 ASP A OD2 1 ATOM 272 N N . THR A 1 39 ? -9.206 -29.208 8.046 1.00 53.71 ? 33 THR A N 1 ATOM 273 C CA . THR A 1 39 ? -8.195 -30.039 8.702 1.00 52.64 ? 33 THR A CA 1 ATOM 274 C C . THR A 1 39 ? -6.788 -29.777 8.152 1.00 56.27 ? 33 THR A C 1 ATOM 275 O O . THR A 1 39 ? -5.803 -30.225 8.737 1.00 55.87 ? 33 THR A O 1 ATOM 276 C CB . THR A 1 39 ? -8.526 -31.537 8.611 1.00 57.09 ? 33 THR A CB 1 ATOM 277 O OG1 . THR A 1 39 ? -8.690 -31.900 7.245 1.00 54.06 ? 33 THR A OG1 1 ATOM 278 C CG2 . THR A 1 39 ? -9.741 -31.920 9.411 1.00 53.03 ? 33 THR A CG2 1 ATOM 279 N N . GLY A 1 40 ? -6.712 -29.065 7.042 1.00 52.36 ? 34 GLY A N 1 ATOM 280 C CA . GLY A 1 40 ? -5.448 -28.713 6.417 1.00 52.06 ? 34 GLY A CA 1 ATOM 281 C C . GLY A 1 40 ? -4.749 -27.525 7.037 1.00 57.54 ? 34 GLY A C 1 ATOM 282 O O . GLY A 1 40 ? -3.640 -27.200 6.621 1.00 58.93 ? 34 GLY A O 1 ATOM 283 N N . SER A 1 41 ? -5.397 -26.840 7.989 1.00 53.28 ? 35 SER A N 1 ATOM 284 C CA . SER A 1 41 ? -4.845 -25.660 8.646 1.00 52.08 ? 35 SER A CA 1 ATOM 285 C C . SER A 1 41 ? -5.305 -25.619 10.100 1.00 58.95 ? 35 SER A C 1 ATOM 286 O O . SER A 1 41 ? -6.162 -26.401 10.515 1.00 58.59 ? 35 SER A O 1 ATOM 287 C CB . SER A 1 41 ? -5.175 -24.375 7.884 1.00 52.03 ? 35 SER A CB 1 ATOM 288 O OG . SER A 1 41 ? -6.555 -24.072 7.954 1.00 58.62 ? 35 SER A OG 1 ATOM 289 N N . SER A 1 42 ? -4.725 -24.710 10.875 1.00 56.31 ? 36 SER A N 1 ATOM 290 C CA . SER A 1 42 ? -4.918 -24.674 12.307 1.00 56.25 ? 36 SER A CA 1 ATOM 291 C C . SER A 1 42 ? -5.320 -23.329 12.895 1.00 60.29 ? 36 SER A C 1 ATOM 292 O O . SER A 1 42 ? -5.473 -23.226 14.112 1.00 60.17 ? 36 SER A O 1 ATOM 293 C CB . SER A 1 42 ? -3.643 -25.173 12.969 1.00 61.35 ? 36 SER A CB 1 ATOM 294 O OG . SER A 1 42 ? -3.208 -26.389 12.374 1.00 70.49 ? 36 SER A OG 1 ATOM 295 N N . ASN A 1 43 ? -5.527 -22.313 12.048 1.00 55.73 ? 37 ASN A N 1 ATOM 296 C CA . ASN A 1 43 ? -5.937 -20.992 12.497 1.00 54.42 ? 37 ASN A CA 1 ATOM 297 C C . ASN A 1 43 ? -7.412 -20.732 12.265 1.00 55.81 ? 37 ASN A C 1 ATOM 298 O O . ASN A 1 43 ? -7.981 -21.235 11.304 1.00 54.71 ? 37 ASN A O 1 ATOM 299 C CB . ASN A 1 43 ? -5.097 -19.892 11.835 1.00 52.08 ? 37 ASN A CB 1 ATOM 300 C CG . ASN A 1 43 ? -3.662 -19.891 12.278 1.00 67.24 ? 37 ASN A CG 1 ATOM 301 O OD1 . ASN A 1 43 ? -2.854 -20.687 11.812 1.00 69.28 ? 37 ASN A OD1 1 ATOM 302 N ND2 . ASN A 1 43 ? -3.315 -18.994 13.178 1.00 52.21 ? 37 ASN A ND2 1 ATOM 303 N N . VAL A 1 44 ? -8.023 -19.932 13.165 1.00 50.84 ? 38 VAL A N 1 ATOM 304 C CA . VAL A 1 44 ? -9.380 -19.420 13.036 1.00 48.97 ? 38 VAL A CA 1 ATOM 305 C C . VAL A 1 44 ? -9.203 -17.989 12.569 1.00 52.97 ? 38 VAL A C 1 ATOM 306 O O . VAL A 1 44 ? -8.380 -17.244 13.120 1.00 52.28 ? 38 VAL A O 1 ATOM 307 C CB . VAL A 1 44 ? -10.220 -19.451 14.332 1.00 52.01 ? 38 VAL A CB 1 ATOM 308 C CG1 . VAL A 1 44 ? -11.610 -18.859 14.108 1.00 51.65 ? 38 VAL A CG1 1 ATOM 309 C CG2 . VAL A 1 44 ? -10.341 -20.864 14.881 1.00 51.65 ? 38 VAL A CG2 1 ATOM 310 N N . TRP A 1 45 ? -9.968 -17.605 11.540 1.00 48.85 ? 39 TRP A N 1 ATOM 311 C CA . TRP A 1 45 ? -9.988 -16.229 11.057 1.00 47.00 ? 39 TRP A CA 1 ATOM 312 C C . TRP A 1 45 ? -11.326 -15.898 10.425 1.00 51.49 ? 39 TRP A C 1 ATOM 313 O O . TRP A 1 45 ? -11.977 -16.762 9.831 1.00 51.66 ? 39 TRP A O 1 ATOM 314 C CB . TRP A 1 45 ? -8.807 -15.884 10.120 1.00 43.70 ? 39 TRP A CB 1 ATOM 315 C CG . TRP A 1 45 ? -8.861 -16.546 8.770 1.00 43.65 ? 39 TRP A CG 1 ATOM 316 C CD1 . TRP A 1 45 ? -8.199 -17.675 8.395 1.00 46.42 ? 39 TRP A CD1 1 ATOM 317 C CD2 . TRP A 1 45 ? -9.563 -16.085 7.597 1.00 42.78 ? 39 TRP A CD2 1 ATOM 318 N NE1 . TRP A 1 45 ? -8.462 -17.971 7.078 1.00 45.56 ? 39 TRP A NE1 1 ATOM 319 C CE2 . TRP A 1 45 ? -9.297 -17.010 6.563 1.00 46.93 ? 39 TRP A CE2 1 ATOM 320 C CE3 . TRP A 1 45 ? -10.415 -15.003 7.329 1.00 42.76 ? 39 TRP A CE3 1 ATOM 321 C CZ2 . TRP A 1 45 ? -9.835 -16.871 5.285 1.00 45.67 ? 39 TRP A CZ2 1 ATOM 322 C CZ3 . TRP A 1 45 ? -10.945 -14.869 6.063 1.00 43.70 ? 39 TRP A CZ3 1 ATOM 323 C CH2 . TRP A 1 45 ? -10.661 -15.793 5.060 1.00 44.37 ? 39 TRP A CH2 1 ATOM 324 N N . VAL A 1 46 ? -11.718 -14.640 10.549 1.00 47.33 ? 40 VAL A N 1 ATOM 325 C CA . VAL A 1 46 ? -12.893 -14.089 9.901 1.00 47.62 ? 40 VAL A CA 1 ATOM 326 C C . VAL A 1 46 ? -12.497 -12.702 9.376 1.00 54.46 ? 40 VAL A C 1 ATOM 327 O O . VAL A 1 46 ? -11.541 -12.101 9.905 1.00 54.25 ? 40 VAL A O 1 ATOM 328 C CB . VAL A 1 46 ? -14.163 -14.026 10.800 1.00 50.65 ? 40 VAL A CB 1 ATOM 329 C CG1 . VAL A 1 46 ? -14.673 -15.421 11.145 1.00 50.00 ? 40 VAL A CG1 1 ATOM 330 C CG2 . VAL A 1 46 ? -13.938 -13.187 12.055 1.00 50.27 ? 40 VAL A CG2 1 ATOM 331 N N . PRO A 1 47 ? -13.214 -12.161 8.352 1.00 52.03 ? 41 PRO A N 1 ATOM 332 C CA . PRO A 1 47 ? -12.894 -10.792 7.897 1.00 51.27 ? 41 PRO A CA 1 ATOM 333 C C . PRO A 1 47 ? -13.205 -9.781 8.991 1.00 54.54 ? 41 PRO A C 1 ATOM 334 O O . PRO A 1 47 ? -14.102 -9.990 9.800 1.00 54.75 ? 41 PRO A O 1 ATOM 335 C CB . PRO A 1 47 ? -13.806 -10.606 6.692 1.00 52.84 ? 41 PRO A CB 1 ATOM 336 C CG . PRO A 1 47 ? -14.230 -12.017 6.291 1.00 57.36 ? 41 PRO A CG 1 ATOM 337 C CD . PRO A 1 47 ? -14.347 -12.726 7.581 1.00 53.22 ? 41 PRO A CD 1 ATOM 338 N N . SER A 1 48 ? -12.427 -8.717 9.048 1.00 52.43 ? 42 SER A N 1 ATOM 339 C CA . SER A 1 48 ? -12.530 -7.677 10.080 1.00 52.45 ? 42 SER A CA 1 ATOM 340 C C . SER A 1 48 ? -13.214 -6.437 9.575 1.00 56.63 ? 42 SER A C 1 ATOM 341 O O . SER A 1 48 ? -13.057 -6.081 8.411 1.00 56.33 ? 42 SER A O 1 ATOM 342 C CB . SER A 1 48 ? -11.129 -7.293 10.553 1.00 53.66 ? 42 SER A CB 1 ATOM 343 O OG . SER A 1 48 ? -11.168 -6.272 11.534 1.00 54.47 ? 42 SER A OG 1 ATOM 344 N N . SER A 1 49 ? -13.907 -5.728 10.468 1.00 53.28 ? 43 SER A N 1 ATOM 345 C CA . SER A 1 49 ? -14.488 -4.419 10.133 1.00 53.25 ? 43 SER A CA 1 ATOM 346 C C . SER A 1 49 ? -13.349 -3.405 9.798 1.00 56.35 ? 43 SER A C 1 ATOM 347 O O . SER A 1 49 ? -13.571 -2.418 9.105 1.00 54.58 ? 43 SER A O 1 ATOM 348 C CB . SER A 1 49 ? -15.321 -3.892 11.288 1.00 57.26 ? 43 SER A CB 1 ATOM 349 O OG . SER A 1 49 ? -14.537 -3.831 12.470 1.00 63.29 ? 43 SER A OG 1 ATOM 350 N N . LYS A 1 50 ? -12.114 -3.696 10.252 1.00 53.89 ? 44 LYS A N 1 ATOM 351 C CA . LYS A 1 50 ? -10.926 -2.896 9.968 1.00 52.61 ? 44 LYS A CA 1 ATOM 352 C C . LYS A 1 50 ? -10.404 -3.152 8.547 1.00 57.17 ? 44 LYS A C 1 ATOM 353 O O . LYS A 1 50 ? -9.440 -2.504 8.136 1.00 57.37 ? 44 LYS A O 1 ATOM 354 C CB . LYS A 1 50 ? -9.827 -3.169 10.995 1.00 53.22 ? 44 LYS A CB 1 ATOM 355 C CG . LYS A 1 50 ? -9.935 -2.348 12.260 1.00 68.83 ? 44 LYS A CG 1 ATOM 356 C CD . LYS A 1 50 ? -10.741 -3.086 13.314 1.00 97.51 ? 44 LYS A CD 1 ATOM 357 C CE . LYS A 1 50 ? -10.685 -2.469 14.696 1.00 112.81 ? 44 LYS A CE 1 ATOM 358 N NZ . LYS A 1 50 ? -11.662 -3.112 15.623 1.00 118.93 ? 44 LYS A NZ 1 ATOM 359 N N . CYS A 1 51 ? -11.018 -4.087 7.800 1.00 53.38 ? 45 CYS A N 1 ATOM 360 C CA . CYS A 1 51 ? -10.611 -4.361 6.411 1.00 53.28 ? 45 CYS A CA 1 ATOM 361 C C . CYS A 1 51 ? -11.017 -3.223 5.485 1.00 58.23 ? 45 CYS A C 1 ATOM 362 O O . CYS A 1 51 ? -12.207 -2.893 5.392 1.00 58.87 ? 45 CYS A O 1 ATOM 363 C CB . CYS A 1 51 ? -11.181 -5.693 5.917 1.00 53.16 ? 45 CYS A CB 1 ATOM 364 S SG . CYS A 1 51 ? -10.726 -6.113 4.224 1.00 56.70 ? 45 CYS A SG 1 ATOM 365 N N . SER A 1 52 ? -10.039 -2.665 4.759 1.00 54.03 ? 46 SER A N 1 ATOM 366 C CA . SER A 1 52 ? -10.283 -1.626 3.762 1.00 53.40 ? 46 SER A CA 1 ATOM 367 C C . SER A 1 52 ? -11.351 -2.104 2.763 1.00 57.43 ? 46 SER A C 1 ATOM 368 O O . SER A 1 52 ? -11.264 -3.222 2.252 1.00 57.16 ? 46 SER A O 1 ATOM 369 C CB . SER A 1 52 ? -8.998 -1.315 3.005 1.00 55.37 ? 46 SER A CB 1 ATOM 370 O OG . SER A 1 52 ? -9.276 -0.467 1.905 1.00 65.45 ? 46 SER A OG 1 ATOM 371 N N . ARG A 1 53 A -12.337 -1.259 2.475 1.00 52.87 ? 46 ARG A N 1 ATOM 372 C CA . ARG A 1 53 A -13.390 -1.604 1.536 1.00 51.54 ? 46 ARG A CA 1 ATOM 373 C C . ARG A 1 53 A -12.897 -1.574 0.084 1.00 54.23 ? 46 ARG A C 1 ATOM 374 O O . ARG A 1 53 A -13.659 -1.861 -0.837 1.00 55.70 ? 46 ARG A O 1 ATOM 375 C CB . ARG A 1 53 A -14.638 -0.746 1.767 1.00 51.64 ? 46 ARG A CB 1 ATOM 376 C CG . ARG A 1 53 A -15.165 -0.746 3.193 1.00 55.86 ? 46 ARG A CG 1 ATOM 377 C CD . ARG A 1 53 A -15.445 -2.129 3.767 1.00 55.71 ? 46 ARG A CD 1 ATOM 378 N NE . ARG A 1 53 A -15.103 -2.153 5.186 1.00 59.42 ? 46 ARG A NE 1 ATOM 379 C CZ . ARG A 1 53 A -15.961 -1.937 6.164 1.00 71.57 ? 46 ARG A CZ 1 ATOM 380 N NH1 . ARG A 1 53 A -17.243 -1.730 5.896 1.00 68.36 ? 46 ARG A NH1 1 ATOM 381 N NH2 . ARG A 1 53 A -15.556 -1.943 7.415 1.00 70.66 ? 46 ARG A NH2 1 ATOM 382 N N . LEU A 1 54 B -11.606 -1.275 -0.113 1.00 48.96 ? 46 LEU A N 1 ATOM 383 C CA . LEU A 1 54 B -10.950 -1.362 -1.422 1.00 48.65 ? 46 LEU A CA 1 ATOM 384 C C . LEU A 1 54 B -10.749 -2.849 -1.797 1.00 55.30 ? 46 LEU A C 1 ATOM 385 O O . LEU A 1 54 B -10.659 -3.182 -2.975 1.00 55.00 ? 46 LEU A O 1 ATOM 386 C CB . LEU A 1 54 B -9.665 -0.518 -1.488 1.00 46.88 ? 46 LEU A CB 1 ATOM 387 C CG . LEU A 1 54 B -9.936 1.009 -1.525 1.00 48.41 ? 46 LEU A CG 1 ATOM 388 C CD1 . LEU A 1 54 B -8.748 1.797 -1.125 1.00 49.12 ? 46 LEU A CD1 1 ATOM 389 C CD2 . LEU A 1 54 B -10.410 1.485 -2.893 1.00 43.73 ? 46 LEU A CD2 1 ATOM 390 N N . TYR A 1 55 ? -10.770 -3.748 -0.777 1.00 52.98 ? 47 TYR A N 1 ATOM 391 C CA . TYR A 1 55 ? -10.831 -5.199 -0.971 1.00 52.08 ? 47 TYR A CA 1 ATOM 392 C C . TYR A 1 55 ? -12.318 -5.514 -1.133 1.00 55.71 ? 47 TYR A C 1 ATOM 393 O O . TYR A 1 55 ? -13.093 -5.472 -0.159 1.00 52.37 ? 47 TYR A O 1 ATOM 394 C CB . TYR A 1 55 ? -10.307 -5.973 0.231 1.00 52.28 ? 47 TYR A CB 1 ATOM 395 C CG . TYR A 1 55 ? -8.832 -5.819 0.411 1.00 54.13 ? 47 TYR A CG 1 ATOM 396 C CD1 . TYR A 1 55 ? -7.937 -6.516 -0.393 1.00 55.14 ? 47 TYR A CD1 1 ATOM 397 C CD2 . TYR A 1 55 ? -8.317 -4.986 1.400 1.00 55.63 ? 47 TYR A CD2 1 ATOM 398 C CE1 . TYR A 1 55 ? -6.562 -6.368 -0.234 1.00 54.52 ? 47 TYR A CE1 1 ATOM 399 C CE2 . TYR A 1 55 ? -6.944 -4.833 1.570 1.00 56.04 ? 47 TYR A CE2 1 ATOM 400 C CZ . TYR A 1 55 ? -6.070 -5.522 0.745 1.00 60.61 ? 47 TYR A CZ 1 ATOM 401 O OH . TYR A 1 55 ? -4.711 -5.398 0.919 1.00 65.03 ? 47 TYR A OH 1 ATOM 402 N N . THR A 1 56 ? -12.721 -5.812 -2.380 1.00 53.67 ? 48 THR A N 1 ATOM 403 C CA . THR A 1 56 ? -14.119 -6.103 -2.711 1.00 52.44 ? 48 THR A CA 1 ATOM 404 C C . THR A 1 56 ? -14.646 -7.264 -1.887 1.00 56.94 ? 48 THR A C 1 ATOM 405 O O . THR A 1 56 ? -15.828 -7.272 -1.528 1.00 57.72 ? 48 THR A O 1 ATOM 406 C CB . THR A 1 56 ? -14.294 -6.248 -4.200 1.00 51.48 ? 48 THR A CB 1 ATOM 407 O OG1 . THR A 1 56 ? -13.689 -5.108 -4.806 1.00 48.42 ? 48 THR A OG1 1 ATOM 408 C CG2 . THR A 1 56 ? -15.735 -6.302 -4.615 1.00 49.27 ? 48 THR A CG2 1 ATOM 409 N N . ALA A 1 57 ? -13.760 -8.224 -1.544 1.00 52.89 ? 49 ALA A N 1 ATOM 410 C CA . ALA A 1 57 ? -14.103 -9.379 -0.704 1.00 52.04 ? 49 ALA A CA 1 ATOM 411 C C . ALA A 1 57 ? -14.630 -8.930 0.670 1.00 55.33 ? 49 ALA A C 1 ATOM 412 O O . ALA A 1 57 ? -15.488 -9.605 1.242 1.00 54.47 ? 49 ALA A O 1 ATOM 413 C CB . ALA A 1 57 ? -12.908 -10.307 -0.550 1.00 52.16 ? 49 ALA A CB 1 ATOM 414 N N . CYS A 1 58 ? -14.162 -7.772 1.160 1.00 51.72 ? 50 CYS A N 1 ATOM 415 C CA . CYS A 1 58 ? -14.606 -7.243 2.431 1.00 51.96 ? 50 CYS A CA 1 ATOM 416 C C . CYS A 1 58 ? -15.915 -6.474 2.327 1.00 59.45 ? 50 CYS A C 1 ATOM 417 O O . CYS A 1 58 ? -16.607 -6.269 3.338 1.00 62.64 ? 50 CYS A O 1 ATOM 418 C CB . CYS A 1 58 ? -13.507 -6.431 3.088 1.00 52.37 ? 50 CYS A CB 1 ATOM 419 S SG . CYS A 1 58 ? -12.127 -7.439 3.640 1.00 56.58 ? 50 CYS A SG 1 ATOM 420 N N . VAL A 1 59 ? -16.274 -6.055 1.104 1.00 51.31 ? 51 VAL A N 1 ATOM 421 C CA . VAL A 1 59 ? -17.558 -5.405 0.853 1.00 47.54 ? 51 VAL A CA 1 ATOM 422 C C . VAL A 1 59 ? -18.640 -6.501 0.846 1.00 53.62 ? 51 VAL A C 1 ATOM 423 O O . VAL A 1 59 ? -19.761 -6.285 1.332 1.00 53.75 ? 51 VAL A O 1 ATOM 424 C CB . VAL A 1 59 ? -17.557 -4.610 -0.472 1.00 47.06 ? 51 VAL A CB 1 ATOM 425 C CG1 . VAL A 1 59 ? -18.942 -4.057 -0.804 1.00 46.13 ? 51 VAL A CG1 1 ATOM 426 C CG2 . VAL A 1 59 ? -16.511 -3.498 -0.459 1.00 45.36 ? 51 VAL A CG2 1 ATOM 427 N N . TYR A 1 60 ? -18.301 -7.666 0.283 1.00 49.50 ? 52 TYR A N 1 ATOM 428 C CA . TYR A 1 60 ? -19.248 -8.765 0.098 1.00 48.62 ? 52 TYR A CA 1 ATOM 429 C C . TYR A 1 60 ? -19.379 -9.754 1.244 1.00 53.05 ? 52 TYR A C 1 ATOM 430 O O . TYR A 1 60 ? -20.405 -10.414 1.341 1.00 54.36 ? 52 TYR A O 1 ATOM 431 C CB . TYR A 1 60 ? -18.987 -9.483 -1.228 1.00 48.50 ? 52 TYR A CB 1 ATOM 432 C CG . TYR A 1 60 ? -19.525 -8.732 -2.425 1.00 51.19 ? 52 TYR A CG 1 ATOM 433 C CD1 . TYR A 1 60 ? -18.789 -7.697 -3.019 1.00 54.26 ? 52 TYR A CD1 1 ATOM 434 C CD2 . TYR A 1 60 ? -20.753 -9.063 -2.987 1.00 50.68 ? 52 TYR A CD2 1 ATOM 435 C CE1 . TYR A 1 60 ? -19.260 -7.026 -4.151 1.00 52.79 ? 52 TYR A CE1 1 ATOM 436 C CE2 . TYR A 1 60 ? -21.220 -8.416 -4.132 1.00 51.66 ? 52 TYR A CE2 1 ATOM 437 C CZ . TYR A 1 60 ? -20.472 -7.391 -4.705 1.00 58.65 ? 52 TYR A CZ 1 ATOM 438 O OH . TYR A 1 60 ? -20.922 -6.735 -5.828 1.00 60.26 ? 52 TYR A OH 1 ATOM 439 N N . HIS A 1 61 ? -18.389 -9.849 2.121 1.00 48.25 ? 53 HIS A N 1 ATOM 440 C CA . HIS A 1 61 ? -18.460 -10.802 3.225 1.00 46.72 ? 53 HIS A CA 1 ATOM 441 C C . HIS A 1 61 ? -18.830 -10.132 4.522 1.00 52.49 ? 53 HIS A C 1 ATOM 442 O O . HIS A 1 61 ? -18.802 -8.894 4.623 1.00 54.38 ? 53 HIS A O 1 ATOM 443 C CB . HIS A 1 61 ? -17.150 -11.581 3.372 1.00 45.99 ? 53 HIS A CB 1 ATOM 444 C CG . HIS A 1 61 ? -16.928 -12.568 2.273 1.00 48.38 ? 53 HIS A CG 1 ATOM 445 N ND1 . HIS A 1 61 ? -16.044 -12.306 1.261 1.00 49.86 ? 53 HIS A ND1 1 ATOM 446 C CD2 . HIS A 1 61 ? -17.476 -13.796 2.074 1.00 49.00 ? 53 HIS A CD2 1 ATOM 447 C CE1 . HIS A 1 61 ? -16.093 -13.361 0.466 1.00 48.84 ? 53 HIS A CE1 1 ATOM 448 N NE2 . HIS A 1 61 ? -16.957 -14.276 0.904 1.00 48.82 ? 53 HIS A NE2 1 ATOM 449 N N . LYS A 1 62 ? -19.208 -10.945 5.511 1.00 46.52 ? 54 LYS A N 1 ATOM 450 C CA . LYS A 1 62 ? -19.545 -10.474 6.840 1.00 45.25 ? 54 LYS A CA 1 ATOM 451 C C . LYS A 1 62 ? -18.239 -10.108 7.562 1.00 50.63 ? 54 LYS A C 1 ATOM 452 O O . LYS A 1 62 ? -17.233 -10.830 7.445 1.00 50.65 ? 54 LYS A O 1 ATOM 453 C CB . LYS A 1 62 ? -20.271 -11.565 7.596 1.00 47.18 ? 54 LYS A CB 1 ATOM 454 C CG . LYS A 1 62 ? -21.506 -11.064 8.276 1.00 79.20 ? 54 LYS A CG 1 ATOM 455 C CD . LYS A 1 62 ? -21.348 -11.064 9.783 1.00 93.16 ? 54 LYS A CD 1 ATOM 456 C CE . LYS A 1 62 ? -22.720 -10.966 10.372 1.00 101.93 ? 54 LYS A CE 1 ATOM 457 N NZ . LYS A 1 62 ? -22.716 -11.295 11.793 1.00 111.57 ? 54 LYS A NZ 1 ATOM 458 N N . LEU A 1 63 ? -18.244 -8.957 8.259 1.00 45.40 ? 55 LEU A N 1 ATOM 459 C CA . LEU A 1 63 ? -17.076 -8.458 8.948 1.00 44.22 ? 55 LEU A CA 1 ATOM 460 C C . LEU A 1 63 ? -17.277 -8.467 10.442 1.00 52.18 ? 55 LEU A C 1 ATOM 461 O O . LEU A 1 63 ? -18.347 -8.103 10.924 1.00 52.73 ? 55 LEU A O 1 ATOM 462 C CB . LEU A 1 63 ? -16.746 -7.044 8.464 1.00 43.58 ? 55 LEU A CB 1 ATOM 463 C CG . LEU A 1 63 ? -16.707 -6.767 6.955 1.00 47.54 ? 55 LEU A CG 1 ATOM 464 C CD1 . LEU A 1 63 ? -16.305 -5.320 6.704 1.00 48.14 ? 55 LEU A CD1 1 ATOM 465 C CD2 . LEU A 1 63 ? -15.710 -7.650 6.224 1.00 45.51 ? 55 LEU A CD2 1 ATOM 466 N N . PHE A 1 64 ? -16.257 -8.894 11.186 1.00 52.02 ? 56 PHE A N 1 ATOM 467 C CA . PHE A 1 64 ? -16.287 -8.865 12.653 1.00 51.89 ? 56 PHE A CA 1 ATOM 468 C C . PHE A 1 64 ? -16.019 -7.461 13.161 1.00 55.48 ? 56 PHE A C 1 ATOM 469 O O . PHE A 1 64 ? -14.978 -6.875 12.847 1.00 56.54 ? 56 PHE A O 1 ATOM 470 C CB . PHE A 1 64 ? -15.282 -9.865 13.269 1.00 53.38 ? 56 PHE A CB 1 ATOM 471 C CG . PHE A 1 64 ? -15.283 -9.852 14.777 1.00 55.15 ? 56 PHE A CG 1 ATOM 472 C CD1 . PHE A 1 64 ? -16.365 -10.356 15.494 1.00 57.45 ? 56 PHE A CD1 1 ATOM 473 C CD2 . PHE A 1 64 ? -14.213 -9.308 15.489 1.00 57.72 ? 56 PHE A CD2 1 ATOM 474 C CE1 . PHE A 1 64 ? -16.375 -10.326 16.889 1.00 57.97 ? 56 PHE A CE1 1 ATOM 475 C CE2 . PHE A 1 64 ? -14.227 -9.275 16.896 1.00 59.75 ? 56 PHE A CE2 1 ATOM 476 C CZ . PHE A 1 64 ? -15.307 -9.783 17.580 1.00 57.12 ? 56 PHE A CZ 1 ATOM 477 N N . ASP A 1 65 ? -16.945 -6.926 13.940 1.00 52.72 ? 57 ASP A N 1 ATOM 478 C CA . ASP A 1 65 ? -16.773 -5.600 14.555 1.00 54.18 ? 57 ASP A CA 1 ATOM 479 C C . ASP A 1 65 ? -16.529 -5.769 16.059 1.00 57.72 ? 57 ASP A C 1 ATOM 480 O O . ASP A 1 65 ? -17.485 -6.035 16.813 1.00 56.20 ? 57 ASP A O 1 ATOM 481 C CB . ASP A 1 65 ? -17.980 -4.670 14.298 1.00 56.58 ? 57 ASP A CB 1 ATOM 482 C CG . ASP A 1 65 ? -17.672 -3.186 14.462 1.00 69.19 ? 57 ASP A CG 1 ATOM 483 O OD1 . ASP A 1 65 ? -16.787 -2.841 15.277 1.00 70.28 ? 57 ASP A OD1 1 ATOM 484 O OD2 . ASP A 1 65 ? -18.318 -2.370 13.781 1.00 76.46 ? 57 ASP A OD2 1 ATOM 485 N N . ALA A 1 66 ? -15.243 -5.633 16.482 1.00 52.62 ? 58 ALA A N 1 ATOM 486 C CA . ALA A 1 66 ? -14.844 -5.770 17.885 1.00 52.91 ? 58 ALA A CA 1 ATOM 487 C C . ALA A 1 66 ? -15.574 -4.772 18.786 1.00 61.78 ? 58 ALA A C 1 ATOM 488 O O . ALA A 1 66 ? -15.896 -5.114 19.921 1.00 64.72 ? 58 ALA A O 1 ATOM 489 C CB . ALA A 1 66 ? -13.357 -5.609 18.038 1.00 53.09 ? 58 ALA A CB 1 ATOM 490 N N . SER A 1 67 ? -15.913 -3.580 18.228 1.00 57.71 ? 59 SER A N 1 ATOM 491 C CA . SER A 1 67 ? -16.611 -2.477 18.897 1.00 57.04 ? 59 SER A CA 1 ATOM 492 C C . SER A 1 67 ? -18.048 -2.827 19.272 1.00 59.23 ? 59 SER A C 1 ATOM 493 O O . SER A 1 67 ? -18.710 -2.039 19.948 1.00 60.36 ? 59 SER A O 1 ATOM 494 C CB . SER A 1 67 ? -16.651 -1.235 18.009 1.00 60.60 ? 59 SER A CB 1 ATOM 495 O OG . SER A 1 67 ? -15.356 -0.831 17.602 1.00 79.00 ? 59 SER A OG 1 ATOM 496 N N . ASP A 1 68 ? -18.552 -3.952 18.820 1.00 52.21 ? 60 ASP A N 1 ATOM 497 C CA . ASP A 1 68 ? -19.929 -4.346 19.097 1.00 51.53 ? 60 ASP A CA 1 ATOM 498 C C . ASP A 1 68 ? -19.935 -5.523 20.028 1.00 57.97 ? 60 ASP A C 1 ATOM 499 O O . ASP A 1 68 ? -21.010 -6.023 20.352 1.00 57.51 ? 60 ASP A O 1 ATOM 500 C CB . ASP A 1 68 ? -20.671 -4.690 17.792 1.00 52.44 ? 60 ASP A CB 1 ATOM 501 C CG . ASP A 1 68 ? -20.915 -3.494 16.889 1.00 63.58 ? 60 ASP A CG 1 ATOM 502 O OD1 . ASP A 1 68 ? -21.038 -2.361 17.417 1.00 63.32 ? 60 ASP A OD1 1 ATOM 503 O OD2 . ASP A 1 68 ? -21.124 -3.697 15.678 1.00 73.65 ? 60 ASP A OD2 1 ATOM 504 N N . SER A 1 69 ? -18.743 -5.990 20.453 1.00 56.00 ? 61 SER A N 1 ATOM 505 C CA . SER A 1 69 ? -18.636 -7.141 21.346 1.00 56.67 ? 61 SER A CA 1 ATOM 506 C C . SER A 1 69 ? -18.116 -6.765 22.749 1.00 64.54 ? 61 SER A C 1 ATOM 507 O O . SER A 1 69 ? -17.000 -6.237 22.903 1.00 63.72 ? 61 SER A O 1 ATOM 508 C CB . SER A 1 69 ? -17.798 -8.247 20.723 1.00 55.94 ? 61 SER A CB 1 ATOM 509 O OG . SER A 1 69 ? -17.586 -9.280 21.668 1.00 63.41 ? 61 SER A OG 1 ATOM 510 N N . SER A 1 70 ? -18.930 -7.076 23.772 1.00 62.75 ? 62 SER A N 1 ATOM 511 C CA . SER A 1 70 ? -18.574 -6.797 25.170 1.00 62.19 ? 62 SER A CA 1 ATOM 512 C C . SER A 1 70 ? -17.603 -7.831 25.755 1.00 66.61 ? 62 SER A C 1 ATOM 513 O O . SER A 1 70 ? -17.044 -7.590 26.827 1.00 68.64 ? 62 SER A O 1 ATOM 514 C CB . SER A 1 70 ? -19.816 -6.664 26.041 1.00 61.44 ? 62 SER A CB 1 ATOM 515 O OG . SER A 1 70 ? -20.610 -7.831 25.957 1.00 67.81 ? 62 SER A OG 1 ATOM 516 N N . SER A 1 71 ? -17.395 -8.966 25.057 1.00 58.85 ? 63 SER A N 1 ATOM 517 C CA . SER A 1 71 ? -16.490 -10.008 25.520 1.00 57.02 ? 63 SER A CA 1 ATOM 518 C C . SER A 1 71 ? -15.134 -10.013 24.810 1.00 61.75 ? 63 SER A C 1 ATOM 519 O O . SER A 1 71 ? -14.270 -10.839 25.108 1.00 63.41 ? 63 SER A O 1 ATOM 520 C CB . SER A 1 71 ? -17.161 -11.372 25.448 1.00 59.76 ? 63 SER A CB 1 ATOM 521 O OG . SER A 1 71 ? -17.769 -11.601 24.193 1.00 71.21 ? 63 SER A OG 1 ATOM 522 N N . TYR A 1 72 ? -14.932 -9.080 23.896 1.00 57.67 ? 64 TYR A N 1 ATOM 523 C CA . TYR A 1 72 ? -13.691 -8.949 23.143 1.00 57.48 ? 64 TYR A CA 1 ATOM 524 C C . TYR A 1 72 ? -12.506 -8.586 24.017 1.00 62.83 ? 64 TYR A C 1 ATOM 525 O O . TYR A 1 72 ? -12.616 -7.731 24.895 1.00 63.00 ? 64 TYR A O 1 ATOM 526 C CB . TYR A 1 72 ? -13.886 -7.898 22.027 1.00 58.02 ? 64 TYR A CB 1 ATOM 527 C CG . TYR A 1 72 ? -12.626 -7.335 21.417 1.00 57.44 ? 64 TYR A CG 1 ATOM 528 C CD1 . TYR A 1 72 ? -12.167 -6.075 21.770 1.00 58.89 ? 64 TYR A CD1 1 ATOM 529 C CD2 . TYR A 1 72 ? -11.932 -8.035 20.427 1.00 57.80 ? 64 TYR A CD2 1 ATOM 530 C CE1 . TYR A 1 72 ? -11.033 -5.527 21.178 1.00 60.12 ? 64 TYR A CE1 1 ATOM 531 C CE2 . TYR A 1 72 ? -10.799 -7.496 19.820 1.00 58.56 ? 64 TYR A CE2 1 ATOM 532 C CZ . TYR A 1 72 ? -10.354 -6.239 20.197 1.00 66.95 ? 64 TYR A CZ 1 ATOM 533 O OH . TYR A 1 72 ? -9.247 -5.694 19.588 1.00 66.43 ? 64 TYR A OH 1 ATOM 534 N N . LYS A 1 73 ? -11.364 -9.230 23.756 1.00 60.45 ? 65 LYS A N 1 ATOM 535 C CA . LYS A 1 73 ? -10.086 -8.922 24.398 1.00 59.82 ? 65 LYS A CA 1 ATOM 536 C C . LYS A 1 73 ? -9.041 -8.681 23.303 1.00 63.48 ? 65 LYS A C 1 ATOM 537 O O . LYS A 1 73 ? -8.777 -9.557 22.474 1.00 62.14 ? 65 LYS A O 1 ATOM 538 C CB . LYS A 1 73 ? -9.645 -10.005 25.393 1.00 61.63 ? 65 LYS A CB 1 ATOM 539 C CG . LYS A 1 73 ? -10.650 -10.230 26.528 1.00 84.70 ? 65 LYS A CG 1 ATOM 540 C CD . LYS A 1 73 ? -10.098 -10.963 27.745 1.00 94.32 ? 65 LYS A CD 1 ATOM 541 C CE . LYS A 1 73 ? -11.199 -11.298 28.737 1.00 100.23 ? 65 LYS A CE 1 ATOM 542 N NZ . LYS A 1 73 ? -10.697 -11.973 29.958 1.00 113.44 ? 65 LYS A NZ 1 ATOM 543 N N . HIS A 1 74 ? -8.498 -7.476 23.277 1.00 61.05 ? 66 HIS A N 1 ATOM 544 C CA . HIS A 1 74 ? -7.506 -7.032 22.323 1.00 63.07 ? 66 HIS A CA 1 ATOM 545 C C . HIS A 1 74 ? -6.216 -7.852 22.384 1.00 69.42 ? 66 HIS A C 1 ATOM 546 O O . HIS A 1 74 ? -5.844 -8.363 23.437 1.00 73.54 ? 66 HIS A O 1 ATOM 547 C CB . HIS A 1 74 ? -7.201 -5.552 22.593 1.00 65.23 ? 66 HIS A CB 1 ATOM 548 C CG . HIS A 1 74 ? -6.119 -4.972 21.745 1.00 71.18 ? 66 HIS A CG 1 ATOM 549 N ND1 . HIS A 1 74 ? -4.822 -4.850 22.221 1.00 74.69 ? 66 HIS A ND1 1 ATOM 550 C CD2 . HIS A 1 74 ? -6.165 -4.512 20.468 1.00 75.44 ? 66 HIS A CD2 1 ATOM 551 C CE1 . HIS A 1 74 ? -4.124 -4.297 21.235 1.00 75.20 ? 66 HIS A CE1 1 ATOM 552 N NE2 . HIS A 1 74 ? -4.890 -4.075 20.155 1.00 75.92 ? 66 HIS A NE2 1 ATOM 553 N N . ASN A 1 75 ? -5.546 -7.987 21.251 1.00 62.19 ? 67 ASN A N 1 ATOM 554 C CA . ASN A 1 75 ? -4.216 -8.564 21.160 1.00 60.62 ? 67 ASN A CA 1 ATOM 555 C C . ASN A 1 75 ? -3.397 -7.721 20.172 1.00 64.05 ? 67 ASN A C 1 ATOM 556 O O . ASN A 1 75 ? -2.467 -7.049 20.583 1.00 64.95 ? 67 ASN A O 1 ATOM 557 C CB . ASN A 1 75 ? -4.218 -10.052 20.846 1.00 58.16 ? 67 ASN A CB 1 ATOM 558 C CG . ASN A 1 75 ? -2.855 -10.641 20.958 1.00 86.24 ? 67 ASN A CG 1 ATOM 559 O OD1 . ASN A 1 75 ? -2.082 -10.610 20.007 1.00 74.30 ? 67 ASN A OD1 1 ATOM 560 N ND2 . ASN A 1 75 ? -2.529 -11.166 22.126 1.00 92.87 ? 67 ASN A ND2 1 ATOM 561 N N . GLY A 1 76 ? -3.780 -7.707 18.902 1.00 58.55 ? 68 GLY A N 1 ATOM 562 C CA . GLY A 1 76 ? -3.144 -6.857 17.919 1.00 57.29 ? 68 GLY A CA 1 ATOM 563 C C . GLY A 1 76 ? -1.910 -7.382 17.229 1.00 62.92 ? 68 GLY A C 1 ATOM 564 O O . GLY A 1 76 ? -1.379 -6.695 16.355 1.00 63.31 ? 68 GLY A O 1 ATOM 565 N N . THR A 1 77 ? -1.432 -8.582 17.595 1.00 60.89 ? 69 THR A N 1 ATOM 566 C CA . THR A 1 77 ? -0.266 -9.188 16.920 1.00 61.19 ? 69 THR A CA 1 ATOM 567 C C . THR A 1 77 ? -0.596 -9.443 15.439 1.00 65.46 ? 69 THR A C 1 ATOM 568 O O . THR A 1 77 ? -1.593 -10.115 15.117 1.00 63.43 ? 69 THR A O 1 ATOM 569 C CB . THR A 1 77 ? 0.166 -10.502 17.600 1.00 66.43 ? 69 THR A CB 1 ATOM 570 O OG1 . THR A 1 77 ? 0.466 -10.256 18.970 1.00 63.13 ? 69 THR A OG1 1 ATOM 571 C CG2 . THR A 1 77 ? 1.357 -11.139 16.922 1.00 62.02 ? 69 THR A CG2 1 ATOM 572 N N . GLU A 1 78 ? 0.251 -8.903 14.552 1.00 62.71 ? 70 GLU A N 1 ATOM 573 C CA . GLU A 1 78 ? 0.046 -9.058 13.118 1.00 62.88 ? 70 GLU A CA 1 ATOM 574 C C . GLU A 1 78 ? 0.323 -10.452 12.654 1.00 68.20 ? 70 GLU A C 1 ATOM 575 O O . GLU A 1 78 ? 1.236 -11.078 13.150 1.00 69.14 ? 70 GLU A O 1 ATOM 576 C CB . GLU A 1 78 ? 0.841 -8.025 12.326 1.00 64.63 ? 70 GLU A CB 1 ATOM 577 C CG . GLU A 1 78 ? 0.177 -6.649 12.392 1.00 83.67 ? 70 GLU A CG 1 ATOM 578 C CD . GLU A 1 78 ? 0.877 -5.472 11.738 1.00 120.73 ? 70 GLU A CD 1 ATOM 579 O OE1 . GLU A 1 78 ? 1.987 -5.654 11.184 1.00 128.17 ? 70 GLU A OE1 1 ATOM 580 O OE2 . GLU A 1 78 ? 0.311 -4.356 11.797 1.00 116.26 ? 70 GLU A OE2 1 ATOM 581 N N . LEU A 1 79 ? -0.455 -10.966 11.725 1.00 66.39 ? 71 LEU A N 1 ATOM 582 C CA . LEU A 1 79 ? -0.184 -12.296 11.184 1.00 66.13 ? 71 LEU A CA 1 ATOM 583 C C . LEU A 1 79 ? -0.658 -12.413 9.752 1.00 65.24 ? 71 LEU A C 1 ATOM 584 O O . LEU A 1 79 ? -1.590 -11.728 9.313 1.00 64.97 ? 71 LEU A O 1 ATOM 585 C CB . LEU A 1 79 ? -0.698 -13.445 12.076 1.00 67.15 ? 71 LEU A CB 1 ATOM 586 C CG . LEU A 1 79 ? -2.163 -13.851 11.887 1.00 74.59 ? 71 LEU A CG 1 ATOM 587 C CD1 . LEU A 1 79 ? -2.419 -15.185 12.537 1.00 76.18 ? 71 LEU A CD1 1 ATOM 588 C CD2 . LEU A 1 79 ? -3.149 -12.777 12.384 1.00 76.44 ? 71 LEU A CD2 1 ATOM 589 N N . THR A 1 80 ? 0.016 -13.275 9.032 1.00 58.46 ? 72 THR A N 1 ATOM 590 C CA . THR A 1 80 ? -0.230 -13.543 7.636 1.00 56.54 ? 72 THR A CA 1 ATOM 591 C C . THR A 1 80 ? -0.397 -15.022 7.504 1.00 59.19 ? 72 THR A C 1 ATOM 592 O O . THR A 1 80 ? 0.429 -15.780 8.017 1.00 62.03 ? 72 THR A O 1 ATOM 593 C CB . THR A 1 80 ? 0.907 -12.984 6.780 1.00 60.16 ? 72 THR A CB 1 ATOM 594 O OG1 . THR A 1 80 ? 0.928 -11.554 6.919 1.00 60.91 ? 72 THR A OG1 1 ATOM 595 C CG2 . THR A 1 80 ? 0.758 -13.344 5.308 1.00 57.21 ? 72 THR A CG2 1 ATOM 596 N N . LEU A 1 81 ? -1.486 -15.434 6.846 1.00 51.69 ? 73 LEU A N 1 ATOM 597 C CA . LEU A 1 81 ? -1.799 -16.841 6.613 1.00 49.49 ? 73 LEU A CA 1 ATOM 598 C C . LEU A 1 81 ? -1.705 -17.096 5.107 1.00 52.31 ? 73 LEU A C 1 ATOM 599 O O . LEU A 1 81 ? -2.485 -16.565 4.326 1.00 50.40 ? 73 LEU A O 1 ATOM 600 C CB . LEU A 1 81 ? -3.192 -17.214 7.179 1.00 48.18 ? 73 LEU A CB 1 ATOM 601 C CG . LEU A 1 81 ? -3.513 -16.798 8.609 1.00 49.15 ? 73 LEU A CG 1 ATOM 602 C CD1 . LEU A 1 81 ? -4.975 -16.981 8.911 1.00 46.99 ? 73 LEU A CD1 1 ATOM 603 C CD2 . LEU A 1 81 ? -2.701 -17.574 9.563 1.00 50.36 ? 73 LEU A CD2 1 ATOM 604 N N . ARG A 1 82 ? -0.714 -17.893 4.697 1.00 50.42 ? 74 ARG A N 1 ATOM 605 C CA . ARG A 1 82 ? -0.471 -18.232 3.288 1.00 49.08 ? 74 ARG A CA 1 ATOM 606 C C . ARG A 1 82 ? -1.021 -19.584 2.944 1.00 52.31 ? 74 ARG A C 1 ATOM 607 O O . ARG A 1 82 ? -0.441 -20.569 3.332 1.00 53.37 ? 74 ARG A O 1 ATOM 608 C CB . ARG A 1 82 ? 1.036 -18.154 2.952 1.00 44.97 ? 74 ARG A CB 1 ATOM 609 C CG . ARG A 1 82 ? 1.609 -16.725 3.062 1.00 47.60 ? 74 ARG A CG 1 ATOM 610 C CD . ARG A 1 82 ? 3.110 -16.647 2.809 1.00 63.57 ? 74 ARG A CD 1 ATOM 611 N NE . ARG A 1 82 ? 3.687 -15.386 3.289 1.00 80.56 ? 74 ARG A NE 1 ATOM 612 C CZ . ARG A 1 82 ? 3.980 -15.122 4.564 1.00 97.93 ? 74 ARG A CZ 1 ATOM 613 N NH1 . ARG A 1 82 ? 3.748 -16.029 5.510 1.00 90.69 ? 74 ARG A NH1 1 ATOM 614 N NH2 . ARG A 1 82 ? 4.489 -13.945 4.906 1.00 81.16 ? 74 ARG A NH2 1 ATOM 615 N N . TYR A 1 83 ? -2.130 -19.639 2.220 1.00 49.06 ? 75 TYR A N 1 ATOM 616 C CA . TYR A 1 83 ? -2.763 -20.883 1.794 1.00 47.45 ? 75 TYR A CA 1 ATOM 617 C C . TYR A 1 83 ? -2.406 -21.208 0.372 1.00 49.50 ? 75 TYR A C 1 ATOM 618 O O . TYR A 1 83 ? -1.858 -20.369 -0.323 1.00 48.88 ? 75 TYR A O 1 ATOM 619 C CB . TYR A 1 83 ? -4.292 -20.757 1.902 1.00 48.18 ? 75 TYR A CB 1 ATOM 620 C CG . TYR A 1 83 ? -4.785 -20.514 3.303 1.00 47.82 ? 75 TYR A CG 1 ATOM 621 C CD1 . TYR A 1 83 ? -4.886 -21.556 4.221 1.00 49.49 ? 75 TYR A CD1 1 ATOM 622 C CD2 . TYR A 1 83 ? -5.170 -19.252 3.710 1.00 48.58 ? 75 TYR A CD2 1 ATOM 623 C CE1 . TYR A 1 83 ? -5.376 -21.342 5.509 1.00 49.63 ? 75 TYR A CE1 1 ATOM 624 C CE2 . TYR A 1 83 ? -5.656 -19.023 4.996 1.00 49.08 ? 75 TYR A CE2 1 ATOM 625 C CZ . TYR A 1 83 ? -5.778 -20.076 5.886 1.00 54.49 ? 75 TYR A CZ 1 ATOM 626 O OH . TYR A 1 83 ? -6.276 -19.864 7.148 1.00 54.77 ? 75 TYR A OH 1 ATOM 627 N N . SER A 1 84 ? -2.771 -22.418 -0.080 1.00 46.88 ? 76 SER A N 1 ATOM 628 C CA . SER A 1 84 ? -2.518 -22.883 -1.443 1.00 46.74 ? 76 SER A CA 1 ATOM 629 C C . SER A 1 84 ? -3.192 -22.014 -2.489 1.00 49.00 ? 76 SER A C 1 ATOM 630 O O . SER A 1 84 ? -2.654 -21.829 -3.574 1.00 47.03 ? 76 SER A O 1 ATOM 631 C CB . SER A 1 84 ? -2.998 -24.323 -1.605 1.00 52.08 ? 76 SER A CB 1 ATOM 632 O OG . SER A 1 84 ? -2.141 -25.141 -0.837 1.00 71.84 ? 76 SER A OG 1 ATOM 633 N N . THR A 1 85 ? -4.372 -21.477 -2.156 1.00 46.56 ? 77 THR A N 1 ATOM 634 C CA . THR A 1 85 ? -5.150 -20.727 -3.133 1.00 45.91 ? 77 THR A CA 1 ATOM 635 C C . THR A 1 85 ? -5.060 -19.210 -2.974 1.00 50.01 ? 77 THR A C 1 ATOM 636 O O . THR A 1 85 ? -5.559 -18.482 -3.835 1.00 50.86 ? 77 THR A O 1 ATOM 637 C CB . THR A 1 85 ? -6.591 -21.215 -3.117 1.00 48.54 ? 77 THR A CB 1 ATOM 638 O OG1 . THR A 1 85 ? -7.109 -21.053 -1.795 1.00 51.37 ? 77 THR A OG1 1 ATOM 639 C CG2 . THR A 1 85 ? -6.716 -22.656 -3.533 1.00 45.02 ? 77 THR A CG2 1 ATOM 640 N N . GLY A 1 86 ? -4.441 -18.740 -1.900 1.00 44.71 ? 78 GLY A N 1 ATOM 641 C CA . GLY A 1 86 ? -4.364 -17.316 -1.662 1.00 45.07 ? 78 GLY A CA 1 ATOM 642 C C . GLY A 1 86 ? -3.823 -16.997 -0.298 1.00 52.51 ? 78 GLY A C 1 ATOM 643 O O . GLY A 1 86 ? -3.464 -17.893 0.466 1.00 54.72 ? 78 GLY A O 1 ATOM 644 N N . THR A 1 87 ? -3.765 -15.704 0.019 1.00 49.03 ? 79 THR A N 1 ATOM 645 C CA . THR A 1 87 ? -3.193 -15.247 1.286 1.00 48.77 ? 79 THR A CA 1 ATOM 646 C C . THR A 1 87 ? -4.115 -14.282 1.986 1.00 50.82 ? 79 THR A C 1 ATOM 647 O O . THR A 1 87 ? -4.764 -13.496 1.332 1.00 51.39 ? 79 THR A O 1 ATOM 648 C CB . THR A 1 87 ? -1.818 -14.583 1.005 1.00 53.55 ? 79 THR A CB 1 ATOM 649 O OG1 . THR A 1 87 ? -0.996 -15.481 0.254 1.00 51.52 ? 79 THR A OG1 1 ATOM 650 C CG2 . THR A 1 87 ? -1.078 -14.165 2.272 1.00 51.51 ? 79 THR A CG2 1 ATOM 651 N N . VAL A 1 88 ? -4.179 -14.353 3.299 1.00 46.42 ? 80 VAL A N 1 ATOM 652 C CA . VAL A 1 88 ? -4.904 -13.403 4.117 1.00 47.33 ? 80 VAL A CA 1 ATOM 653 C C . VAL A 1 88 ? -3.970 -12.816 5.152 1.00 51.94 ? 80 VAL A C 1 ATOM 654 O O . VAL A 1 88 ? -3.079 -13.498 5.661 1.00 50.24 ? 80 VAL A O 1 ATOM 655 C CB . VAL A 1 88 ? -6.203 -13.904 4.779 1.00 52.10 ? 80 VAL A CB 1 ATOM 656 C CG1 . VAL A 1 88 ? -7.326 -14.071 3.763 1.00 51.42 ? 80 VAL A CG1 1 ATOM 657 C CG2 . VAL A 1 88 ? -5.976 -15.181 5.574 1.00 52.01 ? 80 VAL A CG2 1 ATOM 658 N N . SER A 1 89 ? -4.188 -11.551 5.475 1.00 50.81 ? 81 SER A N 1 ATOM 659 C CA . SER A 1 89 ? -3.382 -10.898 6.491 1.00 51.64 ? 81 SER A CA 1 ATOM 660 C C . SER A 1 89 ? -4.250 -10.006 7.396 1.00 54.28 ? 81 SER A C 1 ATOM 661 O O . SER A 1 89 ? -5.274 -9.462 6.965 1.00 53.92 ? 81 SER A O 1 ATOM 662 C CB . SER A 1 89 ? -2.236 -10.119 5.857 1.00 57.14 ? 81 SER A CB 1 ATOM 663 O OG . SER A 1 89 ? -1.363 -9.626 6.862 1.00 73.40 ? 81 SER A OG 1 ATOM 664 N N . GLY A 1 90 ? -3.847 -9.909 8.650 1.00 49.34 ? 82 GLY A N 1 ATOM 665 C CA . GLY A 1 90 ? -4.580 -9.146 9.644 1.00 49.16 ? 82 GLY A CA 1 ATOM 666 C C . GLY A 1 90 ? -3.923 -9.227 10.991 1.00 53.48 ? 82 GLY A C 1 ATOM 667 O O . GLY A 1 90 ? -2.700 -9.212 11.060 1.00 54.59 ? 82 GLY A O 1 ATOM 668 N N . PHE A 1 91 ? -4.715 -9.325 12.057 1.00 50.85 ? 83 PHE A N 1 ATOM 669 C CA . PHE A 1 91 ? -4.204 -9.296 13.436 1.00 52.03 ? 83 PHE A CA 1 ATOM 670 C C . PHE A 1 91 ? -5.016 -10.160 14.367 1.00 60.34 ? 83 PHE A C 1 ATOM 671 O O . PHE A 1 91 ? -6.204 -10.412 14.121 1.00 60.33 ? 83 PHE A O 1 ATOM 672 C CB . PHE A 1 91 ? -4.130 -7.854 13.985 1.00 53.24 ? 83 PHE A CB 1 ATOM 673 C CG . PHE A 1 91 ? -5.457 -7.159 14.050 1.00 55.54 ? 83 PHE A CG 1 ATOM 674 C CD1 . PHE A 1 91 ? -6.258 -7.267 15.179 1.00 59.58 ? 83 PHE A CD1 1 ATOM 675 C CD2 . PHE A 1 91 ? -5.932 -6.430 12.965 1.00 58.70 ? 83 PHE A CD2 1 ATOM 676 C CE1 . PHE A 1 91 ? -7.504 -6.650 15.232 1.00 60.80 ? 83 PHE A CE1 1 ATOM 677 C CE2 . PHE A 1 91 ? -7.190 -5.823 13.009 1.00 61.67 ? 83 PHE A CE2 1 ATOM 678 C CZ . PHE A 1 91 ? -7.960 -5.924 14.148 1.00 60.23 ? 83 PHE A CZ 1 ATOM 679 N N . LEU A 1 92 ? -4.376 -10.595 15.459 1.00 57.79 ? 84 LEU A N 1 ATOM 680 C CA . LEU A 1 92 ? -4.996 -11.482 16.441 1.00 56.15 ? 84 LEU A CA 1 ATOM 681 C C . LEU A 1 92 ? -5.931 -10.765 17.415 1.00 57.80 ? 84 LEU A C 1 ATOM 682 O O . LEU A 1 92 ? -5.666 -9.629 17.824 1.00 56.98 ? 84 LEU A O 1 ATOM 683 C CB . LEU A 1 92 ? -3.907 -12.228 17.223 1.00 55.52 ? 84 LEU A CB 1 ATOM 684 C CG . LEU A 1 92 ? -3.150 -13.333 16.509 1.00 58.72 ? 84 LEU A CG 1 ATOM 685 C CD1 . LEU A 1 92 ? -2.065 -13.873 17.412 1.00 58.19 ? 84 LEU A CD1 1 ATOM 686 C CD2 . LEU A 1 92 ? -4.096 -14.466 16.065 1.00 60.99 ? 84 LEU A CD2 1 ATOM 687 N N . SER A 1 93 ? -7.012 -11.441 17.784 1.00 52.21 ? 85 SER A N 1 ATOM 688 C CA . SER A 1 93 ? -7.981 -10.954 18.760 1.00 52.67 ? 85 SER A CA 1 ATOM 689 C C . SER A 1 93 ? -8.502 -12.154 19.553 1.00 59.41 ? 85 SER A C 1 ATOM 690 O O . SER A 1 93 ? -8.376 -13.301 19.115 1.00 57.64 ? 85 SER A O 1 ATOM 691 C CB . SER A 1 93 ? -9.159 -10.245 18.085 1.00 55.77 ? 85 SER A CB 1 ATOM 692 O OG . SER A 1 93 ? -8.750 -9.095 17.364 1.00 63.78 ? 85 SER A OG 1 ATOM 693 N N . GLN A 1 94 ? -9.108 -11.885 20.709 1.00 58.50 ? 86 GLN A N 1 ATOM 694 C CA . GLN A 1 94 ? -9.694 -12.933 21.508 1.00 59.87 ? 86 GLN A CA 1 ATOM 695 C C . GLN A 1 94 ? -11.151 -12.615 21.786 1.00 63.10 ? 86 GLN A C 1 ATOM 696 O O . GLN A 1 94 ? -11.496 -11.469 22.077 1.00 62.88 ? 86 GLN A O 1 ATOM 697 C CB . GLN A 1 94 ? -8.909 -13.124 22.809 1.00 62.64 ? 86 GLN A CB 1 ATOM 698 C CG . GLN A 1 94 ? -9.351 -14.341 23.608 1.00 81.14 ? 86 GLN A CG 1 ATOM 699 C CD . GLN A 1 94 ? -8.691 -14.386 24.948 1.00 95.06 ? 86 GLN A CD 1 ATOM 700 O OE1 . GLN A 1 94 ? -7.555 -14.816 25.086 1.00 89.52 ? 86 GLN A OE1 1 ATOM 701 N NE2 . GLN A 1 94 ? -9.390 -13.920 25.956 1.00 91.96 ? 86 GLN A NE2 1 ATOM 702 N N . ASP A 1 95 ? -12.012 -13.627 21.685 1.00 58.03 ? 87 ASP A N 1 ATOM 703 C CA . ASP A 1 95 ? -13.435 -13.481 21.981 1.00 56.91 ? 87 ASP A CA 1 ATOM 704 C C . ASP A 1 95 ? -14.070 -14.837 22.146 1.00 62.08 ? 87 ASP A C 1 ATOM 705 O O . ASP A 1 95 ? -13.419 -15.866 21.945 1.00 63.74 ? 87 ASP A O 1 ATOM 706 C CB . ASP A 1 95 ? -14.167 -12.666 20.902 1.00 58.51 ? 87 ASP A CB 1 ATOM 707 C CG . ASP A 1 95 ? -15.311 -11.815 21.439 1.00 66.31 ? 87 ASP A CG 1 ATOM 708 O OD1 . ASP A 1 95 ? -16.001 -12.265 22.379 1.00 67.73 ? 87 ASP A OD1 1 ATOM 709 O OD2 . ASP A 1 95 ? -15.535 -10.721 20.901 1.00 66.24 ? 87 ASP A OD2 1 ATOM 710 N N . ILE A 1 96 ? -15.326 -14.850 22.551 1.00 58.16 ? 88 ILE A N 1 ATOM 711 C CA . ILE A 1 96 ? -16.059 -16.090 22.726 1.00 59.50 ? 88 ILE A CA 1 ATOM 712 C C . ILE A 1 96 ? -16.596 -16.560 21.371 1.00 63.73 ? 88 ILE A C 1 ATOM 713 O O . ILE A 1 96 ? -17.237 -15.779 20.645 1.00 65.20 ? 88 ILE A O 1 ATOM 714 C CB . ILE A 1 96 ? -17.208 -15.905 23.766 1.00 63.52 ? 88 ILE A CB 1 ATOM 715 C CG1 . ILE A 1 96 ? -16.657 -15.457 25.129 1.00 63.90 ? 88 ILE A CG1 1 ATOM 716 C CG2 . ILE A 1 96 ? -18.014 -17.191 23.914 1.00 65.12 ? 88 ILE A CG2 1 ATOM 717 C CD1 . ILE A 1 96 ? -17.716 -14.884 26.051 1.00 72.21 ? 88 ILE A CD1 1 ATOM 718 N N . ILE A 1 97 ? -16.362 -17.838 21.049 1.00 57.07 ? 89 ILE A N 1 ATOM 719 C CA . ILE A 1 97 ? -16.859 -18.449 19.819 1.00 55.11 ? 89 ILE A CA 1 ATOM 720 C C . ILE A 1 97 ? -17.846 -19.574 20.141 1.00 62.54 ? 89 ILE A C 1 ATOM 721 O O . ILE A 1 97 ? -17.525 -20.465 20.931 1.00 61.99 ? 89 ILE A O 1 ATOM 722 C CB . ILE A 1 97 ? -15.709 -18.919 18.865 1.00 54.64 ? 89 ILE A CB 1 ATOM 723 C CG1 . ILE A 1 97 ? -14.795 -17.739 18.485 1.00 52.96 ? 89 ILE A CG1 1 ATOM 724 C CG2 . ILE A 1 97 ? -16.270 -19.656 17.630 1.00 50.16 ? 89 ILE A CG2 1 ATOM 725 C CD1 . ILE A 1 97 ? -13.745 -18.024 17.470 1.00 53.62 ? 89 ILE A CD1 1 ATOM 726 N N . THR A 1 98 ? -19.022 -19.544 19.505 1.00 61.17 ? 90 THR A N 1 ATOM 727 C CA . THR A 1 98 ? -20.019 -20.606 19.643 1.00 62.50 ? 90 THR A CA 1 ATOM 728 C C . THR A 1 98 ? -19.982 -21.501 18.409 1.00 67.55 ? 90 THR A C 1 ATOM 729 O O . THR A 1 98 ? -20.152 -21.019 17.291 1.00 67.33 ? 90 THR A O 1 ATOM 730 C CB . THR A 1 98 ? -21.438 -20.058 19.820 1.00 80.27 ? 90 THR A CB 1 ATOM 731 O OG1 . THR A 1 98 ? -21.457 -18.882 20.647 1.00 84.88 ? 90 THR A OG1 1 ATOM 732 C CG2 . THR A 1 98 ? -22.406 -21.136 20.305 1.00 79.56 ? 90 THR A CG2 1 ATOM 733 N N . VAL A 1 99 ? -19.764 -22.799 18.622 1.00 65.80 ? 91 VAL A N 1 ATOM 734 C CA . VAL A 1 99 ? -19.697 -23.829 17.584 1.00 66.57 ? 91 VAL A CA 1 ATOM 735 C C . VAL A 1 99 ? -20.636 -24.970 17.992 1.00 75.83 ? 91 VAL A C 1 ATOM 736 O O . VAL A 1 99 ? -20.321 -25.693 18.930 1.00 75.02 ? 91 VAL A O 1 ATOM 737 C CB . VAL A 1 99 ? -18.259 -24.381 17.398 1.00 68.58 ? 91 VAL A CB 1 ATOM 738 C CG1 . VAL A 1 99 ? -18.135 -25.141 16.087 1.00 68.08 ? 91 VAL A CG1 1 ATOM 739 C CG2 . VAL A 1 99 ? -17.227 -23.275 17.467 1.00 67.96 ? 91 VAL A CG2 1 ATOM 740 N N . GLY A 1 100 ? -21.748 -25.150 17.282 1.00 75.96 ? 92 GLY A N 1 ATOM 741 C CA . GLY A 1 100 ? -22.709 -26.215 17.576 1.00 76.77 ? 92 GLY A CA 1 ATOM 742 C C . GLY A 1 100 ? -23.097 -26.364 19.038 1.00 81.50 ? 92 GLY A C 1 ATOM 743 O O . GLY A 1 100 ? -23.074 -27.471 19.576 1.00 82.25 ? 92 GLY A O 1 ATOM 744 N N . GLY A 1 101 ? -23.425 -25.266 19.700 1.00 76.65 ? 93 GLY A N 1 ATOM 745 C CA . GLY A 1 101 ? -23.814 -25.352 21.101 1.00 76.09 ? 93 GLY A CA 1 ATOM 746 C C . GLY A 1 101 ? -22.674 -25.304 22.097 1.00 80.31 ? 93 GLY A C 1 ATOM 747 O O . GLY A 1 101 ? -22.918 -25.065 23.279 1.00 83.31 ? 93 GLY A O 1 ATOM 748 N N . ILE A 1 102 ? -21.427 -25.496 21.643 1.00 72.27 ? 94 ILE A N 1 ATOM 749 C CA . ILE A 1 102 ? -20.234 -25.396 22.483 1.00 69.39 ? 94 ILE A CA 1 ATOM 750 C C . ILE A 1 102 ? -19.703 -23.956 22.411 1.00 73.94 ? 94 ILE A C 1 ATOM 751 O O . ILE A 1 102 ? -19.550 -23.406 21.327 1.00 75.69 ? 94 ILE A O 1 ATOM 752 C CB . ILE A 1 102 ? -19.165 -26.411 22.057 1.00 70.68 ? 94 ILE A CB 1 ATOM 753 C CG1 . ILE A 1 102 ? -19.595 -27.830 22.367 1.00 70.61 ? 94 ILE A CG1 1 ATOM 754 C CG2 . ILE A 1 102 ? -17.821 -26.091 22.658 1.00 70.11 ? 94 ILE A CG2 1 ATOM 755 C CD1 . ILE A 1 102 ? -18.675 -28.880 21.830 1.00 77.51 ? 94 ILE A CD1 1 ATOM 756 N N . THR A 1 103 ? -19.407 -23.369 23.562 1.00 69.30 ? 95 THR A N 1 ATOM 757 C CA . THR A 1 103 ? -18.883 -22.016 23.677 1.00 68.72 ? 95 THR A CA 1 ATOM 758 C C . THR A 1 103 ? -17.455 -22.074 24.169 1.00 74.80 ? 95 THR A C 1 ATOM 759 O O . THR A 1 103 ? -17.213 -22.712 25.181 1.00 77.70 ? 95 THR A O 1 ATOM 760 C CB . THR A 1 103 ? -19.792 -21.195 24.583 1.00 69.57 ? 95 THR A CB 1 ATOM 761 O OG1 . THR A 1 103 ? -21.066 -21.064 23.974 1.00 77.05 ? 95 THR A OG1 1 ATOM 762 C CG2 . THR A 1 103 ? -19.250 -19.850 24.867 1.00 61.18 ? 95 THR A CG2 1 ATOM 763 N N . VAL A 1 104 ? -16.511 -21.427 23.463 1.00 69.77 ? 96 VAL A N 1 ATOM 764 C CA . VAL A 1 104 ? -15.085 -21.403 23.826 1.00 68.93 ? 96 VAL A CA 1 ATOM 765 C C . VAL A 1 104 ? -14.494 -20.032 23.677 1.00 74.57 ? 96 VAL A C 1 ATOM 766 O O . VAL A 1 104 ? -14.819 -19.317 22.725 1.00 76.89 ? 96 VAL A O 1 ATOM 767 C CB . VAL A 1 104 ? -14.188 -22.381 23.013 1.00 72.82 ? 96 VAL A CB 1 ATOM 768 C CG1 . VAL A 1 104 ? -14.125 -23.758 23.638 1.00 72.80 ? 96 VAL A CG1 1 ATOM 769 C CG2 . VAL A 1 104 ? -14.603 -22.443 21.545 1.00 73.08 ? 96 VAL A CG2 1 ATOM 770 N N . THR A 1 105 ? -13.561 -19.683 24.578 1.00 69.28 ? 97 THR A N 1 ATOM 771 C CA . THR A 1 105 ? -12.759 -18.472 24.464 1.00 67.82 ? 97 THR A CA 1 ATOM 772 C C . THR A 1 105 ? -11.654 -18.836 23.460 1.00 71.12 ? 97 THR A C 1 ATOM 773 O O . THR A 1 105 ? -10.923 -19.805 23.663 1.00 72.55 ? 97 THR A O 1 ATOM 774 C CB . THR A 1 105 ? -12.214 -18.024 25.811 1.00 69.80 ? 97 THR A CB 1 ATOM 775 O OG1 . THR A 1 105 ? -13.310 -17.659 26.644 1.00 76.50 ? 97 THR A OG1 1 ATOM 776 C CG2 . THR A 1 105 ? -11.272 -16.839 25.684 1.00 63.90 ? 97 THR A CG2 1 ATOM 777 N N . GLN A 1 106 ? -11.556 -18.077 22.369 1.00 64.56 ? 99 GLN A N 1 ATOM 778 C CA . GLN A 1 106 ? -10.636 -18.397 21.289 1.00 62.09 ? 99 GLN A CA 1 ATOM 779 C C . GLN A 1 106 ? -9.862 -17.210 20.747 1.00 65.35 ? 99 GLN A C 1 ATOM 780 O O . GLN A 1 106 ? -10.419 -16.118 20.588 1.00 63.92 ? 99 GLN A O 1 ATOM 781 C CB . GLN A 1 106 ? -11.452 -19.062 20.162 1.00 62.15 ? 99 GLN A CB 1 ATOM 782 C CG . GLN A 1 106 ? -10.669 -19.555 18.951 1.00 64.62 ? 99 GLN A CG 1 ATOM 783 C CD . GLN A 1 106 ? -9.672 -20.631 19.262 1.00 76.91 ? 99 GLN A CD 1 ATOM 784 O OE1 . GLN A 1 106 ? -8.569 -20.644 18.702 1.00 72.24 ? 99 GLN A OE1 1 ATOM 785 N NE2 . GLN A 1 106 ? -10.028 -21.543 20.159 1.00 63.53 ? 99 GLN A NE2 1 ATOM 786 N N . MET A 1 107 ? -8.575 -17.439 20.441 1.00 62.79 ? 100 MET A N 1 ATOM 787 C CA . MET A 1 107 ? -7.736 -16.465 19.756 1.00 63.62 ? 100 MET A CA 1 ATOM 788 C C . MET A 1 107 ? -7.933 -16.701 18.263 1.00 65.26 ? 100 MET A C 1 ATOM 789 O O . MET A 1 107 ? -7.855 -17.841 17.791 1.00 65.77 ? 100 MET A O 1 ATOM 790 C CB . MET A 1 107 ? -6.276 -16.604 20.134 1.00 67.43 ? 100 MET A CB 1 ATOM 791 C CG . MET A 1 107 ? -5.891 -15.773 21.312 1.00 75.18 ? 100 MET A CG 1 ATOM 792 S SD . MET A 1 107 ? -5.358 -14.126 20.822 1.00 83.70 ? 100 MET A SD 1 ATOM 793 C CE . MET A 1 107 ? -4.935 -13.472 22.405 1.00 81.63 ? 100 MET A CE 1 ATOM 794 N N . PHE A 1 108 ? -8.253 -15.641 17.527 1.00 57.84 ? 101 PHE A N 1 ATOM 795 C CA . PHE A 1 108 ? -8.520 -15.750 16.101 1.00 55.46 ? 101 PHE A CA 1 ATOM 796 C C . PHE A 1 108 ? -7.984 -14.546 15.342 1.00 58.37 ? 101 PHE A C 1 ATOM 797 O O . PHE A 1 108 ? -7.711 -13.500 15.930 1.00 57.52 ? 101 PHE A O 1 ATOM 798 C CB . PHE A 1 108 ? -10.031 -15.934 15.853 1.00 56.19 ? 101 PHE A CB 1 ATOM 799 C CG . PHE A 1 108 ? -10.875 -14.749 16.229 1.00 56.87 ? 101 PHE A CG 1 ATOM 800 C CD1 . PHE A 1 108 ? -11.294 -14.561 17.541 1.00 60.34 ? 101 PHE A CD1 1 ATOM 801 C CD2 . PHE A 1 108 ? -11.259 -13.820 15.272 1.00 57.80 ? 101 PHE A CD2 1 ATOM 802 C CE1 . PHE A 1 108 ? -12.056 -13.448 17.896 1.00 61.36 ? 101 PHE A CE1 1 ATOM 803 C CE2 . PHE A 1 108 ? -12.019 -12.713 15.623 1.00 60.67 ? 101 PHE A CE2 1 ATOM 804 C CZ . PHE A 1 108 ? -12.414 -12.531 16.935 1.00 59.61 ? 101 PHE A CZ 1 ATOM 805 N N . GLY A 1 109 ? -7.848 -14.706 14.038 1.00 54.46 ? 102 GLY A N 1 ATOM 806 C CA . GLY A 1 109 ? -7.396 -13.630 13.177 1.00 53.70 ? 102 GLY A CA 1 ATOM 807 C C . GLY A 1 109 ? -8.540 -12.765 12.687 1.00 56.52 ? 102 GLY A C 1 ATOM 808 O O . GLY A 1 109 ? -9.592 -13.265 12.270 1.00 55.99 ? 102 GLY A O 1 ATOM 809 N N . GLU A 1 110 ? -8.348 -11.449 12.785 1.00 51.66 ? 103 GLU A N 1 ATOM 810 C CA . GLU A 1 110 ? -9.236 -10.444 12.219 1.00 50.22 ? 103 GLU A CA 1 ATOM 811 C C . GLU A 1 110 ? -8.520 -10.048 10.907 1.00 53.97 ? 103 GLU A C 1 ATOM 812 O O . GLU A 1 110 ? -7.449 -9.428 10.938 1.00 52.49 ? 103 GLU A O 1 ATOM 813 C CB . GLU A 1 110 ? -9.384 -9.230 13.144 1.00 50.63 ? 103 GLU A CB 1 ATOM 814 C CG . GLU A 1 110 ? -10.511 -9.351 14.147 1.00 57.57 ? 103 GLU A CG 1 ATOM 815 C CD . GLU A 1 110 ? -10.915 -8.031 14.788 1.00 73.44 ? 103 GLU A CD 1 ATOM 816 O OE1 . GLU A 1 110 ? -11.439 -7.148 14.073 1.00 63.26 ? 103 GLU A OE1 1 ATOM 817 O OE2 . GLU A 1 110 ? -10.709 -7.878 16.013 1.00 71.63 ? 103 GLU A OE2 1 ATOM 818 N N . VAL A 1 111 ? -9.082 -10.474 9.763 1.00 49.71 ? 104 VAL A N 1 ATOM 819 C CA . VAL A 1 111 ? -8.477 -10.254 8.459 1.00 48.26 ? 104 VAL A CA 1 ATOM 820 C C . VAL A 1 111 ? -8.757 -8.861 7.908 1.00 54.20 ? 104 VAL A C 1 ATOM 821 O O . VAL A 1 111 ? -9.916 -8.464 7.746 1.00 53.14 ? 104 VAL A O 1 ATOM 822 C CB . VAL A 1 111 ? -8.798 -11.412 7.490 1.00 50.15 ? 104 VAL A CB 1 ATOM 823 C CG1 . VAL A 1 111 ? -8.496 -11.051 6.045 1.00 48.53 ? 104 VAL A CG1 1 ATOM 824 C CG2 . VAL A 1 111 ? -8.017 -12.654 7.894 1.00 50.39 ? 104 VAL A CG2 1 ATOM 825 N N . THR A 1 112 ? -7.671 -8.122 7.620 1.00 51.19 ? 105 THR A N 1 ATOM 826 C CA . THR A 1 112 ? -7.753 -6.770 7.090 1.00 51.01 ? 105 THR A CA 1 ATOM 827 C C . THR A 1 112 ? -7.349 -6.709 5.620 1.00 57.23 ? 105 THR A C 1 ATOM 828 O O . THR A 1 112 ? -7.533 -5.684 4.968 1.00 58.00 ? 105 THR A O 1 ATOM 829 C CB . THR A 1 112 ? -6.931 -5.811 7.959 1.00 50.74 ? 105 THR A CB 1 ATOM 830 O OG1 . THR A 1 112 ? -5.579 -6.225 7.970 1.00 48.30 ? 105 THR A OG1 1 ATOM 831 C CG2 . THR A 1 112 ? -7.454 -5.710 9.385 1.00 46.56 ? 105 THR A CG2 1 ATOM 832 N N . GLU A 1 113 ? -6.758 -7.793 5.104 1.00 54.23 ? 106 GLU A N 1 ATOM 833 C CA . GLU A 1 113 ? -6.293 -7.871 3.715 1.00 53.58 ? 106 GLU A CA 1 ATOM 834 C C . GLU A 1 113 ? -6.787 -9.188 3.130 1.00 56.04 ? 106 GLU A C 1 ATOM 835 O O . GLU A 1 113 ? -6.337 -10.249 3.539 1.00 55.72 ? 106 GLU A O 1 ATOM 836 C CB . GLU A 1 113 ? -4.766 -7.700 3.646 1.00 55.14 ? 106 GLU A CB 1 ATOM 837 C CG . GLU A 1 113 ? -4.284 -6.369 4.229 1.00 63.69 ? 106 GLU A CG 1 ATOM 838 C CD . GLU A 1 113 ? -2.790 -6.106 4.200 1.00 95.91 ? 106 GLU A CD 1 ATOM 839 O OE1 . GLU A 1 113 ? -2.010 -7.069 4.349 1.00 98.54 ? 106 GLU A OE1 1 ATOM 840 O OE2 . GLU A 1 113 ? -2.401 -4.923 4.095 1.00 103.29 ? 106 GLU A OE2 1 ATOM 841 N N . MET A 1 114 ? -7.766 -9.105 2.212 1.00 51.96 ? 107 MET A N 1 ATOM 842 C CA . MET A 1 114 ? -8.504 -10.238 1.667 1.00 51.65 ? 107 MET A CA 1 ATOM 843 C C . MET A 1 114 ? -8.648 -10.128 0.142 1.00 57.00 ? 107 MET A C 1 ATOM 844 O O . MET A 1 114 ? -9.546 -9.448 -0.361 1.00 56.29 ? 107 MET A O 1 ATOM 845 C CB . MET A 1 114 ? -9.877 -10.245 2.354 1.00 54.25 ? 107 MET A CB 1 ATOM 846 C CG . MET A 1 114 ? -10.567 -11.587 2.349 1.00 57.64 ? 107 MET A CG 1 ATOM 847 S SD . MET A 1 114 ? -12.115 -11.447 3.223 1.00 60.66 ? 107 MET A SD 1 ATOM 848 C CE . MET A 1 114 ? -12.719 -13.100 3.025 1.00 57.29 ? 107 MET A CE 1 ATOM 849 N N . PRO A 1 115 ? -7.749 -10.802 -0.598 1.00 55.47 ? 108 PRO A N 1 ATOM 850 C CA . PRO A 1 115 ? -7.748 -10.711 -2.074 1.00 54.69 ? 108 PRO A CA 1 ATOM 851 C C . PRO A 1 115 ? -8.997 -11.264 -2.743 1.00 56.21 ? 108 PRO A C 1 ATOM 852 O O . PRO A 1 115 ? -9.550 -12.294 -2.319 1.00 54.84 ? 108 PRO A O 1 ATOM 853 C CB . PRO A 1 115 ? -6.511 -11.526 -2.480 1.00 56.45 ? 108 PRO A CB 1 ATOM 854 C CG . PRO A 1 115 ? -5.693 -11.614 -1.258 1.00 60.92 ? 108 PRO A CG 1 ATOM 855 C CD . PRO A 1 115 ? -6.643 -11.644 -0.122 1.00 56.89 ? 108 PRO A CD 1 ATOM 856 N N . ALA A 1 116 ? -9.409 -10.590 -3.819 1.00 52.04 ? 109 ALA A N 1 ATOM 857 C CA . ALA A 1 116 ? -10.580 -10.977 -4.615 1.00 52.19 ? 109 ALA A CA 1 ATOM 858 C C . ALA A 1 116 ? -10.460 -12.406 -5.120 1.00 53.21 ? 109 ALA A C 1 ATOM 859 O O . ALA A 1 116 ? -11.442 -13.136 -5.146 1.00 52.74 ? 109 ALA A O 1 ATOM 860 C CB . ALA A 1 116 ? -10.792 -10.001 -5.768 1.00 53.39 ? 109 ALA A CB 1 ATOM 861 N N . LEU A 1 117 ? -9.245 -12.812 -5.495 1.00 47.28 ? 110 LEU A N 1 ATOM 862 C CA . LEU A 1 117 ? -8.954 -14.181 -5.856 1.00 45.98 ? 110 LEU A CA 1 ATOM 863 C C . LEU A 1 117 ? -8.206 -14.785 -4.680 1.00 51.36 ? 110 LEU A C 1 ATOM 864 O O . LEU A 1 117 ? -7.147 -14.304 -4.305 1.00 52.84 ? 110 LEU A O 1 ATOM 865 C CB . LEU A 1 117 ? -8.114 -14.267 -7.121 1.00 46.07 ? 110 LEU A CB 1 ATOM 866 C CG . LEU A 1 117 ? -8.825 -14.021 -8.449 1.00 50.33 ? 110 LEU A CG 1 ATOM 867 C CD1 . LEU A 1 117 ? -7.858 -14.181 -9.571 1.00 51.03 ? 110 LEU A CD1 1 ATOM 868 C CD2 . LEU A 1 117 ? -9.941 -14.994 -8.657 1.00 51.32 ? 110 LEU A CD2 1 ATOM 869 N N . PRO A 1 118 ? -8.761 -15.788 -4.004 1.00 48.15 ? 111 PRO A N 1 ATOM 870 C CA . PRO A 1 118 ? -10.000 -16.542 -4.307 1.00 48.08 ? 111 PRO A CA 1 ATOM 871 C C . PRO A 1 118 ? -11.254 -16.112 -3.548 1.00 52.34 ? 111 PRO A C 1 ATOM 872 O O . PRO A 1 118 ? -12.320 -16.680 -3.781 1.00 52.36 ? 111 PRO A O 1 ATOM 873 C CB . PRO A 1 118 ? -9.627 -17.956 -3.841 1.00 48.71 ? 111 PRO A CB 1 ATOM 874 C CG . PRO A 1 118 ? -8.746 -17.714 -2.638 1.00 53.18 ? 111 PRO A CG 1 ATOM 875 C CD . PRO A 1 118 ? -8.048 -16.369 -2.853 1.00 48.81 ? 111 PRO A CD 1 ATOM 876 N N . PHE A 1 119 ? -11.134 -15.149 -2.632 1.00 47.90 ? 112 PHE A N 1 ATOM 877 C CA . PHE A 1 119 ? -12.187 -14.816 -1.667 1.00 46.22 ? 112 PHE A CA 1 ATOM 878 C C . PHE A 1 119 ? -13.504 -14.290 -2.202 1.00 51.19 ? 112 PHE A C 1 ATOM 879 O O . PHE A 1 119 ? -14.516 -14.496 -1.558 1.00 51.69 ? 112 PHE A O 1 ATOM 880 C CB . PHE A 1 119 ? -11.640 -14.084 -0.412 1.00 46.45 ? 112 PHE A CB 1 ATOM 881 C CG . PHE A 1 119 ? -10.531 -14.887 0.257 1.00 46.19 ? 112 PHE A CG 1 ATOM 882 C CD1 . PHE A 1 119 ? -10.822 -16.057 0.974 1.00 45.12 ? 112 PHE A CD1 1 ATOM 883 C CD2 . PHE A 1 119 ? -9.186 -14.534 0.089 1.00 46.08 ? 112 PHE A CD2 1 ATOM 884 C CE1 . PHE A 1 119 ? -9.793 -16.834 1.524 1.00 43.68 ? 112 PHE A CE1 1 ATOM 885 C CE2 . PHE A 1 119 ? -8.160 -15.310 0.651 1.00 46.27 ? 112 PHE A CE2 1 ATOM 886 C CZ . PHE A 1 119 ? -8.470 -16.450 1.355 1.00 43.49 ? 112 PHE A CZ 1 ATOM 887 N N . MET A 1 120 ? -13.523 -13.715 -3.405 1.00 47.36 ? 113 MET A N 1 ATOM 888 C CA . MET A 1 120 ? -14.776 -13.290 -4.035 1.00 46.84 ? 113 MET A CA 1 ATOM 889 C C . MET A 1 120 ? -15.533 -14.496 -4.589 1.00 52.83 ? 113 MET A C 1 ATOM 890 O O . MET A 1 120 ? -16.704 -14.382 -4.949 1.00 54.60 ? 113 MET A O 1 ATOM 891 C CB . MET A 1 120 ? -14.523 -12.268 -5.125 1.00 48.95 ? 113 MET A CB 1 ATOM 892 C CG . MET A 1 120 ? -14.400 -10.845 -4.585 1.00 52.83 ? 113 MET A CG 1 ATOM 893 S SD . MET A 1 120 ? -15.877 -10.198 -3.755 1.00 56.19 ? 113 MET A SD 1 ATOM 894 C CE . MET A 1 120 ? -16.994 -10.116 -5.170 1.00 53.78 ? 113 MET A CE 1 ATOM 895 N N . LEU A 1 121 ? -14.872 -15.665 -4.626 1.00 47.87 ? 114 LEU A N 1 ATOM 896 C CA . LEU A 1 121 ? -15.490 -16.912 -5.084 1.00 47.14 ? 114 LEU A CA 1 ATOM 897 C C . LEU A 1 121 ? -15.978 -17.744 -3.899 1.00 49.85 ? 114 LEU A C 1 ATOM 898 O O . LEU A 1 121 ? -16.581 -18.807 -4.088 1.00 46.61 ? 114 LEU A O 1 ATOM 899 C CB . LEU A 1 121 ? -14.506 -17.734 -5.936 1.00 46.82 ? 114 LEU A CB 1 ATOM 900 C CG . LEU A 1 121 ? -13.876 -17.016 -7.140 1.00 50.18 ? 114 LEU A CG 1 ATOM 901 C CD1 . LEU A 1 121 ? -12.551 -17.635 -7.549 1.00 51.02 ? 114 LEU A CD1 1 ATOM 902 C CD2 . LEU A 1 121 ? -14.877 -16.704 -8.225 1.00 43.93 ? 114 LEU A CD2 1 ATOM 903 N N . ALA A 1 122 ? -15.687 -17.273 -2.689 1.00 49.00 ? 115 ALA A N 1 ATOM 904 C CA . ALA A 1 122 ? -16.047 -17.972 -1.461 1.00 50.15 ? 115 ALA A CA 1 ATOM 905 C C . ALA A 1 122 ? -17.438 -17.586 -0.987 1.00 53.33 ? 115 ALA A C 1 ATOM 906 O O . ALA A 1 122 ? -17.731 -16.407 -0.786 1.00 54.42 ? 115 ALA A O 1 ATOM 907 C CB . ALA A 1 122 ? -15.009 -17.684 -0.361 1.00 50.84 ? 115 ALA A CB 1 ATOM 908 N N . GLU A 1 123 ? -18.266 -18.592 -0.759 1.00 49.46 ? 116 GLU A N 1 ATOM 909 C CA . GLU A 1 123 ? -19.604 -18.433 -0.181 1.00 50.90 ? 116 GLU A CA 1 ATOM 910 C C . GLU A 1 123 ? -19.459 -18.247 1.325 1.00 56.78 ? 116 GLU A C 1 ATOM 911 O O . GLU A 1 123 ? -20.317 -17.666 1.965 1.00 57.51 ? 116 GLU A O 1 ATOM 912 C CB . GLU A 1 123 ? -20.532 -19.644 -0.514 1.00 52.16 ? 116 GLU A CB 1 ATOM 913 C CG . GLU A 1 123 ? -21.147 -19.594 -1.895 1.00 67.32 ? 116 GLU A CG 1 ATOM 914 C CD . GLU A 1 123 ? -22.108 -18.441 -2.062 1.00 103.93 ? 116 GLU A CD 1 ATOM 915 O OE1 . GLU A 1 123 ? -22.814 -18.106 -1.085 1.00 88.09 ? 116 GLU A OE1 1 ATOM 916 O OE2 . GLU A 1 123 ? -22.118 -17.840 -3.157 1.00 115.47 ? 116 GLU A OE2 1 ATOM 917 N N . PHE A 1 124 ? -18.363 -18.731 1.884 1.00 52.47 ? 117 PHE A N 1 ATOM 918 C CA . PHE A 1 124 ? -18.078 -18.624 3.299 1.00 50.84 ? 117 PHE A CA 1 ATOM 919 C C . PHE A 1 124 ? -17.321 -17.334 3.587 1.00 57.43 ? 117 PHE A C 1 ATOM 920 O O . PHE A 1 124 ? -16.697 -16.764 2.687 1.00 59.48 ? 117 PHE A O 1 ATOM 921 C CB . PHE A 1 124 ? -17.259 -19.836 3.763 1.00 51.30 ? 117 PHE A CB 1 ATOM 922 C CG . PHE A 1 124 ? -15.984 -20.070 2.987 1.00 51.88 ? 117 PHE A CG 1 ATOM 923 C CD1 . PHE A 1 124 ? -15.994 -20.839 1.814 1.00 54.33 ? 117 PHE A CD1 1 ATOM 924 C CD2 . PHE A 1 124 ? -14.767 -19.529 3.427 1.00 52.00 ? 117 PHE A CD2 1 ATOM 925 C CE1 . PHE A 1 124 ? -14.804 -21.076 1.103 1.00 53.99 ? 117 PHE A CE1 1 ATOM 926 C CE2 . PHE A 1 124 ? -13.583 -19.750 2.711 1.00 52.88 ? 117 PHE A CE2 1 ATOM 927 C CZ . PHE A 1 124 ? -13.609 -20.528 1.558 1.00 51.25 ? 117 PHE A CZ 1 ATOM 928 N N . ASP A 1 125 ? -17.343 -16.900 4.857 1.00 52.49 ? 118 ASP A N 1 ATOM 929 C CA . ASP A 1 125 ? -16.646 -15.697 5.315 1.00 51.00 ? 118 ASP A CA 1 ATOM 930 C C . ASP A 1 125 ? -15.230 -15.999 5.802 1.00 53.56 ? 118 ASP A C 1 ATOM 931 O O . ASP A 1 125 ? -14.286 -15.262 5.493 1.00 53.52 ? 118 ASP A O 1 ATOM 932 C CB . ASP A 1 125 ? -17.437 -15.017 6.432 1.00 51.78 ? 118 ASP A CB 1 ATOM 933 C CG . ASP A 1 125 ? -18.839 -14.660 6.016 1.00 58.05 ? 118 ASP A CG 1 ATOM 934 O OD1 . ASP A 1 125 ? -18.984 -13.902 5.032 1.00 57.23 ? 118 ASP A OD1 1 ATOM 935 O OD2 . ASP A 1 125 ? -19.802 -15.143 6.672 1.00 63.67 ? 118 ASP A OD2 1 ATOM 936 N N . GLY A 1 126 ? -15.104 -17.052 6.589 1.00 47.73 ? 119 GLY A N 1 ATOM 937 C CA . GLY A 1 126 ? -13.828 -17.382 7.177 1.00 46.86 ? 119 GLY A CA 1 ATOM 938 C C . GLY A 1 126 ? -13.526 -18.852 7.260 1.00 51.19 ? 119 GLY A C 1 ATOM 939 O O . GLY A 1 126 ? -14.164 -19.689 6.602 1.00 49.69 ? 119 GLY A O 1 ATOM 940 N N . VAL A 1 127 ? -12.513 -19.156 8.070 1.00 49.76 ? 120 VAL A N 1 ATOM 941 C CA . VAL A 1 127 ? -12.015 -20.512 8.224 1.00 50.99 ? 120 VAL A CA 1 ATOM 942 C C . VAL A 1 127 ? -11.872 -20.850 9.680 1.00 57.23 ? 120 VAL A C 1 ATOM 943 O O . VAL A 1 127 ? -11.403 -20.023 10.468 1.00 58.66 ? 120 VAL A O 1 ATOM 944 C CB . VAL A 1 127 ? -10.654 -20.713 7.455 1.00 54.47 ? 120 VAL A CB 1 ATOM 945 C CG1 . VAL A 1 127 ? -10.130 -22.140 7.581 1.00 53.49 ? 120 VAL A CG1 1 ATOM 946 C CG2 . VAL A 1 127 ? -10.785 -20.332 5.973 1.00 54.53 ? 120 VAL A CG2 1 ATOM 947 N N . VAL A 1 128 ? -12.258 -22.083 10.036 1.00 52.81 ? 121 VAL A N 1 ATOM 948 C CA . VAL A 1 128 ? -11.998 -22.644 11.353 1.00 52.46 ? 121 VAL A CA 1 ATOM 949 C C . VAL A 1 128 ? -11.028 -23.803 11.100 1.00 58.04 ? 121 VAL A C 1 ATOM 950 O O . VAL A 1 128 ? -11.414 -24.823 10.526 1.00 58.27 ? 121 VAL A O 1 ATOM 951 C CB . VAL A 1 128 ? -13.290 -23.068 12.091 1.00 55.85 ? 121 VAL A CB 1 ATOM 952 C CG1 . VAL A 1 128 ? -12.980 -23.939 13.294 1.00 54.86 ? 121 VAL A CG1 1 ATOM 953 C CG2 . VAL A 1 128 ? -14.100 -21.840 12.503 1.00 55.73 ? 121 VAL A CG2 1 ATOM 954 N N . GLY A 1 129 ? -9.764 -23.602 11.453 1.00 56.60 ? 122 GLY A N 1 ATOM 955 C CA . GLY A 1 129 ? -8.730 -24.611 11.251 1.00 57.40 ? 122 GLY A CA 1 ATOM 956 C C . GLY A 1 129 ? -8.907 -25.765 12.218 1.00 61.99 ? 122 GLY A C 1 ATOM 957 O O . GLY A 1 129 ? -9.055 -25.543 13.419 1.00 62.43 ? 122 GLY A O 1 ATOM 958 N N . MET A 1 130 ? -8.938 -27.001 11.701 1.00 56.88 ? 123 MET A N 1 ATOM 959 C CA . MET A 1 130 ? -9.127 -28.209 12.519 1.00 55.74 ? 123 MET A CA 1 ATOM 960 C C . MET A 1 130 ? -7.836 -29.024 12.651 1.00 61.91 ? 123 MET A C 1 ATOM 961 O O . MET A 1 130 ? -7.861 -30.160 13.126 1.00 63.61 ? 123 MET A O 1 ATOM 962 C CB . MET A 1 130 ? -10.247 -29.093 11.943 1.00 57.54 ? 123 MET A CB 1 ATOM 963 C CG . MET A 1 130 ? -11.624 -28.450 11.924 1.00 60.18 ? 123 MET A CG 1 ATOM 964 S SD . MET A 1 130 ? -12.245 -27.967 13.521 1.00 62.84 ? 123 MET A SD 1 ATOM 965 C CE . MET A 1 130 ? -12.740 -29.571 14.204 1.00 58.79 ? 123 MET A CE 1 ATOM 966 N N . GLY A 1 131 ? -6.720 -28.441 12.238 1.00 58.85 ? 124 GLY A N 1 ATOM 967 C CA . GLY A 1 131 ? -5.404 -29.054 12.341 1.00 58.62 ? 124 GLY A CA 1 ATOM 968 C C . GLY A 1 131 ? -4.787 -28.902 13.719 1.00 62.96 ? 124 GLY A C 1 ATOM 969 O O . GLY A 1 131 ? -5.438 -28.448 14.667 1.00 60.29 ? 124 GLY A O 1 ATOM 970 N N . PHE A 1 132 ? -3.525 -29.296 13.835 1.00 63.77 ? 125 PHE A N 1 ATOM 971 C CA . PHE A 1 132 ? -2.788 -29.280 15.100 1.00 65.51 ? 125 PHE A CA 1 ATOM 972 C C . PHE A 1 132 ? -2.064 -27.971 15.358 1.00 70.13 ? 125 PHE A C 1 ATOM 973 O O . PHE A 1 132 ? -1.692 -27.272 14.413 1.00 70.63 ? 125 PHE A O 1 ATOM 974 C CB . PHE A 1 132 ? -1.760 -30.405 15.106 1.00 67.96 ? 125 PHE A CB 1 ATOM 975 C CG . PHE A 1 132 ? -2.320 -31.805 15.018 1.00 69.08 ? 125 PHE A CG 1 ATOM 976 C CD1 . PHE A 1 132 ? -2.725 -32.333 13.795 1.00 73.51 ? 125 PHE A CD1 1 ATOM 977 C CD2 . PHE A 1 132 ? -2.392 -32.614 16.142 1.00 68.71 ? 125 PHE A CD2 1 ATOM 978 C CE1 . PHE A 1 132 ? -3.211 -33.651 13.701 1.00 73.93 ? 125 PHE A CE1 1 ATOM 979 C CE2 . PHE A 1 132 ? -2.874 -33.929 16.048 1.00 71.64 ? 125 PHE A CE2 1 ATOM 980 C CZ . PHE A 1 132 ? -3.300 -34.435 14.835 1.00 70.46 ? 125 PHE A CZ 1 ATOM 981 N N . ILE A 1 133 ? -1.775 -27.689 16.641 1.00 66.67 ? 126 ILE A N 1 ATOM 982 C CA . ILE A 1 133 ? -1.024 -26.488 17.073 1.00 65.95 ? 126 ILE A CA 1 ATOM 983 C C . ILE A 1 133 ? 0.311 -26.344 16.354 1.00 66.13 ? 126 ILE A C 1 ATOM 984 O O . ILE A 1 133 ? 0.714 -25.235 16.035 1.00 64.13 ? 126 ILE A O 1 ATOM 985 C CB . ILE A 1 133 ? -0.883 -26.412 18.611 1.00 69.34 ? 126 ILE A CB 1 ATOM 986 C CG1 . ILE A 1 133 ? -0.430 -25.016 19.072 1.00 69.26 ? 126 ILE A CG1 1 ATOM 987 C CG2 . ILE A 1 133 ? 0.003 -27.531 19.158 1.00 71.13 ? 126 ILE A CG2 1 ATOM 988 C CD1 . ILE A 1 133 ? -0.785 -24.682 20.504 1.00 74.77 ? 126 ILE A CD1 1 ATOM 989 N N . GLU A 1 134 ? 0.959 -27.473 16.040 1.00 63.03 ? 127 GLU A N 1 ATOM 990 C CA . GLU A 1 134 ? 2.231 -27.504 15.303 1.00 61.75 ? 127 GLU A CA 1 ATOM 991 C C . GLU A 1 134 ? 2.157 -26.775 13.953 1.00 66.06 ? 127 GLU A C 1 ATOM 992 O O . GLU A 1 134 ? 3.181 -26.334 13.443 1.00 66.59 ? 127 GLU A O 1 ATOM 993 C CB . GLU A 1 134 ? 2.709 -28.947 15.108 1.00 62.13 ? 127 GLU A CB 1 ATOM 994 C CG . GLU A 1 134 ? 3.152 -29.625 16.399 1.00 71.24 ? 127 GLU A CG 1 ATOM 995 C CD . GLU A 1 134 ? 2.126 -30.476 17.126 1.00 89.20 ? 127 GLU A CD 1 ATOM 996 O OE1 . GLU A 1 134 ? 0.917 -30.162 17.053 1.00 79.01 ? 127 GLU A OE1 1 ATOM 997 O OE2 . GLU A 1 134 ? 2.535 -31.464 17.778 1.00 89.70 ? 127 GLU A OE2 1 ATOM 998 N N . GLN A 1 135 ? 0.951 -26.642 13.381 1.00 62.16 ? 128 GLN A N 1 ATOM 999 C CA . GLN A 1 135 ? 0.768 -25.953 12.102 1.00 62.51 ? 128 GLN A CA 1 ATOM 1000 C C . GLN A 1 135 ? 0.132 -24.566 12.224 1.00 64.77 ? 128 GLN A C 1 ATOM 1001 O O . GLN A 1 135 ? -0.086 -23.891 11.203 1.00 61.89 ? 128 GLN A O 1 ATOM 1002 C CB . GLN A 1 135 ? -0.047 -26.804 11.144 1.00 64.76 ? 128 GLN A CB 1 ATOM 1003 C CG . GLN A 1 135 ? 0.694 -28.001 10.607 1.00 91.30 ? 128 GLN A CG 1 ATOM 1004 C CD . GLN A 1 135 ? 0.100 -28.389 9.268 1.00 113.14 ? 128 GLN A CD 1 ATOM 1005 O OE1 . GLN A 1 135 ? 0.681 -28.173 8.197 1.00 113.82 ? 128 GLN A OE1 1 ATOM 1006 N NE2 . GLN A 1 135 ? -1.044 -29.049 9.300 1.00 91.61 ? 128 GLN A NE2 1 ATOM 1007 N N . ALA A 1 136 ? -0.177 -24.149 13.469 1.00 61.34 ? 129 ALA A N 1 ATOM 1008 C CA . ALA A 1 136 ? -0.798 -22.864 13.722 1.00 59.76 ? 129 ALA A CA 1 ATOM 1009 C C . ALA A 1 136 ? 0.210 -21.734 13.598 1.00 63.21 ? 129 ALA A C 1 ATOM 1010 O O . ALA A 1 136 ? 1.260 -21.757 14.236 1.00 63.92 ? 129 ALA A O 1 ATOM 1011 C CB . ALA A 1 136 ? -1.447 -22.853 15.088 1.00 60.25 ? 129 ALA A CB 1 ATOM 1012 N N . ILE A 1 137 ? -0.106 -20.745 12.763 1.00 58.56 ? 130 ILE A N 1 ATOM 1013 C CA . ILE A 1 137 ? 0.734 -19.560 12.596 1.00 56.75 ? 130 ILE A CA 1 ATOM 1014 C C . ILE A 1 137 ? 0.574 -18.716 13.840 1.00 58.89 ? 130 ILE A C 1 ATOM 1015 O O . ILE A 1 137 ? -0.543 -18.559 14.330 1.00 55.90 ? 130 ILE A O 1 ATOM 1016 C CB . ILE A 1 137 ? 0.433 -18.834 11.266 1.00 59.08 ? 130 ILE A CB 1 ATOM 1017 C CG1 . ILE A 1 137 ? 1.017 -19.659 10.104 1.00 58.07 ? 130 ILE A CG1 1 ATOM 1018 C CG2 . ILE A 1 137 ? 0.937 -17.358 11.262 1.00 60.01 ? 130 ILE A CG2 1 ATOM 1019 C CD1 . ILE A 1 137 ? 0.265 -19.536 8.796 1.00 78.52 ? 130 ILE A CD1 1 ATOM 1020 N N . GLY A 1 138 ? 1.704 -18.277 14.394 1.00 58.42 ? 131 GLY A N 1 ATOM 1021 C CA . GLY A 1 138 ? 1.747 -17.521 15.650 1.00 58.51 ? 131 GLY A CA 1 ATOM 1022 C C . GLY A 1 138 ? 1.556 -18.434 16.844 1.00 63.23 ? 131 GLY A C 1 ATOM 1023 O O . GLY A 1 138 ? 1.327 -17.957 17.953 1.00 61.22 ? 131 GLY A O 1 ATOM 1024 N N . ARG A 1 139 ? 1.632 -19.770 16.622 1.00 64.16 ? 132 ARG A N 1 ATOM 1025 C CA . ARG A 1 139 ? 1.463 -20.792 17.673 1.00 66.14 ? 132 ARG A CA 1 ATOM 1026 C C . ARG A 1 139 ? 0.188 -20.582 18.533 1.00 68.33 ? 132 ARG A C 1 ATOM 1027 O O . ARG A 1 139 ? 0.174 -20.876 19.719 1.00 68.15 ? 132 ARG A O 1 ATOM 1028 C CB . ARG A 1 139 ? 2.719 -20.884 18.576 1.00 71.66 ? 132 ARG A CB 1 ATOM 1029 C CG . ARG A 1 139 ? 3.991 -21.371 17.881 1.00 96.09 ? 132 ARG A CG 1 ATOM 1030 C CD . ARG A 1 139 ? 4.861 -20.233 17.342 1.00 116.38 ? 132 ARG A CD 1 ATOM 1031 N NE . ARG A 1 139 ? 5.339 -19.336 18.404 1.00 129.08 ? 132 ARG A NE 1 ATOM 1032 C CZ . ARG A 1 139 ? 5.535 -18.027 18.257 1.00 139.75 ? 132 ARG A CZ 1 ATOM 1033 N NH1 . ARG A 1 139 ? 5.306 -17.440 17.086 1.00 123.52 ? 132 ARG A NH1 1 ATOM 1034 N NH2 . ARG A 1 139 ? 5.950 -17.292 19.282 1.00 122.39 ? 132 ARG A NH2 1 ATOM 1035 N N . VAL A 1 140 ? -0.874 -20.068 17.934 1.00 63.77 ? 133 VAL A N 1 ATOM 1036 C CA . VAL A 1 140 ? -2.142 -19.842 18.630 1.00 63.25 ? 133 VAL A CA 1 ATOM 1037 C C . VAL A 1 140 ? -2.852 -21.171 18.825 1.00 64.11 ? 133 VAL A C 1 ATOM 1038 O O . VAL A 1 140 ? -2.880 -21.982 17.897 1.00 61.47 ? 133 VAL A O 1 ATOM 1039 C CB . VAL A 1 140 ? -3.019 -18.769 17.905 1.00 67.59 ? 133 VAL A CB 1 ATOM 1040 C CG1 . VAL A 1 140 ? -2.995 -18.959 16.397 1.00 68.47 ? 133 VAL A CG1 1 ATOM 1041 C CG2 . VAL A 1 140 ? -4.443 -18.765 18.392 1.00 67.07 ? 133 VAL A CG2 1 ATOM 1042 N N . THR A 1 141 ? -3.413 -21.392 20.026 1.00 61.26 ? 134 THR A N 1 ATOM 1043 C CA . THR A 1 141 ? -4.124 -22.639 20.335 1.00 61.99 ? 134 THR A CA 1 ATOM 1044 C C . THR A 1 141 ? -5.331 -22.839 19.403 1.00 66.64 ? 134 THR A C 1 ATOM 1045 O O . THR A 1 141 ? -6.215 -21.993 19.364 1.00 65.97 ? 134 THR A O 1 ATOM 1046 C CB . THR A 1 141 ? -4.548 -22.722 21.819 1.00 67.84 ? 134 THR A CB 1 ATOM 1047 O OG1 . THR A 1 141 ? -3.399 -22.560 22.645 1.00 68.53 ? 134 THR A OG1 1 ATOM 1048 C CG2 . THR A 1 141 ? -5.216 -24.044 22.153 1.00 62.22 ? 134 THR A CG2 1 ATOM 1049 N N . PRO A 1 142 ? -5.370 -23.961 18.664 1.00 63.24 ? 135 PRO A N 1 ATOM 1050 C CA . PRO A 1 142 ? -6.505 -24.219 17.766 1.00 62.99 ? 135 PRO A CA 1 ATOM 1051 C C . PRO A 1 142 ? -7.801 -24.438 18.517 1.00 67.02 ? 135 PRO A C 1 ATOM 1052 O O . PRO A 1 142 ? -7.778 -24.848 19.666 1.00 68.69 ? 135 PRO A O 1 ATOM 1053 C CB . PRO A 1 142 ? -6.084 -25.486 17.029 1.00 65.25 ? 135 PRO A CB 1 ATOM 1054 C CG . PRO A 1 142 ? -4.584 -25.549 17.196 1.00 69.80 ? 135 PRO A CG 1 ATOM 1055 C CD . PRO A 1 142 ? -4.357 -25.023 18.566 1.00 65.21 ? 135 PRO A CD 1 ATOM 1056 N N . ILE A 1 143 ? -8.931 -24.165 17.876 1.00 63.19 ? 136 ILE A N 1 ATOM 1057 C CA . ILE A 1 143 ? -10.239 -24.276 18.524 1.00 63.30 ? 136 ILE A CA 1 ATOM 1058 C C . ILE A 1 143 ? -10.550 -25.654 19.128 1.00 66.77 ? 136 ILE A C 1 ATOM 1059 O O . ILE A 1 143 ? -11.131 -25.725 20.209 1.00 65.55 ? 136 ILE A O 1 ATOM 1060 C CB . ILE A 1 143 ? -11.393 -23.749 17.625 1.00 65.81 ? 136 ILE A CB 1 ATOM 1061 C CG1 . ILE A 1 143 ? -12.639 -23.401 18.467 1.00 65.25 ? 136 ILE A CG1 1 ATOM 1062 C CG2 . ILE A 1 143 ? -11.716 -24.719 16.476 1.00 63.84 ? 136 ILE A CG2 1 ATOM 1063 C CD1 . ILE A 1 143 ? -13.601 -22.457 17.812 1.00 62.59 ? 136 ILE A CD1 1 ATOM 1064 N N . PHE A 1 144 ? -10.172 -26.742 18.437 1.00 62.78 ? 137 PHE A N 1 ATOM 1065 C CA . PHE A 1 144 ? -10.493 -28.069 18.944 1.00 62.25 ? 137 PHE A CA 1 ATOM 1066 C C . PHE A 1 144 ? -9.725 -28.400 20.203 1.00 68.75 ? 137 PHE A C 1 ATOM 1067 O O . PHE A 1 144 ? -10.269 -29.067 21.093 1.00 69.61 ? 137 PHE A O 1 ATOM 1068 C CB . PHE A 1 144 ? -10.379 -29.152 17.887 1.00 63.23 ? 137 PHE A CB 1 ATOM 1069 C CG . PHE A 1 144 ? -11.059 -30.441 18.291 1.00 64.44 ? 137 PHE A CG 1 ATOM 1070 C CD1 . PHE A 1 144 ? -12.446 -30.539 18.329 1.00 66.65 ? 137 PHE A CD1 1 ATOM 1071 C CD2 . PHE A 1 144 ? -10.315 -31.562 18.617 1.00 66.16 ? 137 PHE A CD2 1 ATOM 1072 C CE1 . PHE A 1 144 ? -13.068 -31.743 18.685 1.00 66.54 ? 137 PHE A CE1 1 ATOM 1073 C CE2 . PHE A 1 144 ? -10.942 -32.759 18.977 1.00 68.67 ? 137 PHE A CE2 1 ATOM 1074 C CZ . PHE A 1 144 ? -12.313 -32.840 19.013 1.00 65.99 ? 137 PHE A CZ 1 ATOM 1075 N N . ASP A 1 145 ? -8.484 -27.878 20.314 1.00 64.09 ? 138 ASP A N 1 ATOM 1076 C CA . ASP A 1 145 ? -7.659 -28.042 21.514 1.00 63.22 ? 138 ASP A CA 1 ATOM 1077 C C . ASP A 1 145 ? -8.321 -27.326 22.689 1.00 69.54 ? 138 ASP A C 1 ATOM 1078 O O . ASP A 1 145 ? -8.371 -27.883 23.790 1.00 70.26 ? 138 ASP A O 1 ATOM 1079 C CB . ASP A 1 145 ? -6.233 -27.537 21.290 1.00 63.86 ? 138 ASP A CB 1 ATOM 1080 C CG . ASP A 1 145 ? -5.509 -28.286 20.193 1.00 78.43 ? 138 ASP A CG 1 ATOM 1081 O OD1 . ASP A 1 145 ? -6.107 -28.493 19.115 1.00 80.98 ? 138 ASP A OD1 1 ATOM 1082 O OD2 . ASP A 1 145 ? -4.335 -28.635 20.391 1.00 86.18 ? 138 ASP A OD2 1 ATOM 1083 N N . ASN A 1 146 ? -8.868 -26.126 22.448 1.00 66.34 ? 139 ASN A N 1 ATOM 1084 C CA . ASN A 1 146 ? -9.584 -25.380 23.474 1.00 67.26 ? 139 ASN A CA 1 ATOM 1085 C C . ASN A 1 146 ? -10.876 -26.074 23.890 1.00 74.39 ? 139 ASN A C 1 ATOM 1086 O O . ASN A 1 146 ? -11.219 -26.046 25.072 1.00 74.24 ? 139 ASN A O 1 ATOM 1087 C CB . ASN A 1 146 ? -9.853 -23.944 23.031 1.00 67.78 ? 139 ASN A CB 1 ATOM 1088 C CG . ASN A 1 146 ? -8.651 -23.049 23.111 1.00 84.49 ? 139 ASN A CG 1 ATOM 1089 O OD1 . ASN A 1 146 ? -8.467 -22.160 22.298 1.00 82.80 ? 139 ASN A OD1 1 ATOM 1090 N ND2 . ASN A 1 146 ? -7.816 -23.239 24.100 1.00 78.80 ? 139 ASN A ND2 1 ATOM 1091 N N . ILE A 1 147 ? -11.587 -26.693 22.931 1.00 73.77 ? 140 ILE A N 1 ATOM 1092 C CA . ILE A 1 147 ? -12.816 -27.439 23.225 1.00 75.32 ? 140 ILE A CA 1 ATOM 1093 C C . ILE A 1 147 ? -12.462 -28.699 24.054 1.00 83.07 ? 140 ILE A C 1 ATOM 1094 O O . ILE A 1 147 ? -13.162 -29.002 25.027 1.00 83.46 ? 140 ILE A O 1 ATOM 1095 C CB . ILE A 1 147 ? -13.611 -27.796 21.948 1.00 78.02 ? 140 ILE A CB 1 ATOM 1096 C CG1 . ILE A 1 147 ? -14.185 -26.526 21.284 1.00 78.56 ? 140 ILE A CG1 1 ATOM 1097 C CG2 . ILE A 1 147 ? -14.730 -28.787 22.260 1.00 77.44 ? 140 ILE A CG2 1 ATOM 1098 C CD1 . ILE A 1 147 ? -14.739 -26.706 19.843 1.00 78.85 ? 140 ILE A CD1 1 ATOM 1099 N N . ILE A 1 148 ? -11.362 -29.403 23.684 1.00 78.74 ? 141 ILE A N 1 ATOM 1100 C CA . ILE A 1 148 ? -10.865 -30.559 24.429 1.00 78.56 ? 141 ILE A CA 1 ATOM 1101 C C . ILE A 1 148 ? -10.597 -30.176 25.880 1.00 84.51 ? 141 ILE A C 1 ATOM 1102 O O . ILE A 1 148 ? -11.057 -30.877 26.778 1.00 86.12 ? 141 ILE A O 1 ATOM 1103 C CB . ILE A 1 148 ? -9.607 -31.189 23.759 1.00 81.21 ? 141 ILE A CB 1 ATOM 1104 C CG1 . ILE A 1 148 ? -9.980 -31.954 22.482 1.00 81.97 ? 141 ILE A CG1 1 ATOM 1105 C CG2 . ILE A 1 148 ? -8.839 -32.100 24.723 1.00 79.92 ? 141 ILE A CG2 1 ATOM 1106 C CD1 . ILE A 1 148 ? -11.263 -32.978 22.689 1.00 101.17 ? 141 ILE A CD1 1 ATOM 1107 N N . SER A 1 149 ? -9.894 -29.053 26.106 1.00 81.33 ? 142 SER A N 1 ATOM 1108 C CA . SER A 1 149 ? -9.558 -28.537 27.437 1.00 82.01 ? 142 SER A CA 1 ATOM 1109 C C . SER A 1 149 ? -10.763 -28.378 28.358 1.00 88.02 ? 142 SER A C 1 ATOM 1110 O O . SER A 1 149 ? -10.611 -28.462 29.570 1.00 90.39 ? 142 SER A O 1 ATOM 1111 C CB . SER A 1 149 ? -8.808 -27.213 27.330 1.00 85.85 ? 142 SER A CB 1 ATOM 1112 O OG . SER A 1 149 ? -7.542 -27.400 26.715 1.00 94.31 ? 142 SER A OG 1 ATOM 1113 N N . GLN A 1 150 ? -11.950 -28.194 27.788 1.00 83.72 ? 143 GLN A N 1 ATOM 1114 C CA . GLN A 1 150 ? -13.201 -28.037 28.530 1.00 83.68 ? 143 GLN A CA 1 ATOM 1115 C C . GLN A 1 150 ? -13.697 -29.323 29.186 1.00 88.09 ? 143 GLN A C 1 ATOM 1116 O O . GLN A 1 150 ? -14.480 -29.248 30.134 1.00 87.32 ? 143 GLN A O 1 ATOM 1117 C CB . GLN A 1 150 ? -14.292 -27.511 27.605 1.00 84.78 ? 143 GLN A CB 1 ATOM 1118 C CG . GLN A 1 150 ? -14.069 -26.076 27.192 1.00 80.11 ? 143 GLN A CG 1 ATOM 1119 C CD . GLN A 1 150 ? -15.307 -25.468 26.625 1.00 100.14 ? 143 GLN A CD 1 ATOM 1120 O OE1 . GLN A 1 150 ? -15.533 -24.283 26.809 1.00 86.44 ? 143 GLN A OE1 1 ATOM 1121 N NE2 . GLN A 1 150 ? -16.120 -26.232 25.899 1.00 107.49 ? 143 GLN A NE2 1 ATOM 1122 N N . GLY A 1 151 ? -13.283 -30.470 28.645 1.00 85.39 ? 144 GLY A N 1 ATOM 1123 C CA . GLY A 1 151 ? -13.653 -31.791 29.140 1.00 86.50 ? 144 GLY A CA 1 ATOM 1124 C C . GLY A 1 151 ? -15.135 -32.108 29.058 1.00 93.16 ? 144 GLY A C 1 ATOM 1125 O O . GLY A 1 151 ? -15.675 -32.785 29.931 1.00 94.29 ? 144 GLY A O 1 ATOM 1126 N N . VAL A 1 152 ? -15.798 -31.635 28.002 1.00 89.59 ? 145 VAL A N 1 ATOM 1127 C CA . VAL A 1 152 ? -17.234 -31.839 27.763 1.00 88.35 ? 145 VAL A CA 1 ATOM 1128 C C . VAL A 1 152 ? -17.503 -32.937 26.723 1.00 91.71 ? 145 VAL A C 1 ATOM 1129 O O . VAL A 1 152 ? -18.564 -33.564 26.737 1.00 92.14 ? 145 VAL A O 1 ATOM 1130 C CB . VAL A 1 152 ? -17.963 -30.508 27.403 1.00 91.29 ? 145 VAL A CB 1 ATOM 1131 C CG1 . VAL A 1 152 ? -17.969 -29.550 28.581 1.00 90.65 ? 145 VAL A CG1 1 ATOM 1132 C CG2 . VAL A 1 152 ? -17.358 -29.830 26.169 1.00 91.21 ? 145 VAL A CG2 1 ATOM 1133 N N . LEU A 1 153 ? -16.549 -33.150 25.818 1.00 87.36 ? 146 LEU A N 1 ATOM 1134 C CA . LEU A 1 153 ? -16.695 -34.111 24.728 1.00 87.39 ? 146 LEU A CA 1 ATOM 1135 C C . LEU A 1 153 ? -16.497 -35.548 25.166 1.00 90.50 ? 146 LEU A C 1 ATOM 1136 O O . LEU A 1 153 ? -15.549 -35.841 25.892 1.00 90.46 ? 146 LEU A O 1 ATOM 1137 C CB . LEU A 1 153 ? -15.739 -33.788 23.551 1.00 87.16 ? 146 LEU A CB 1 ATOM 1138 C CG . LEU A 1 153 ? -15.872 -32.455 22.810 1.00 90.78 ? 146 LEU A CG 1 ATOM 1139 C CD1 . LEU A 1 153 ? -14.915 -32.420 21.689 1.00 90.06 ? 146 LEU A CD1 1 ATOM 1140 C CD2 . LEU A 1 153 ? -17.279 -32.222 22.275 1.00 93.22 ? 146 LEU A CD2 1 ATOM 1141 N N . LYS A 1 154 ? -17.364 -36.451 24.689 1.00 86.38 ? 147 LYS A N 1 ATOM 1142 C CA . LYS A 1 154 ? -17.290 -37.880 24.990 1.00 85.92 ? 147 LYS A CA 1 ATOM 1143 C C . LYS A 1 154 ? -15.976 -38.488 24.479 1.00 90.18 ? 147 LYS A C 1 ATOM 1144 O O . LYS A 1 154 ? -15.400 -39.359 25.131 1.00 89.94 ? 147 LYS A O 1 ATOM 1145 C CB . LYS A 1 154 ? -18.498 -38.611 24.385 1.00 87.87 ? 147 LYS A CB 1 ATOM 1146 C CG . LYS A 1 154 ? -18.631 -40.054 24.867 1.00 102.92 ? 147 LYS A CG 1 ATOM 1147 C CD . LYS A 1 154 ? -19.726 -40.848 24.155 1.00 112.92 ? 147 LYS A CD 1 ATOM 1148 C CE . LYS A 1 154 ? -19.988 -42.159 24.878 1.00 119.79 ? 147 LYS A CE 1 ATOM 1149 N NZ . LYS A 1 154 ? -21.205 -42.864 24.399 1.00 121.28 ? 147 LYS A NZ 1 ATOM 1150 N N . GLU A 1 155 ? -15.501 -38.017 23.325 1.00 87.46 ? 148 GLU A N 1 ATOM 1151 C CA . GLU A 1 155 ? -14.259 -38.504 22.729 1.00 87.61 ? 148 GLU A CA 1 ATOM 1152 C C . GLU A 1 155 ? -13.410 -37.373 22.162 1.00 91.70 ? 148 GLU A C 1 ATOM 1153 O O . GLU A 1 155 ? -13.930 -36.342 21.758 1.00 91.33 ? 148 GLU A O 1 ATOM 1154 C CB . GLU A 1 155 ? -14.560 -39.493 21.604 1.00 88.99 ? 148 GLU A CB 1 ATOM 1155 C CG . GLU A 1 155 ? -14.959 -40.885 22.042 1.00 97.07 ? 148 GLU A CG 1 ATOM 1156 C CD . GLU A 1 155 ? -15.243 -41.769 20.849 1.00 127.26 ? 148 GLU A CD 1 ATOM 1157 O OE1 . GLU A 1 155 ? -16.236 -41.490 20.139 1.00 133.12 ? 148 GLU A OE1 1 ATOM 1158 O OE2 . GLU A 1 155 ? -14.445 -42.702 20.588 1.00 124.46 ? 148 GLU A OE2 1 ATOM 1159 N N . ASP A 1 156 ? -12.106 -37.598 22.089 1.00 88.68 ? 149 ASP A N 1 ATOM 1160 C CA . ASP A 1 156 ? -11.159 -36.649 21.543 1.00 88.71 ? 149 ASP A CA 1 ATOM 1161 C C . ASP A 1 156 ? -11.125 -36.822 20.014 1.00 86.39 ? 149 ASP A C 1 ATOM 1162 O O . ASP A 1 156 ? -10.050 -36.989 19.427 1.00 85.51 ? 149 ASP A O 1 ATOM 1163 C CB . ASP A 1 156 ? -9.770 -36.950 22.139 1.00 92.96 ? 149 ASP A CB 1 ATOM 1164 C CG . ASP A 1 156 ? -8.771 -35.807 22.048 1.00 116.26 ? 149 ASP A CG 1 ATOM 1165 O OD1 . ASP A 1 156 ? -9.058 -34.807 21.338 1.00 120.30 ? 149 ASP A OD1 1 ATOM 1166 O OD2 . ASP A 1 156 ? -7.691 -35.929 22.621 1.00 122.83 ? 149 ASP A OD2 1 ATOM 1167 N N . VAL A 1 157 ? -12.303 -36.831 19.377 1.00 78.78 ? 150 VAL A N 1 ATOM 1168 C CA . VAL A 1 157 ? -12.425 -37.040 17.933 1.00 76.78 ? 150 VAL A CA 1 ATOM 1169 C C . VAL A 1 157 ? -13.419 -36.061 17.308 1.00 78.43 ? 150 VAL A C 1 ATOM 1170 O O . VAL A 1 157 ? -14.296 -35.529 17.998 1.00 78.62 ? 150 VAL A O 1 ATOM 1171 C CB . VAL A 1 157 ? -12.814 -38.527 17.560 1.00 79.36 ? 150 VAL A CB 1 ATOM 1172 C CG1 . VAL A 1 157 ? -11.953 -39.554 18.273 1.00 79.32 ? 150 VAL A CG1 1 ATOM 1173 C CG2 . VAL A 1 157 ? -14.285 -38.811 17.810 1.00 78.74 ? 150 VAL A CG2 1 ATOM 1174 N N . PHE A 1 158 ? -13.332 -35.892 15.985 1.00 71.10 ? 151 PHE A N 1 ATOM 1175 C CA . PHE A 1 158 ? -14.335 -35.166 15.214 1.00 68.62 ? 151 PHE A CA 1 ATOM 1176 C C . PHE A 1 158 ? -14.498 -35.838 13.851 1.00 69.85 ? 151 PHE A C 1 ATOM 1177 O O . PHE A 1 158 ? -13.539 -36.394 13.300 1.00 69.31 ? 151 PHE A O 1 ATOM 1178 C CB . PHE A 1 158 ? -14.080 -33.654 15.140 1.00 69.73 ? 151 PHE A CB 1 ATOM 1179 C CG . PHE A 1 158 ? -12.768 -33.270 14.515 1.00 70.55 ? 151 PHE A CG 1 ATOM 1180 C CD1 . PHE A 1 158 ? -12.657 -33.107 13.143 1.00 73.19 ? 151 PHE A CD1 1 ATOM 1181 C CD2 . PHE A 1 158 ? -11.646 -33.066 15.297 1.00 72.45 ? 151 PHE A CD2 1 ATOM 1182 C CE1 . PHE A 1 158 ? -11.444 -32.758 12.567 1.00 73.80 ? 151 PHE A CE1 1 ATOM 1183 C CE2 . PHE A 1 158 ? -10.430 -32.727 14.719 1.00 74.76 ? 151 PHE A CE2 1 ATOM 1184 C CZ . PHE A 1 158 ? -10.337 -32.571 13.358 1.00 72.79 ? 151 PHE A CZ 1 ATOM 1185 N N . SER A 1 159 ? -15.713 -35.804 13.322 1.00 64.56 ? 152 SER A N 1 ATOM 1186 C CA . SER A 1 159 ? -16.054 -36.501 12.085 1.00 63.02 ? 152 SER A CA 1 ATOM 1187 C C . SER A 1 159 ? -16.701 -35.607 11.046 1.00 63.91 ? 152 SER A C 1 ATOM 1188 O O . SER A 1 159 ? -17.475 -34.696 11.377 1.00 62.79 ? 152 SER A O 1 ATOM 1189 C CB . SER A 1 159 ? -16.993 -37.660 12.403 1.00 67.41 ? 152 SER A CB 1 ATOM 1190 O OG . SER A 1 159 ? -16.382 -38.587 13.284 1.00 77.54 ? 152 SER A OG 1 ATOM 1191 N N . PHE A 1 160 ? -16.436 -35.922 9.779 1.00 58.98 ? 153 PHE A N 1 ATOM 1192 C CA . PHE A 1 160 ? -16.982 -35.183 8.653 1.00 57.78 ? 153 PHE A CA 1 ATOM 1193 C C . PHE A 1 160 ? -17.816 -36.035 7.751 1.00 58.34 ? 153 PHE A C 1 ATOM 1194 O O . PHE A 1 160 ? -17.370 -37.097 7.301 1.00 56.77 ? 153 PHE A O 1 ATOM 1195 C CB . PHE A 1 160 ? -15.852 -34.573 7.803 1.00 59.14 ? 153 PHE A CB 1 ATOM 1196 C CG . PHE A 1 160 ? -15.314 -33.270 8.329 1.00 60.46 ? 153 PHE A CG 1 ATOM 1197 C CD1 . PHE A 1 160 ? -14.557 -33.233 9.497 1.00 63.71 ? 153 PHE A CD1 1 ATOM 1198 C CD2 . PHE A 1 160 ? -15.538 -32.075 7.640 1.00 62.33 ? 153 PHE A CD2 1 ATOM 1199 C CE1 . PHE A 1 160 ? -14.055 -32.022 9.985 1.00 65.26 ? 153 PHE A CE1 1 ATOM 1200 C CE2 . PHE A 1 160 ? -15.028 -30.859 8.123 1.00 66.35 ? 153 PHE A CE2 1 ATOM 1201 C CZ . PHE A 1 160 ? -14.277 -30.841 9.284 1.00 64.96 ? 153 PHE A CZ 1 ATOM 1202 N N . TYR A 1 161 ? -19.009 -35.534 7.465 1.00 54.94 ? 154 TYR A N 1 ATOM 1203 C CA . TYR A 1 161 ? -19.897 -36.073 6.451 1.00 55.89 ? 154 TYR A CA 1 ATOM 1204 C C . TYR A 1 161 ? -20.109 -34.939 5.436 1.00 61.44 ? 154 TYR A C 1 ATOM 1205 O O . TYR A 1 161 ? -20.480 -33.816 5.821 1.00 62.61 ? 154 TYR A O 1 ATOM 1206 C CB . TYR A 1 161 ? -21.251 -36.510 7.046 1.00 57.37 ? 154 TYR A CB 1 ATOM 1207 C CG . TYR A 1 161 ? -22.327 -36.758 6.008 1.00 57.00 ? 154 TYR A CG 1 ATOM 1208 C CD1 . TYR A 1 161 ? -22.211 -37.805 5.092 1.00 59.87 ? 154 TYR A CD1 1 ATOM 1209 C CD2 . TYR A 1 161 ? -23.444 -35.926 5.921 1.00 54.81 ? 154 TYR A CD2 1 ATOM 1210 C CE1 . TYR A 1 161 ? -23.176 -38.019 4.111 1.00 60.47 ? 154 TYR A CE1 1 ATOM 1211 C CE2 . TYR A 1 161 ? -24.415 -36.131 4.952 1.00 54.91 ? 154 TYR A CE2 1 ATOM 1212 C CZ . TYR A 1 161 ? -24.280 -37.182 4.046 1.00 66.07 ? 154 TYR A CZ 1 ATOM 1213 O OH . TYR A 1 161 ? -25.236 -37.422 3.080 1.00 69.21 ? 154 TYR A OH 1 ATOM 1214 N N . TYR A 1 162 ? -19.851 -35.226 4.160 1.00 56.66 ? 155 TYR A N 1 ATOM 1215 C CA . TYR A 1 162 ? -20.099 -34.282 3.072 1.00 56.29 ? 155 TYR A CA 1 ATOM 1216 C C . TYR A 1 162 ? -21.075 -34.965 2.108 1.00 61.69 ? 155 TYR A C 1 ATOM 1217 O O . TYR A 1 162 ? -20.754 -36.016 1.551 1.00 61.64 ? 155 TYR A O 1 ATOM 1218 C CB . TYR A 1 162 ? -18.797 -33.931 2.331 1.00 56.59 ? 155 TYR A CB 1 ATOM 1219 C CG . TYR A 1 162 ? -17.872 -32.901 2.964 1.00 58.42 ? 155 TYR A CG 1 ATOM 1220 C CD1 . TYR A 1 162 ? -18.238 -32.202 4.119 1.00 59.74 ? 155 TYR A CD1 1 ATOM 1221 C CD2 . TYR A 1 162 ? -16.640 -32.602 2.390 1.00 59.54 ? 155 TYR A CD2 1 ATOM 1222 C CE1 . TYR A 1 162 ? -17.385 -31.243 4.686 1.00 58.29 ? 155 TYR A CE1 1 ATOM 1223 C CE2 . TYR A 1 162 ? -15.795 -31.625 2.936 1.00 59.64 ? 155 TYR A CE2 1 ATOM 1224 C CZ . TYR A 1 162 ? -16.172 -30.949 4.077 1.00 58.26 ? 155 TYR A CZ 1 ATOM 1225 O OH . TYR A 1 162 ? -15.309 -30.007 4.571 1.00 54.10 ? 155 TYR A OH 1 ATOM 1226 N N . ASN A 1 163 ? -22.260 -34.391 1.929 1.00 60.44 ? 156 ASN A N 1 ATOM 1227 C CA . ASN A 1 163 ? -23.269 -34.945 1.038 1.00 61.90 ? 156 ASN A CA 1 ATOM 1228 C C . ASN A 1 163 ? -22.927 -34.743 -0.417 1.00 71.20 ? 156 ASN A C 1 ATOM 1229 O O . ASN A 1 163 ? -22.225 -33.787 -0.779 1.00 72.62 ? 156 ASN A O 1 ATOM 1230 C CB . ASN A 1 163 ? -24.666 -34.382 1.360 1.00 62.62 ? 156 ASN A CB 1 ATOM 1231 C CG . ASN A 1 163 ? -25.832 -35.208 0.864 1.00 82.51 ? 156 ASN A CG 1 ATOM 1232 O OD1 . ASN A 1 163 ? -25.688 -36.137 0.073 1.00 76.98 ? 156 ASN A OD1 1 ATOM 1233 N ND2 . ASN A 1 163 ? -27.023 -34.887 1.329 1.00 76.50 ? 156 ASN A ND2 1 ATOM 1234 N N . ARG A 1 164 ? -23.365 -35.729 -1.224 1.00 70.07 ? 157 ARG A N 1 ATOM 1235 C CA . ARG A 1 164 ? -23.224 -35.748 -2.672 1.00 72.70 ? 157 ARG A CA 1 ATOM 1236 C C . ARG A 1 164 ? -24.268 -34.858 -3.317 1.00 83.22 ? 157 ARG A C 1 ATOM 1237 O O . ARG A 1 164 ? -24.116 -34.485 -4.475 1.00 84.86 ? 157 ARG A O 1 ATOM 1238 C CB . ARG A 1 164 ? -23.389 -37.174 -3.213 1.00 75.36 ? 157 ARG A CB 1 ATOM 1239 C CG . ARG A 1 164 ? -22.300 -38.160 -2.803 1.00 90.93 ? 157 ARG A CG 1 ATOM 1240 C CD . ARG A 1 164 ? -22.802 -39.570 -3.048 1.00 98.81 ? 157 ARG A CD 1 ATOM 1241 N NE . ARG A 1 164 ? -21.712 -40.538 -3.086 1.00 93.76 ? 157 ARG A NE 1 ATOM 1242 C CZ . ARG A 1 164 ? -21.504 -41.443 -2.148 1.00 101.59 ? 157 ARG A CZ 1 ATOM 1243 N NH1 . ARG A 1 164 ? -22.301 -41.507 -1.094 1.00 87.46 ? 157 ARG A NH1 1 ATOM 1244 N NH2 . ARG A 1 164 ? -20.504 -42.303 -2.261 1.00 92.14 ? 157 ARG A NH2 1 ATOM 1245 N N . ASP A 1 165 ? -25.348 -34.563 -2.602 1.00 84.10 ? 158 ASP A N 1 ATOM 1246 C CA . ASP A 1 165 ? -26.423 -33.746 -3.127 1.00 86.95 ? 158 ASP A CA 1 ATOM 1247 C C . ASP A 1 165 ? -26.242 -32.299 -2.685 1.00 94.92 ? 158 ASP A C 1 ATOM 1248 O O . ASP A 1 165 ? -26.195 -32.014 -1.475 1.00 95.72 ? 158 ASP A O 1 ATOM 1249 C CB . ASP A 1 165 ? -27.794 -34.315 -2.720 1.00 90.06 ? 158 ASP A CB 1 ATOM 1250 C CG . ASP A 1 165 ? -28.904 -33.902 -3.665 1.00 108.48 ? 158 ASP A CG 1 ATOM 1251 O OD1 . ASP A 1 165 ? -29.269 -32.683 -3.666 1.00 111.45 ? 158 ASP A OD1 1 ATOM 1252 O OD2 . ASP A 1 165 ? -29.410 -34.787 -4.409 1.00 111.36 ? 158 ASP A OD2 1 ATOM 1253 N N . SER A 1 166 ? -26.096 -31.396 -3.668 1.00 92.67 ? 159 SER A N 1 ATOM 1254 C CA . SER A 1 166 ? -25.873 -29.977 -3.397 1.00 94.04 ? 159 SER A CA 1 ATOM 1255 C C . SER A 1 166 ? -27.084 -29.148 -3.736 1.00 104.08 ? 159 SER A C 1 ATOM 1256 O O . SER A 1 166 ? -27.215 -28.003 -3.279 1.00 102.96 ? 159 SER A O 1 ATOM 1257 C CB . SER A 1 166 ? -24.687 -29.466 -4.206 1.00 94.85 ? 159 SER A CB 1 ATOM 1258 O OG . SER A 1 166 ? -25.059 -29.228 -5.549 1.00 94.23 ? 159 SER A OG 1 ATOM 1259 N N . GLU A 1 167 ? -27.941 -29.712 -4.587 1.00 106.11 ? 160 GLU A N 1 ATOM 1260 C CA . GLU A 1 167 ? -29.101 -29.015 -5.095 1.00 108.33 ? 160 GLU A CA 1 ATOM 1261 C C . GLU A 1 167 ? -30.275 -28.956 -4.136 1.00 117.17 ? 160 GLU A C 1 ATOM 1262 O O . GLU A 1 167 ? -30.320 -28.061 -3.283 1.00 118.25 ? 160 GLU A O 1 ATOM 1263 C CB . GLU A 1 167 ? -29.483 -29.472 -6.521 1.00 109.93 ? 160 GLU A CB 1 ATOM 1264 C CG . GLU A 1 167 ? -29.639 -30.974 -6.719 1.00 123.45 ? 160 GLU A CG 1 ATOM 1265 C CD . GLU A 1 167 ? -30.525 -31.340 -7.895 1.00 151.56 ? 160 GLU A CD 1 ATOM 1266 O OE1 . GLU A 1 167 ? -30.063 -31.199 -9.051 1.00 156.77 ? 160 GLU A OE1 1 ATOM 1267 O OE2 . GLU A 1 167 ? -31.673 -31.786 -7.664 1.00 143.01 ? 160 GLU A OE2 1 ATOM 1268 N N . ASN A 1 168 A -31.207 -29.905 -4.260 1.00 115.26 ? 160 ASN A N 1 ATOM 1269 C CA . ASN A 1 168 A -32.452 -29.936 -3.516 1.00 115.99 ? 160 ASN A CA 1 ATOM 1270 C C . ASN A 1 168 A -32.354 -29.692 -2.032 1.00 120.38 ? 160 ASN A C 1 ATOM 1271 O O . ASN A 1 168 A -31.419 -30.160 -1.383 1.00 119.84 ? 160 ASN A O 1 ATOM 1272 C CB . ASN A 1 168 A -33.272 -31.185 -3.845 1.00 119.87 ? 160 ASN A CB 1 ATOM 1273 C CG . ASN A 1 168 A -34.096 -31.064 -5.124 1.00 144.95 ? 160 ASN A CG 1 ATOM 1274 O OD1 . ASN A 1 168 A -34.110 -30.028 -5.810 1.00 137.65 ? 160 ASN A OD1 1 ATOM 1275 N ND2 . ASN A 1 168 A -34.818 -32.122 -5.470 1.00 135.23 ? 160 ASN A ND2 1 ATOM 1276 N N . SER A 1 169 B -33.321 -28.931 -1.502 1.00 117.48 ? 160 SER A N 1 ATOM 1277 C CA . SER A 1 169 B -33.425 -28.646 -0.070 1.00 117.41 ? 160 SER A CA 1 ATOM 1278 C C . SER A 1 169 B -33.816 -29.953 0.649 1.00 120.51 ? 160 SER A C 1 ATOM 1279 O O . SER A 1 169 B -34.024 -30.978 -0.018 1.00 121.11 ? 160 SER A O 1 ATOM 1280 C CB . SER A 1 169 B -34.472 -27.564 0.175 1.00 121.18 ? 160 SER A CB 1 ATOM 1281 O OG . SER A 1 169 B -34.204 -26.436 -0.642 1.00 129.43 ? 160 SER A OG 1 ATOM 1282 N N . GLN A 1 170 C -33.889 -29.938 1.998 1.00 114.56 ? 160 GLN A N 1 ATOM 1283 C CA . GLN A 1 170 C -34.253 -31.113 2.819 1.00 113.19 ? 160 GLN A CA 1 ATOM 1284 C C . GLN A 1 170 C -33.218 -32.262 2.748 1.00 113.15 ? 160 GLN A C 1 ATOM 1285 O O . GLN A 1 170 C -33.435 -33.317 3.365 1.00 112.97 ? 160 GLN A O 1 ATOM 1286 C CB . GLN A 1 170 C -35.670 -31.667 2.475 1.00 114.86 ? 160 GLN A CB 1 ATOM 1287 C CG . GLN A 1 170 C -36.785 -30.637 2.282 1.00 132.39 ? 160 GLN A CG 1 ATOM 1288 C CD . GLN A 1 170 C -37.585 -30.412 3.536 1.00 155.08 ? 160 GLN A CD 1 ATOM 1289 O OE1 . GLN A 1 170 C -38.750 -30.826 3.643 1.00 151.70 ? 160 GLN A OE1 1 ATOM 1290 N NE2 . GLN A 1 170 C -36.988 -29.728 4.507 1.00 146.73 ? 160 GLN A NE2 1 ATOM 1291 N N . SER A 1 171 D -32.105 -32.070 2.004 1.00 105.82 ? 160 SER A N 1 ATOM 1292 C CA . SER A 1 171 D -31.081 -33.101 1.877 1.00 103.75 ? 160 SER A CA 1 ATOM 1293 C C . SER A 1 171 D -30.104 -33.089 3.043 1.00 101.75 ? 160 SER A C 1 ATOM 1294 O O . SER A 1 171 D -29.820 -34.163 3.598 1.00 102.99 ? 160 SER A O 1 ATOM 1295 C CB . SER A 1 171 D -30.336 -32.993 0.544 1.00 108.23 ? 160 SER A CB 1 ATOM 1296 O OG . SER A 1 171 D -29.775 -31.708 0.328 1.00 119.73 ? 160 SER A OG 1 ATOM 1297 N N . LEU A 1 172 ? -29.619 -31.873 3.428 1.00 90.31 ? 161 LEU A N 1 ATOM 1298 C CA . LEU A 1 172 ? -28.567 -31.620 4.428 1.00 86.30 ? 161 LEU A CA 1 ATOM 1299 C C . LEU A 1 172 ? -27.232 -31.741 3.704 1.00 81.02 ? 161 LEU A C 1 ATOM 1300 O O . LEU A 1 172 ? -26.827 -32.837 3.312 1.00 78.76 ? 161 LEU A O 1 ATOM 1301 C CB . LEU A 1 172 ? -28.614 -32.563 5.649 1.00 86.13 ? 161 LEU A CB 1 ATOM 1302 C CG . LEU A 1 172 ? -27.420 -32.500 6.595 1.00 90.75 ? 161 LEU A CG 1 ATOM 1303 C CD1 . LEU A 1 172 ? -27.841 -32.086 7.967 1.00 91.42 ? 161 LEU A CD1 1 ATOM 1304 C CD2 . LEU A 1 172 ? -26.707 -33.816 6.642 1.00 90.56 ? 161 LEU A CD2 1 ATOM 1305 N N . GLY A 1 173 ? -26.577 -30.601 3.540 1.00 72.61 ? 162 GLY A N 1 ATOM 1306 C CA . GLY A 1 173 ? -25.311 -30.487 2.832 1.00 70.15 ? 162 GLY A CA 1 ATOM 1307 C C . GLY A 1 173 ? -24.149 -31.290 3.397 1.00 69.04 ? 162 GLY A C 1 ATOM 1308 O O . GLY A 1 173 ? -23.289 -31.778 2.666 1.00 68.58 ? 162 GLY A O 1 ATOM 1309 N N . GLY A 1 174 ? -24.114 -31.403 4.697 1.00 61.88 ? 163 GLY A N 1 ATOM 1310 C CA . GLY A 1 174 ? -23.051 -32.102 5.379 1.00 61.00 ? 163 GLY A CA 1 ATOM 1311 C C . GLY A 1 174 ? -23.167 -31.878 6.866 1.00 64.52 ? 163 GLY A C 1 ATOM 1312 O O . GLY A 1 174 ? -24.092 -31.185 7.328 1.00 64.43 ? 163 GLY A O 1 ATOM 1313 N N . GLN A 1 175 ? -22.243 -32.473 7.619 1.00 60.39 ? 164 GLN A N 1 ATOM 1314 C CA . GLN A 1 175 ? -22.296 -32.447 9.065 1.00 61.06 ? 164 GLN A CA 1 ATOM 1315 C C . GLN A 1 175 ? -20.940 -32.729 9.675 1.00 68.49 ? 164 GLN A C 1 ATOM 1316 O O . GLN A 1 175 ? -20.225 -33.646 9.240 1.00 69.59 ? 164 GLN A O 1 ATOM 1317 C CB . GLN A 1 175 ? -23.301 -33.528 9.538 1.00 62.18 ? 164 GLN A CB 1 ATOM 1318 C CG . GLN A 1 175 ? -23.520 -33.618 11.039 1.00 70.15 ? 164 GLN A CG 1 ATOM 1319 C CD . GLN A 1 175 ? -23.991 -34.988 11.450 1.00 76.29 ? 164 GLN A CD 1 ATOM 1320 O OE1 . GLN A 1 175 ? -23.382 -36.007 11.133 1.00 69.59 ? 164 GLN A OE1 1 ATOM 1321 N NE2 . GLN A 1 175 ? -25.085 -35.031 12.186 1.00 66.42 ? 164 GLN A NE2 1 ATOM 1322 N N . ILE A 1 176 ? -20.596 -31.943 10.692 1.00 65.14 ? 165 ILE A N 1 ATOM 1323 C CA . ILE A 1 176 ? -19.429 -32.209 11.515 1.00 65.46 ? 165 ILE A CA 1 ATOM 1324 C C . ILE A 1 176 ? -19.974 -32.642 12.859 1.00 71.67 ? 165 ILE A C 1 ATOM 1325 O O . ILE A 1 176 ? -20.865 -31.977 13.416 1.00 71.29 ? 165 ILE A O 1 ATOM 1326 C CB . ILE A 1 176 ? -18.495 -30.992 11.720 1.00 67.80 ? 165 ILE A CB 1 ATOM 1327 C CG1 . ILE A 1 176 ? -18.217 -30.294 10.381 1.00 68.74 ? 165 ILE A CG1 1 ATOM 1328 C CG2 . ILE A 1 176 ? -17.231 -31.373 12.524 1.00 65.55 ? 165 ILE A CG2 1 ATOM 1329 C CD1 . ILE A 1 176 ? -17.506 -29.278 10.372 1.00 75.54 ? 165 ILE A CD1 1 ATOM 1330 N N . VAL A 1 177 ? -19.430 -33.737 13.386 1.00 69.37 ? 166 VAL A N 1 ATOM 1331 C CA . VAL A 1 177 ? -19.766 -34.182 14.738 1.00 69.86 ? 166 VAL A CA 1 ATOM 1332 C C . VAL A 1 177 ? -18.517 -33.934 15.576 1.00 73.01 ? 166 VAL A C 1 ATOM 1333 O O . VAL A 1 177 ? -17.435 -34.434 15.239 1.00 71.22 ? 166 VAL A O 1 ATOM 1334 C CB . VAL A 1 177 ? -20.224 -35.670 14.827 1.00 73.81 ? 166 VAL A CB 1 ATOM 1335 C CG1 . VAL A 1 177 ? -20.452 -36.078 16.276 1.00 73.29 ? 166 VAL A CG1 1 ATOM 1336 C CG2 . VAL A 1 177 ? -21.477 -35.918 13.997 1.00 73.55 ? 166 VAL A CG2 1 ATOM 1337 N N . LEU A 1 178 ? -18.667 -33.143 16.638 1.00 69.65 ? 167 LEU A N 1 ATOM 1338 C CA . LEU A 1 178 ? -17.590 -32.897 17.585 1.00 69.57 ? 167 LEU A CA 1 ATOM 1339 C C . LEU A 1 178 ? -17.763 -33.885 18.744 1.00 74.18 ? 167 LEU A C 1 ATOM 1340 O O . LEU A 1 178 ? -18.820 -33.926 19.377 1.00 71.42 ? 167 LEU A O 1 ATOM 1341 C CB . LEU A 1 178 ? -17.608 -31.446 18.094 1.00 69.16 ? 167 LEU A CB 1 ATOM 1342 C CG . LEU A 1 178 ? -17.520 -30.353 17.042 1.00 72.97 ? 167 LEU A CG 1 ATOM 1343 C CD1 . LEU A 1 178 ? -17.622 -28.977 17.676 1.00 73.12 ? 167 LEU A CD1 1 ATOM 1344 C CD2 . LEU A 1 178 ? -16.230 -30.454 16.221 1.00 72.32 ? 167 LEU A CD2 1 ATOM 1345 N N . GLY A 1 179 ? -16.758 -34.715 18.959 1.00 73.21 ? 168 GLY A N 1 ATOM 1346 C CA . GLY A 1 179 ? -16.787 -35.676 20.052 1.00 74.58 ? 168 GLY A CA 1 ATOM 1347 C C . GLY A 1 179 ? -17.236 -37.078 19.701 1.00 81.52 ? 168 GLY A C 1 ATOM 1348 O O . GLY A 1 179 ? -17.407 -37.900 20.596 1.00 82.85 ? 168 GLY A O 1 ATOM 1349 N N . GLY A 1 180 ? -17.438 -37.349 18.419 1.00 78.04 ? 169 GLY A N 1 ATOM 1350 C CA . GLY A 1 180 ? -17.866 -38.657 17.947 1.00 77.22 ? 169 GLY A CA 1 ATOM 1351 C C . GLY A 1 180 ? -18.115 -38.736 16.461 1.00 79.88 ? 169 GLY A C 1 ATOM 1352 O O . GLY A 1 180 ? -17.536 -37.976 15.686 1.00 79.95 ? 169 GLY A O 1 ATOM 1353 N N . SER A 1 181 ? -18.993 -39.667 16.069 1.00 75.45 ? 170 SER A N 1 ATOM 1354 C CA . SER A 1 181 ? -19.397 -39.956 14.694 1.00 75.15 ? 170 SER A CA 1 ATOM 1355 C C . SER A 1 181 ? -20.884 -40.175 14.635 1.00 80.00 ? 170 SER A C 1 ATOM 1356 O O . SER A 1 181 ? -21.491 -40.490 15.649 1.00 82.35 ? 170 SER A O 1 ATOM 1357 C CB . SER A 1 181 ? -18.703 -41.214 14.177 1.00 79.14 ? 170 SER A CB 1 ATOM 1358 O OG . SER A 1 181 ? -17.366 -40.926 13.813 1.00 94.81 ? 170 SER A OG 1 ATOM 1359 N N . ASP A 1 182 ? -21.482 -40.008 13.455 1.00 74.82 ? 171 ASP A N 1 ATOM 1360 C CA . ASP A 1 182 ? -22.896 -40.236 13.275 1.00 73.21 ? 171 ASP A CA 1 ATOM 1361 C C . ASP A 1 182 ? -23.133 -41.486 12.409 1.00 79.06 ? 171 ASP A C 1 ATOM 1362 O O . ASP A 1 182 ? -22.976 -41.440 11.182 1.00 76.65 ? 171 ASP A O 1 ATOM 1363 C CB . ASP A 1 182 ? -23.603 -38.998 12.727 1.00 73.49 ? 171 ASP A CB 1 ATOM 1364 C CG . ASP A 1 182 ? -25.119 -39.096 12.700 1.00 76.65 ? 171 ASP A CG 1 ATOM 1365 O OD1 . ASP A 1 182 ? -25.662 -40.193 12.999 1.00 74.72 ? 171 ASP A OD1 1 ATOM 1366 O OD2 . ASP A 1 182 ? -25.764 -38.087 12.385 1.00 82.45 ? 171 ASP A OD2 1 ATOM 1367 N N . PRO A 1 183 ? -23.553 -42.599 13.073 1.00 79.26 ? 172 PRO A N 1 ATOM 1368 C CA . PRO A 1 183 ? -23.851 -43.864 12.356 1.00 79.30 ? 172 PRO A CA 1 ATOM 1369 C C . PRO A 1 183 ? -24.888 -43.747 11.236 1.00 81.40 ? 172 PRO A C 1 ATOM 1370 O O . PRO A 1 183 ? -24.908 -44.585 10.325 1.00 81.20 ? 172 PRO A O 1 ATOM 1371 C CB . PRO A 1 183 ? -24.362 -44.777 13.464 1.00 80.97 ? 172 PRO A CB 1 ATOM 1372 C CG . PRO A 1 183 ? -23.745 -44.232 14.703 1.00 85.42 ? 172 PRO A CG 1 ATOM 1373 C CD . PRO A 1 183 ? -23.735 -42.760 14.529 1.00 80.71 ? 172 PRO A CD 1 ATOM 1374 N N . GLN A 1 184 ? -25.739 -42.703 11.296 1.00 75.14 ? 173 GLN A N 1 ATOM 1375 C CA . GLN A 1 184 ? -26.723 -42.429 10.246 1.00 73.82 ? 173 GLN A CA 1 ATOM 1376 C C . GLN A 1 184 ? -26.080 -42.099 8.899 1.00 75.36 ? 173 GLN A C 1 ATOM 1377 O O . GLN A 1 184 ? -26.737 -42.254 7.870 1.00 75.33 ? 173 GLN A O 1 ATOM 1378 C CB . GLN A 1 184 ? -27.646 -41.271 10.652 1.00 75.18 ? 173 GLN A CB 1 ATOM 1379 C CG . GLN A 1 184 ? -28.776 -41.681 11.599 1.00 106.90 ? 173 GLN A CG 1 ATOM 1380 C CD . GLN A 1 184 ? -29.961 -42.264 10.854 1.00 134.10 ? 173 GLN A CD 1 ATOM 1381 O OE1 . GLN A 1 184 ? -30.721 -41.540 10.188 1.00 132.37 ? 173 GLN A OE1 1 ATOM 1382 N NE2 . GLN A 1 184 ? -30.199 -43.568 10.984 1.00 121.99 ? 173 GLN A NE2 1 ATOM 1383 N N . HIS A 1 185 ? -24.795 -41.672 8.903 1.00 69.74 ? 174 HIS A N 1 ATOM 1384 C CA . HIS A 1 185 ? -24.097 -41.216 7.710 1.00 68.36 ? 174 HIS A CA 1 ATOM 1385 C C . HIS A 1 185 ? -22.980 -42.088 7.182 1.00 75.59 ? 174 HIS A C 1 ATOM 1386 O O . HIS A 1 185 ? -22.312 -41.715 6.214 1.00 76.99 ? 174 HIS A O 1 ATOM 1387 C CB . HIS A 1 185 ? -23.706 -39.742 7.855 1.00 68.05 ? 174 HIS A CB 1 ATOM 1388 C CG . HIS A 1 185 ? -24.901 -38.826 7.967 1.00 70.69 ? 174 HIS A CG 1 ATOM 1389 N ND1 . HIS A 1 185 ? -25.860 -38.747 6.951 1.00 71.28 ? 174 HIS A ND1 1 ATOM 1390 C CD2 . HIS A 1 185 ? -25.259 -37.978 8.966 1.00 70.93 ? 174 HIS A CD2 1 ATOM 1391 C CE1 . HIS A 1 185 ? -26.756 -37.867 7.372 1.00 69.68 ? 174 HIS A CE1 1 ATOM 1392 N NE2 . HIS A 1 185 ? -26.438 -37.371 8.571 1.00 70.03 ? 174 HIS A NE2 1 ATOM 1393 N N . TYR A 1 186 ? -22.789 -43.264 7.783 1.00 72.54 ? 175 TYR A N 1 ATOM 1394 C CA . TYR A 1 186 ? -21.802 -44.218 7.283 1.00 71.50 ? 175 TYR A CA 1 ATOM 1395 C C . TYR A 1 186 ? -22.314 -45.641 7.450 1.00 73.88 ? 175 TYR A C 1 ATOM 1396 O O . TYR A 1 186 ? -23.251 -45.894 8.199 1.00 72.77 ? 175 TYR A O 1 ATOM 1397 C CB . TYR A 1 186 ? -20.404 -44.016 7.907 1.00 71.96 ? 175 TYR A CB 1 ATOM 1398 C CG . TYR A 1 186 ? -20.319 -44.345 9.385 1.00 74.23 ? 175 TYR A CG 1 ATOM 1399 C CD1 . TYR A 1 186 ? -20.536 -43.361 10.354 1.00 76.95 ? 175 TYR A CD1 1 ATOM 1400 C CD2 . TYR A 1 186 ? -19.976 -45.630 9.818 1.00 74.48 ? 175 TYR A CD2 1 ATOM 1401 C CE1 . TYR A 1 186 ? -20.422 -43.646 11.714 1.00 78.71 ? 175 TYR A CE1 1 ATOM 1402 C CE2 . TYR A 1 186 ? -19.871 -45.932 11.176 1.00 74.98 ? 175 TYR A CE2 1 ATOM 1403 C CZ . TYR A 1 186 ? -20.106 -44.935 12.122 1.00 84.57 ? 175 TYR A CZ 1 ATOM 1404 O OH . TYR A 1 186 ? -20.015 -45.203 13.469 1.00 86.75 ? 175 TYR A OH 1 ATOM 1405 N N . GLU A 1 187 ? -21.711 -46.561 6.727 1.00 70.35 ? 176 GLU A N 1 ATOM 1406 C CA . GLU A 1 187 ? -22.041 -47.970 6.821 1.00 69.27 ? 176 GLU A CA 1 ATOM 1407 C C . GLU A 1 187 ? -20.793 -48.802 6.873 1.00 75.24 ? 176 GLU A C 1 ATOM 1408 O O . GLU A 1 187 ? -19.725 -48.372 6.426 1.00 73.32 ? 176 GLU A O 1 ATOM 1409 C CB . GLU A 1 187 ? -23.019 -48.426 5.739 1.00 69.84 ? 176 GLU A CB 1 ATOM 1410 C CG . GLU A 1 187 ? -22.515 -48.255 4.335 1.00 69.42 ? 176 GLU A CG 1 ATOM 1411 C CD . GLU A 1 187 ? -23.601 -48.521 3.332 1.00 81.13 ? 176 GLU A CD 1 ATOM 1412 O OE1 . GLU A 1 187 ? -24.767 -48.778 3.733 1.00 71.04 ? 176 GLU A OE1 1 ATOM 1413 O OE2 . GLU A 1 187 ? -23.298 -48.335 2.135 1.00 71.09 ? 176 GLU A OE2 1 ATOM 1414 N N . GLY A 1 188 ? -20.922 -49.967 7.477 1.00 75.41 ? 177 GLY A N 1 ATOM 1415 C CA . GLY A 1 188 ? -19.783 -50.833 7.719 1.00 76.32 ? 177 GLY A CA 1 ATOM 1416 C C . GLY A 1 188 ? -18.985 -50.281 8.884 1.00 83.11 ? 177 GLY A C 1 ATOM 1417 O O . GLY A 1 188 ? -19.468 -49.469 9.700 1.00 80.92 ? 177 GLY A O 1 ATOM 1418 N N . ASN A 1 189 ? -17.747 -50.712 8.947 1.00 84.95 ? 178 ASN A N 1 ATOM 1419 C CA . ASN A 1 189 ? -16.855 -50.285 10.009 1.00 86.86 ? 178 ASN A CA 1 ATOM 1420 C C . ASN A 1 189 ? -15.771 -49.386 9.497 1.00 90.33 ? 178 ASN A C 1 ATOM 1421 O O . ASN A 1 189 ? -15.419 -49.415 8.306 1.00 88.61 ? 178 ASN A O 1 ATOM 1422 C CB . ASN A 1 189 ? -16.259 -51.496 10.766 1.00 92.57 ? 178 ASN A CB 1 ATOM 1423 C CG . ASN A 1 189 ? -17.326 -52.395 11.359 1.00 109.12 ? 178 ASN A CG 1 ATOM 1424 O OD1 . ASN A 1 189 ? -18.168 -51.980 12.191 1.00 93.77 ? 178 ASN A OD1 1 ATOM 1425 N ND2 . ASN A 1 189 ? -17.353 -53.628 10.879 1.00 96.68 ? 178 ASN A ND2 1 ATOM 1426 N N . PHE A 1 190 ? -15.260 -48.568 10.425 1.00 86.24 ? 179 PHE A N 1 ATOM 1427 C CA . PHE A 1 190 ? -14.164 -47.699 10.158 1.00 85.43 ? 179 PHE A CA 1 ATOM 1428 C C . PHE A 1 190 ? -12.919 -48.533 9.962 1.00 89.79 ? 179 PHE A C 1 ATOM 1429 O O . PHE A 1 190 ? -12.728 -49.560 10.603 1.00 88.58 ? 179 PHE A O 1 ATOM 1430 C CB . PHE A 1 190 ? -13.971 -46.728 11.317 1.00 87.51 ? 179 PHE A CB 1 ATOM 1431 C CG . PHE A 1 190 ? -14.872 -45.519 11.285 1.00 89.70 ? 179 PHE A CG 1 ATOM 1432 C CD1 . PHE A 1 190 ? -14.681 -44.514 10.345 1.00 92.79 ? 179 PHE A CD1 1 ATOM 1433 C CD2 . PHE A 1 190 ? -15.889 -45.368 12.216 1.00 91.93 ? 179 PHE A CD2 1 ATOM 1434 C CE1 . PHE A 1 190 ? -15.513 -43.399 10.315 1.00 93.50 ? 179 PHE A CE1 1 ATOM 1435 C CE2 . PHE A 1 190 ? -16.715 -44.241 12.194 1.00 94.73 ? 179 PHE A CE2 1 ATOM 1436 C CZ . PHE A 1 190 ? -16.528 -43.271 11.238 1.00 92.84 ? 179 PHE A CZ 1 ATOM 1437 N N . HIS A 1 191 ? -12.101 -48.103 9.021 1.00 89.81 ? 180 HIS A N 1 ATOM 1438 C CA . HIS A 1 191 ? -10.785 -48.673 8.759 1.00 91.39 ? 180 HIS A CA 1 ATOM 1439 C C . HIS A 1 191 ? -9.831 -47.535 9.031 1.00 92.19 ? 180 HIS A C 1 ATOM 1440 O O . HIS A 1 191 ? -9.987 -46.446 8.475 1.00 91.77 ? 180 HIS A O 1 ATOM 1441 C CB . HIS A 1 191 ? -10.668 -49.283 7.353 1.00 94.46 ? 180 HIS A CB 1 ATOM 1442 C CG . HIS A 1 191 ? -11.629 -50.426 7.135 1.00 100.44 ? 180 HIS A CG 1 ATOM 1443 N ND1 . HIS A 1 191 ? -12.804 -50.262 6.395 1.00 103.48 ? 180 HIS A ND1 1 ATOM 1444 C CD2 . HIS A 1 191 ? -11.604 -51.692 7.630 1.00 103.43 ? 180 HIS A CD2 1 ATOM 1445 C CE1 . HIS A 1 191 ? -13.427 -51.432 6.439 1.00 103.25 ? 180 HIS A CE1 1 ATOM 1446 N NE2 . HIS A 1 191 ? -12.750 -52.323 7.175 1.00 103.47 ? 180 HIS A NE2 1 ATOM 1447 N N . TYR A 1 192 ? -8.923 -47.749 9.986 1.00 86.36 ? 181 TYR A N 1 ATOM 1448 C CA . TYR A 1 192 ? -8.033 -46.719 10.489 1.00 83.87 ? 181 TYR A CA 1 ATOM 1449 C C . TYR A 1 192 ? -6.671 -46.712 9.889 1.00 85.43 ? 181 TYR A C 1 ATOM 1450 O O . TYR A 1 192 ? -6.156 -47.766 9.524 1.00 85.06 ? 181 TYR A O 1 ATOM 1451 C CB . TYR A 1 192 ? -7.957 -46.806 12.007 1.00 83.81 ? 181 TYR A CB 1 ATOM 1452 C CG . TYR A 1 192 ? -9.260 -46.466 12.690 1.00 84.85 ? 181 TYR A CG 1 ATOM 1453 C CD1 . TYR A 1 192 ? -9.584 -45.149 12.998 1.00 87.60 ? 181 TYR A CD1 1 ATOM 1454 C CD2 . TYR A 1 192 ? -10.158 -47.461 13.055 1.00 85.16 ? 181 TYR A CD2 1 ATOM 1455 C CE1 . TYR A 1 192 ? -10.771 -44.829 13.657 1.00 88.79 ? 181 TYR A CE1 1 ATOM 1456 C CE2 . TYR A 1 192 ? -11.354 -47.154 13.710 1.00 85.75 ? 181 TYR A CE2 1 ATOM 1457 C CZ . TYR A 1 192 ? -11.659 -45.835 14.004 1.00 91.72 ? 181 TYR A CZ 1 ATOM 1458 O OH . TYR A 1 192 ? -12.835 -45.521 14.637 1.00 89.60 ? 181 TYR A OH 1 ATOM 1459 N N . ILE A 1 193 ? -6.093 -45.509 9.754 1.00 81.56 ? 182 ILE A N 1 ATOM 1460 C CA . ILE A 1 193 ? -4.734 -45.318 9.231 1.00 80.67 ? 182 ILE A CA 1 ATOM 1461 C C . ILE A 1 193 ? -4.056 -44.346 10.175 1.00 85.33 ? 182 ILE A C 1 ATOM 1462 O O . ILE A 1 193 ? -4.556 -43.237 10.395 1.00 85.75 ? 182 ILE A O 1 ATOM 1463 C CB . ILE A 1 193 ? -4.671 -44.867 7.734 1.00 82.79 ? 182 ILE A CB 1 ATOM 1464 C CG1 . ILE A 1 193 ? -5.490 -45.781 6.815 1.00 83.35 ? 182 ILE A CG1 1 ATOM 1465 C CG2 . ILE A 1 193 ? -3.241 -44.824 7.237 1.00 82.33 ? 182 ILE A CG2 1 ATOM 1466 C CD1 . ILE A 1 193 ? -6.552 -45.093 6.091 1.00 96.47 ? 182 ILE A CD1 1 ATOM 1467 N N . ASN A 1 194 ? -2.934 -44.768 10.753 1.00 81.58 ? 183 ASN A N 1 ATOM 1468 C CA . ASN A 1 194 ? -2.184 -43.928 11.685 1.00 80.79 ? 183 ASN A CA 1 ATOM 1469 C C . ASN A 1 194 ? -1.485 -42.803 10.953 1.00 82.23 ? 183 ASN A C 1 ATOM 1470 O O . ASN A 1 194 ? -1.062 -42.969 9.788 1.00 79.42 ? 183 ASN A O 1 ATOM 1471 C CB . ASN A 1 194 ? -1.162 -44.757 12.480 1.00 79.67 ? 183 ASN A CB 1 ATOM 1472 C CG . ASN A 1 194 ? -1.773 -45.805 13.367 1.00 96.04 ? 183 ASN A CG 1 ATOM 1473 O OD1 . ASN A 1 194 ? -1.272 -46.916 13.448 1.00 98.98 ? 183 ASN A OD1 1 ATOM 1474 N ND2 . ASN A 1 194 ? -2.861 -45.488 14.051 1.00 85.36 ? 183 ASN A ND2 1 ATOM 1475 N N . LEU A 1 195 ? -1.367 -41.656 11.642 1.00 78.57 ? 184 LEU A N 1 ATOM 1476 C CA . LEU A 1 195 ? -0.684 -40.503 11.077 1.00 78.56 ? 184 LEU A CA 1 ATOM 1477 C C . LEU A 1 195 ? 0.810 -40.801 10.985 1.00 83.72 ? 184 LEU A C 1 ATOM 1478 O O . LEU A 1 195 ? 1.346 -41.486 11.866 1.00 84.27 ? 184 LEU A O 1 ATOM 1479 C CB . LEU A 1 195 ? -0.908 -39.243 11.954 1.00 78.16 ? 184 LEU A CB 1 ATOM 1480 C CG . LEU A 1 195 ? -2.357 -38.790 12.188 1.00 82.21 ? 184 LEU A CG 1 ATOM 1481 C CD1 . LEU A 1 195 ? -2.415 -37.522 12.992 1.00 81.77 ? 184 LEU A CD1 1 ATOM 1482 C CD2 . LEU A 1 195 ? -3.112 -38.613 10.876 1.00 85.80 ? 184 LEU A CD2 1 ATOM 1483 N N . ILE A 1 196 ? 1.481 -40.289 9.935 1.00 79.47 ? 185 ILE A N 1 ATOM 1484 C CA . ILE A 1 196 ? 2.930 -40.384 9.792 1.00 79.32 ? 185 ILE A CA 1 ATOM 1485 C C . ILE A 1 196 ? 3.557 -39.769 11.056 1.00 88.78 ? 185 ILE A C 1 ATOM 1486 O O . ILE A 1 196 ? 4.513 -40.319 11.607 1.00 90.22 ? 185 ILE A O 1 ATOM 1487 C CB . ILE A 1 196 ? 3.391 -39.635 8.532 1.00 81.77 ? 185 ILE A CB 1 ATOM 1488 C CG1 . ILE A 1 196 ? 2.902 -40.360 7.273 1.00 81.01 ? 185 ILE A CG1 1 ATOM 1489 C CG2 . ILE A 1 196 ? 4.919 -39.428 8.519 1.00 83.36 ? 185 ILE A CG2 1 ATOM 1490 C CD1 . ILE A 1 196 ? 2.687 -39.615 6.152 1.00 82.45 ? 185 ILE A CD1 1 ATOM 1491 N N . LYS A 1 197 ? 2.990 -38.647 11.526 1.00 87.45 ? 186 LYS A N 1 ATOM 1492 C CA . LYS A 1 197 ? 3.411 -37.943 12.739 1.00 87.49 ? 186 LYS A CA 1 ATOM 1493 C C . LYS A 1 197 ? 2.299 -37.068 13.266 1.00 91.15 ? 186 LYS A C 1 ATOM 1494 O O . LYS A 1 197 ? 1.395 -36.694 12.514 1.00 91.26 ? 186 LYS A O 1 ATOM 1495 C CB . LYS A 1 197 ? 4.652 -37.071 12.469 1.00 89.43 ? 186 LYS A CB 1 ATOM 1496 C CG . LYS A 1 197 ? 4.476 -36.030 11.370 1.00 85.31 ? 186 LYS A CG 1 ATOM 1497 C CD . LYS A 1 197 ? 5.735 -35.220 11.144 1.00 87.83 ? 186 LYS A CD 1 ATOM 1498 C CE . LYS A 1 197 ? 5.591 -34.239 10.008 1.00 84.83 ? 186 LYS A CE 1 ATOM 1499 N NZ . LYS A 1 197 ? 4.858 -34.816 8.824 1.00 85.31 ? 186 LYS A NZ 1 ATOM 1500 N N . THR A 1 198 ? 2.390 -36.697 14.550 1.00 86.79 ? 187 THR A N 1 ATOM 1501 C CA . THR A 1 198 ? 1.455 -35.755 15.181 1.00 85.83 ? 187 THR A CA 1 ATOM 1502 C C . THR A 1 198 ? 1.757 -34.384 14.563 1.00 88.12 ? 187 THR A C 1 ATOM 1503 O O . THR A 1 198 ? 2.863 -34.173 14.040 1.00 89.47 ? 187 THR A O 1 ATOM 1504 C CB . THR A 1 198 ? 1.655 -35.696 16.724 1.00 93.10 ? 187 THR A CB 1 ATOM 1505 O OG1 . THR A 1 198 ? 1.812 -36.993 17.275 1.00 100.87 ? 187 THR A OG1 1 ATOM 1506 C CG2 . THR A 1 198 ? 0.550 -34.974 17.459 1.00 86.23 ? 187 THR A CG2 1 ATOM 1507 N N . GLY A 1 199 ? 0.781 -33.481 14.599 1.00 80.70 ? 188 GLY A N 1 ATOM 1508 C CA . GLY A 1 199 ? 0.966 -32.142 14.066 1.00 79.23 ? 188 GLY A CA 1 ATOM 1509 C C . GLY A 1 199 ? 0.367 -31.929 12.697 1.00 81.75 ? 188 GLY A C 1 ATOM 1510 O O . GLY A 1 199 ? 0.169 -30.786 12.287 1.00 82.42 ? 188 GLY A O 1 ATOM 1511 N N . VAL A 1 200 ? 0.045 -33.012 11.988 1.00 75.28 ? 189 VAL A N 1 ATOM 1512 C CA . VAL A 1 200 ? -0.520 -32.925 10.651 1.00 73.47 ? 189 VAL A CA 1 ATOM 1513 C C . VAL A 1 200 ? -1.441 -34.118 10.352 1.00 77.08 ? 189 VAL A C 1 ATOM 1514 O O . VAL A 1 200 ? -1.077 -35.256 10.636 1.00 78.40 ? 189 VAL A O 1 ATOM 1515 C CB . VAL A 1 200 ? 0.574 -32.670 9.580 1.00 75.42 ? 189 VAL A CB 1 ATOM 1516 C CG1 . VAL A 1 200 ? 1.557 -33.803 9.501 1.00 74.77 ? 189 VAL A CG1 1 ATOM 1517 C CG2 . VAL A 1 200 ? -0.024 -32.383 8.221 1.00 75.42 ? 189 VAL A CG2 1 ATOM 1518 N N . TRP A 1 201 ? -2.638 -33.854 9.790 1.00 70.41 ? 190 TRP A N 1 ATOM 1519 C CA . TRP A 1 201 ? -3.576 -34.907 9.409 1.00 67.76 ? 190 TRP A CA 1 ATOM 1520 C C . TRP A 1 201 ? -3.119 -35.501 8.077 1.00 73.17 ? 190 TRP A C 1 ATOM 1521 O O . TRP A 1 201 ? -3.781 -35.355 7.043 1.00 72.68 ? 190 TRP A O 1 ATOM 1522 C CB . TRP A 1 201 ? -5.015 -34.380 9.328 1.00 63.97 ? 190 TRP A CB 1 ATOM 1523 C CG . TRP A 1 201 ? -5.596 -33.943 10.630 1.00 63.44 ? 190 TRP A CG 1 ATOM 1524 C CD1 . TRP A 1 201 ? -5.945 -32.670 10.984 1.00 66.04 ? 190 TRP A CD1 1 ATOM 1525 C CD2 . TRP A 1 201 ? -5.969 -34.788 11.735 1.00 62.35 ? 190 TRP A CD2 1 ATOM 1526 N NE1 . TRP A 1 201 ? -6.512 -32.665 12.240 1.00 64.55 ? 190 TRP A NE1 1 ATOM 1527 C CE2 . TRP A 1 201 ? -6.528 -33.951 12.729 1.00 65.56 ? 190 TRP A CE2 1 ATOM 1528 C CE3 . TRP A 1 201 ? -5.894 -36.179 11.977 1.00 62.32 ? 190 TRP A CE3 1 ATOM 1529 C CZ2 . TRP A 1 201 ? -7.009 -34.456 13.942 1.00 63.85 ? 190 TRP A CZ2 1 ATOM 1530 C CZ3 . TRP A 1 201 ? -6.356 -36.670 13.181 1.00 62.69 ? 190 TRP A CZ3 1 ATOM 1531 C CH2 . TRP A 1 201 ? -6.910 -35.813 14.146 1.00 63.12 ? 190 TRP A CH2 1 ATOM 1532 N N . GLN A 1 202 ? -1.978 -36.179 8.119 1.00 70.61 ? 191 GLN A N 1 ATOM 1533 C CA . GLN A 1 202 ? -1.337 -36.742 6.936 1.00 70.89 ? 191 GLN A CA 1 ATOM 1534 C C . GLN A 1 202 ? -0.991 -38.201 7.175 1.00 75.80 ? 191 GLN A C 1 ATOM 1535 O O . GLN A 1 202 ? -0.543 -38.577 8.259 1.00 77.93 ? 191 GLN A O 1 ATOM 1536 C CB . GLN A 1 202 ? -0.085 -35.921 6.617 1.00 71.87 ? 191 GLN A CB 1 ATOM 1537 C CG . GLN A 1 202 ? 0.537 -36.205 5.283 1.00 71.83 ? 191 GLN A CG 1 ATOM 1538 C CD . GLN A 1 202 ? 1.601 -35.187 4.980 1.00 81.06 ? 191 GLN A CD 1 ATOM 1539 O OE1 . GLN A 1 202 ? 1.607 -34.563 3.930 1.00 70.50 ? 191 GLN A OE1 1 ATOM 1540 N NE2 . GLN A 1 202 ? 2.511 -34.978 5.911 1.00 76.29 ? 191 GLN A NE2 1 ATOM 1541 N N . ILE A 1 203 ? -1.235 -39.023 6.173 1.00 70.05 ? 192 ILE A N 1 ATOM 1542 C CA . ILE A 1 203 ? -1.035 -40.463 6.247 1.00 68.35 ? 192 ILE A CA 1 ATOM 1543 C C . ILE A 1 203 ? -0.192 -40.946 5.069 1.00 76.22 ? 192 ILE A C 1 ATOM 1544 O O . ILE A 1 203 ? -0.017 -40.220 4.070 1.00 76.53 ? 192 ILE A O 1 ATOM 1545 C CB . ILE A 1 203 ? -2.400 -41.203 6.318 1.00 69.58 ? 192 ILE A CB 1 ATOM 1546 C CG1 . ILE A 1 203 ? -3.300 -40.841 5.099 1.00 69.68 ? 192 ILE A CG1 1 ATOM 1547 C CG2 . ILE A 1 203 ? -3.104 -40.958 7.672 1.00 66.77 ? 192 ILE A CG2 1 ATOM 1548 C CD1 . ILE A 1 203 ? -4.496 -41.718 4.887 1.00 70.61 ? 192 ILE A CD1 1 ATOM 1549 N N . GLN A 1 204 ? 0.360 -42.165 5.198 1.00 73.94 ? 193 GLN A N 1 ATOM 1550 C CA . GLN A 1 204 ? 1.151 -42.737 4.122 1.00 73.97 ? 193 GLN A CA 1 ATOM 1551 C C . GLN A 1 204 ? 0.189 -43.289 3.076 1.00 77.76 ? 193 GLN A C 1 ATOM 1552 O O . GLN A 1 204 ? -0.808 -43.917 3.432 1.00 77.73 ? 193 GLN A O 1 ATOM 1553 C CB . GLN A 1 204 ? 2.074 -43.848 4.662 1.00 75.09 ? 193 GLN A CB 1 ATOM 1554 C CG . GLN A 1 204 ? 3.007 -44.496 3.622 1.00 90.17 ? 193 GLN A CG 1 ATOM 1555 C CD . GLN A 1 204 ? 4.125 -43.590 3.150 1.00 119.93 ? 193 GLN A CD 1 ATOM 1556 O OE1 . GLN A 1 204 ? 4.674 -42.769 3.901 1.00 116.91 ? 193 GLN A OE1 1 ATOM 1557 N NE2 . GLN A 1 204 ? 4.501 -43.738 1.889 1.00 116.63 ? 193 GLN A NE2 1 ATOM 1558 N N . MET A 1 205 ? 0.487 -43.042 1.799 1.00 74.74 ? 194 MET A N 1 ATOM 1559 C CA . MET A 1 205 ? -0.265 -43.615 0.680 1.00 76.48 ? 194 MET A CA 1 ATOM 1560 C C . MET A 1 205 ? 0.694 -44.546 -0.071 1.00 85.90 ? 194 MET A C 1 ATOM 1561 O O . MET A 1 205 ? 1.820 -44.159 -0.409 1.00 84.90 ? 194 MET A O 1 ATOM 1562 C CB . MET A 1 205 ? -0.849 -42.534 -0.244 1.00 78.15 ? 194 MET A CB 1 ATOM 1563 C CG . MET A 1 205 ? -1.672 -43.084 -1.395 1.00 80.44 ? 194 MET A CG 1 ATOM 1564 S SD . MET A 1 205 ? -2.935 -41.960 -1.999 1.00 82.77 ? 194 MET A SD 1 ATOM 1565 C CE . MET A 1 205 ? -1.963 -40.657 -2.570 1.00 79.31 ? 194 MET A CE 1 ATOM 1566 N N . LYS A 1 206 ? 0.237 -45.777 -0.302 1.00 85.53 ? 195 LYS A N 1 ATOM 1567 C CA . LYS A 1 206 ? 1.053 -46.831 -0.891 1.00 85.56 ? 195 LYS A CA 1 ATOM 1568 C C . LYS A 1 206 ? 0.994 -46.938 -2.413 1.00 88.09 ? 195 LYS A C 1 ATOM 1569 O O . LYS A 1 206 ? 1.784 -47.685 -2.970 1.00 89.09 ? 195 LYS A O 1 ATOM 1570 C CB . LYS A 1 206 ? 0.737 -48.181 -0.221 1.00 88.65 ? 195 LYS A CB 1 ATOM 1571 C CG . LYS A 1 206 ? 0.857 -48.195 1.315 1.00 106.08 ? 195 LYS A CG 1 ATOM 1572 C CD . LYS A 1 206 ? 0.201 -49.435 1.932 1.00 116.93 ? 195 LYS A CD 1 ATOM 1573 C CE . LYS A 1 206 ? 0.462 -49.563 3.415 1.00 122.18 ? 195 LYS A CE 1 ATOM 1574 N NZ . LYS A 1 206 ? 0.007 -50.877 3.936 1.00 125.29 ? 195 LYS A NZ 1 ATOM 1575 N N . GLY A 1 207 ? 0.126 -46.175 -3.073 1.00 82.50 ? 196 GLY A N 1 ATOM 1576 C CA . GLY A 1 207 ? -0.038 -46.201 -4.526 1.00 81.78 ? 196 GLY A CA 1 ATOM 1577 C C . GLY A 1 207 ? -1.337 -45.594 -5.029 1.00 85.06 ? 196 GLY A C 1 ATOM 1578 O O . GLY A 1 207 ? -2.331 -45.542 -4.300 1.00 86.39 ? 196 GLY A O 1 ATOM 1579 N N . VAL A 1 208 ? -1.322 -45.105 -6.271 1.00 79.84 ? 197 VAL A N 1 ATOM 1580 C CA . VAL A 1 208 ? -2.496 -44.550 -6.947 1.00 80.19 ? 197 VAL A CA 1 ATOM 1581 C C . VAL A 1 208 ? -2.685 -45.304 -8.269 1.00 87.54 ? 197 VAL A C 1 ATOM 1582 O O . VAL A 1 208 ? -1.818 -45.270 -9.151 1.00 86.40 ? 197 VAL A O 1 ATOM 1583 C CB . VAL A 1 208 ? -2.460 -43.012 -7.153 1.00 83.28 ? 197 VAL A CB 1 ATOM 1584 C CG1 . VAL A 1 208 ? -3.703 -42.531 -7.885 1.00 82.56 ? 197 VAL A CG1 1 ATOM 1585 C CG2 . VAL A 1 208 ? -2.343 -42.294 -5.827 1.00 83.25 ? 197 VAL A CG2 1 ATOM 1586 N N . SER A 1 209 ? -3.820 -45.987 -8.397 1.00 86.47 ? 198 SER A N 1 ATOM 1587 C CA . SER A 1 209 ? -4.121 -46.766 -9.586 1.00 86.94 ? 198 SER A CA 1 ATOM 1588 C C . SER A 1 209 ? -5.120 -46.080 -10.498 1.00 93.13 ? 198 SER A C 1 ATOM 1589 O O . SER A 1 209 ? -6.091 -45.483 -10.035 1.00 92.51 ? 198 SER A O 1 ATOM 1590 C CB . SER A 1 209 ? -4.661 -48.132 -9.183 1.00 90.61 ? 198 SER A CB 1 ATOM 1591 O OG . SER A 1 209 ? -3.746 -48.794 -8.327 1.00 100.74 ? 198 SER A OG 1 ATOM 1592 N N . VAL A 1 210 ? -4.890 -46.200 -11.799 1.00 92.76 ? 199 VAL A N 1 ATOM 1593 C CA . VAL A 1 210 ? -5.806 -45.747 -12.843 1.00 94.62 ? 199 VAL A CA 1 ATOM 1594 C C . VAL A 1 210 ? -6.208 -47.034 -13.556 1.00 104.41 ? 199 VAL A C 1 ATOM 1595 O O . VAL A 1 210 ? -5.408 -47.617 -14.288 1.00 104.46 ? 199 VAL A O 1 ATOM 1596 C CB . VAL A 1 210 ? -5.188 -44.704 -13.797 1.00 97.62 ? 199 VAL A CB 1 ATOM 1597 C CG1 . VAL A 1 210 ? -6.166 -44.328 -14.905 1.00 96.97 ? 199 VAL A CG1 1 ATOM 1598 C CG2 . VAL A 1 210 ? -4.778 -43.469 -13.023 1.00 97.23 ? 199 VAL A CG2 1 ATOM 1599 N N . GLY A 1 211 ? -7.414 -47.503 -13.275 1.00 105.04 ? 200 GLY A N 1 ATOM 1600 C CA . GLY A 1 211 ? -7.858 -48.798 -13.757 1.00 107.05 ? 200 GLY A CA 1 ATOM 1601 C C . GLY A 1 211 ? -7.239 -49.863 -12.863 1.00 116.03 ? 200 GLY A C 1 ATOM 1602 O O . GLY A 1 211 ? -7.195 -49.702 -11.632 1.00 115.69 ? 200 GLY A O 1 ATOM 1603 N N . SER A 1 212 ? -6.709 -50.934 -13.476 1.00 115.43 ? 201 SER A N 1 ATOM 1604 C CA . SER A 1 212 ? -6.097 -52.042 -12.737 1.00 116.07 ? 201 SER A CA 1 ATOM 1605 C C . SER A 1 212 ? -4.594 -51.847 -12.453 1.00 119.99 ? 201 SER A C 1 ATOM 1606 O O . SER A 1 212 ? -4.026 -52.561 -11.620 1.00 119.46 ? 201 SER A O 1 ATOM 1607 C CB . SER A 1 212 ? -6.330 -53.352 -13.480 1.00 120.43 ? 201 SER A CB 1 ATOM 1608 O OG . SER A 1 212 ? -5.841 -54.444 -12.721 1.00 131.34 ? 201 SER A OG 1 ATOM 1609 N N . SER A 1 213 ? -3.965 -50.884 -13.129 1.00 116.20 ? 202 SER A N 1 ATOM 1610 C CA . SER A 1 213 ? -2.529 -50.652 -13.018 1.00 115.78 ? 202 SER A CA 1 ATOM 1611 C C . SER A 1 213 ? -2.115 -49.453 -12.154 1.00 118.49 ? 202 SER A C 1 ATOM 1612 O O . SER A 1 213 ? -2.649 -48.348 -12.309 1.00 118.50 ? 202 SER A O 1 ATOM 1613 C CB . SER A 1 213 ? -1.907 -50.550 -14.412 1.00 119.55 ? 202 SER A CB 1 ATOM 1614 O OG . SER A 1 213 ? -2.571 -49.589 -15.218 1.00 126.67 ? 202 SER A OG 1 ATOM 1615 N N . THR A 1 214 ? -1.118 -49.666 -11.278 1.00 113.09 ? 203 THR A N 1 ATOM 1616 C CA . THR A 1 214 ? -0.563 -48.624 -10.408 1.00 111.38 ? 203 THR A CA 1 ATOM 1617 C C . THR A 1 214 ? 0.387 -47.732 -11.203 1.00 112.30 ? 203 THR A C 1 ATOM 1618 O O . THR A 1 214 ? 1.596 -47.961 -11.218 1.00 112.63 ? 203 THR A O 1 ATOM 1619 C CB . THR A 1 214 ? 0.080 -49.230 -9.144 1.00 116.69 ? 203 THR A CB 1 ATOM 1620 O OG1 . THR A 1 214 ? -0.849 -50.125 -8.525 1.00 121.88 ? 203 THR A OG1 1 ATOM 1621 C CG2 . THR A 1 214 ? 0.497 -48.181 -8.143 1.00 111.17 ? 203 THR A CG2 1 ATOM 1622 N N . LEU A 1 215 ? -0.163 -46.714 -11.859 1.00 105.95 ? 204 LEU A N 1 ATOM 1623 C CA . LEU A 1 215 ? 0.605 -45.755 -12.638 1.00 104.53 ? 204 LEU A CA 1 ATOM 1624 C C . LEU A 1 215 ? 1.398 -44.810 -11.725 1.00 106.31 ? 204 LEU A C 1 ATOM 1625 O O . LEU A 1 215 ? 2.479 -44.363 -12.106 1.00 106.63 ? 204 LEU A O 1 ATOM 1626 C CB . LEU A 1 215 ? -0.369 -44.890 -13.473 1.00 104.47 ? 204 LEU A CB 1 ATOM 1627 C CG . LEU A 1 215 ? -0.793 -45.209 -14.905 1.00 109.11 ? 204 LEU A CG 1 ATOM 1628 C CD1 . LEU A 1 215 ? 0.343 -44.964 -15.898 1.00 109.42 ? 204 LEU A CD1 1 ATOM 1629 C CD2 . LEU A 1 215 ? -1.385 -46.560 -15.039 1.00 110.42 ? 204 LEU A CD2 1 ATOM 1630 N N . LEU A 1 216 ? 0.845 -44.468 -10.546 1.00 100.16 ? 205 LEU A N 1 ATOM 1631 C CA . LEU A 1 216 ? 1.438 -43.457 -9.678 1.00 98.78 ? 205 LEU A CA 1 ATOM 1632 C C . LEU A 1 216 ? 1.683 -43.893 -8.255 1.00 100.59 ? 205 LEU A C 1 ATOM 1633 O O . LEU A 1 216 ? 1.103 -44.870 -7.785 1.00 99.01 ? 205 LEU A O 1 ATOM 1634 C CB . LEU A 1 216 ? 0.549 -42.195 -9.677 1.00 98.73 ? 205 LEU A CB 1 ATOM 1635 C CG . LEU A 1 216 ? 0.358 -41.494 -11.005 1.00 103.91 ? 205 LEU A CG 1 ATOM 1636 C CD1 . LEU A 1 216 ? -0.935 -40.707 -11.025 1.00 104.38 ? 205 LEU A CD1 1 ATOM 1637 C CD2 . LEU A 1 216 ? 1.531 -40.593 -11.314 1.00 107.25 ? 205 LEU A CD2 1 ATOM 1638 N N . CYS A 1 217 ? 2.554 -43.137 -7.561 1.00 97.18 ? 206 CYS A N 1 ATOM 1639 C CA . CYS A 1 217 ? 2.853 -43.309 -6.148 1.00 97.03 ? 206 CYS A CA 1 ATOM 1640 C C . CYS A 1 217 ? 3.355 -44.728 -5.770 1.00 105.16 ? 206 CYS A C 1 ATOM 1641 O O . CYS A 1 217 ? 3.201 -45.165 -4.628 1.00 105.04 ? 206 CYS A O 1 ATOM 1642 C CB . CYS A 1 217 ? 1.665 -42.838 -5.300 1.00 96.22 ? 206 CYS A CB 1 ATOM 1643 S SG . CYS A 1 217 ? 1.890 -42.966 -3.507 1.00 99.59 ? 206 CYS A SG 1 ATOM 1644 N N . GLU A 1 218 ? 3.990 -45.439 -6.726 1.00 104.15 ? 207 GLU A N 1 ATOM 1645 C CA . GLU A 1 218 ? 4.635 -46.716 -6.400 1.00 104.73 ? 207 GLU A CA 1 ATOM 1646 C C . GLU A 1 218 ? 5.896 -46.296 -5.631 1.00 109.89 ? 207 GLU A C 1 ATOM 1647 O O . GLU A 1 218 ? 6.508 -45.268 -5.970 1.00 109.32 ? 207 GLU A O 1 ATOM 1648 C CB . GLU A 1 218 ? 4.945 -47.571 -7.641 1.00 106.20 ? 207 GLU A CB 1 ATOM 1649 C CG . GLU A 1 218 ? 5.818 -46.914 -8.699 1.00 120.17 ? 207 GLU A CG 1 ATOM 1650 C CD . GLU A 1 218 ? 5.074 -46.082 -9.725 1.00 143.09 ? 207 GLU A CD 1 ATOM 1651 O OE1 . GLU A 1 218 ? 4.732 -46.636 -10.796 1.00 123.37 ? 207 GLU A OE1 1 ATOM 1652 O OE2 . GLU A 1 218 ? 4.839 -44.878 -9.464 1.00 143.02 ? 207 GLU A OE2 1 ATOM 1653 N N . ASP A 1 219 ? 6.220 -47.019 -4.551 1.00 107.16 ? 208 ASP A N 1 ATOM 1654 C CA . ASP A 1 219 ? 7.303 -46.680 -3.602 1.00 106.83 ? 208 ASP A CA 1 ATOM 1655 C C . ASP A 1 219 ? 6.794 -45.695 -2.529 1.00 107.42 ? 208 ASP A C 1 ATOM 1656 O O . ASP A 1 219 ? 7.596 -45.142 -1.774 1.00 106.02 ? 208 ASP A O 1 ATOM 1657 C CB . ASP A 1 219 ? 8.596 -46.138 -4.279 1.00 109.14 ? 208 ASP A CB 1 ATOM 1658 C CG . ASP A 1 219 ? 9.202 -47.045 -5.335 1.00 121.66 ? 208 ASP A CG 1 ATOM 1659 O OD1 . ASP A 1 219 ? 9.252 -48.278 -5.103 1.00 121.65 ? 208 ASP A OD1 1 ATOM 1660 O OD2 . ASP A 1 219 ? 9.642 -46.518 -6.393 1.00 126.52 ? 208 ASP A OD2 1 ATOM 1661 N N . GLY A 1 220 ? 5.473 -45.488 -2.480 1.00 102.25 ? 209 GLY A N 1 ATOM 1662 C CA . GLY A 1 220 ? 4.820 -44.646 -1.485 1.00 100.53 ? 209 GLY A CA 1 ATOM 1663 C C . GLY A 1 220 ? 4.875 -43.149 -1.697 1.00 101.07 ? 209 GLY A C 1 ATOM 1664 O O . GLY A 1 220 ? 5.726 -42.632 -2.427 1.00 100.81 ? 209 GLY A O 1 ATOM 1665 N N . CYS A 1 221 ? 3.927 -42.448 -1.064 1.00 94.64 ? 210 CYS A N 1 ATOM 1666 C CA . CYS A 1 221 ? 3.809 -40.992 -1.076 1.00 92.65 ? 210 CYS A CA 1 ATOM 1667 C C . CYS A 1 221 ? 2.952 -40.545 0.097 1.00 88.70 ? 210 CYS A C 1 ATOM 1668 O O . CYS A 1 221 ? 2.507 -41.375 0.899 1.00 87.90 ? 210 CYS A O 1 ATOM 1669 C CB . CYS A 1 221 ? 3.273 -40.476 -2.407 1.00 94.17 ? 210 CYS A CB 1 ATOM 1670 S SG . CYS A 1 221 ? 1.624 -41.075 -2.820 1.00 99.10 ? 210 CYS A SG 1 ATOM 1671 N N . LEU A 1 222 ? 2.740 -39.233 0.226 1.00 80.02 ? 211 LEU A N 1 ATOM 1672 C CA . LEU A 1 222 ? 1.955 -38.698 1.332 1.00 76.99 ? 211 LEU A CA 1 ATOM 1673 C C . LEU A 1 222 ? 0.540 -38.300 0.917 1.00 74.71 ? 211 LEU A C 1 ATOM 1674 O O . LEU A 1 222 ? 0.304 -37.917 -0.235 1.00 73.98 ? 211 LEU A O 1 ATOM 1675 C CB . LEU A 1 222 ? 2.685 -37.497 1.931 1.00 76.58 ? 211 LEU A CB 1 ATOM 1676 C CG . LEU A 1 222 ? 4.113 -37.691 2.414 1.00 79.36 ? 211 LEU A CG 1 ATOM 1677 C CD1 . LEU A 1 222 ? 4.811 -36.349 2.516 1.00 79.92 ? 211 LEU A CD1 1 ATOM 1678 C CD2 . LEU A 1 222 ? 4.153 -38.421 3.737 1.00 77.64 ? 211 LEU A CD2 1 ATOM 1679 N N . ALA A 1 223 ? -0.405 -38.398 1.864 1.00 66.75 ? 212 ALA A N 1 ATOM 1680 C CA . ALA A 1 223 ? -1.801 -37.994 1.640 1.00 63.80 ? 212 ALA A CA 1 ATOM 1681 C C . ALA A 1 223 ? -2.330 -37.175 2.801 1.00 65.35 ? 212 ALA A C 1 ATOM 1682 O O . ALA A 1 223 ? -2.513 -37.686 3.906 1.00 64.13 ? 212 ALA A O 1 ATOM 1683 C CB . ALA A 1 223 ? -2.682 -39.193 1.393 1.00 63.63 ? 212 ALA A CB 1 ATOM 1684 N N . LEU A 1 224 ? -2.537 -35.877 2.546 1.00 61.43 ? 213 LEU A N 1 ATOM 1685 C CA . LEU A 1 224 ? -3.126 -34.963 3.511 1.00 60.81 ? 213 LEU A CA 1 ATOM 1686 C C . LEU A 1 224 ? -4.656 -35.128 3.384 1.00 64.45 ? 213 LEU A C 1 ATOM 1687 O O . LEU A 1 224 ? -5.194 -35.102 2.263 1.00 64.62 ? 213 LEU A O 1 ATOM 1688 C CB . LEU A 1 224 ? -2.694 -33.533 3.195 1.00 60.57 ? 213 LEU A CB 1 ATOM 1689 C CG . LEU A 1 224 ? -3.156 -32.422 4.127 1.00 64.47 ? 213 LEU A CG 1 ATOM 1690 C CD1 . LEU A 1 224 ? -2.516 -32.536 5.489 1.00 64.09 ? 213 LEU A CD1 1 ATOM 1691 C CD2 . LEU A 1 224 ? -2.831 -31.092 3.520 1.00 65.94 ? 213 LEU A CD2 1 ATOM 1692 N N . VAL A 1 225 ? -5.336 -35.375 4.515 1.00 58.78 ? 214 VAL A N 1 ATOM 1693 C CA . VAL A 1 225 ? -6.793 -35.567 4.523 1.00 58.05 ? 214 VAL A CA 1 ATOM 1694 C C . VAL A 1 225 ? -7.347 -34.202 4.887 1.00 60.61 ? 214 VAL A C 1 ATOM 1695 O O . VAL A 1 225 ? -7.334 -33.807 6.035 1.00 58.71 ? 214 VAL A O 1 ATOM 1696 C CB . VAL A 1 225 ? -7.229 -36.730 5.445 1.00 60.77 ? 214 VAL A CB 1 ATOM 1697 C CG1 . VAL A 1 225 ? -8.721 -36.932 5.377 1.00 59.77 ? 214 VAL A CG1 1 ATOM 1698 C CG2 . VAL A 1 225 ? -6.510 -38.030 5.065 1.00 60.66 ? 214 VAL A CG2 1 ATOM 1699 N N . ASP A 1 226 ? -7.767 -33.471 3.864 1.00 58.63 ? 215 ASP A N 1 ATOM 1700 C CA . ASP A 1 226 ? -8.036 -32.050 3.880 1.00 58.80 ? 215 ASP A CA 1 ATOM 1701 C C . ASP A 1 226 ? -9.468 -31.650 3.613 1.00 61.64 ? 215 ASP A C 1 ATOM 1702 O O . ASP A 1 226 ? -9.878 -31.516 2.456 1.00 62.78 ? 215 ASP A O 1 ATOM 1703 C CB . ASP A 1 226 ? -7.098 -31.404 2.852 1.00 60.58 ? 215 ASP A CB 1 ATOM 1704 C CG . ASP A 1 226 ? -6.951 -29.938 2.979 1.00 73.17 ? 215 ASP A CG 1 ATOM 1705 O OD1 . ASP A 1 226 ? -7.626 -29.350 3.847 1.00 74.46 ? 215 ASP A OD1 1 ATOM 1706 O OD2 . ASP A 1 226 ? -6.143 -29.372 2.238 1.00 83.84 ? 215 ASP A OD2 1 ATOM 1707 N N . THR A 1 227 ? -10.199 -31.377 4.682 1.00 53.91 ? 216 THR A N 1 ATOM 1708 C CA . THR A 1 227 ? -11.616 -31.059 4.607 1.00 52.37 ? 216 THR A CA 1 ATOM 1709 C C . THR A 1 227 ? -11.897 -29.695 3.979 1.00 54.82 ? 216 THR A C 1 ATOM 1710 O O . THR A 1 227 ? -13.039 -29.439 3.575 1.00 53.40 ? 216 THR A O 1 ATOM 1711 C CB . THR A 1 227 ? -12.263 -31.194 5.982 1.00 55.93 ? 216 THR A CB 1 ATOM 1712 O OG1 . THR A 1 227 ? -11.681 -30.234 6.846 1.00 57.68 ? 216 THR A OG1 1 ATOM 1713 C CG2 . THR A 1 227 ? -12.103 -32.577 6.579 1.00 54.15 ? 216 THR A CG2 1 ATOM 1714 N N . GLY A 1 228 ? -10.866 -28.842 3.926 1.00 49.31 ? 217 GLY A N 1 ATOM 1715 C CA . GLY A 1 228 ? -10.933 -27.492 3.379 1.00 47.90 ? 217 GLY A CA 1 ATOM 1716 C C . GLY A 1 228 ? -10.624 -27.409 1.909 1.00 53.03 ? 217 GLY A C 1 ATOM 1717 O O . GLY A 1 228 ? -10.726 -26.334 1.319 1.00 53.87 ? 217 GLY A O 1 ATOM 1718 N N . ALA A 1 229 ? -10.240 -28.521 1.304 1.00 50.46 ? 218 ALA A N 1 ATOM 1719 C CA . ALA A 1 229 ? -9.924 -28.568 -0.125 1.00 49.89 ? 218 ALA A CA 1 ATOM 1720 C C . ALA A 1 229 ? -11.139 -29.110 -0.885 1.00 53.51 ? 218 ALA A C 1 ATOM 1721 O O . ALA A 1 229 ? -11.738 -30.087 -0.440 1.00 54.60 ? 218 ALA A O 1 ATOM 1722 C CB . ALA A 1 229 ? -8.707 -29.463 -0.346 1.00 50.23 ? 218 ALA A CB 1 ATOM 1723 N N . SER A 1 230 ? -11.510 -28.491 -2.010 1.00 49.24 ? 219 SER A N 1 ATOM 1724 C CA . SER A 1 230 ? -12.666 -28.941 -2.785 1.00 49.15 ? 219 SER A CA 1 ATOM 1725 C C . SER A 1 230 ? -12.418 -30.234 -3.515 1.00 57.87 ? 219 SER A C 1 ATOM 1726 O O . SER A 1 230 ? -13.357 -31.019 -3.678 1.00 60.44 ? 219 SER A O 1 ATOM 1727 C CB . SER A 1 230 ? -13.087 -27.904 -3.816 1.00 49.01 ? 219 SER A CB 1 ATOM 1728 O OG . SER A 1 230 ? -13.378 -26.654 -3.224 1.00 48.61 ? 219 SER A OG 1 ATOM 1729 N N . TYR A 1 231 ? -11.185 -30.469 -3.949 1.00 55.72 ? 220 TYR A N 1 ATOM 1730 C CA . TYR A 1 231 ? -10.845 -31.616 -4.785 1.00 56.31 ? 220 TYR A CA 1 ATOM 1731 C C . TYR A 1 231 ? -9.814 -32.563 -4.201 1.00 63.42 ? 220 TYR A C 1 ATOM 1732 O O . TYR A 1 231 ? -9.263 -32.351 -3.112 1.00 64.74 ? 220 TYR A O 1 ATOM 1733 C CB . TYR A 1 231 ? -10.340 -31.082 -6.143 1.00 57.32 ? 220 TYR A CB 1 ATOM 1734 C CG . TYR A 1 231 ? -11.208 -29.973 -6.713 1.00 60.25 ? 220 TYR A CG 1 ATOM 1735 C CD1 . TYR A 1 231 ? -10.721 -28.679 -6.845 1.00 62.36 ? 220 TYR A CD1 1 ATOM 1736 C CD2 . TYR A 1 231 ? -12.548 -30.201 -7.042 1.00 61.44 ? 220 TYR A CD2 1 ATOM 1737 C CE1 . TYR A 1 231 ? -11.526 -27.647 -7.333 1.00 63.22 ? 220 TYR A CE1 1 ATOM 1738 C CE2 . TYR A 1 231 ? -13.361 -29.180 -7.542 1.00 62.67 ? 220 TYR A CE2 1 ATOM 1739 C CZ . TYR A 1 231 ? -12.848 -27.901 -7.681 1.00 73.68 ? 220 TYR A CZ 1 ATOM 1740 O OH . TYR A 1 231 ? -13.673 -26.911 -8.154 1.00 80.67 ? 220 TYR A OH 1 ATOM 1741 N N . ILE A 1 232 ? -9.549 -33.616 -4.941 1.00 60.17 ? 221 ILE A N 1 ATOM 1742 C CA . ILE A 1 232 ? -8.404 -34.474 -4.692 1.00 60.12 ? 221 ILE A CA 1 ATOM 1743 C C . ILE A 1 232 ? -7.284 -33.771 -5.481 1.00 64.47 ? 221 ILE A C 1 ATOM 1744 O O . ILE A 1 232 ? -7.486 -33.405 -6.646 1.00 62.91 ? 221 ILE A O 1 ATOM 1745 C CB . ILE A 1 232 ? -8.608 -35.928 -5.187 1.00 62.92 ? 221 ILE A CB 1 ATOM 1746 C CG1 . ILE A 1 232 ? -9.608 -36.661 -4.283 1.00 63.22 ? 221 ILE A CG1 1 ATOM 1747 C CG2 . ILE A 1 232 ? -7.251 -36.665 -5.261 1.00 63.21 ? 221 ILE A CG2 1 ATOM 1748 C CD1 . ILE A 1 232 ? -10.092 -37.909 -4.806 1.00 70.77 ? 221 ILE A CD1 1 ATOM 1749 N N . SER A 1 233 ? -6.135 -33.550 -4.852 1.00 62.84 ? 222 SER A N 1 ATOM 1750 C CA . SER A 1 233 ? -5.008 -32.934 -5.560 1.00 63.35 ? 222 SER A CA 1 ATOM 1751 C C . SER A 1 233 ? -3.733 -33.739 -5.396 1.00 70.72 ? 222 SER A C 1 ATOM 1752 O O . SER A 1 233 ? -3.564 -34.464 -4.416 1.00 70.29 ? 222 SER A O 1 ATOM 1753 C CB . SER A 1 233 ? -4.789 -31.488 -5.130 1.00 64.92 ? 222 SER A CB 1 ATOM 1754 O OG . SER A 1 233 ? -4.331 -31.390 -3.790 1.00 72.57 ? 222 SER A OG 1 ATOM 1755 N N . GLY A 1 234 ? -2.866 -33.621 -6.381 1.00 69.29 ? 223 GLY A N 1 ATOM 1756 C CA . GLY A 1 234 ? -1.527 -34.183 -6.351 1.00 70.62 ? 223 GLY A CA 1 ATOM 1757 C C . GLY A 1 234 ? -0.562 -33.127 -6.862 1.00 77.55 ? 223 GLY A C 1 ATOM 1758 O O . GLY A 1 234 ? -0.989 -32.048 -7.291 1.00 76.73 ? 223 GLY A O 1 ATOM 1759 N N . SER A 1 235 ? 0.743 -33.416 -6.831 1.00 76.47 ? 224 SER A N 1 ATOM 1760 C CA . SER A 1 235 ? 1.752 -32.524 -7.414 1.00 77.38 ? 224 SER A CA 1 ATOM 1761 C C . SER A 1 235 ? 1.524 -32.419 -8.940 1.00 83.98 ? 224 SER A C 1 ATOM 1762 O O . SER A 1 235 ? 0.891 -33.310 -9.540 1.00 84.88 ? 224 SER A O 1 ATOM 1763 C CB . SER A 1 235 ? 3.145 -33.075 -7.160 1.00 82.08 ? 224 SER A CB 1 ATOM 1764 O OG . SER A 1 235 ? 3.293 -34.377 -7.707 1.00 94.63 ? 224 SER A OG 1 ATOM 1765 N N . THR A 1 236 ? 2.020 -31.322 -9.558 1.00 80.98 ? 225 THR A N 1 ATOM 1766 C CA . THR A 1 236 ? 1.885 -31.082 -11.005 1.00 80.93 ? 225 THR A CA 1 ATOM 1767 C C . THR A 1 236 ? 2.337 -32.293 -11.833 1.00 86.05 ? 225 THR A C 1 ATOM 1768 O O . THR A 1 236 ? 1.625 -32.700 -12.750 1.00 85.24 ? 225 THR A O 1 ATOM 1769 C CB . THR A 1 236 ? 2.594 -29.774 -11.460 1.00 79.19 ? 225 THR A CB 1 ATOM 1770 O OG1 . THR A 1 236 ? 2.034 -28.668 -10.756 1.00 82.40 ? 225 THR A OG1 1 ATOM 1771 C CG2 . THR A 1 236 ? 2.422 -29.499 -12.960 1.00 67.04 ? 225 THR A CG2 1 ATOM 1772 N N . SER A 1 237 ? 3.506 -32.874 -11.510 1.00 83.69 ? 226 SER A N 1 ATOM 1773 C CA . SER A 1 237 ? 4.025 -34.030 -12.242 1.00 83.45 ? 226 SER A CA 1 ATOM 1774 C C . SER A 1 237 ? 3.123 -35.259 -12.105 1.00 86.91 ? 226 SER A C 1 ATOM 1775 O O . SER A 1 237 ? 2.880 -35.925 -13.113 1.00 88.16 ? 226 SER A O 1 ATOM 1776 C CB . SER A 1 237 ? 5.473 -34.333 -11.859 1.00 86.15 ? 226 SER A CB 1 ATOM 1777 O OG . SER A 1 237 ? 5.657 -34.417 -10.456 1.00 92.76 ? 226 SER A OG 1 ATOM 1778 N N . SER A 1 238 ? 2.584 -35.526 -10.884 1.00 80.52 ? 227 SER A N 1 ATOM 1779 C CA . SER A 1 238 ? 1.670 -36.651 -10.654 1.00 79.04 ? 227 SER A CA 1 ATOM 1780 C C . SER A 1 238 ? 0.380 -36.492 -11.451 1.00 81.72 ? 227 SER A C 1 ATOM 1781 O O . SER A 1 238 ? -0.078 -37.434 -12.112 1.00 81.38 ? 227 SER A O 1 ATOM 1782 C CB . SER A 1 238 ? 1.339 -36.785 -9.174 1.00 80.66 ? 227 SER A CB 1 ATOM 1783 O OG . SER A 1 238 ? 2.498 -37.091 -8.428 1.00 91.67 ? 227 SER A OG 1 ATOM 1784 N N . ILE A 1 239 ? -0.206 -35.297 -11.379 1.00 76.17 ? 228 ILE A N 1 ATOM 1785 C CA . ILE A 1 239 ? -1.468 -34.995 -12.042 1.00 74.71 ? 228 ILE A CA 1 ATOM 1786 C C . ILE A 1 239 ? -1.330 -35.009 -13.560 1.00 82.59 ? 228 ILE A C 1 ATOM 1787 O O . ILE A 1 239 ? -2.191 -35.556 -14.241 1.00 82.41 ? 228 ILE A O 1 ATOM 1788 C CB . ILE A 1 239 ? -2.118 -33.720 -11.469 1.00 75.18 ? 228 ILE A CB 1 ATOM 1789 C CG1 . ILE A 1 239 ? -2.482 -33.893 -9.994 1.00 74.00 ? 228 ILE A CG1 1 ATOM 1790 C CG2 . ILE A 1 239 ? -3.337 -33.291 -12.248 1.00 72.98 ? 228 ILE A CG2 1 ATOM 1791 C CD1 . ILE A 1 239 ? -3.324 -35.149 -9.638 1.00 69.26 ? 228 ILE A CD1 1 ATOM 1792 N N . GLU A 1 240 ? -0.228 -34.465 -14.083 1.00 82.49 ? 229 GLU A N 1 ATOM 1793 C CA . GLU A 1 240 ? 0.070 -34.481 -15.517 1.00 84.18 ? 229 GLU A CA 1 ATOM 1794 C C . GLU A 1 240 ? 0.075 -35.937 -16.029 1.00 89.45 ? 229 GLU A C 1 ATOM 1795 O O . GLU A 1 240 ? -0.491 -36.211 -17.090 1.00 90.74 ? 229 GLU A O 1 ATOM 1796 C CB . GLU A 1 240 ? 1.434 -33.803 -15.748 1.00 86.16 ? 229 GLU A CB 1 ATOM 1797 C CG . GLU A 1 240 ? 2.100 -33.936 -17.099 1.00 105.79 ? 229 GLU A CG 1 ATOM 1798 C CD . GLU A 1 240 ? 3.374 -33.105 -17.200 1.00 143.94 ? 229 GLU A CD 1 ATOM 1799 O OE1 . GLU A 1 240 ? 3.673 -32.326 -16.258 1.00 140.48 ? 229 GLU A OE1 1 ATOM 1800 O OE2 . GLU A 1 240 ? 4.084 -33.253 -18.222 1.00 143.54 ? 229 GLU A OE2 1 ATOM 1801 N N . LYS A 1 241 ? 0.682 -36.859 -15.258 1.00 83.85 ? 230 LYS A N 1 ATOM 1802 C CA . LYS A 1 241 ? 0.719 -38.285 -15.588 1.00 82.70 ? 230 LYS A CA 1 ATOM 1803 C C . LYS A 1 241 ? -0.667 -38.890 -15.463 1.00 84.81 ? 230 LYS A C 1 ATOM 1804 O O . LYS A 1 241 ? -1.081 -39.631 -16.351 1.00 85.72 ? 230 LYS A O 1 ATOM 1805 C CB . LYS A 1 241 ? 1.709 -39.033 -14.688 1.00 85.53 ? 230 LYS A CB 1 ATOM 1806 C CG . LYS A 1 241 ? 3.172 -38.736 -14.994 1.00 110.14 ? 230 LYS A CG 1 ATOM 1807 C CD . LYS A 1 241 ? 4.112 -39.358 -13.949 1.00 124.30 ? 230 LYS A CD 1 ATOM 1808 C CE . LYS A 1 241 ? 5.576 -39.092 -14.208 1.00 139.95 ? 230 LYS A CE 1 ATOM 1809 N NZ . LYS A 1 241 ? 6.068 -39.876 -15.375 1.00 152.05 ? 230 LYS A NZ 1 ATOM 1810 N N . LEU A 1 242 ? -1.389 -38.571 -14.366 1.00 79.31 ? 231 LEU A N 1 ATOM 1811 C CA . LEU A 1 242 ? -2.744 -39.062 -14.119 1.00 77.31 ? 231 LEU A CA 1 ATOM 1812 C C . LEU A 1 242 ? -3.664 -38.680 -15.283 1.00 81.19 ? 231 LEU A C 1 ATOM 1813 O O . LEU A 1 242 ? -4.399 -39.518 -15.792 1.00 80.98 ? 231 LEU A O 1 ATOM 1814 C CB . LEU A 1 242 ? -3.297 -38.482 -12.807 1.00 76.68 ? 231 LEU A CB 1 ATOM 1815 C CG . LEU A 1 242 ? -4.682 -38.973 -12.340 1.00 81.34 ? 231 LEU A CG 1 ATOM 1816 C CD1 . LEU A 1 242 ? -4.574 -40.250 -11.604 1.00 81.80 ? 231 LEU A CD1 1 ATOM 1817 C CD2 . LEU A 1 242 ? -5.301 -38.018 -11.372 1.00 85.79 ? 231 LEU A CD2 1 ATOM 1818 N N . MET A 1 243 ? -3.592 -37.424 -15.719 1.00 77.33 ? 232 MET A N 1 ATOM 1819 C CA . MET A 1 243 ? -4.456 -36.866 -16.747 1.00 76.51 ? 232 MET A CA 1 ATOM 1820 C C . MET A 1 243 ? -4.193 -37.396 -18.139 1.00 82.25 ? 232 MET A C 1 ATOM 1821 O O . MET A 1 243 ? -5.147 -37.594 -18.897 1.00 81.13 ? 232 MET A O 1 ATOM 1822 C CB . MET A 1 243 ? -4.462 -35.336 -16.668 1.00 77.68 ? 232 MET A CB 1 ATOM 1823 C CG . MET A 1 243 ? -5.032 -34.821 -15.344 1.00 79.22 ? 232 MET A CG 1 ATOM 1824 S SD . MET A 1 243 ? -6.801 -35.168 -15.117 1.00 80.36 ? 232 MET A SD 1 ATOM 1825 C CE . MET A 1 243 ? -7.056 -34.612 -13.474 1.00 76.96 ? 232 MET A CE 1 ATOM 1826 N N . GLU A 1 244 ? -2.916 -37.663 -18.478 1.00 80.11 ? 233 GLU A N 1 ATOM 1827 C CA . GLU A 1 244 ? -2.546 -38.273 -19.756 1.00 80.22 ? 233 GLU A CA 1 ATOM 1828 C C . GLU A 1 244 ? -3.200 -39.667 -19.837 1.00 81.56 ? 233 GLU A C 1 ATOM 1829 O O . GLU A 1 244 ? -3.753 -40.028 -20.879 1.00 80.99 ? 233 GLU A O 1 ATOM 1830 C CB . GLU A 1 244 ? -1.020 -38.383 -19.867 1.00 82.52 ? 233 GLU A CB 1 ATOM 1831 C CG . GLU A 1 244 ? -0.513 -38.926 -21.198 1.00 101.12 ? 233 GLU A CG 1 ATOM 1832 C CD . GLU A 1 244 ? 0.983 -39.187 -21.233 1.00 131.59 ? 233 GLU A CD 1 ATOM 1833 O OE1 . GLU A 1 244 ? 1.381 -40.330 -21.552 1.00 134.83 ? 233 GLU A OE1 1 ATOM 1834 O OE2 . GLU A 1 244 ? 1.756 -38.259 -20.900 1.00 128.20 ? 233 GLU A OE2 1 ATOM 1835 N N . ALA A 1 245 ? -3.181 -40.416 -18.716 1.00 76.10 ? 234 ALA A N 1 ATOM 1836 C CA . ALA A 1 245 ? -3.827 -41.717 -18.627 1.00 75.80 ? 234 ALA A CA 1 ATOM 1837 C C . ALA A 1 245 ? -5.345 -41.629 -18.803 1.00 81.87 ? 234 ALA A C 1 ATOM 1838 O O . ALA A 1 245 ? -5.955 -42.572 -19.311 1.00 83.35 ? 234 ALA A O 1 ATOM 1839 C CB . ALA A 1 245 ? -3.486 -42.388 -17.303 1.00 76.22 ? 234 ALA A CB 1 ATOM 1840 N N . LEU A 1 246 ? -5.956 -40.512 -18.378 1.00 77.67 ? 235 LEU A N 1 ATOM 1841 C CA . LEU A 1 246 ? -7.402 -40.333 -18.493 1.00 76.96 ? 235 LEU A CA 1 ATOM 1842 C C . LEU A 1 246 ? -7.809 -39.754 -19.857 1.00 79.76 ? 235 LEU A C 1 ATOM 1843 O O . LEU A 1 246 ? -8.982 -39.836 -20.240 1.00 80.96 ? 235 LEU A O 1 ATOM 1844 C CB . LEU A 1 246 ? -7.941 -39.426 -17.362 1.00 76.75 ? 235 LEU A CB 1 ATOM 1845 C CG . LEU A 1 246 ? -7.779 -39.887 -15.905 1.00 80.97 ? 235 LEU A CG 1 ATOM 1846 C CD1 . LEU A 1 246 ? -8.292 -38.828 -14.951 1.00 80.12 ? 235 LEU A CD1 1 ATOM 1847 C CD2 . LEU A 1 246 ? -8.488 -41.212 -15.628 1.00 83.66 ? 235 LEU A CD2 1 ATOM 1848 N N . GLY A 1 247 ? -6.857 -39.152 -20.557 1.00 73.96 ? 236 GLY A N 1 ATOM 1849 C CA . GLY A 1 247 ? -7.131 -38.492 -21.826 1.00 74.31 ? 236 GLY A CA 1 ATOM 1850 C C . GLY A 1 247 ? -7.714 -37.107 -21.627 1.00 80.16 ? 236 GLY A C 1 ATOM 1851 O O . GLY A 1 247 ? -8.394 -36.581 -22.516 1.00 79.44 ? 236 GLY A O 1 ATOM 1852 N N . ALA A 1 248 ? -7.445 -36.515 -20.445 1.00 77.81 ? 237 ALA A N 1 ATOM 1853 C CA . ALA A 1 248 ? -7.955 -35.206 -20.061 1.00 78.00 ? 237 ALA A CA 1 ATOM 1854 C C . ALA A 1 248 ? -7.052 -34.095 -20.537 1.00 82.17 ? 237 ALA A C 1 ATOM 1855 O O . ALA A 1 248 ? -5.837 -34.244 -20.553 1.00 82.27 ? 237 ALA A O 1 ATOM 1856 C CB . ALA A 1 248 ? -8.151 -35.132 -18.555 1.00 78.90 ? 237 ALA A CB 1 ATOM 1857 N N . LYS A 1 249 ? -7.652 -32.979 -20.883 1.00 78.51 ? 238 LYS A N 1 ATOM 1858 C CA . LYS A 1 249 ? -7.017 -31.791 -21.431 1.00 78.16 ? 238 LYS A CA 1 ATOM 1859 C C . LYS A 1 249 ? -6.918 -30.707 -20.361 1.00 81.37 ? 238 LYS A C 1 ATOM 1860 O O . LYS A 1 249 ? -7.919 -30.365 -19.702 1.00 81.95 ? 238 LYS A O 1 ATOM 1861 C CB . LYS A 1 249 ? -7.873 -31.278 -22.606 1.00 80.76 ? 238 LYS A CB 1 ATOM 1862 C CG . LYS A 1 249 ? -8.042 -32.258 -23.782 1.00 105.35 ? 238 LYS A CG 1 ATOM 1863 C CD . LYS A 1 249 ? -9.407 -32.089 -24.524 1.00 124.55 ? 238 LYS A CD 1 ATOM 1864 C CE . LYS A 1 249 ? -9.540 -30.953 -25.536 1.00 144.51 ? 238 LYS A CE 1 ATOM 1865 N NZ . LYS A 1 249 ? -8.714 -31.183 -26.752 1.00 156.81 ? 238 LYS A NZ 1 ATOM 1866 N N . LYS A 1 250 ? -5.689 -30.194 -20.192 1.00 75.53 ? 239 LYS A N 1 ATOM 1867 C CA . LYS A 1 250 ? -5.365 -29.148 -19.228 1.00 74.11 ? 239 LYS A CA 1 ATOM 1868 C C . LYS A 1 250 ? -5.927 -27.818 -19.655 1.00 75.68 ? 239 LYS A C 1 ATOM 1869 O O . LYS A 1 250 ? -5.850 -27.463 -20.823 1.00 77.03 ? 239 LYS A O 1 ATOM 1870 C CB . LYS A 1 250 ? -3.841 -29.012 -19.037 1.00 76.05 ? 239 LYS A CB 1 ATOM 1871 C CG . LYS A 1 250 ? -3.433 -28.164 -17.831 1.00 82.38 ? 239 LYS A CG 1 ATOM 1872 C CD . LYS A 1 250 ? -2.083 -27.496 -18.040 1.00 87.28 ? 239 LYS A CD 1 ATOM 1873 C CE . LYS A 1 250 ? -1.834 -26.365 -17.072 1.00 100.25 ? 239 LYS A CE 1 ATOM 1874 N NZ . LYS A 1 250 ? -0.374 -26.063 -16.979 1.00 110.46 ? 239 LYS A NZ 1 ATOM 1875 N N . ARG A 1 251 ? -6.521 -27.105 -18.710 1.00 68.87 ? 240 ARG A N 1 ATOM 1876 C CA . ARG A 1 251 ? -6.960 -25.742 -18.901 1.00 67.57 ? 240 ARG A CA 1 ATOM 1877 C C . ARG A 1 251 ? -6.224 -24.931 -17.839 1.00 71.86 ? 240 ARG A C 1 ATOM 1878 O O . ARG A 1 251 ? -5.290 -25.438 -17.193 1.00 72.97 ? 240 ARG A O 1 ATOM 1879 C CB . ARG A 1 251 ? -8.474 -25.583 -18.785 1.00 65.04 ? 240 ARG A CB 1 ATOM 1880 C CG . ARG A 1 251 ? -9.262 -26.407 -19.787 1.00 71.26 ? 240 ARG A CG 1 ATOM 1881 C CD . ARG A 1 251 ? -10.667 -25.867 -19.982 1.00 70.01 ? 240 ARG A CD 1 ATOM 1882 N NE . ARG A 1 251 ? -11.415 -25.798 -18.731 1.00 74.26 ? 240 ARG A NE 1 ATOM 1883 C CZ . ARG A 1 251 ? -12.723 -25.590 -18.656 1.00 90.91 ? 240 ARG A CZ 1 ATOM 1884 N NH1 . ARG A 1 251 ? -13.444 -25.437 -19.765 1.00 72.02 ? 240 ARG A NH1 1 ATOM 1885 N NH2 . ARG A 1 251 ? -13.330 -25.565 -17.472 1.00 79.81 ? 240 ARG A NH2 1 ATOM 1886 N N . LEU A 1 252 ? -6.624 -23.683 -17.668 1.00 67.12 ? 242 LEU A N 1 ATOM 1887 C CA . LEU A 1 252 ? -6.022 -22.753 -16.728 1.00 66.99 ? 242 LEU A CA 1 ATOM 1888 C C . LEU A 1 252 ? -6.037 -23.249 -15.293 1.00 71.27 ? 242 LEU A C 1 ATOM 1889 O O . LEU A 1 252 ? -4.970 -23.373 -14.678 1.00 69.68 ? 242 LEU A O 1 ATOM 1890 C CB . LEU A 1 252 ? -6.780 -21.414 -16.838 1.00 67.44 ? 242 LEU A CB 1 ATOM 1891 C CG . LEU A 1 252 ? -6.062 -20.095 -16.569 1.00 71.83 ? 242 LEU A CG 1 ATOM 1892 C CD1 . LEU A 1 252 ? -4.827 -19.956 -17.390 1.00 70.92 ? 242 LEU A CD1 1 ATOM 1893 C CD2 . LEU A 1 252 ? -6.951 -18.943 -16.961 1.00 75.03 ? 242 LEU A CD2 1 ATOM 1894 N N . PHE A 1 253 ? -7.249 -23.555 -14.761 1.00 69.68 ? 243 PHE A N 1 ATOM 1895 C CA . PHE A 1 253 ? -7.432 -23.920 -13.348 1.00 69.74 ? 243 PHE A CA 1 ATOM 1896 C C . PHE A 1 253 ? -7.976 -25.321 -13.076 1.00 74.02 ? 243 PHE A C 1 ATOM 1897 O O . PHE A 1 253 ? -8.282 -25.680 -11.918 1.00 74.86 ? 243 PHE A O 1 ATOM 1898 C CB . PHE A 1 253 ? -8.314 -22.864 -12.670 1.00 71.54 ? 243 PHE A CB 1 ATOM 1899 C CG . PHE A 1 253 ? -7.846 -21.438 -12.871 1.00 72.95 ? 243 PHE A CG 1 ATOM 1900 C CD1 . PHE A 1 253 ? -6.593 -21.025 -12.418 1.00 75.73 ? 243 PHE A CD1 1 ATOM 1901 C CD2 . PHE A 1 253 ? -8.653 -20.511 -13.518 1.00 74.60 ? 243 PHE A CD2 1 ATOM 1902 C CE1 . PHE A 1 253 ? -6.161 -19.710 -12.601 1.00 76.42 ? 243 PHE A CE1 1 ATOM 1903 C CE2 . PHE A 1 253 ? -8.226 -19.193 -13.690 1.00 77.71 ? 243 PHE A CE2 1 ATOM 1904 C CZ . PHE A 1 253 ? -6.984 -18.801 -13.228 1.00 75.91 ? 243 PHE A CZ 1 ATOM 1905 N N . ASP A 1 254 ? -8.077 -26.124 -14.137 1.00 69.01 ? 244 ASP A N 1 ATOM 1906 C CA . ASP A 1 254 ? -8.622 -27.466 -14.049 1.00 67.71 ? 244 ASP A CA 1 ATOM 1907 C C . ASP A 1 254 ? -8.283 -28.294 -15.292 1.00 70.32 ? 244 ASP A C 1 ATOM 1908 O O . ASP A 1 254 ? -7.676 -27.807 -16.246 1.00 68.82 ? 244 ASP A O 1 ATOM 1909 C CB . ASP A 1 254 ? -10.159 -27.359 -13.895 1.00 69.19 ? 244 ASP A CB 1 ATOM 1910 C CG . ASP A 1 254 ? -10.924 -26.809 -15.122 1.00 79.82 ? 244 ASP A CG 1 ATOM 1911 O OD1 . ASP A 1 254 ? -10.274 -26.355 -16.091 1.00 79.11 ? 244 ASP A OD1 1 ATOM 1912 O OD2 . ASP A 1 254 ? -12.171 -26.823 -15.102 1.00 86.50 ? 244 ASP A OD2 1 ATOM 1913 N N . TYR A 1 255 ? -8.726 -29.540 -15.285 1.00 67.26 ? 245 TYR A N 1 ATOM 1914 C CA . TYR A 1 255 ? -8.623 -30.449 -16.395 1.00 66.57 ? 245 TYR A CA 1 ATOM 1915 C C . TYR A 1 255 ? -10.035 -30.781 -16.834 1.00 70.87 ? 245 TYR A C 1 ATOM 1916 O O . TYR A 1 255 ? -10.956 -30.831 -16.009 1.00 70.87 ? 245 TYR A O 1 ATOM 1917 C CB . TYR A 1 255 ? -7.893 -31.693 -15.930 1.00 67.19 ? 245 TYR A CB 1 ATOM 1918 C CG . TYR A 1 255 ? -6.389 -31.536 -15.940 1.00 68.31 ? 245 TYR A CG 1 ATOM 1919 C CD1 . TYR A 1 255 ? -5.637 -31.905 -17.051 1.00 71.41 ? 245 TYR A CD1 1 ATOM 1920 C CD2 . TYR A 1 255 ? -5.713 -31.041 -14.836 1.00 67.66 ? 245 TYR A CD2 1 ATOM 1921 C CE1 . TYR A 1 255 ? -4.247 -31.796 -17.056 1.00 73.29 ? 245 TYR A CE1 1 ATOM 1922 C CE2 . TYR A 1 255 ? -4.325 -30.925 -14.833 1.00 68.63 ? 245 TYR A CE2 1 ATOM 1923 C CZ . TYR A 1 255 ? -3.596 -31.292 -15.953 1.00 81.04 ? 245 TYR A CZ 1 ATOM 1924 O OH . TYR A 1 255 ? -2.221 -31.187 -15.995 1.00 86.83 ? 245 TYR A OH 1 ATOM 1925 N N . VAL A 1 256 ? -10.214 -30.989 -18.135 1.00 66.50 ? 246 VAL A N 1 ATOM 1926 C CA . VAL A 1 256 ? -11.515 -31.315 -18.713 1.00 65.24 ? 246 VAL A CA 1 ATOM 1927 C C . VAL A 1 256 ? -11.470 -32.538 -19.614 1.00 71.22 ? 246 VAL A C 1 ATOM 1928 O O . VAL A 1 256 ? -10.424 -32.899 -20.140 1.00 71.11 ? 246 VAL A O 1 ATOM 1929 C CB . VAL A 1 256 ? -12.156 -30.121 -19.457 1.00 67.60 ? 246 VAL A CB 1 ATOM 1930 C CG1 . VAL A 1 256 ? -12.624 -29.043 -18.491 1.00 66.82 ? 246 VAL A CG1 1 ATOM 1931 C CG2 . VAL A 1 256 ? -11.220 -29.554 -20.520 1.00 67.08 ? 246 VAL A CG2 1 ATOM 1932 N N . VAL A 1 257 ? -12.625 -33.152 -19.810 1.00 69.80 ? 247 VAL A N 1 ATOM 1933 C CA . VAL A 1 257 ? -12.843 -34.275 -20.704 1.00 69.39 ? 247 VAL A CA 1 ATOM 1934 C C . VAL A 1 257 ? -14.093 -33.912 -21.474 1.00 76.54 ? 247 VAL A C 1 ATOM 1935 O O . VAL A 1 257 ? -14.907 -33.128 -20.976 1.00 77.58 ? 247 VAL A O 1 ATOM 1936 C CB . VAL A 1 257 ? -12.976 -35.615 -19.911 1.00 72.41 ? 247 VAL A CB 1 ATOM 1937 C CG1 . VAL A 1 257 ? -13.726 -36.661 -20.693 1.00 72.78 ? 247 VAL A CG1 1 ATOM 1938 C CG2 . VAL A 1 257 ? -11.614 -36.155 -19.529 1.00 71.60 ? 247 VAL A CG2 1 ATOM 1939 N N . LYS A 1 258 ? -14.251 -34.449 -22.693 1.00 74.46 ? 248 LYS A N 1 ATOM 1940 C CA . LYS A 1 258 ? -15.498 -34.289 -23.444 1.00 75.01 ? 248 LYS A CA 1 ATOM 1941 C C . LYS A 1 258 ? -16.569 -35.048 -22.649 1.00 76.07 ? 248 LYS A C 1 ATOM 1942 O O . LYS A 1 258 ? -16.331 -36.174 -22.212 1.00 74.42 ? 248 LYS A O 1 ATOM 1943 C CB . LYS A 1 258 ? -15.358 -34.854 -24.858 1.00 79.49 ? 248 LYS A CB 1 ATOM 1944 C CG . LYS A 1 258 ? -14.656 -33.874 -25.820 1.00 98.79 ? 248 LYS A CG 1 ATOM 1945 C CD . LYS A 1 258 ? -14.087 -34.554 -27.033 1.00 113.80 ? 248 LYS A CD 1 ATOM 1946 C CE . LYS A 1 258 ? -15.056 -34.682 -28.180 1.00 128.76 ? 248 LYS A CE 1 ATOM 1947 N NZ . LYS A 1 258 ? -14.424 -35.456 -29.289 1.00 136.67 ? 248 LYS A NZ 1 ATOM 1948 N N . CYS A 1 259 ? -17.704 -34.408 -22.395 1.00 72.45 ? 249 CYS A N 1 ATOM 1949 C CA . CYS A 1 259 ? -18.738 -34.956 -21.528 1.00 72.68 ? 249 CYS A CA 1 ATOM 1950 C C . CYS A 1 259 ? -19.189 -36.381 -21.841 1.00 78.97 ? 249 CYS A C 1 ATOM 1951 O O . CYS A 1 259 ? -19.439 -37.151 -20.916 1.00 78.25 ? 249 CYS A O 1 ATOM 1952 C CB . CYS A 1 259 ? -19.912 -33.991 -21.393 1.00 72.68 ? 249 CYS A CB 1 ATOM 1953 S SG . CYS A 1 259 ? -19.501 -32.438 -20.549 1.00 76.02 ? 249 CYS A SG 1 ATOM 1954 N N . ASN A 1 260 ? -19.230 -36.760 -23.135 1.00 77.85 ? 250 ASN A N 1 ATOM 1955 C CA . ASN A 1 260 ? -19.594 -38.120 -23.560 1.00 77.82 ? 250 ASN A CA 1 ATOM 1956 C C . ASN A 1 260 ? -18.568 -39.154 -23.080 1.00 82.69 ? 250 ASN A C 1 ATOM 1957 O O . ASN A 1 260 ? -18.916 -40.313 -22.823 1.00 84.31 ? 250 ASN A O 1 ATOM 1958 C CB . ASN A 1 260 ? -19.719 -38.190 -25.076 1.00 77.30 ? 250 ASN A CB 1 ATOM 1959 C CG . ASN A 1 260 ? -18.406 -38.039 -25.799 1.00 104.90 ? 250 ASN A CG 1 ATOM 1960 O OD1 . ASN A 1 260 ? -17.855 -36.948 -25.889 1.00 106.95 ? 250 ASN A OD1 1 ATOM 1961 N ND2 . ASN A 1 260 ? -17.862 -39.128 -26.314 1.00 95.96 ? 250 ASN A ND2 1 ATOM 1962 N N . GLU A 1 261 ? -17.311 -38.725 -22.950 1.00 77.66 ? 251 GLU A N 1 ATOM 1963 C CA . GLU A 1 261 ? -16.240 -39.607 -22.512 1.00 76.44 ? 251 GLU A CA 1 ATOM 1964 C C . GLU A 1 261 ? -16.284 -39.849 -21.016 1.00 78.82 ? 251 GLU A C 1 ATOM 1965 O O . GLU A 1 261 ? -15.670 -40.812 -20.570 1.00 77.99 ? 251 GLU A O 1 ATOM 1966 C CB . GLU A 1 261 ? -14.847 -39.108 -22.942 1.00 77.77 ? 251 GLU A CB 1 ATOM 1967 C CG . GLU A 1 261 ? -14.686 -38.733 -24.399 1.00 93.54 ? 251 GLU A CG 1 ATOM 1968 C CD . GLU A 1 261 ? -13.367 -38.053 -24.734 1.00 131.28 ? 251 GLU A CD 1 ATOM 1969 O OE1 . GLU A 1 261 ? -12.802 -38.375 -25.805 1.00 147.99 ? 251 GLU A OE1 1 ATOM 1970 O OE2 . GLU A 1 261 ? -12.917 -37.175 -23.960 1.00 122.74 ? 251 GLU A OE2 1 ATOM 1971 N N . GLY A 1 262 ? -16.950 -38.971 -20.260 1.00 75.17 ? 252 GLY A N 1 ATOM 1972 C CA . GLY A 1 262 ? -17.013 -39.053 -18.803 1.00 75.61 ? 252 GLY A CA 1 ATOM 1973 C C . GLY A 1 262 ? -17.317 -40.438 -18.240 1.00 81.94 ? 252 GLY A C 1 ATOM 1974 O O . GLY A 1 262 ? -16.501 -41.014 -17.506 1.00 80.57 ? 252 GLY A O 1 ATOM 1975 N N . PRO A 1 263 ? -18.476 -41.024 -18.619 1.00 81.48 ? 253 PRO A N 1 ATOM 1976 C CA . PRO A 1 263 ? -18.810 -42.369 -18.125 1.00 81.23 ? 253 PRO A CA 1 ATOM 1977 C C . PRO A 1 263 ? -17.860 -43.493 -18.565 1.00 87.83 ? 253 PRO A C 1 ATOM 1978 O O . PRO A 1 263 ? -17.939 -44.583 -18.007 1.00 89.80 ? 253 PRO A O 1 ATOM 1979 C CB . PRO A 1 263 ? -20.227 -42.594 -18.671 1.00 82.35 ? 253 PRO A CB 1 ATOM 1980 C CG . PRO A 1 263 ? -20.772 -41.242 -18.996 1.00 86.85 ? 253 PRO A CG 1 ATOM 1981 C CD . PRO A 1 263 ? -19.574 -40.482 -19.461 1.00 83.11 ? 253 PRO A CD 1 ATOM 1982 N N . THR A 1 264 ? -16.977 -43.249 -19.543 1.00 83.92 ? 254 THR A N 1 ATOM 1983 C CA . THR A 1 264 ? -16.029 -44.262 -20.038 1.00 83.22 ? 254 THR A CA 1 ATOM 1984 C C . THR A 1 264 ? -14.702 -44.244 -19.260 1.00 87.59 ? 254 THR A C 1 ATOM 1985 O O . THR A 1 264 ? -13.891 -45.159 -19.410 1.00 88.78 ? 254 THR A O 1 ATOM 1986 C CB . THR A 1 264 ? -15.752 -44.089 -21.555 1.00 90.56 ? 254 THR A CB 1 ATOM 1987 O OG1 . THR A 1 264 ? -14.794 -43.045 -21.772 1.00 85.31 ? 254 THR A OG1 1 ATOM 1988 C CG2 . THR A 1 264 ? -17.014 -43.838 -22.371 1.00 92.58 ? 254 THR A CG2 1 ATOM 1989 N N . LEU A 1 265 ? -14.453 -43.178 -18.486 1.00 82.14 ? 255 LEU A N 1 ATOM 1990 C CA . LEU A 1 265 ? -13.222 -42.997 -17.725 1.00 80.59 ? 255 LEU A CA 1 ATOM 1991 C C . LEU A 1 265 ? -13.022 -44.098 -16.687 1.00 83.33 ? 255 LEU A C 1 ATOM 1992 O O . LEU A 1 265 ? -14.000 -44.576 -16.093 1.00 83.76 ? 255 LEU A O 1 ATOM 1993 C CB . LEU A 1 265 ? -13.241 -41.622 -17.051 1.00 80.79 ? 255 LEU A CB 1 ATOM 1994 C CG . LEU A 1 265 ? -12.453 -40.437 -17.647 1.00 85.61 ? 255 LEU A CG 1 ATOM 1995 C CD1 . LEU A 1 265 ? -12.413 -40.427 -19.173 1.00 85.53 ? 255 LEU A CD1 1 ATOM 1996 C CD2 . LEU A 1 265 ? -13.000 -39.141 -17.123 1.00 86.68 ? 255 LEU A CD2 1 ATOM 1997 N N . PRO A 1 266 ? -11.754 -44.525 -16.472 1.00 78.37 ? 256 PRO A N 1 ATOM 1998 C CA . PRO A 1 266 ? -11.492 -45.610 -15.505 1.00 77.87 ? 256 PRO A CA 1 ATOM 1999 C C . PRO A 1 266 ? -11.617 -45.215 -14.050 1.00 81.54 ? 256 PRO A C 1 ATOM 2000 O O . PRO A 1 266 ? -11.579 -44.040 -13.730 1.00 82.04 ? 256 PRO A O 1 ATOM 2001 C CB . PRO A 1 266 ? -10.053 -46.014 -15.821 1.00 79.17 ? 256 PRO A CB 1 ATOM 2002 C CG . PRO A 1 266 ? -9.438 -44.794 -16.364 1.00 82.70 ? 256 PRO A CG 1 ATOM 2003 C CD . PRO A 1 266 ? -10.506 -44.066 -17.115 1.00 78.61 ? 256 PRO A CD 1 ATOM 2004 N N . ASP A 1 267 ? -11.714 -46.209 -13.169 1.00 77.46 ? 257 ASP A N 1 ATOM 2005 C CA . ASP A 1 267 ? -11.729 -45.996 -11.730 1.00 76.57 ? 257 ASP A CA 1 ATOM 2006 C C . ASP A 1 267 ? -10.360 -45.516 -11.295 1.00 78.69 ? 257 ASP A C 1 ATOM 2007 O O . ASP A 1 267 ? -9.351 -45.879 -11.910 1.00 79.43 ? 257 ASP A O 1 ATOM 2008 C CB . ASP A 1 267 ? -12.031 -47.311 -11.004 1.00 78.15 ? 257 ASP A CB 1 ATOM 2009 C CG . ASP A 1 267 ? -13.423 -47.851 -11.248 1.00 91.75 ? 257 ASP A CG 1 ATOM 2010 O OD1 . ASP A 1 267 ? -14.232 -47.148 -11.900 1.00 91.90 ? 257 ASP A OD1 1 ATOM 2011 O OD2 . ASP A 1 267 ? -13.712 -48.971 -10.776 1.00 101.42 ? 257 ASP A OD2 1 ATOM 2012 N N . ILE A 1 268 ? -10.324 -44.686 -10.246 1.00 71.78 ? 258 ILE A N 1 ATOM 2013 C CA . ILE A 1 268 ? -9.070 -44.232 -9.645 1.00 69.89 ? 258 ILE A CA 1 ATOM 2014 C C . ILE A 1 268 ? -9.063 -44.746 -8.225 1.00 73.46 ? 258 ILE A C 1 ATOM 2015 O O . ILE A 1 268 ? -10.018 -44.505 -7.471 1.00 72.63 ? 258 ILE A O 1 ATOM 2016 C CB . ILE A 1 268 ? -8.811 -42.708 -9.748 1.00 71.91 ? 258 ILE A CB 1 ATOM 2017 C CG1 . ILE A 1 268 ? -8.729 -42.269 -11.233 1.00 72.26 ? 258 ILE A CG1 1 ATOM 2018 C CG2 . ILE A 1 268 ? -7.522 -42.326 -8.994 1.00 70.96 ? 258 ILE A CG2 1 ATOM 2019 C CD1 . ILE A 1 268 ? -8.831 -40.812 -11.471 1.00 77.90 ? 258 ILE A CD1 1 ATOM 2020 N N . SER A 1 269 ? -8.006 -45.491 -7.877 1.00 71.04 ? 259 SER A N 1 ATOM 2021 C CA . SER A 1 269 ? -7.891 -46.114 -6.567 1.00 72.86 ? 259 SER A CA 1 ATOM 2022 C C . SER A 1 269 ? -6.740 -45.580 -5.786 1.00 79.31 ? 259 SER A C 1 ATOM 2023 O O . SER A 1 269 ? -5.650 -45.405 -6.333 1.00 78.86 ? 259 SER A O 1 ATOM 2024 C CB . SER A 1 269 ? -7.762 -47.628 -6.704 1.00 78.02 ? 259 SER A CB 1 ATOM 2025 O OG . SER A 1 269 ? -8.974 -48.200 -7.168 1.00 91.85 ? 259 SER A OG 1 ATOM 2026 N N . PHE A 1 270 ? -6.977 -45.331 -4.492 1.00 76.89 ? 260 PHE A N 1 ATOM 2027 C CA . PHE A 1 270 ? -5.976 -44.815 -3.566 1.00 76.24 ? 260 PHE A CA 1 ATOM 2028 C C . PHE A 1 270 ? -5.699 -45.895 -2.541 1.00 84.39 ? 260 PHE A C 1 ATOM 2029 O O . PHE A 1 270 ? -6.624 -46.367 -1.867 1.00 84.72 ? 260 PHE A O 1 ATOM 2030 C CB . PHE A 1 270 ? -6.477 -43.504 -2.899 1.00 76.81 ? 260 PHE A CB 1 ATOM 2031 C CG . PHE A 1 270 ? -6.822 -42.412 -3.887 1.00 76.37 ? 260 PHE A CG 1 ATOM 2032 C CD1 . PHE A 1 270 ? -5.866 -41.487 -4.285 1.00 77.89 ? 260 PHE A CD1 1 ATOM 2033 C CD2 . PHE A 1 270 ? -8.092 -42.336 -4.449 1.00 76.68 ? 260 PHE A CD2 1 ATOM 2034 C CE1 . PHE A 1 270 ? -6.174 -40.502 -5.227 1.00 78.17 ? 260 PHE A CE1 1 ATOM 2035 C CE2 . PHE A 1 270 ? -8.396 -41.358 -5.393 1.00 78.69 ? 260 PHE A CE2 1 ATOM 2036 C CZ . PHE A 1 270 ? -7.437 -40.441 -5.771 1.00 76.62 ? 260 PHE A CZ 1 ATOM 2037 N N . HIS A 1 271 ? -4.431 -46.318 -2.457 1.00 84.20 ? 261 HIS A N 1 ATOM 2038 C CA . HIS A 1 271 ? -4.015 -47.374 -1.537 1.00 85.98 ? 261 HIS A CA 1 ATOM 2039 C C . HIS A 1 271 ? -3.596 -46.798 -0.188 1.00 84.20 ? 261 HIS A C 1 ATOM 2040 O O . HIS A 1 271 ? -2.526 -46.193 -0.071 1.00 82.12 ? 261 HIS A O 1 ATOM 2041 C CB . HIS A 1 271 ? -2.925 -48.277 -2.168 1.00 89.32 ? 261 HIS A CB 1 ATOM 2042 C CG . HIS A 1 271 ? -2.723 -49.577 -1.434 1.00 95.24 ? 261 HIS A CG 1 ATOM 2043 N ND1 . HIS A 1 271 ? -3.796 -50.236 -0.802 1.00 98.46 ? 261 HIS A ND1 1 ATOM 2044 C CD2 . HIS A 1 271 ? -1.633 -50.373 -1.345 1.00 98.52 ? 261 HIS A CD2 1 ATOM 2045 C CE1 . HIS A 1 271 ? -3.291 -51.350 -0.290 1.00 98.22 ? 261 HIS A CE1 1 ATOM 2046 N NE2 . HIS A 1 271 ? -1.986 -51.456 -0.545 1.00 98.69 ? 261 HIS A NE2 1 ATOM 2047 N N . LEU A 1 272 ? -4.471 -46.951 0.814 1.00 79.04 ? 262 LEU A N 1 ATOM 2048 C CA . LEU A 1 272 ? -4.269 -46.399 2.148 1.00 79.16 ? 262 LEU A CA 1 ATOM 2049 C C . LEU A 1 272 ? -4.503 -47.462 3.203 1.00 85.58 ? 262 LEU A C 1 ATOM 2050 O O . LEU A 1 272 ? -5.566 -48.095 3.205 1.00 84.44 ? 262 LEU A O 1 ATOM 2051 C CB . LEU A 1 272 ? -5.239 -45.214 2.408 1.00 79.01 ? 262 LEU A CB 1 ATOM 2052 C CG . LEU A 1 272 ? -5.345 -44.079 1.370 1.00 83.26 ? 262 LEU A CG 1 ATOM 2053 C CD1 . LEU A 1 272 ? -6.619 -43.293 1.569 1.00 82.82 ? 262 LEU A CD1 1 ATOM 2054 C CD2 . LEU A 1 272 ? -4.122 -43.160 1.415 1.00 85.13 ? 262 LEU A CD2 1 ATOM 2055 N N . GLY A 1 273 ? -3.517 -47.640 4.088 1.00 84.40 ? 263 GLY A N 1 ATOM 2056 C CA . GLY A 1 273 ? -3.574 -48.594 5.190 1.00 85.21 ? 263 GLY A CA 1 ATOM 2057 C C . GLY A 1 273 ? -3.943 -50.018 4.817 1.00 91.89 ? 263 GLY A C 1 ATOM 2058 O O . GLY A 1 273 ? -4.712 -50.675 5.532 1.00 91.85 ? 263 GLY A O 1 ATOM 2059 N N . GLY A 1 274 ? -3.440 -50.477 3.676 1.00 89.53 ? 264 GLY A N 1 ATOM 2060 C CA . GLY A 1 274 ? -3.690 -51.833 3.201 1.00 89.52 ? 264 GLY A CA 1 ATOM 2061 C C . GLY A 1 274 ? -4.975 -52.025 2.428 1.00 94.29 ? 264 GLY A C 1 ATOM 2062 O O . GLY A 1 274 ? -5.131 -53.050 1.754 1.00 96.41 ? 264 GLY A O 1 ATOM 2063 N N . LYS A 1 275 ? -5.896 -51.040 2.509 1.00 88.44 ? 265 LYS A N 1 ATOM 2064 C CA . LYS A 1 275 ? -7.174 -51.062 1.803 1.00 87.19 ? 265 LYS A CA 1 ATOM 2065 C C . LYS A 1 275 ? -7.083 -50.193 0.538 1.00 89.78 ? 265 LYS A C 1 ATOM 2066 O O . LYS A 1 275 ? -6.268 -49.271 0.464 1.00 90.47 ? 265 LYS A O 1 ATOM 2067 C CB . LYS A 1 275 ? -8.328 -50.610 2.732 1.00 89.18 ? 265 LYS A CB 1 ATOM 2068 C CG . LYS A 1 275 ? -9.727 -51.062 2.264 1.00 101.87 ? 265 LYS A CG 1 ATOM 2069 C CD . LYS A 1 275 ? -10.877 -50.046 2.558 1.00 107.54 ? 265 LYS A CD 1 ATOM 2070 C CE . LYS A 1 275 ? -12.102 -50.209 1.648 1.00 95.50 ? 265 LYS A CE 1 ATOM 2071 N NZ . LYS A 1 275 ? -13.152 -49.154 1.871 1.00 70.14 ? 265 LYS A NZ 1 ATOM 2072 N N . GLU A 1 276 ? -7.885 -50.518 -0.470 1.00 84.10 ? 266 GLU A N 1 ATOM 2073 C CA . GLU A 1 276 ? -7.948 -49.711 -1.676 1.00 83.05 ? 266 GLU A CA 1 ATOM 2074 C C . GLU A 1 276 ? -9.233 -48.855 -1.614 1.00 85.36 ? 266 GLU A C 1 ATOM 2075 O O . GLU A 1 276 ? -10.333 -49.375 -1.354 1.00 85.65 ? 266 GLU A O 1 ATOM 2076 C CB . GLU A 1 276 ? -7.921 -50.582 -2.933 1.00 84.44 ? 266 GLU A CB 1 ATOM 2077 C CG . GLU A 1 276 ? -7.108 -49.984 -4.066 1.00 99.37 ? 266 GLU A CG 1 ATOM 2078 C CD . GLU A 1 276 ? -5.605 -50.244 -4.038 1.00 129.30 ? 266 GLU A CD 1 ATOM 2079 O OE1 . GLU A 1 276 ? -5.192 -51.298 -3.502 1.00 122.73 ? 266 GLU A OE1 1 ATOM 2080 O OE2 . GLU A 1 276 ? -4.840 -49.414 -4.584 1.00 124.54 ? 266 GLU A OE2 1 ATOM 2081 N N . TYR A 1 277 ? -9.078 -47.526 -1.801 1.00 78.35 ? 267 TYR A N 1 ATOM 2082 C CA . TYR A 1 277 ? -10.202 -46.579 -1.790 1.00 74.95 ? 267 TYR A CA 1 ATOM 2083 C C . TYR A 1 277 ? -10.473 -46.150 -3.219 1.00 74.97 ? 267 TYR A C 1 ATOM 2084 O O . TYR A 1 277 ? -9.674 -45.450 -3.827 1.00 71.83 ? 267 TYR A O 1 ATOM 2085 C CB . TYR A 1 277 ? -9.937 -45.425 -0.830 1.00 73.62 ? 267 TYR A CB 1 ATOM 2086 C CG . TYR A 1 277 ? -9.905 -45.875 0.617 1.00 72.62 ? 267 TYR A CG 1 ATOM 2087 C CD1 . TYR A 1 277 ? -11.051 -45.825 1.409 1.00 73.12 ? 267 TYR A CD1 1 ATOM 2088 C CD2 . TYR A 1 277 ? -8.736 -46.391 1.186 1.00 73.05 ? 267 TYR A CD2 1 ATOM 2089 C CE1 . TYR A 1 277 ? -11.038 -46.265 2.733 1.00 71.34 ? 267 TYR A CE1 1 ATOM 2090 C CE2 . TYR A 1 277 ? -8.715 -46.840 2.509 1.00 73.69 ? 267 TYR A CE2 1 ATOM 2091 C CZ . TYR A 1 277 ? -9.869 -46.771 3.274 1.00 80.50 ? 267 TYR A CZ 1 ATOM 2092 O OH . TYR A 1 277 ? -9.855 -47.223 4.568 1.00 86.50 ? 267 TYR A OH 1 ATOM 2093 N N . THR A 1 278 ? -11.562 -46.666 -3.780 1.00 72.47 ? 268 THR A N 1 ATOM 2094 C CA . THR A 1 278 ? -11.865 -46.506 -5.199 1.00 72.51 ? 268 THR A CA 1 ATOM 2095 C C . THR A 1 278 ? -12.932 -45.490 -5.486 1.00 76.85 ? 268 THR A C 1 ATOM 2096 O O . THR A 1 278 ? -14.033 -45.543 -4.908 1.00 77.46 ? 268 THR A O 1 ATOM 2097 C CB . THR A 1 278 ? -12.206 -47.882 -5.852 1.00 72.53 ? 268 THR A CB 1 ATOM 2098 O OG1 . THR A 1 278 ? -11.142 -48.787 -5.586 1.00 74.30 ? 268 THR A OG1 1 ATOM 2099 C CG2 . THR A 1 278 ? -12.408 -47.806 -7.355 1.00 66.86 ? 268 THR A CG2 1 ATOM 2100 N N . LEU A 1 279 ? -12.610 -44.587 -6.431 1.00 71.14 ? 269 LEU A N 1 ATOM 2101 C CA . LEU A 1 279 ? -13.555 -43.625 -6.961 1.00 69.76 ? 269 LEU A CA 1 ATOM 2102 C C . LEU A 1 279 ? -13.831 -43.981 -8.409 1.00 70.35 ? 269 LEU A C 1 ATOM 2103 O O . LEU A 1 279 ? -12.896 -44.130 -9.201 1.00 67.92 ? 269 LEU A O 1 ATOM 2104 C CB . LEU A 1 279 ? -13.039 -42.162 -6.893 1.00 69.90 ? 269 LEU A CB 1 ATOM 2105 C CG . LEU A 1 279 ? -12.582 -41.488 -5.574 1.00 73.58 ? 269 LEU A CG 1 ATOM 2106 C CD1 . LEU A 1 279 ? -12.781 -40.035 -5.677 1.00 73.82 ? 269 LEU A CD1 1 ATOM 2107 C CD2 . LEU A 1 279 ? -13.329 -41.947 -4.330 1.00 75.20 ? 269 LEU A CD2 1 ATOM 2108 N N . THR A 1 280 ? -15.109 -44.126 -8.751 1.00 68.92 ? 270 THR A N 1 ATOM 2109 C CA . THR A 1 280 ? -15.537 -44.340 -10.140 1.00 69.59 ? 270 THR A CA 1 ATOM 2110 C C . THR A 1 280 ? -15.590 -42.954 -10.821 1.00 71.83 ? 270 THR A C 1 ATOM 2111 O O . THR A 1 280 ? -15.490 -41.940 -10.136 1.00 71.07 ? 270 THR A O 1 ATOM 2112 C CB . THR A 1 280 ? -16.905 -45.034 -10.227 1.00 78.39 ? 270 THR A CB 1 ATOM 2113 O OG1 . THR A 1 280 ? -17.299 -45.040 -11.606 1.00 91.21 ? 270 THR A OG1 1 ATOM 2114 C CG2 . THR A 1 280 ? -17.977 -44.294 -9.457 1.00 71.02 ? 270 THR A CG2 1 ATOM 2115 N N . SER A 1 281 ? -15.788 -42.920 -12.149 1.00 67.69 ? 271 SER A N 1 ATOM 2116 C CA . SER A 1 281 ? -15.879 -41.666 -12.892 1.00 67.85 ? 271 SER A CA 1 ATOM 2117 C C . SER A 1 281 ? -17.040 -40.785 -12.388 1.00 70.57 ? 271 SER A C 1 ATOM 2118 O O . SER A 1 281 ? -16.914 -39.561 -12.357 1.00 69.08 ? 271 SER A O 1 ATOM 2119 C CB . SER A 1 281 ? -15.958 -41.901 -14.394 1.00 72.20 ? 271 SER A CB 1 ATOM 2120 O OG . SER A 1 281 ? -17.184 -42.529 -14.728 1.00 83.72 ? 271 SER A OG 1 ATOM 2121 N N . ALA A 1 282 ? -18.130 -41.410 -11.920 1.00 66.70 ? 272 ALA A N 1 ATOM 2122 C CA . ALA A 1 282 ? -19.282 -40.694 -11.351 1.00 66.15 ? 272 ALA A CA 1 ATOM 2123 C C . ALA A 1 282 ? -18.877 -39.946 -10.089 1.00 68.02 ? 272 ALA A C 1 ATOM 2124 O O . ALA A 1 282 ? -19.500 -38.937 -9.778 1.00 68.26 ? 272 ALA A O 1 ATOM 2125 C CB . ALA A 1 282 ? -20.427 -41.661 -11.046 1.00 66.68 ? 272 ALA A CB 1 ATOM 2126 N N . ASP A 1 283 ? -17.847 -40.437 -9.371 1.00 62.33 ? 273 ASP A N 1 ATOM 2127 C CA . ASP A 1 283 ? -17.327 -39.820 -8.146 1.00 61.08 ? 273 ASP A CA 1 ATOM 2128 C C . ASP A 1 283 ? -16.366 -38.668 -8.419 1.00 65.17 ? 273 ASP A C 1 ATOM 2129 O O . ASP A 1 283 ? -16.192 -37.829 -7.538 1.00 66.24 ? 273 ASP A O 1 ATOM 2130 C CB . ASP A 1 283 ? -16.613 -40.845 -7.256 1.00 61.95 ? 273 ASP A CB 1 ATOM 2131 C CG . ASP A 1 283 ? -17.460 -41.987 -6.801 1.00 72.29 ? 273 ASP A CG 1 ATOM 2132 O OD1 . ASP A 1 283 ? -18.599 -41.739 -6.377 1.00 75.44 ? 273 ASP A OD1 1 ATOM 2133 O OD2 . ASP A 1 283 ? -16.964 -43.129 -6.816 1.00 78.20 ? 273 ASP A OD2 1 ATOM 2134 N N . TYR A 1 284 ? -15.720 -38.631 -9.592 1.00 60.08 ? 274 TYR A N 1 ATOM 2135 C CA . TYR A 1 284 ? -14.734 -37.585 -9.847 1.00 59.31 ? 274 TYR A CA 1 ATOM 2136 C C . TYR A 1 284 ? -14.990 -36.668 -11.056 1.00 59.63 ? 274 TYR A C 1 ATOM 2137 O O . TYR A 1 284 ? -14.221 -35.736 -11.279 1.00 58.41 ? 274 TYR A O 1 ATOM 2138 C CB . TYR A 1 284 ? -13.306 -38.155 -9.803 1.00 60.97 ? 274 TYR A CB 1 ATOM 2139 C CG . TYR A 1 284 ? -12.917 -39.051 -10.955 1.00 63.62 ? 274 TYR A CG 1 ATOM 2140 C CD1 . TYR A 1 284 ? -12.508 -38.515 -12.175 1.00 66.43 ? 274 TYR A CD1 1 ATOM 2141 C CD2 . TYR A 1 284 ? -12.861 -40.430 -10.798 1.00 64.06 ? 274 TYR A CD2 1 ATOM 2142 C CE1 . TYR A 1 284 ? -12.115 -39.332 -13.228 1.00 69.80 ? 274 TYR A CE1 1 ATOM 2143 C CE2 . TYR A 1 284 ? -12.467 -41.258 -11.845 1.00 65.29 ? 274 TYR A CE2 1 ATOM 2144 C CZ . TYR A 1 284 ? -12.083 -40.701 -13.054 1.00 76.58 ? 274 TYR A CZ 1 ATOM 2145 O OH . TYR A 1 284 ? -11.671 -41.480 -14.101 1.00 79.39 ? 274 TYR A OH 1 ATOM 2146 N N . VAL A 1 285 ? -16.057 -36.932 -11.826 1.00 53.44 ? 275 VAL A N 1 ATOM 2147 C CA . VAL A 1 285 ? -16.398 -36.103 -12.979 1.00 52.56 ? 275 VAL A CA 1 ATOM 2148 C C . VAL A 1 285 ? -17.619 -35.293 -12.645 1.00 57.97 ? 275 VAL A C 1 ATOM 2149 O O . VAL A 1 285 ? -18.605 -35.854 -12.160 1.00 59.96 ? 275 VAL A O 1 ATOM 2150 C CB . VAL A 1 285 ? -16.663 -36.932 -14.280 1.00 56.30 ? 275 VAL A CB 1 ATOM 2151 C CG1 . VAL A 1 285 ? -17.139 -36.039 -15.442 1.00 55.98 ? 275 VAL A CG1 1 ATOM 2152 C CG2 . VAL A 1 285 ? -15.442 -37.730 -14.703 1.00 55.98 ? 275 VAL A CG2 1 ATOM 2153 N N . PHE A 1 286 ? -17.592 -33.985 -12.956 1.00 54.52 ? 276 PHE A N 1 ATOM 2154 C CA . PHE A 1 286 ? -18.775 -33.133 -12.830 1.00 54.11 ? 276 PHE A CA 1 ATOM 2155 C C . PHE A 1 286 ? -19.552 -33.366 -14.133 1.00 65.06 ? 276 PHE A C 1 ATOM 2156 O O . PHE A 1 286 ? -19.355 -32.657 -15.118 1.00 66.01 ? 276 PHE A O 1 ATOM 2157 C CB . PHE A 1 286 ? -18.367 -31.653 -12.642 1.00 54.47 ? 276 PHE A CB 1 ATOM 2158 C CG . PHE A 1 286 ? -17.878 -31.321 -11.242 1.00 54.21 ? 276 PHE A CG 1 ATOM 2159 C CD1 . PHE A 1 286 ? -18.780 -31.133 -10.205 1.00 55.75 ? 276 PHE A CD1 1 ATOM 2160 C CD2 . PHE A 1 286 ? -16.520 -31.169 -10.972 1.00 55.01 ? 276 PHE A CD2 1 ATOM 2161 C CE1 . PHE A 1 286 ? -18.342 -30.843 -8.913 1.00 56.46 ? 276 PHE A CE1 1 ATOM 2162 C CE2 . PHE A 1 286 ? -16.078 -30.911 -9.675 1.00 57.94 ? 276 PHE A CE2 1 ATOM 2163 C CZ . PHE A 1 286 ? -16.991 -30.785 -8.642 1.00 56.12 ? 276 PHE A CZ 1 ATOM 2164 N N . GLN A 1 287 ? -20.357 -34.440 -14.169 1.00 66.63 ? 277 GLN A N 1 ATOM 2165 C CA . GLN A 1 287 ? -21.103 -34.887 -15.358 1.00 68.48 ? 277 GLN A CA 1 ATOM 2166 C C . GLN A 1 287 ? -22.323 -34.023 -15.593 1.00 77.90 ? 277 GLN A C 1 ATOM 2167 O O . GLN A 1 287 ? -23.443 -34.395 -15.216 1.00 80.36 ? 277 GLN A O 1 ATOM 2168 C CB . GLN A 1 287 ? -21.483 -36.378 -15.215 1.00 69.60 ? 277 GLN A CB 1 ATOM 2169 C CG . GLN A 1 287 ? -21.886 -37.053 -16.521 1.00 74.11 ? 277 GLN A CG 1 ATOM 2170 C CD . GLN A 1 287 ? -20.690 -37.323 -17.407 1.00 88.30 ? 277 GLN A CD 1 ATOM 2171 O OE1 . GLN A 1 287 ? -19.686 -37.939 -16.990 1.00 77.35 ? 277 GLN A OE1 1 ATOM 2172 N NE2 . GLN A 1 287 ? -20.777 -36.857 -18.649 1.00 77.52 ? 277 GLN A NE2 1 ATOM 2173 N N . GLU A 1 288 ? -22.104 -32.867 -16.210 1.00 76.44 ? 278 GLU A N 1 ATOM 2174 C CA . GLU A 1 288 ? -23.128 -31.844 -16.394 1.00 78.61 ? 278 GLU A CA 1 ATOM 2175 C C . GLU A 1 288 ? -23.973 -31.951 -17.652 1.00 86.35 ? 278 GLU A C 1 ATOM 2176 O O . GLU A 1 288 ? -24.951 -31.209 -17.806 1.00 87.42 ? 278 GLU A O 1 ATOM 2177 C CB . GLU A 1 288 ? -22.516 -30.445 -16.222 1.00 80.72 ? 278 GLU A CB 1 ATOM 2178 C CG . GLU A 1 288 ? -23.349 -29.527 -15.340 1.00 101.73 ? 278 GLU A CG 1 ATOM 2179 C CD . GLU A 1 288 ? -23.800 -30.128 -14.018 1.00 136.95 ? 278 GLU A CD 1 ATOM 2180 O OE1 . GLU A 1 288 ? -25.022 -30.351 -13.841 1.00 141.64 ? 278 GLU A OE1 1 ATOM 2181 O OE2 . GLU A 1 288 ? -22.917 -30.426 -13.180 1.00 123.93 ? 278 GLU A OE2 1 ATOM 2182 N N . SER A 1 289 ? -23.599 -32.884 -18.533 1.00 83.78 ? 279 SER A N 1 ATOM 2183 C CA . SER A 1 289 ? -24.282 -33.275 -19.755 1.00 84.03 ? 279 SER A CA 1 ATOM 2184 C C . SER A 1 289 ? -23.554 -34.484 -20.338 1.00 89.17 ? 279 SER A C 1 ATOM 2185 O O . SER A 1 289 ? -22.543 -34.929 -19.793 1.00 88.73 ? 279 SER A O 1 ATOM 2186 C CB . SER A 1 289 ? -24.358 -32.126 -20.760 1.00 88.01 ? 279 SER A CB 1 ATOM 2187 O OG . SER A 1 289 ? -23.225 -32.035 -21.612 1.00 96.52 ? 279 SER A OG 1 ATOM 2188 N N . TYR A 1 290 A -24.083 -35.010 -21.440 1.00 86.69 ? 279 TYR A N 1 ATOM 2189 C CA . TYR A 1 290 A -23.501 -36.156 -22.111 1.00 86.77 ? 279 TYR A CA 1 ATOM 2190 C C . TYR A 1 290 A -23.086 -35.808 -23.532 1.00 92.44 ? 279 TYR A C 1 ATOM 2191 O O . TYR A 1 290 A -22.808 -36.713 -24.326 1.00 92.59 ? 279 TYR A O 1 ATOM 2192 C CB . TYR A 1 290 A -24.483 -37.335 -22.085 1.00 87.09 ? 279 TYR A CB 1 ATOM 2193 C CG . TYR A 1 290 A -24.766 -37.842 -20.696 1.00 86.49 ? 279 TYR A CG 1 ATOM 2194 C CD1 . TYR A 1 290 A -23.830 -38.613 -20.012 1.00 88.10 ? 279 TYR A CD1 1 ATOM 2195 C CD2 . TYR A 1 290 A -25.984 -37.584 -20.076 1.00 87.01 ? 279 TYR A CD2 1 ATOM 2196 C CE1 . TYR A 1 290 A -24.091 -39.099 -18.736 1.00 89.28 ? 279 TYR A CE1 1 ATOM 2197 C CE2 . TYR A 1 290 A -26.263 -38.073 -18.804 1.00 87.94 ? 279 TYR A CE2 1 ATOM 2198 C CZ . TYR A 1 290 A -25.310 -38.831 -18.137 1.00 95.45 ? 279 TYR A CZ 1 ATOM 2199 O OH . TYR A 1 290 A -25.543 -39.321 -16.881 1.00 93.86 ? 279 TYR A OH 1 ATOM 2200 N N . SER A 1 291 B -23.008 -34.500 -23.839 1.00 89.42 ? 279 SER A N 1 ATOM 2201 C CA . SER A 1 291 B -22.654 -34.024 -25.170 1.00 89.73 ? 279 SER A CA 1 ATOM 2202 C C . SER A 1 291 B -21.164 -34.117 -25.479 1.00 94.36 ? 279 SER A C 1 ATOM 2203 O O . SER A 1 291 B -20.341 -33.844 -24.609 1.00 93.38 ? 279 SER A O 1 ATOM 2204 C CB . SER A 1 291 B -23.130 -32.587 -25.355 1.00 93.20 ? 279 SER A CB 1 ATOM 2205 O OG . SER A 1 291 B -22.950 -32.141 -26.691 1.00 99.05 ? 279 SER A OG 1 ATOM 2206 N N . SER A 1 292 C -20.822 -34.469 -26.738 1.00 92.17 ? 279 SER A N 1 ATOM 2207 C CA . SER A 1 292 C -19.451 -34.436 -27.261 1.00 92.31 ? 279 SER A CA 1 ATOM 2208 C C . SER A 1 292 C -19.089 -32.980 -27.545 1.00 95.56 ? 279 SER A C 1 ATOM 2209 O O . SER A 1 292 C -17.915 -32.673 -27.748 1.00 95.65 ? 279 SER A O 1 ATOM 2210 C CB . SER A 1 292 C -19.332 -35.221 -28.566 1.00 97.19 ? 279 SER A CB 1 ATOM 2211 O OG . SER A 1 292 C -19.375 -36.626 -28.385 1.00 108.35 ? 279 SER A OG 1 ATOM 2212 N N . LYS A 1 293 D -20.107 -32.088 -27.580 1.00 91.31 ? 279 LYS A N 1 ATOM 2213 C CA . LYS A 1 293 D -19.931 -30.656 -27.838 1.00 90.83 ? 279 LYS A CA 1 ATOM 2214 C C . LYS A 1 293 D -19.625 -29.840 -26.574 1.00 91.96 ? 279 LYS A C 1 ATOM 2215 O O . LYS A 1 293 D -19.325 -28.645 -26.666 1.00 92.84 ? 279 LYS A O 1 ATOM 2216 C CB . LYS A 1 293 D -21.147 -30.091 -28.588 1.00 93.78 ? 279 LYS A CB 1 ATOM 2217 C CG . LYS A 1 293 D -21.164 -30.449 -30.076 1.00 104.80 ? 279 LYS A CG 1 ATOM 2218 C CD . LYS A 1 293 D -22.065 -31.643 -30.384 1.00 113.26 ? 279 LYS A CD 1 ATOM 2219 C CE . LYS A 1 293 D -22.123 -31.980 -31.865 1.00 123.91 ? 279 LYS A CE 1 ATOM 2220 N NZ . LYS A 1 293 D -22.741 -30.904 -32.681 1.00 132.38 ? 279 LYS A NZ 1 ATOM 2221 N N . LYS A 1 294 ? -19.693 -30.490 -25.404 1.00 84.25 ? 280 LYS A N 1 ATOM 2222 C CA . LYS A 1 294 ? -19.447 -29.852 -24.121 1.00 82.00 ? 280 LYS A CA 1 ATOM 2223 C C . LYS A 1 294 ? -18.273 -30.471 -23.400 1.00 83.50 ? 280 LYS A C 1 ATOM 2224 O O . LYS A 1 294 ? -17.974 -31.658 -23.574 1.00 82.51 ? 280 LYS A O 1 ATOM 2225 C CB . LYS A 1 294 ? -20.690 -29.920 -23.228 1.00 83.87 ? 280 LYS A CB 1 ATOM 2226 C CG . LYS A 1 294 ? -21.960 -29.366 -23.868 1.00 96.14 ? 280 LYS A CG 1 ATOM 2227 C CD . LYS A 1 294 ? -22.199 -27.890 -23.577 1.00 107.10 ? 280 LYS A CD 1 ATOM 2228 C CE . LYS A 1 294 ? -22.789 -27.566 -22.196 1.00 124.11 ? 280 LYS A CE 1 ATOM 2229 N NZ . LYS A 1 294 ? -24.013 -28.360 -21.808 1.00 134.90 ? 280 LYS A NZ 1 ATOM 2230 N N . LEU A 1 295 ? -17.606 -29.654 -22.577 1.00 78.68 ? 281 LEU A N 1 ATOM 2231 C CA . LEU A 1 295 ? -16.476 -30.091 -21.769 1.00 77.05 ? 281 LEU A CA 1 ATOM 2232 C C . LEU A 1 295 ? -16.915 -30.226 -20.324 1.00 76.98 ? 281 LEU A C 1 ATOM 2233 O O . LEU A 1 295 ? -17.654 -29.384 -19.815 1.00 75.46 ? 281 LEU A O 1 ATOM 2234 C CB . LEU A 1 295 ? -15.308 -29.112 -21.886 1.00 77.09 ? 281 LEU A CB 1 ATOM 2235 C CG . LEU A 1 295 ? -14.660 -28.952 -23.264 1.00 81.44 ? 281 LEU A CG 1 ATOM 2236 C CD1 . LEU A 1 295 ? -13.718 -27.762 -23.265 1.00 81.57 ? 281 LEU A CD1 1 ATOM 2237 C CD2 . LEU A 1 295 ? -13.933 -30.219 -23.702 1.00 83.08 ? 281 LEU A CD2 1 ATOM 2238 N N . CYS A 1 296 ? -16.505 -31.323 -19.684 1.00 72.03 ? 282 CYS A N 1 ATOM 2239 C CA . CYS A 1 296 ? -16.863 -31.634 -18.300 1.00 71.08 ? 282 CYS A CA 1 ATOM 2240 C C . CYS A 1 296 ? -15.610 -31.570 -17.437 1.00 71.79 ? 282 CYS A C 1 ATOM 2241 O O . CYS A 1 296 ? -14.582 -32.143 -17.805 1.00 71.87 ? 282 CYS A O 1 ATOM 2242 C CB . CYS A 1 296 ? -17.567 -32.992 -18.201 1.00 71.53 ? 282 CYS A CB 1 ATOM 2243 S SG . CYS A 1 296 ? -19.337 -32.935 -18.577 1.00 75.75 ? 282 CYS A SG 1 ATOM 2244 N N . THR A 1 297 ? -15.674 -30.843 -16.314 1.00 65.09 ? 283 THR A N 1 ATOM 2245 C CA . THR A 1 297 ? -14.516 -30.692 -15.429 1.00 63.48 ? 283 THR A CA 1 ATOM 2246 C C . THR A 1 297 ? -14.365 -31.899 -14.511 1.00 64.54 ? 283 THR A C 1 ATOM 2247 O O . THR A 1 297 ? -15.365 -32.526 -14.137 1.00 65.35 ? 283 THR A O 1 ATOM 2248 C CB . THR A 1 297 ? -14.659 -29.424 -14.577 1.00 70.72 ? 283 THR A CB 1 ATOM 2249 O OG1 . THR A 1 297 ? -14.889 -28.277 -15.388 1.00 76.64 ? 283 THR A OG1 1 ATOM 2250 C CG2 . THR A 1 297 ? -13.466 -29.185 -13.665 1.00 69.46 ? 283 THR A CG2 1 ATOM 2251 N N . LEU A 1 298 ? -13.124 -32.172 -14.095 1.00 56.92 ? 284 LEU A N 1 ATOM 2252 C CA . LEU A 1 298 ? -12.835 -33.235 -13.150 1.00 56.51 ? 284 LEU A CA 1 ATOM 2253 C C . LEU A 1 298 ? -12.591 -32.660 -11.766 1.00 61.17 ? 284 LEU A C 1 ATOM 2254 O O . LEU A 1 298 ? -12.008 -31.588 -11.632 1.00 62.27 ? 284 LEU A O 1 ATOM 2255 C CB . LEU A 1 298 ? -11.620 -34.084 -13.568 1.00 56.85 ? 284 LEU A CB 1 ATOM 2256 C CG . LEU A 1 298 ? -11.512 -34.711 -14.960 1.00 62.19 ? 284 LEU A CG 1 ATOM 2257 C CD1 . LEU A 1 298 ? -10.526 -35.823 -14.932 1.00 62.12 ? 284 LEU A CD1 1 ATOM 2258 C CD2 . LEU A 1 298 ? -12.852 -35.239 -15.465 1.00 65.18 ? 284 LEU A CD2 1 ATOM 2259 N N . ALA A 1 299 ? -12.999 -33.391 -10.738 1.00 57.28 ? 285 ALA A N 1 ATOM 2260 C CA . ALA A 1 299 ? -12.842 -32.986 -9.358 1.00 56.46 ? 285 ALA A CA 1 ATOM 2261 C C . ALA A 1 299 ? -11.478 -33.440 -8.807 1.00 61.26 ? 285 ALA A C 1 ATOM 2262 O O . ALA A 1 299 ? -11.354 -33.838 -7.647 1.00 60.05 ? 285 ALA A O 1 ATOM 2263 C CB . ALA A 1 299 ? -13.990 -33.519 -8.524 1.00 57.01 ? 285 ALA A CB 1 ATOM 2264 N N . ILE A 1 300 ? -10.452 -33.376 -9.662 1.00 59.13 ? 286 ILE A N 1 ATOM 2265 C CA . ILE A 1 300 ? -9.050 -33.695 -9.360 1.00 59.02 ? 286 ILE A CA 1 ATOM 2266 C C . ILE A 1 300 ? -8.207 -32.614 -10.045 1.00 64.59 ? 286 ILE A C 1 ATOM 2267 O O . ILE A 1 300 ? -8.408 -32.329 -11.230 1.00 61.24 ? 286 ILE A O 1 ATOM 2268 C CB . ILE A 1 300 ? -8.620 -35.103 -9.868 1.00 61.28 ? 286 ILE A CB 1 ATOM 2269 C CG1 . ILE A 1 300 ? -9.529 -36.198 -9.300 1.00 62.25 ? 286 ILE A CG1 1 ATOM 2270 C CG2 . ILE A 1 300 ? -7.122 -35.385 -9.577 1.00 57.74 ? 286 ILE A CG2 1 ATOM 2271 C CD1 . ILE A 1 300 ? -9.425 -37.513 -10.006 1.00 61.68 ? 286 ILE A CD1 1 ATOM 2272 N N . HIS A 1 301 ? -7.261 -32.033 -9.326 1.00 64.82 ? 287 HIS A N 1 ATOM 2273 C CA . HIS A 1 301 ? -6.421 -31.005 -9.934 1.00 66.11 ? 287 HIS A CA 1 ATOM 2274 C C . HIS A 1 301 ? -4.994 -30.998 -9.393 1.00 63.98 ? 287 HIS A C 1 ATOM 2275 O O . HIS A 1 301 ? -4.684 -31.737 -8.452 1.00 61.95 ? 287 HIS A O 1 ATOM 2276 C CB . HIS A 1 301 ? -7.098 -29.610 -9.882 1.00 69.34 ? 287 HIS A CB 1 ATOM 2277 C CG . HIS A 1 301 ? -7.209 -28.993 -8.522 1.00 75.43 ? 287 HIS A CG 1 ATOM 2278 N ND1 . HIS A 1 301 ? -7.604 -27.680 -8.382 1.00 80.02 ? 287 HIS A ND1 1 ATOM 2279 C CD2 . HIS A 1 301 ? -6.972 -29.510 -7.287 1.00 78.85 ? 287 HIS A CD2 1 ATOM 2280 C CE1 . HIS A 1 301 ? -7.598 -27.435 -7.074 1.00 80.30 ? 287 HIS A CE1 1 ATOM 2281 N NE2 . HIS A 1 301 ? -7.211 -28.509 -6.378 1.00 79.92 ? 287 HIS A NE2 1 ATOM 2282 N N . ALA A 1 302 ? -4.120 -30.179 -9.990 1.00 57.89 ? 288 ALA A N 1 ATOM 2283 C CA . ALA A 1 302 ? -2.746 -30.096 -9.517 1.00 56.74 ? 288 ALA A CA 1 ATOM 2284 C C . ALA A 1 302 ? -2.664 -29.036 -8.457 1.00 64.11 ? 288 ALA A C 1 ATOM 2285 O O . ALA A 1 302 ? -3.266 -27.957 -8.589 1.00 63.39 ? 288 ALA A O 1 ATOM 2286 C CB . ALA A 1 302 ? -1.802 -29.770 -10.663 1.00 56.86 ? 288 ALA A CB 1 ATOM 2287 N N . MET A 1 303 ? -1.975 -29.366 -7.368 1.00 63.42 ? 289 MET A N 1 ATOM 2288 C CA . MET A 1 303 ? -1.703 -28.424 -6.296 1.00 64.71 ? 289 MET A CA 1 ATOM 2289 C C . MET A 1 303 ? -0.384 -28.777 -5.670 1.00 69.48 ? 289 MET A C 1 ATOM 2290 O O . MET A 1 303 ? -0.251 -29.835 -5.058 1.00 70.03 ? 289 MET A O 1 ATOM 2291 C CB . MET A 1 303 ? -2.820 -28.341 -5.253 1.00 68.22 ? 289 MET A CB 1 ATOM 2292 C CG . MET A 1 303 ? -2.802 -27.054 -4.466 1.00 73.89 ? 289 MET A CG 1 ATOM 2293 S SD . MET A 1 303 ? -3.941 -25.833 -5.245 1.00 80.69 ? 289 MET A SD 1 ATOM 2294 C CE . MET A 1 303 ? -5.385 -26.206 -4.452 1.00 79.03 ? 289 MET A CE 1 ATOM 2295 N N . ASP A 1 304 ? 0.614 -27.911 -5.872 1.00 66.22 ? 290 ASP A N 1 ATOM 2296 C CA . ASP A 1 304 ? 1.926 -28.099 -5.291 1.00 66.30 ? 290 ASP A CA 1 ATOM 2297 C C . ASP A 1 304 ? 1.995 -27.500 -3.903 1.00 69.65 ? 290 ASP A C 1 ATOM 2298 O O . ASP A 1 304 ? 2.080 -26.284 -3.758 1.00 67.47 ? 290 ASP A O 1 ATOM 2299 C CB . ASP A 1 304 ? 3.028 -27.579 -6.227 1.00 68.17 ? 290 ASP A CB 1 ATOM 2300 C CG . ASP A 1 304 ? 3.138 -28.402 -7.495 1.00 73.08 ? 290 ASP A CG 1 ATOM 2301 O OD1 . ASP A 1 304 ? 3.512 -29.595 -7.400 1.00 73.98 ? 290 ASP A OD1 1 ATOM 2302 O OD2 . ASP A 1 304 ? 2.835 -27.864 -8.570 1.00 72.61 ? 290 ASP A OD2 1 ATOM 2303 N N . ILE A 1 305 ? 1.914 -28.362 -2.884 1.00 69.80 ? 291 ILE A N 1 ATOM 2304 C CA . ILE A 1 305 ? 1.990 -27.953 -1.478 1.00 71.94 ? 291 ILE A CA 1 ATOM 2305 C C . ILE A 1 305 ? 3.456 -27.961 -1.062 1.00 82.18 ? 291 ILE A C 1 ATOM 2306 O O . ILE A 1 305 ? 4.137 -28.976 -1.245 1.00 82.98 ? 291 ILE A O 1 ATOM 2307 C CB . ILE A 1 305 ? 1.098 -28.832 -0.576 1.00 74.62 ? 291 ILE A CB 1 ATOM 2308 C CG1 . ILE A 1 305 ? -0.385 -28.769 -1.043 1.00 73.80 ? 291 ILE A CG1 1 ATOM 2309 C CG2 . ILE A 1 305 ? 1.234 -28.429 0.876 1.00 74.63 ? 291 ILE A CG2 1 ATOM 2310 C CD1 . ILE A 1 305 ? -1.221 -29.948 -0.680 1.00 73.84 ? 291 ILE A CD1 1 ATOM 2311 N N . PRO A 1 306 ? 3.966 -26.822 -0.553 1.00 81.67 ? 292 PRO A N 1 ATOM 2312 C CA . PRO A 1 306 ? 5.403 -26.724 -0.248 1.00 82.00 ? 292 PRO A CA 1 ATOM 2313 C C . PRO A 1 306 ? 5.819 -27.444 1.015 1.00 87.25 ? 292 PRO A C 1 ATOM 2314 O O . PRO A 1 306 ? 4.963 -27.677 1.873 1.00 86.31 ? 292 PRO A O 1 ATOM 2315 C CB . PRO A 1 306 ? 5.610 -25.214 -0.081 1.00 83.72 ? 292 PRO A CB 1 ATOM 2316 C CG . PRO A 1 306 ? 4.311 -24.731 0.423 1.00 88.18 ? 292 PRO A CG 1 ATOM 2317 C CD . PRO A 1 306 ? 3.278 -25.542 -0.305 1.00 83.58 ? 292 PRO A CD 1 ATOM 2318 N N . PRO A 1 307 ? 7.141 -27.730 1.179 1.00 85.81 ? 293 PRO A N 1 ATOM 2319 C CA . PRO A 1 307 ? 7.634 -28.311 2.446 1.00 85.50 ? 293 PRO A CA 1 ATOM 2320 C C . PRO A 1 307 ? 7.345 -27.398 3.648 1.00 88.50 ? 293 PRO A C 1 ATOM 2321 O O . PRO A 1 307 ? 7.168 -26.186 3.479 1.00 86.35 ? 293 PRO A O 1 ATOM 2322 C CB . PRO A 1 307 ? 9.140 -28.459 2.209 1.00 87.30 ? 293 PRO A CB 1 ATOM 2323 C CG . PRO A 1 307 ? 9.293 -28.495 0.734 1.00 91.84 ? 293 PRO A CG 1 ATOM 2324 C CD . PRO A 1 307 ? 8.249 -27.548 0.221 1.00 87.67 ? 293 PRO A CD 1 ATOM 2325 N N . PRO A 1 308 ? 7.232 -27.961 4.867 1.00 86.74 ? 294 PRO A N 1 ATOM 2326 C CA . PRO A 1 308 ? 7.415 -29.382 5.226 1.00 87.41 ? 294 PRO A CA 1 ATOM 2327 C C . PRO A 1 308 ? 6.218 -30.295 4.934 1.00 96.23 ? 294 PRO A C 1 ATOM 2328 O O . PRO A 1 308 ? 6.419 -31.506 4.768 1.00 96.95 ? 294 PRO A O 1 ATOM 2329 C CB . PRO A 1 308 ? 7.722 -29.318 6.724 1.00 88.04 ? 294 PRO A CB 1 ATOM 2330 C CG . PRO A 1 308 ? 6.950 -28.131 7.209 1.00 91.64 ? 294 PRO A CG 1 ATOM 2331 C CD . PRO A 1 308 ? 6.915 -27.143 6.055 1.00 87.45 ? 294 PRO A CD 1 ATOM 2332 N N . THR A 1 309 ? 4.978 -29.726 4.884 1.00 93.45 ? 295 THR A N 1 ATOM 2333 C CA . THR A 1 309 ? 3.751 -30.497 4.654 1.00 92.38 ? 295 THR A CA 1 ATOM 2334 C C . THR A 1 309 ? 3.830 -31.250 3.338 1.00 93.47 ? 295 THR A C 1 ATOM 2335 O O . THR A 1 309 ? 3.603 -32.455 3.306 1.00 93.47 ? 295 THR A O 1 ATOM 2336 C CB . THR A 1 309 ? 2.490 -29.623 4.720 1.00 99.54 ? 295 THR A CB 1 ATOM 2337 O OG1 . THR A 1 309 ? 2.513 -28.787 5.874 1.00 96.93 ? 295 THR A OG1 1 ATOM 2338 C CG2 . THR A 1 309 ? 1.229 -30.455 4.714 1.00 99.75 ? 295 THR A CG2 1 ATOM 2339 N N . GLY A 1 310 ? 4.168 -30.534 2.280 1.00 87.62 ? 296 GLY A N 1 ATOM 2340 C CA . GLY A 1 310 ? 4.288 -31.105 0.955 1.00 86.28 ? 296 GLY A CA 1 ATOM 2341 C C . GLY A 1 310 ? 5.704 -31.462 0.580 1.00 88.23 ? 296 GLY A C 1 ATOM 2342 O O . GLY A 1 310 ? 6.621 -31.243 1.370 1.00 89.02 ? 296 GLY A O 1 ATOM 2343 N N . PRO A 1 311 ? 5.907 -32.013 -0.635 1.00 81.86 ? 297 PRO A N 1 ATOM 2344 C CA . PRO A 1 311 ? 4.882 -32.363 -1.629 1.00 81.05 ? 297 PRO A CA 1 ATOM 2345 C C . PRO A 1 311 ? 3.956 -33.465 -1.093 1.00 81.69 ? 297 PRO A C 1 ATOM 2346 O O . PRO A 1 311 ? 4.417 -34.421 -0.474 1.00 81.03 ? 297 PRO A O 1 ATOM 2347 C CB . PRO A 1 311 ? 5.716 -32.830 -2.836 1.00 82.75 ? 297 PRO A CB 1 ATOM 2348 C CG . PRO A 1 311 ? 7.075 -32.272 -2.613 1.00 86.00 ? 297 PRO A CG 1 ATOM 2349 C CD . PRO A 1 311 ? 7.244 -32.361 -1.133 1.00 81.92 ? 297 PRO A CD 1 ATOM 2350 N N . THR A 1 312 ? 2.644 -33.274 -1.247 1.00 76.28 ? 298 THR A N 1 ATOM 2351 C CA . THR A 1 312 ? 1.622 -34.233 -0.807 1.00 74.23 ? 298 THR A CA 1 ATOM 2352 C C . THR A 1 312 ? 0.465 -34.268 -1.771 1.00 74.77 ? 298 THR A C 1 ATOM 2353 O O . THR A 1 312 ? 0.189 -33.304 -2.493 1.00 74.04 ? 298 THR A O 1 ATOM 2354 C CB . THR A 1 312 ? 0.932 -33.800 0.501 1.00 79.36 ? 298 THR A CB 1 ATOM 2355 O OG1 . THR A 1 312 ? 1.710 -32.866 1.225 1.00 90.29 ? 298 THR A OG1 1 ATOM 2356 C CG2 . THR A 1 312 ? 0.555 -34.966 1.374 1.00 71.09 ? 298 THR A CG2 1 ATOM 2357 N N . TRP A 1 313 ? -0.253 -35.377 -1.736 1.00 69.95 ? 299 TRP A N 1 ATOM 2358 C CA . TRP A 1 313 ? -1.557 -35.472 -2.330 1.00 69.07 ? 299 TRP A CA 1 ATOM 2359 C C . TRP A 1 313 ? -2.469 -34.912 -1.247 1.00 69.04 ? 299 TRP A C 1 ATOM 2360 O O . TRP A 1 313 ? -2.149 -34.970 -0.057 1.00 67.86 ? 299 TRP A O 1 ATOM 2361 C CB . TRP A 1 313 ? -1.958 -36.925 -2.600 1.00 68.38 ? 299 TRP A CB 1 ATOM 2362 C CG . TRP A 1 313 ? -1.278 -37.534 -3.778 1.00 69.94 ? 299 TRP A CG 1 ATOM 2363 C CD1 . TRP A 1 313 ? -0.001 -38.011 -3.832 1.00 73.06 ? 299 TRP A CD1 1 ATOM 2364 C CD2 . TRP A 1 313 ? -1.864 -37.805 -5.051 1.00 69.86 ? 299 TRP A CD2 1 ATOM 2365 N NE1 . TRP A 1 313 ? 0.252 -38.543 -5.072 1.00 72.77 ? 299 TRP A NE1 1 ATOM 2366 C CE2 . TRP A 1 313 ? -0.872 -38.427 -5.843 1.00 73.69 ? 299 TRP A CE2 1 ATOM 2367 C CE3 . TRP A 1 313 ? -3.129 -37.563 -5.609 1.00 71.25 ? 299 TRP A CE3 1 ATOM 2368 C CZ2 . TRP A 1 313 ? -1.100 -38.811 -7.161 1.00 72.58 ? 299 TRP A CZ2 1 ATOM 2369 C CZ3 . TRP A 1 313 ? -3.352 -37.943 -6.922 1.00 72.87 ? 299 TRP A CZ3 1 ATOM 2370 C CH2 . TRP A 1 313 ? -2.339 -38.549 -7.687 1.00 73.32 ? 299 TRP A CH2 1 ATOM 2371 N N . ALA A 1 314 ? -3.599 -34.365 -1.651 1.00 64.00 ? 300 ALA A N 1 ATOM 2372 C CA . ALA A 1 314 ? -4.570 -33.899 -0.688 1.00 62.40 ? 300 ALA A CA 1 ATOM 2373 C C . ALA A 1 314 ? -5.880 -34.551 -1.021 1.00 61.09 ? 300 ALA A C 1 ATOM 2374 O O . ALA A 1 314 ? -6.291 -34.518 -2.184 1.00 60.31 ? 300 ALA A O 1 ATOM 2375 C CB . ALA A 1 314 ? -4.680 -32.382 -0.736 1.00 63.01 ? 300 ALA A CB 1 ATOM 2376 N N . LEU A 1 315 ? -6.502 -35.196 -0.021 1.00 54.59 ? 301 LEU A N 1 ATOM 2377 C CA . LEU A 1 315 ? -7.811 -35.841 -0.175 1.00 54.41 ? 301 LEU A CA 1 ATOM 2378 C C . LEU A 1 315 ? -8.877 -34.914 0.386 1.00 60.12 ? 301 LEU A C 1 ATOM 2379 O O . LEU A 1 315 ? -9.101 -34.892 1.602 1.00 60.33 ? 301 LEU A O 1 ATOM 2380 C CB . LEU A 1 315 ? -7.842 -37.223 0.484 1.00 54.13 ? 301 LEU A CB 1 ATOM 2381 C CG . LEU A 1 315 ? -6.736 -38.230 0.010 1.00 57.47 ? 301 LEU A CG 1 ATOM 2382 C CD1 . LEU A 1 315 ? -6.808 -39.524 0.760 1.00 55.35 ? 301 LEU A CD1 1 ATOM 2383 C CD2 . LEU A 1 315 ? -6.752 -38.463 -1.511 1.00 56.68 ? 301 LEU A CD2 1 ATOM 2384 N N . GLY A 1 316 ? -9.461 -34.102 -0.512 1.00 56.48 ? 302 GLY A N 1 ATOM 2385 C CA . GLY A 1 316 ? -10.474 -33.104 -0.202 1.00 55.45 ? 302 GLY A CA 1 ATOM 2386 C C . GLY A 1 316 ? -11.889 -33.615 -0.341 1.00 58.60 ? 302 GLY A C 1 ATOM 2387 O O . GLY A 1 316 ? -12.133 -34.823 -0.200 1.00 60.29 ? 302 GLY A O 1 ATOM 2388 N N . ALA A 1 317 ? -12.837 -32.705 -0.649 1.00 52.84 ? 303 ALA A N 1 ATOM 2389 C CA . ALA A 1 317 ? -14.265 -33.048 -0.699 1.00 52.34 ? 303 ALA A CA 1 ATOM 2390 C C . ALA A 1 317 ? -14.636 -34.169 -1.676 1.00 58.56 ? 303 ALA A C 1 ATOM 2391 O O . ALA A 1 317 ? -15.547 -34.956 -1.393 1.00 58.44 ? 303 ALA A O 1 ATOM 2392 C CB . ALA A 1 317 ? -15.107 -31.824 -0.926 1.00 52.38 ? 303 ALA A CB 1 ATOM 2393 N N . THR A 1 318 ? -13.915 -34.276 -2.793 1.00 54.67 ? 304 THR A N 1 ATOM 2394 C CA . THR A 1 318 ? -14.149 -35.358 -3.752 1.00 54.86 ? 304 THR A CA 1 ATOM 2395 C C . THR A 1 318 ? -14.065 -36.737 -3.053 1.00 60.06 ? 304 THR A C 1 ATOM 2396 O O . THR A 1 318 ? -14.899 -37.623 -3.304 1.00 57.46 ? 304 THR A O 1 ATOM 2397 C CB . THR A 1 318 ? -13.132 -35.291 -4.898 1.00 58.27 ? 304 THR A CB 1 ATOM 2398 O OG1 . THR A 1 318 ? -13.111 -33.978 -5.436 1.00 57.69 ? 304 THR A OG1 1 ATOM 2399 C CG2 . THR A 1 318 ? -13.433 -36.282 -5.991 1.00 51.62 ? 304 THR A CG2 1 ATOM 2400 N N . PHE A 1 319 ? -13.037 -36.892 -2.178 1.00 58.22 ? 305 PHE A N 1 ATOM 2401 C CA . PHE A 1 319 ? -12.802 -38.130 -1.451 1.00 57.69 ? 305 PHE A CA 1 ATOM 2402 C C . PHE A 1 319 ? -13.782 -38.311 -0.285 1.00 60.43 ? 305 PHE A C 1 ATOM 2403 O O . PHE A 1 319 ? -14.334 -39.401 -0.104 1.00 59.63 ? 305 PHE A O 1 ATOM 2404 C CB . PHE A 1 319 ? -11.359 -38.163 -0.943 1.00 59.22 ? 305 PHE A CB 1 ATOM 2405 C CG . PHE A 1 319 ? -10.912 -39.521 -0.448 1.00 60.23 ? 305 PHE A CG 1 ATOM 2406 C CD1 . PHE A 1 319 ? -11.011 -39.856 0.901 1.00 61.47 ? 305 PHE A CD1 1 ATOM 2407 C CD2 . PHE A 1 319 ? -10.380 -40.463 -1.335 1.00 63.11 ? 305 PHE A CD2 1 ATOM 2408 C CE1 . PHE A 1 319 ? -10.599 -41.110 1.357 1.00 62.83 ? 305 PHE A CE1 1 ATOM 2409 C CE2 . PHE A 1 319 ? -9.975 -41.722 -0.884 1.00 65.18 ? 305 PHE A CE2 1 ATOM 2410 C CZ . PHE A 1 319 ? -10.081 -42.036 0.463 1.00 62.49 ? 305 PHE A CZ 1 ATOM 2411 N N . ILE A 1 320 ? -13.994 -37.251 0.500 1.00 55.87 ? 306 ILE A N 1 ATOM 2412 C CA . ILE A 1 320 ? -14.840 -37.305 1.693 1.00 56.44 ? 306 ILE A CA 1 ATOM 2413 C C . ILE A 1 320 ? -16.299 -37.591 1.375 1.00 63.75 ? 306 ILE A C 1 ATOM 2414 O O . ILE A 1 320 ? -16.991 -38.216 2.186 1.00 64.45 ? 306 ILE A O 1 ATOM 2415 C CB . ILE A 1 320 ? -14.636 -36.049 2.597 1.00 58.82 ? 306 ILE A CB 1 ATOM 2416 C CG1 . ILE A 1 320 ? -13.170 -35.944 3.048 1.00 59.39 ? 306 ILE A CG1 1 ATOM 2417 C CG2 . ILE A 1 320 ? -15.581 -36.056 3.804 1.00 56.51 ? 306 ILE A CG2 1 ATOM 2418 C CD1 . ILE A 1 320 ? -12.714 -34.564 3.387 1.00 68.53 ? 306 ILE A CD1 1 ATOM 2419 N N . ARG A 1 321 ? -16.768 -37.138 0.204 1.00 61.09 ? 307 ARG A N 1 ATOM 2420 C CA . ARG A 1 321 ? -18.128 -37.439 -0.229 1.00 61.26 ? 307 ARG A CA 1 ATOM 2421 C C . ARG A 1 321 ? -18.383 -38.951 -0.261 1.00 66.00 ? 307 ARG A C 1 ATOM 2422 O O . ARG A 1 321 ? -19.459 -39.397 0.161 1.00 65.85 ? 307 ARG A O 1 ATOM 2423 C CB . ARG A 1 321 ? -18.398 -36.865 -1.608 1.00 59.86 ? 307 ARG A CB 1 ATOM 2424 C CG . ARG A 1 321 ? -18.838 -35.434 -1.573 1.00 66.87 ? 307 ARG A CG 1 ATOM 2425 C CD . ARG A 1 321 ? -19.450 -35.067 -2.908 1.00 67.73 ? 307 ARG A CD 1 ATOM 2426 N NE . ARG A 1 321 ? -18.442 -34.887 -3.960 1.00 64.99 ? 307 ARG A NE 1 ATOM 2427 C CZ . ARG A 1 321 ? -17.743 -33.766 -4.129 1.00 75.76 ? 307 ARG A CZ 1 ATOM 2428 N NH1 . ARG A 1 321 ? -17.929 -32.734 -3.315 1.00 65.25 ? 307 ARG A NH1 1 ATOM 2429 N NH2 . ARG A 1 321 ? -16.847 -33.671 -5.112 1.00 51.91 ? 307 ARG A NH2 1 ATOM 2430 N N . LYS A 1 322 ? -17.405 -39.722 -0.750 1.00 62.57 ? 308 LYS A N 1 ATOM 2431 C CA . LYS A 1 322 ? -17.525 -41.179 -0.808 1.00 62.47 ? 308 LYS A CA 1 ATOM 2432 C C . LYS A 1 322 ? -17.204 -41.813 0.561 1.00 65.60 ? 308 LYS A C 1 ATOM 2433 O O . LYS A 1 322 ? -17.876 -42.755 0.979 1.00 64.25 ? 308 LYS A O 1 ATOM 2434 C CB . LYS A 1 322 ? -16.604 -41.748 -1.893 1.00 64.57 ? 308 LYS A CB 1 ATOM 2435 C CG . LYS A 1 322 ? -16.761 -43.240 -2.107 1.00 65.82 ? 308 LYS A CG 1 ATOM 2436 C CD . LYS A 1 322 ? -17.395 -43.483 -3.428 1.00 76.78 ? 308 LYS A CD 1 ATOM 2437 C CE . LYS A 1 322 ? -17.345 -44.957 -3.691 1.00 84.37 ? 308 LYS A CE 1 ATOM 2438 N NZ . LYS A 1 322 ? -16.795 -45.266 -5.044 1.00 82.34 ? 308 LYS A NZ 1 ATOM 2439 N N . PHE A 1 323 ? -16.187 -41.280 1.254 1.00 61.31 ? 309 PHE A N 1 ATOM 2440 C CA . PHE A 1 323 ? -15.725 -41.832 2.519 1.00 59.36 ? 309 PHE A CA 1 ATOM 2441 C C . PHE A 1 323 ? -15.870 -40.912 3.722 1.00 63.96 ? 309 PHE A C 1 ATOM 2442 O O . PHE A 1 323 ? -15.104 -39.960 3.874 1.00 64.02 ? 309 PHE A O 1 ATOM 2443 C CB . PHE A 1 323 ? -14.287 -42.348 2.375 1.00 60.09 ? 309 PHE A CB 1 ATOM 2444 C CG . PHE A 1 323 ? -14.135 -43.358 1.254 1.00 60.61 ? 309 PHE A CG 1 ATOM 2445 C CD1 . PHE A 1 323 ? -14.646 -44.644 1.383 1.00 62.39 ? 309 PHE A CD1 1 ATOM 2446 C CD2 . PHE A 1 323 ? -13.540 -42.996 0.034 1.00 62.24 ? 309 PHE A CD2 1 ATOM 2447 C CE1 . PHE A 1 323 ? -14.530 -45.561 0.328 1.00 63.34 ? 309 PHE A CE1 1 ATOM 2448 C CE2 . PHE A 1 323 ? -13.393 -43.922 -1.012 1.00 66.01 ? 309 PHE A CE2 1 ATOM 2449 C CZ . PHE A 1 323 ? -13.880 -45.201 -0.856 1.00 64.36 ? 309 PHE A CZ 1 ATOM 2450 N N . TYR A 1 324 ? -16.867 -41.212 4.582 1.00 60.29 ? 310 TYR A N 1 ATOM 2451 C CA . TYR A 1 324 ? -17.130 -40.553 5.867 1.00 58.68 ? 310 TYR A CA 1 ATOM 2452 C C . TYR A 1 324 ? -15.826 -40.658 6.656 1.00 63.96 ? 310 TYR A C 1 ATOM 2453 O O . TYR A 1 324 ? -15.229 -41.742 6.722 1.00 62.38 ? 310 TYR A O 1 ATOM 2454 C CB . TYR A 1 324 ? -18.256 -41.286 6.607 1.00 58.46 ? 310 TYR A CB 1 ATOM 2455 C CG . TYR A 1 324 ? -18.698 -40.612 7.891 1.00 57.45 ? 310 TYR A CG 1 ATOM 2456 C CD1 . TYR A 1 324 ? -17.991 -40.796 9.081 1.00 58.28 ? 310 TYR A CD1 1 ATOM 2457 C CD2 . TYR A 1 324 ? -19.840 -39.818 7.928 1.00 56.74 ? 310 TYR A CD2 1 ATOM 2458 C CE1 . TYR A 1 324 ? -18.390 -40.175 10.262 1.00 57.81 ? 310 TYR A CE1 1 ATOM 2459 C CE2 . TYR A 1 324 ? -20.243 -39.186 9.102 1.00 57.10 ? 310 TYR A CE2 1 ATOM 2460 C CZ . TYR A 1 324 ? -19.514 -39.365 10.266 1.00 62.16 ? 310 TYR A CZ 1 ATOM 2461 O OH . TYR A 1 324 ? -19.916 -38.738 11.418 1.00 61.98 ? 310 TYR A OH 1 ATOM 2462 N N . THR A 1 325 ? -15.365 -39.518 7.214 1.00 62.08 ? 311 THR A N 1 ATOM 2463 C CA . THR A 1 325 ? -14.048 -39.434 7.837 1.00 62.17 ? 311 THR A CA 1 ATOM 2464 C C . THR A 1 325 ? -14.062 -39.076 9.301 1.00 67.74 ? 311 THR A C 1 ATOM 2465 O O . THR A 1 325 ? -14.649 -38.065 9.677 1.00 68.68 ? 311 THR A O 1 ATOM 2466 C CB . THR A 1 325 ? -13.157 -38.468 7.022 1.00 66.15 ? 311 THR A CB 1 ATOM 2467 O OG1 . THR A 1 325 ? -13.161 -38.832 5.635 1.00 61.97 ? 311 THR A OG1 1 ATOM 2468 C CG2 . THR A 1 325 ? -11.728 -38.461 7.502 1.00 64.93 ? 311 THR A CG2 1 ATOM 2469 N N . GLU A 1 326 ? -13.374 -39.881 10.124 1.00 65.16 ? 312 GLU A N 1 ATOM 2470 C CA . GLU A 1 326 ? -13.226 -39.603 11.561 1.00 65.36 ? 312 GLU A CA 1 ATOM 2471 C C . GLU A 1 326 ? -11.787 -39.216 11.849 1.00 66.27 ? 312 GLU A C 1 ATOM 2472 O O . GLU A 1 326 ? -10.862 -39.955 11.492 1.00 65.20 ? 312 GLU A O 1 ATOM 2473 C CB . GLU A 1 326 ? -13.630 -40.802 12.423 1.00 67.36 ? 312 GLU A CB 1 ATOM 2474 C CG . GLU A 1 326 ? -13.546 -40.524 13.919 1.00 82.23 ? 312 GLU A CG 1 ATOM 2475 C CD . GLU A 1 326 ? -13.868 -41.733 14.771 1.00 110.42 ? 312 GLU A CD 1 ATOM 2476 O OE1 . GLU A 1 326 ? -12.987 -42.606 14.933 1.00 114.75 ? 312 GLU A OE1 1 ATOM 2477 O OE2 . GLU A 1 326 ? -15.008 -41.810 15.277 1.00 107.30 ? 312 GLU A OE2 1 ATOM 2478 N N . PHE A 1 327 ? -11.602 -38.046 12.472 1.00 60.52 ? 313 PHE A N 1 ATOM 2479 C CA . PHE A 1 327 ? -10.280 -37.553 12.815 1.00 60.05 ? 313 PHE A CA 1 ATOM 2480 C C . PHE A 1 327 ? -10.084 -37.798 14.300 1.00 69.36 ? 313 PHE A C 1 ATOM 2481 O O . PHE A 1 327 ? -10.757 -37.183 15.134 1.00 67.81 ? 313 PHE A O 1 ATOM 2482 C CB . PHE A 1 327 ? -10.143 -36.077 12.456 1.00 60.53 ? 313 PHE A CB 1 ATOM 2483 C CG . PHE A 1 327 ? -10.246 -35.787 10.985 1.00 60.34 ? 313 PHE A CG 1 ATOM 2484 C CD1 . PHE A 1 327 ? -9.109 -35.766 10.184 1.00 61.93 ? 313 PHE A CD1 1 ATOM 2485 C CD2 . PHE A 1 327 ? -11.483 -35.545 10.392 1.00 61.36 ? 313 PHE A CD2 1 ATOM 2486 C CE1 . PHE A 1 327 ? -9.200 -35.507 8.812 1.00 62.48 ? 313 PHE A CE1 1 ATOM 2487 C CE2 . PHE A 1 327 ? -11.579 -35.292 9.017 1.00 64.10 ? 313 PHE A CE2 1 ATOM 2488 C CZ . PHE A 1 327 ? -10.434 -35.272 8.235 1.00 61.99 ? 313 PHE A CZ 1 ATOM 2489 N N . ASP A 1 328 ? -9.189 -38.751 14.620 1.00 70.51 ? 314 ASP A N 1 ATOM 2490 C CA . ASP A 1 328 ? -8.965 -39.213 15.979 1.00 72.28 ? 314 ASP A CA 1 ATOM 2491 C C . ASP A 1 328 ? -7.726 -38.606 16.605 1.00 76.64 ? 314 ASP A C 1 ATOM 2492 O O . ASP A 1 328 ? -6.608 -39.041 16.324 1.00 75.91 ? 314 ASP A O 1 ATOM 2493 C CB . ASP A 1 328 ? -8.919 -40.756 15.982 1.00 75.09 ? 314 ASP A CB 1 ATOM 2494 C CG . ASP A 1 328 ? -8.839 -41.419 17.348 1.00 87.86 ? 314 ASP A CG 1 ATOM 2495 O OD1 . ASP A 1 328 ? -8.627 -40.701 18.357 1.00 91.87 ? 314 ASP A OD1 1 ATOM 2496 O OD2 . ASP A 1 328 ? -8.990 -42.650 17.412 1.00 89.03 ? 314 ASP A OD2 1 ATOM 2497 N N . ARG A 1 329 ? -7.936 -37.617 17.474 1.00 73.93 ? 315 ARG A N 1 ATOM 2498 C CA . ARG A 1 329 ? -6.849 -36.925 18.158 1.00 75.38 ? 315 ARG A CA 1 ATOM 2499 C C . ARG A 1 329 ? -6.197 -37.763 19.259 1.00 83.91 ? 315 ARG A C 1 ATOM 2500 O O . ARG A 1 329 ? -4.981 -37.659 19.473 1.00 84.83 ? 315 ARG A O 1 ATOM 2501 C CB . ARG A 1 329 ? -7.315 -35.577 18.728 1.00 73.51 ? 315 ARG A CB 1 ATOM 2502 C CG . ARG A 1 329 ? -7.393 -34.439 17.719 1.00 72.81 ? 315 ARG A CG 1 ATOM 2503 C CD . ARG A 1 329 ? -6.029 -33.943 17.326 1.00 72.55 ? 315 ARG A CD 1 ATOM 2504 N NE . ARG A 1 329 ? -5.264 -33.452 18.474 1.00 86.59 ? 315 ARG A NE 1 ATOM 2505 C CZ . ARG A 1 329 ? -5.235 -32.186 18.867 1.00 100.91 ? 315 ARG A CZ 1 ATOM 2506 N NH1 . ARG A 1 329 ? -5.904 -31.260 18.195 1.00 94.89 ? 315 ARG A NH1 1 ATOM 2507 N NH2 . ARG A 1 329 ? -4.515 -31.831 19.920 1.00 84.11 ? 315 ARG A NH2 1 ATOM 2508 N N . ARG A 1 330 ? -7.010 -38.571 19.964 1.00 80.17 ? 316 ARG A N 1 ATOM 2509 C CA . ARG A 1 330 ? -6.557 -39.435 21.048 1.00 78.89 ? 316 ARG A CA 1 ATOM 2510 C C . ARG A 1 330 ? -5.512 -40.428 20.577 1.00 80.23 ? 316 ARG A C 1 ATOM 2511 O O . ARG A 1 330 ? -4.507 -40.599 21.260 1.00 80.51 ? 316 ARG A O 1 ATOM 2512 C CB . ARG A 1 330 ? -7.769 -40.145 21.691 1.00 80.70 ? 316 ARG A CB 1 ATOM 2513 C CG . ARG A 1 330 ? -7.453 -41.220 22.733 1.00 99.08 ? 316 ARG A CG 1 ATOM 2514 C CD . ARG A 1 330 ? -6.789 -40.693 23.992 1.00 123.03 ? 316 ARG A CD 1 ATOM 2515 N NE . ARG A 1 330 ? -6.346 -41.786 24.862 1.00 140.11 ? 316 ARG A NE 1 ATOM 2516 C CZ . ARG A 1 330 ? -5.636 -41.625 25.977 1.00 156.81 ? 316 ARG A CZ 1 ATOM 2517 N NH1 . ARG A 1 330 ? -5.286 -42.677 26.705 1.00 144.64 ? 316 ARG A NH1 1 ATOM 2518 N NH2 . ARG A 1 330 ? -5.265 -40.411 26.370 1.00 142.89 ? 316 ARG A NH2 1 ATOM 2519 N N . ASN A 1 331 ? -5.733 -41.061 19.414 1.00 74.38 ? 317 ASN A N 1 ATOM 2520 C CA . ASN A 1 331 ? -4.844 -42.096 18.892 1.00 73.10 ? 317 ASN A CA 1 ATOM 2521 C C . ASN A 1 331 ? -4.028 -41.682 17.684 1.00 76.68 ? 317 ASN A C 1 ATOM 2522 O O . ASN A 1 331 ? -3.355 -42.531 17.097 1.00 75.71 ? 317 ASN A O 1 ATOM 2523 C CB . ASN A 1 331 ? -5.664 -43.351 18.566 1.00 74.64 ? 317 ASN A CB 1 ATOM 2524 C CG . ASN A 1 331 ? -6.477 -43.880 19.730 1.00 96.61 ? 317 ASN A CG 1 ATOM 2525 O OD1 . ASN A 1 331 ? -7.696 -44.047 19.653 1.00 91.23 ? 317 ASN A OD1 1 ATOM 2526 N ND2 . ASN A 1 331 ? -5.826 -44.146 20.841 1.00 88.20 ? 317 ASN A ND2 1 ATOM 2527 N N . ASN A 1 332 ? -4.095 -40.398 17.294 1.00 74.81 ? 318 ASN A N 1 ATOM 2528 C CA . ASN A 1 332 ? -3.415 -39.867 16.107 1.00 75.55 ? 318 ASN A CA 1 ATOM 2529 C C . ASN A 1 332 ? -3.603 -40.752 14.860 1.00 81.97 ? 318 ASN A C 1 ATOM 2530 O O . ASN A 1 332 ? -2.640 -41.289 14.285 1.00 83.48 ? 318 ASN A O 1 ATOM 2531 C CB . ASN A 1 332 ? -1.957 -39.537 16.372 1.00 75.78 ? 318 ASN A CB 1 ATOM 2532 C CG . ASN A 1 332 ? -1.744 -38.250 17.129 1.00 112.68 ? 318 ASN A CG 1 ATOM 2533 O OD1 . ASN A 1 332 ? -2.521 -37.277 17.090 1.00 99.60 ? 318 ASN A OD1 1 ATOM 2534 N ND2 . ASN A 1 332 ? -0.685 -38.240 17.902 1.00 117.24 ? 318 ASN A ND2 1 ATOM 2535 N N . ARG A 1 333 ? -4.872 -40.911 14.466 1.00 77.13 ? 319 ARG A N 1 ATOM 2536 C CA . ARG A 1 333 ? -5.259 -41.734 13.332 1.00 75.90 ? 319 ARG A CA 1 ATOM 2537 C C . ARG A 1 333 ? -6.490 -41.150 12.654 1.00 76.80 ? 319 ARG A C 1 ATOM 2538 O O . ARG A 1 333 ? -7.198 -40.303 13.226 1.00 74.13 ? 319 ARG A O 1 ATOM 2539 C CB . ARG A 1 333 ? -5.524 -43.179 13.787 1.00 74.85 ? 319 ARG A CB 1 ATOM 2540 C CG . ARG A 1 333 ? -6.482 -43.291 14.959 1.00 81.21 ? 319 ARG A CG 1 ATOM 2541 C CD . ARG A 1 333 ? -6.813 -44.736 15.177 1.00 84.32 ? 319 ARG A CD 1 ATOM 2542 N NE . ARG A 1 333 ? -8.021 -44.900 15.963 1.00 84.01 ? 319 ARG A NE 1 ATOM 2543 C CZ . ARG A 1 333 ? -8.552 -46.059 16.326 1.00 88.11 ? 319 ARG A CZ 1 ATOM 2544 N NH1 . ARG A 1 333 ? -9.631 -46.082 17.085 1.00 69.17 ? 319 ARG A NH1 1 ATOM 2545 N NH2 . ARG A 1 333 ? -7.991 -47.208 15.950 1.00 74.28 ? 319 ARG A NH2 1 ATOM 2546 N N . ILE A 1 334 ? -6.745 -41.630 11.432 1.00 71.59 ? 320 ILE A N 1 ATOM 2547 C CA . ILE A 1 334 ? -7.890 -41.226 10.644 1.00 70.00 ? 320 ILE A CA 1 ATOM 2548 C C . ILE A 1 334 ? -8.640 -42.484 10.260 1.00 72.18 ? 320 ILE A C 1 ATOM 2549 O O . ILE A 1 334 ? -8.040 -43.427 9.752 1.00 70.86 ? 320 ILE A O 1 ATOM 2550 C CB . ILE A 1 334 ? -7.447 -40.406 9.373 1.00 71.90 ? 320 ILE A CB 1 ATOM 2551 C CG1 . ILE A 1 334 ? -6.805 -39.067 9.782 1.00 70.17 ? 320 ILE A CG1 1 ATOM 2552 C CG2 . ILE A 1 334 ? -8.623 -40.188 8.398 1.00 71.72 ? 320 ILE A CG2 1 ATOM 2553 C CD1 . ILE A 1 334 ? -6.105 -38.384 8.719 1.00 57.90 ? 320 ILE A CD1 1 ATOM 2554 N N . GLY A 1 335 ? -9.940 -42.472 10.488 1.00 69.65 ? 321 GLY A N 1 ATOM 2555 C CA . GLY A 1 335 ? -10.786 -43.583 10.092 1.00 70.74 ? 321 GLY A CA 1 ATOM 2556 C C . GLY A 1 335 ? -11.662 -43.238 8.908 1.00 77.71 ? 321 GLY A C 1 ATOM 2557 O O . GLY A 1 335 ? -12.198 -42.124 8.838 1.00 79.53 ? 321 GLY A O 1 ATOM 2558 N N . PHE A 1 336 ? -11.811 -44.193 7.977 1.00 73.16 ? 322 PHE A N 1 ATOM 2559 C CA . PHE A 1 336 ? -12.692 -44.050 6.818 1.00 72.56 ? 322 PHE A CA 1 ATOM 2560 C C . PHE A 1 336 ? -13.769 -45.121 6.813 1.00 75.65 ? 322 PHE A C 1 ATOM 2561 O O . PHE A 1 336 ? -13.494 -46.279 7.095 1.00 74.34 ? 322 PHE A O 1 ATOM 2562 C CB . PHE A 1 336 ? -11.911 -44.133 5.501 1.00 74.08 ? 322 PHE A CB 1 ATOM 2563 C CG . PHE A 1 336 ? -10.940 -43.010 5.287 1.00 75.89 ? 322 PHE A CG 1 ATOM 2564 C CD1 . PHE A 1 336 ? -11.388 -41.690 5.171 1.00 79.51 ? 322 PHE A CD1 1 ATOM 2565 C CD2 . PHE A 1 336 ? -9.582 -43.268 5.136 1.00 76.91 ? 322 PHE A CD2 1 ATOM 2566 C CE1 . PHE A 1 336 ? -10.487 -40.654 4.927 1.00 79.83 ? 322 PHE A CE1 1 ATOM 2567 C CE2 . PHE A 1 336 ? -8.683 -42.232 4.895 1.00 79.15 ? 322 PHE A CE2 1 ATOM 2568 C CZ . PHE A 1 336 ? -9.142 -40.934 4.788 1.00 77.80 ? 322 PHE A CZ 1 ATOM 2569 N N . ALA A 1 337 ? -14.986 -44.740 6.482 1.00 73.19 ? 323 ALA A N 1 ATOM 2570 C CA . ALA A 1 337 ? -16.076 -45.681 6.310 1.00 73.91 ? 323 ALA A CA 1 ATOM 2571 C C . ALA A 1 337 ? -16.882 -45.193 5.118 1.00 78.40 ? 323 ALA A C 1 ATOM 2572 O O . ALA A 1 337 ? -16.838 -44.006 4.811 1.00 77.60 ? 323 ALA A O 1 ATOM 2573 C CB . ALA A 1 337 ? -16.946 -45.758 7.566 1.00 74.71 ? 323 ALA A CB 1 ATOM 2574 N N . LEU A 1 338 ? -17.602 -46.100 4.442 1.00 76.02 ? 324 LEU A N 1 ATOM 2575 C CA . LEU A 1 338 ? -18.449 -45.760 3.305 1.00 76.10 ? 324 LEU A CA 1 ATOM 2576 C C . LEU A 1 338 ? -19.561 -44.817 3.751 1.00 77.01 ? 324 LEU A C 1 ATOM 2577 O O . LEU A 1 338 ? -20.360 -45.161 4.623 1.00 73.19 ? 324 LEU A O 1 ATOM 2578 C CB . LEU A 1 338 ? -19.084 -47.031 2.735 1.00 76.96 ? 324 LEU A CB 1 ATOM 2579 C CG . LEU A 1 338 ? -18.692 -47.528 1.369 1.00 83.06 ? 324 LEU A CG 1 ATOM 2580 C CD1 . LEU A 1 338 ? -19.722 -48.588 0.917 1.00 83.79 ? 324 LEU A CD1 1 ATOM 2581 C CD2 . LEU A 1 338 ? -18.552 -46.355 0.348 1.00 89.16 ? 324 LEU A CD2 1 ATOM 2582 N N . ALA A 1 339 ? -19.585 -43.615 3.172 1.00 76.22 ? 325 ALA A N 1 ATOM 2583 C CA . ALA A 1 339 ? -20.609 -42.626 3.510 1.00 77.48 ? 325 ALA A CA 1 ATOM 2584 C C . ALA A 1 339 ? -21.981 -43.050 2.994 1.00 83.36 ? 325 ALA A C 1 ATOM 2585 O O . ALA A 1 339 ? -22.069 -43.728 1.963 1.00 83.59 ? 325 ALA A O 1 ATOM 2586 C CB . ALA A 1 339 ? -20.246 -41.277 2.924 1.00 78.27 ? 325 ALA A CB 1 ATOM 2587 N N . ARG A 1 340 ? -23.049 -42.619 3.693 1.00 79.36 ? 326 ARG A N 1 ATOM 2588 C CA . ARG A 1 340 ? -24.420 -42.852 3.240 1.00 79.25 ? 326 ARG A CA 1 ATOM 2589 C C . ARG A 1 340 ? -25.322 -41.635 3.456 1.00 78.75 ? 326 ARG A C 1 ATOM 2590 O O . ARG A 1 340 ? -25.141 -40.884 4.454 1.00 76.42 ? 326 ARG A O 1 ATOM 2591 C CB . ARG A 1 340 ? -25.023 -44.198 3.723 1.00 79.02 ? 326 ARG A CB 1 ATOM 2592 C CG . ARG A 1 340 ? -25.083 -44.400 5.234 1.00 83.58 ? 326 ARG A CG 1 ATOM 2593 C CD . ARG A 1 340 ? -26.161 -45.382 5.571 1.00 95.83 ? 326 ARG A CD 1 ATOM 2594 N NE . ARG A 1 340 ? -25.927 -46.214 6.744 1.00 108.81 ? 326 ARG A NE 1 ATOM 2595 C CZ . ARG A 1 340 ? -26.479 -47.422 6.930 1.00 123.91 ? 326 ARG A CZ 1 ATOM 2596 N NH1 . ARG A 1 340 ? -27.298 -47.939 6.016 1.00 102.28 ? 326 ARG A NH1 1 ATOM 2597 N NH2 . ARG A 1 340 ? -26.215 -48.117 8.026 1.00 115.95 ? 326 ARG A NH2 1 ATOM 2598 O OXT . ARG A 1 340 ? -26.081 -41.322 2.514 1.00 101.91 ? 326 ARG A OXT 1 ATOM 2599 N N . GLY B 1 4 ? -31.967 -59.937 12.979 1.00 110.58 ? -2 GLY B N 1 ATOM 2600 C CA . GLY B 1 4 ? -31.033 -58.975 12.406 1.00 110.60 ? -2 GLY B CA 1 ATOM 2601 C C . GLY B 1 4 ? -31.280 -57.550 12.853 1.00 114.65 ? -2 GLY B C 1 ATOM 2602 O O . GLY B 1 4 ? -32.397 -57.214 13.262 1.00 113.61 ? -2 GLY B O 1 ATOM 2603 N N . ASN B 1 5 ? -30.244 -56.690 12.752 1.00 111.66 ? -1 ASN B N 1 ATOM 2604 C CA . ASN B 1 5 ? -30.321 -55.310 13.246 1.00 111.35 ? -1 ASN B CA 1 ATOM 2605 C C . ASN B 1 5 ? -29.848 -54.229 12.262 1.00 112.27 ? -1 ASN B C 1 ATOM 2606 O O . ASN B 1 5 ? -29.879 -53.031 12.590 1.00 111.91 ? -1 ASN B O 1 ATOM 2607 C CB . ASN B 1 5 ? -29.520 -55.207 14.557 1.00 114.77 ? -1 ASN B CB 1 ATOM 2608 C CG . ASN B 1 5 ? -29.863 -54.011 15.415 1.00 145.69 ? -1 ASN B CG 1 ATOM 2609 O OD1 . ASN B 1 5 ? -31.035 -53.639 15.571 1.00 138.96 ? -1 ASN B OD1 1 ATOM 2610 N ND2 . ASN B 1 5 ? -28.842 -53.381 15.992 1.00 139.65 ? -1 ASN B ND2 1 ATOM 2611 N N . THR B 1 6 ? -29.425 -54.629 11.058 1.00 105.16 ? 0 THR B N 1 ATOM 2612 C CA . THR B 1 6 ? -28.872 -53.651 10.122 1.00 102.67 ? 0 THR B CA 1 ATOM 2613 C C . THR B 1 6 ? -29.626 -53.439 8.811 1.00 99.54 ? 0 THR B C 1 ATOM 2614 O O . THR B 1 6 ? -30.501 -54.212 8.416 1.00 97.38 ? 0 THR B O 1 ATOM 2615 C CB . THR B 1 6 ? -27.362 -53.953 9.848 1.00 114.39 ? 0 THR B CB 1 ATOM 2616 O OG1 . THR B 1 6 ? -27.234 -55.097 8.989 1.00 116.25 ? 0 THR B OG1 1 ATOM 2617 C CG2 . THR B 1 6 ? -26.538 -54.144 11.129 1.00 113.28 ? 0 THR B CG2 1 ATOM 2618 N N . THR B 1 7 ? -29.266 -52.340 8.156 1.00 93.24 ? 1 THR B N 1 ATOM 2619 C CA . THR B 1 7 ? -29.656 -51.990 6.804 1.00 91.19 ? 1 THR B CA 1 ATOM 2620 C C . THR B 1 7 ? -28.393 -51.575 6.063 1.00 91.03 ? 1 THR B C 1 ATOM 2621 O O . THR B 1 7 ? -27.442 -51.020 6.643 1.00 90.12 ? 1 THR B O 1 ATOM 2622 C CB . THR B 1 7 ? -30.756 -50.938 6.697 1.00 89.53 ? 1 THR B CB 1 ATOM 2623 O OG1 . THR B 1 7 ? -30.262 -49.690 7.176 1.00 89.24 ? 1 THR B OG1 1 ATOM 2624 C CG2 . THR B 1 7 ? -32.027 -51.352 7.391 1.00 83.23 ? 1 THR B CG2 1 ATOM 2625 N N . SER B 1 8 ? -28.403 -51.844 4.781 1.00 84.30 ? 2 SER B N 1 ATOM 2626 C CA . SER B 1 8 ? -27.294 -51.529 3.924 1.00 83.26 ? 2 SER B CA 1 ATOM 2627 C C . SER B 1 8 ? -27.773 -50.843 2.687 1.00 84.79 ? 2 SER B C 1 ATOM 2628 O O . SER B 1 8 ? -28.719 -51.300 2.055 1.00 83.61 ? 2 SER B O 1 ATOM 2629 C CB . SER B 1 8 ? -26.544 -52.802 3.566 1.00 86.40 ? 2 SER B CB 1 ATOM 2630 O OG . SER B 1 8 ? -25.513 -52.547 2.626 1.00 94.36 ? 2 SER B OG 1 ATOM 2631 N N . SER B 1 9 ? -27.135 -49.724 2.342 1.00 80.35 ? 3 SER B N 1 ATOM 2632 C CA . SER B 1 9 ? -27.518 -49.004 1.140 1.00 79.50 ? 3 SER B CA 1 ATOM 2633 C C . SER B 1 9 ? -26.449 -48.996 0.070 1.00 80.78 ? 3 SER B C 1 ATOM 2634 O O . SER B 1 9 ? -25.254 -48.965 0.370 1.00 80.34 ? 3 SER B O 1 ATOM 2635 C CB . SER B 1 9 ? -27.981 -47.582 1.457 1.00 82.08 ? 3 SER B CB 1 ATOM 2636 O OG . SER B 1 9 ? -26.961 -46.793 2.048 1.00 84.92 ? 3 SER B OG 1 ATOM 2637 N N . VAL B 1 10 ? -26.889 -49.054 -1.188 1.00 74.21 ? 4 VAL B N 1 ATOM 2638 C CA . VAL B 1 10 ? -26.004 -48.989 -2.338 1.00 71.65 ? 4 VAL B CA 1 ATOM 2639 C C . VAL B 1 10 ? -26.402 -47.731 -3.090 1.00 75.32 ? 4 VAL B C 1 ATOM 2640 O O . VAL B 1 10 ? -27.562 -47.605 -3.487 1.00 77.75 ? 4 VAL B O 1 ATOM 2641 C CB . VAL B 1 10 ? -26.097 -50.240 -3.232 1.00 72.91 ? 4 VAL B CB 1 ATOM 2642 C CG1 . VAL B 1 10 ? -25.130 -50.148 -4.390 1.00 72.07 ? 4 VAL B CG1 1 ATOM 2643 C CG2 . VAL B 1 10 ? -25.845 -51.496 -2.432 1.00 72.23 ? 4 VAL B CG2 1 ATOM 2644 N N . ILE B 1 11 ? -25.468 -46.783 -3.236 1.00 67.51 ? 5 ILE B N 1 ATOM 2645 C CA . ILE B 1 11 ? -25.715 -45.571 -4.000 1.00 66.65 ? 5 ILE B CA 1 ATOM 2646 C C . ILE B 1 11 ? -25.686 -45.941 -5.485 1.00 68.85 ? 5 ILE B C 1 ATOM 2647 O O . ILE B 1 11 ? -24.832 -46.719 -5.930 1.00 69.12 ? 5 ILE B O 1 ATOM 2648 C CB . ILE B 1 11 ? -24.701 -44.439 -3.649 1.00 70.15 ? 5 ILE B CB 1 ATOM 2649 C CG1 . ILE B 1 11 ? -24.781 -44.038 -2.152 1.00 71.89 ? 5 ILE B CG1 1 ATOM 2650 C CG2 . ILE B 1 11 ? -24.835 -43.223 -4.569 1.00 68.42 ? 5 ILE B CG2 1 ATOM 2651 C CD1 . ILE B 1 11 ? -26.212 -43.769 -1.570 1.00 78.02 ? 5 ILE B CD1 1 ATOM 2652 N N . LEU B 1 12 ? -26.642 -45.420 -6.233 1.00 62.33 ? 6 LEU B N 1 ATOM 2653 C CA . LEU B 1 12 ? -26.727 -45.717 -7.651 1.00 61.07 ? 6 LEU B CA 1 ATOM 2654 C C . LEU B 1 12 ? -26.425 -44.524 -8.487 1.00 64.77 ? 6 LEU B C 1 ATOM 2655 O O . LEU B 1 12 ? -26.684 -43.381 -8.103 1.00 64.77 ? 6 LEU B O 1 ATOM 2656 C CB . LEU B 1 12 ? -28.125 -46.272 -8.051 1.00 60.74 ? 6 LEU B CB 1 ATOM 2657 C CG . LEU B 1 12 ? -28.701 -47.494 -7.298 1.00 63.80 ? 6 LEU B CG 1 ATOM 2658 C CD1 . LEU B 1 12 ? -30.083 -47.803 -7.780 1.00 63.39 ? 6 LEU B CD1 1 ATOM 2659 C CD2 . LEU B 1 12 ? -27.829 -48.713 -7.435 1.00 63.07 ? 6 LEU B CD2 1 ATOM 2660 N N . THR B 1 13 ? -25.891 -44.799 -9.657 1.00 62.68 ? 7 THR B N 1 ATOM 2661 C CA . THR B 1 13 ? -25.632 -43.789 -10.668 1.00 62.46 ? 7 THR B CA 1 ATOM 2662 C C . THR B 1 13 ? -26.805 -43.885 -11.629 1.00 63.72 ? 7 THR B C 1 ATOM 2663 O O . THR B 1 13 ? -27.232 -44.989 -11.998 1.00 62.23 ? 7 THR B O 1 ATOM 2664 C CB . THR B 1 13 ? -24.259 -44.032 -11.362 1.00 63.27 ? 7 THR B CB 1 ATOM 2665 O OG1 . THR B 1 13 ? -23.223 -43.921 -10.381 1.00 65.44 ? 7 THR B OG1 1 ATOM 2666 C CG2 . THR B 1 13 ? -24.005 -43.072 -12.507 1.00 49.44 ? 7 THR B CG2 1 ATOM 2667 N N . ASN B 1 14 ? -27.321 -42.733 -12.012 1.00 60.20 ? 8 ASN B N 1 ATOM 2668 C CA . ASN B 1 14 ? -28.387 -42.641 -12.989 1.00 60.80 ? 8 ASN B CA 1 ATOM 2669 C C . ASN B 1 14 ? -27.773 -42.207 -14.301 1.00 67.54 ? 8 ASN B C 1 ATOM 2670 O O . ASN B 1 14 ? -27.368 -41.059 -14.447 1.00 68.04 ? 8 ASN B O 1 ATOM 2671 C CB . ASN B 1 14 ? -29.462 -41.637 -12.555 1.00 59.25 ? 8 ASN B CB 1 ATOM 2672 C CG . ASN B 1 14 ? -30.519 -41.376 -13.592 1.00 70.34 ? 8 ASN B CG 1 ATOM 2673 O OD1 . ASN B 1 14 ? -30.468 -41.841 -14.722 1.00 60.73 ? 8 ASN B OD1 1 ATOM 2674 N ND2 . ASN B 1 14 ? -31.486 -40.580 -13.235 1.00 71.68 ? 8 ASN B ND2 1 ATOM 2675 N N . TYR B 1 15 ? -27.732 -43.119 -15.255 1.00 65.40 ? 9 TYR B N 1 ATOM 2676 C CA . TYR B 1 15 ? -27.270 -42.811 -16.594 1.00 65.78 ? 9 TYR B CA 1 ATOM 2677 C C . TYR B 1 15 ? -28.466 -42.580 -17.521 1.00 69.59 ? 9 TYR B C 1 ATOM 2678 O O . TYR B 1 15 ? -29.207 -43.520 -17.833 1.00 68.24 ? 9 TYR B O 1 ATOM 2679 C CB . TYR B 1 15 ? -26.333 -43.912 -17.121 1.00 66.93 ? 9 TYR B CB 1 ATOM 2680 C CG . TYR B 1 15 ? -25.906 -43.685 -18.549 1.00 67.92 ? 9 TYR B CG 1 ATOM 2681 C CD1 . TYR B 1 15 ? -24.856 -42.822 -18.855 1.00 68.68 ? 9 TYR B CD1 1 ATOM 2682 C CD2 . TYR B 1 15 ? -26.536 -44.348 -19.596 1.00 70.28 ? 9 TYR B CD2 1 ATOM 2683 C CE1 . TYR B 1 15 ? -24.465 -42.597 -20.172 1.00 69.46 ? 9 TYR B CE1 1 ATOM 2684 C CE2 . TYR B 1 15 ? -26.156 -44.131 -20.923 1.00 72.08 ? 9 TYR B CE2 1 ATOM 2685 C CZ . TYR B 1 15 ? -25.134 -43.234 -21.207 1.00 81.53 ? 9 TYR B CZ 1 ATOM 2686 O OH . TYR B 1 15 ? -24.766 -42.986 -22.508 1.00 85.26 ? 9 TYR B OH 1 ATOM 2687 N N . MET B 1 16 ? -28.669 -41.307 -17.922 1.00 67.17 ? 10 MET B N 1 ATOM 2688 C CA . MET B 1 16 ? -29.690 -40.850 -18.878 1.00 67.10 ? 10 MET B CA 1 ATOM 2689 C C . MET B 1 16 ? -31.122 -41.293 -18.595 1.00 70.24 ? 10 MET B C 1 ATOM 2690 O O . MET B 1 16 ? -31.920 -41.424 -19.542 1.00 69.56 ? 10 MET B O 1 ATOM 2691 C CB . MET B 1 16 ? -29.312 -41.307 -20.285 1.00 69.53 ? 10 MET B CB 1 ATOM 2692 C CG . MET B 1 16 ? -27.915 -40.910 -20.714 1.00 73.30 ? 10 MET B CG 1 ATOM 2693 S SD . MET B 1 16 ? -27.811 -40.970 -22.517 1.00 76.97 ? 10 MET B SD 1 ATOM 2694 C CE . MET B 1 16 ? -28.843 -42.452 -22.875 1.00 74.03 ? 10 MET B CE 1 ATOM 2695 N N . ASP B 1 17 ? -31.456 -41.541 -17.302 1.00 65.83 ? 11 ASP B N 1 ATOM 2696 C CA . ASP B 1 17 ? -32.771 -42.051 -16.877 1.00 64.43 ? 11 ASP B CA 1 ATOM 2697 C C . ASP B 1 17 ? -33.081 -43.458 -17.427 1.00 66.69 ? 11 ASP B C 1 ATOM 2698 O O . ASP B 1 17 ? -34.220 -43.925 -17.304 1.00 65.84 ? 11 ASP B O 1 ATOM 2699 C CB . ASP B 1 17 ? -33.897 -41.074 -17.241 1.00 65.66 ? 11 ASP B CB 1 ATOM 2700 C CG . ASP B 1 17 ? -34.087 -39.930 -16.278 1.00 73.80 ? 11 ASP B CG 1 ATOM 2701 O OD1 . ASP B 1 17 ? -33.390 -39.891 -15.254 1.00 70.41 ? 11 ASP B OD1 1 ATOM 2702 O OD2 . ASP B 1 17 ? -34.958 -39.090 -16.532 1.00 89.41 ? 11 ASP B OD2 1 ATOM 2703 N N . THR B 1 18 ? -32.080 -44.137 -18.030 1.00 60.71 ? 12 THR B N 1 ATOM 2704 C CA . THR B 1 18 ? -32.310 -45.472 -18.593 1.00 58.84 ? 12 THR B CA 1 ATOM 2705 C C . THR B 1 18 ? -31.550 -46.594 -17.885 1.00 61.48 ? 12 THR B C 1 ATOM 2706 O O . THR B 1 18 ? -31.948 -47.753 -17.971 1.00 61.90 ? 12 THR B O 1 ATOM 2707 C CB . THR B 1 18 ? -32.050 -45.499 -20.095 1.00 57.97 ? 12 THR B CB 1 ATOM 2708 O OG1 . THR B 1 18 ? -30.700 -45.092 -20.361 1.00 69.03 ? 12 THR B OG1 1 ATOM 2709 C CG2 . THR B 1 18 ? -33.045 -44.680 -20.864 1.00 50.94 ? 12 THR B CG2 1 ATOM 2710 N N . GLN B 1 19 ? -30.421 -46.272 -17.270 1.00 55.89 ? 13 GLN B N 1 ATOM 2711 C CA . GLN B 1 19 ? -29.604 -47.268 -16.613 1.00 55.05 ? 13 GLN B CA 1 ATOM 2712 C C . GLN B 1 19 ? -29.268 -46.808 -15.213 1.00 57.38 ? 13 GLN B C 1 ATOM 2713 O O . GLN B 1 19 ? -28.738 -45.705 -15.019 1.00 58.46 ? 13 GLN B O 1 ATOM 2714 C CB . GLN B 1 19 ? -28.314 -47.523 -17.413 1.00 56.83 ? 13 GLN B CB 1 ATOM 2715 C CG . GLN B 1 19 ? -28.556 -47.938 -18.850 1.00 69.64 ? 13 GLN B CG 1 ATOM 2716 C CD . GLN B 1 19 ? -27.285 -48.193 -19.590 1.00 73.44 ? 13 GLN B CD 1 ATOM 2717 O OE1 . GLN B 1 19 ? -26.284 -48.651 -19.028 1.00 62.08 ? 13 GLN B OE1 1 ATOM 2718 N NE2 . GLN B 1 19 ? -27.315 -47.902 -20.872 1.00 62.09 ? 13 GLN B NE2 1 ATOM 2719 N N . TYR B 1 20 ? -29.581 -47.639 -14.240 1.00 51.91 ? 14 TYR B N 1 ATOM 2720 C CA . TYR B 1 20 ? -29.305 -47.346 -12.836 1.00 52.79 ? 14 TYR B CA 1 ATOM 2721 C C . TYR B 1 20 ? -28.448 -48.459 -12.331 1.00 63.07 ? 14 TYR B C 1 ATOM 2722 O O . TYR B 1 20 ? -28.842 -49.637 -12.393 1.00 62.31 ? 14 TYR B O 1 ATOM 2723 C CB . TYR B 1 20 ? -30.606 -47.228 -11.992 1.00 51.83 ? 14 TYR B CB 1 ATOM 2724 C CG . TYR B 1 20 ? -31.500 -46.061 -12.359 1.00 49.44 ? 14 TYR B CG 1 ATOM 2725 C CD1 . TYR B 1 20 ? -31.477 -44.884 -11.622 1.00 50.38 ? 14 TYR B CD1 1 ATOM 2726 C CD2 . TYR B 1 20 ? -32.372 -46.136 -13.455 1.00 49.76 ? 14 TYR B CD2 1 ATOM 2727 C CE1 . TYR B 1 20 ? -32.304 -43.812 -11.949 1.00 52.22 ? 14 TYR B CE1 1 ATOM 2728 C CE2 . TYR B 1 20 ? -33.188 -45.063 -13.806 1.00 50.28 ? 14 TYR B CE2 1 ATOM 2729 C CZ . TYR B 1 20 ? -33.151 -43.903 -13.048 1.00 59.18 ? 14 TYR B CZ 1 ATOM 2730 O OH . TYR B 1 20 ? -33.982 -42.860 -13.374 1.00 58.43 ? 14 TYR B OH 1 ATOM 2731 N N . TYR B 1 21 ? -27.244 -48.103 -11.871 1.00 63.91 ? 15 TYR B N 1 ATOM 2732 C CA . TYR B 1 21 ? -26.288 -49.120 -11.419 1.00 65.24 ? 15 TYR B CA 1 ATOM 2733 C C . TYR B 1 21 ? -25.474 -48.676 -10.229 1.00 69.62 ? 15 TYR B C 1 ATOM 2734 O O . TYR B 1 21 ? -25.226 -47.480 -10.036 1.00 69.44 ? 15 TYR B O 1 ATOM 2735 C CB . TYR B 1 21 ? -25.349 -49.528 -12.567 1.00 67.11 ? 15 TYR B CB 1 ATOM 2736 C CG . TYR B 1 21 ? -24.753 -48.352 -13.314 1.00 68.95 ? 15 TYR B CG 1 ATOM 2737 C CD1 . TYR B 1 21 ? -25.404 -47.796 -14.410 1.00 71.23 ? 15 TYR B CD1 1 ATOM 2738 C CD2 . TYR B 1 21 ? -23.528 -47.801 -12.932 1.00 68.93 ? 15 TYR B CD2 1 ATOM 2739 C CE1 . TYR B 1 21 ? -24.865 -46.707 -15.094 1.00 73.75 ? 15 TYR B CE1 1 ATOM 2740 C CE2 . TYR B 1 21 ? -22.987 -46.702 -13.602 1.00 69.24 ? 15 TYR B CE2 1 ATOM 2741 C CZ . TYR B 1 21 ? -23.651 -46.167 -14.691 1.00 79.71 ? 15 TYR B CZ 1 ATOM 2742 O OH . TYR B 1 21 ? -23.102 -45.108 -15.381 1.00 82.91 ? 15 TYR B OH 1 ATOM 2743 N N . GLY B 1 22 ? -25.071 -49.645 -9.435 1.00 66.68 ? 16 GLY B N 1 ATOM 2744 C CA . GLY B 1 22 ? -24.253 -49.387 -8.266 1.00 67.20 ? 16 GLY B CA 1 ATOM 2745 C C . GLY B 1 22 ? -22.975 -50.176 -8.326 1.00 72.91 ? 16 GLY B C 1 ATOM 2746 O O . GLY B 1 22 ? -22.742 -50.895 -9.297 1.00 72.28 ? 16 GLY B O 1 ATOM 2747 N N . GLU B 1 23 ? -22.155 -50.054 -7.290 1.00 70.67 ? 17 GLU B N 1 ATOM 2748 C CA . GLU B 1 23 ? -20.908 -50.786 -7.265 1.00 70.93 ? 17 GLU B CA 1 ATOM 2749 C C . GLU B 1 23 ? -20.999 -51.923 -6.278 1.00 71.86 ? 17 GLU B C 1 ATOM 2750 O O . GLU B 1 23 ? -21.591 -51.783 -5.199 1.00 69.01 ? 17 GLU B O 1 ATOM 2751 C CB . GLU B 1 23 ? -19.700 -49.905 -6.878 1.00 73.10 ? 17 GLU B CB 1 ATOM 2752 C CG . GLU B 1 23 ? -19.433 -48.599 -7.608 1.00 91.39 ? 17 GLU B CG 1 ATOM 2753 C CD . GLU B 1 23 ? -18.551 -47.618 -6.806 1.00 118.97 ? 17 GLU B CD 1 ATOM 2754 O OE1 . GLU B 1 23 ? -17.619 -48.089 -6.107 1.00 104.36 ? 17 GLU B OE1 1 ATOM 2755 O OE2 . GLU B 1 23 ? -18.798 -46.386 -6.860 1.00 113.68 ? 17 GLU B OE2 1 ATOM 2756 N N . ILE B 1 24 ? -20.394 -53.047 -6.656 1.00 69.81 ? 18 ILE B N 1 ATOM 2757 C CA . ILE B 1 24 ? -20.173 -54.198 -5.783 1.00 70.72 ? 18 ILE B CA 1 ATOM 2758 C C . ILE B 1 24 ? -18.688 -54.533 -5.882 1.00 81.67 ? 18 ILE B C 1 ATOM 2759 O O . ILE B 1 24 ? -18.033 -54.205 -6.868 1.00 81.32 ? 18 ILE B O 1 ATOM 2760 C CB . ILE B 1 24 ? -21.051 -55.437 -6.060 1.00 72.25 ? 18 ILE B CB 1 ATOM 2761 C CG1 . ILE B 1 24 ? -20.784 -56.005 -7.476 1.00 71.91 ? 18 ILE B CG1 1 ATOM 2762 C CG2 . ILE B 1 24 ? -22.508 -55.145 -5.790 1.00 71.28 ? 18 ILE B CG2 1 ATOM 2763 C CD1 . ILE B 1 24 ? -21.321 -57.399 -7.741 1.00 66.44 ? 18 ILE B CD1 1 ATOM 2764 N N . GLY B 1 25 ? -18.174 -55.175 -4.858 1.00 83.89 ? 19 GLY B N 1 ATOM 2765 C CA . GLY B 1 25 ? -16.809 -55.657 -4.847 1.00 85.80 ? 19 GLY B CA 1 ATOM 2766 C C . GLY B 1 25 ? -16.853 -57.166 -4.912 1.00 94.00 ? 19 GLY B C 1 ATOM 2767 O O . GLY B 1 25 ? -17.731 -57.785 -4.305 1.00 93.13 ? 19 GLY B O 1 ATOM 2768 N N . ILE B 1 26 ? -15.953 -57.768 -5.690 1.00 93.83 ? 20 ILE B N 1 ATOM 2769 C CA . ILE B 1 26 ? -15.845 -59.225 -5.790 1.00 94.75 ? 20 ILE B CA 1 ATOM 2770 C C . ILE B 1 26 ? -14.380 -59.612 -5.559 1.00 99.74 ? 20 ILE B C 1 ATOM 2771 O O . ILE B 1 26 ? -13.476 -59.069 -6.213 1.00 98.80 ? 20 ILE B O 1 ATOM 2772 C CB . ILE B 1 26 ? -16.365 -59.807 -7.137 1.00 98.08 ? 20 ILE B CB 1 ATOM 2773 C CG1 . ILE B 1 26 ? -17.776 -59.327 -7.486 1.00 98.26 ? 20 ILE B CG1 1 ATOM 2774 C CG2 . ILE B 1 26 ? -16.304 -61.352 -7.122 1.00 99.14 ? 20 ILE B CG2 1 ATOM 2775 C CD1 . ILE B 1 26 ? -18.287 -59.846 -8.796 1.00 101.92 ? 20 ILE B CD1 1 ATOM 2776 N N . GLY B 1 27 ? -14.176 -60.563 -4.647 1.00 97.10 ? 21 GLY B N 1 ATOM 2777 C CA . GLY B 1 27 ? -12.861 -61.103 -4.349 1.00 97.37 ? 21 GLY B CA 1 ATOM 2778 C C . GLY B 1 27 ? -12.106 -60.444 -3.223 1.00 102.79 ? 21 GLY B C 1 ATOM 2779 O O . GLY B 1 27 ? -12.594 -59.497 -2.604 1.00 101.88 ? 21 GLY B O 1 ATOM 2780 N N . THR B 1 28 ? -10.900 -60.958 -2.956 1.00 101.75 ? 22 THR B N 1 ATOM 2781 C CA . THR B 1 28 ? -9.994 -60.445 -1.930 1.00 101.99 ? 22 THR B CA 1 ATOM 2782 C C . THR B 1 28 ? -8.615 -60.208 -2.564 1.00 107.10 ? 22 THR B C 1 ATOM 2783 O O . THR B 1 28 ? -7.937 -61.173 -2.928 1.00 107.08 ? 22 THR B O 1 ATOM 2784 C CB . THR B 1 28 ? -9.928 -61.358 -0.698 1.00 110.84 ? 22 THR B CB 1 ATOM 2785 O OG1 . THR B 1 28 ? -11.240 -61.771 -0.306 1.00 112.34 ? 22 THR B OG1 1 ATOM 2786 C CG2 . THR B 1 28 ? -9.254 -60.680 0.472 1.00 108.91 ? 22 THR B CG2 1 ATOM 2787 N N . PRO B 1 29 ? -8.189 -58.939 -2.723 1.00 104.69 ? 23 PRO B N 1 ATOM 2788 C CA . PRO B 1 29 ? -8.920 -57.703 -2.391 1.00 104.81 ? 23 PRO B CA 1 ATOM 2789 C C . PRO B 1 29 ? -10.103 -57.491 -3.355 1.00 108.78 ? 23 PRO B C 1 ATOM 2790 O O . PRO B 1 29 ? -10.146 -58.129 -4.427 1.00 109.79 ? 23 PRO B O 1 ATOM 2791 C CB . PRO B 1 29 ? -7.840 -56.621 -2.504 1.00 106.63 ? 23 PRO B CB 1 ATOM 2792 C CG . PRO B 1 29 ? -6.914 -57.145 -3.562 1.00 111.23 ? 23 PRO B CG 1 ATOM 2793 C CD . PRO B 1 29 ? -6.891 -58.642 -3.361 1.00 106.70 ? 23 PRO B CD 1 ATOM 2794 N N . PRO B 1 30 ? -11.083 -56.627 -2.988 1.00 102.20 ? 24 PRO B N 1 ATOM 2795 C CA . PRO B 1 30 ? -12.245 -56.424 -3.855 1.00 100.41 ? 24 PRO B CA 1 ATOM 2796 C C . PRO B 1 30 ? -11.943 -55.819 -5.219 1.00 101.73 ? 24 PRO B C 1 ATOM 2797 O O . PRO B 1 30 ? -11.251 -54.804 -5.310 1.00 101.02 ? 24 PRO B O 1 ATOM 2798 C CB . PRO B 1 30 ? -13.132 -55.480 -3.033 1.00 101.88 ? 24 PRO B CB 1 ATOM 2799 C CG . PRO B 1 30 ? -12.663 -55.608 -1.649 1.00 106.70 ? 24 PRO B CG 1 ATOM 2800 C CD . PRO B 1 30 ? -11.201 -55.818 -1.762 1.00 103.05 ? 24 PRO B CD 1 ATOM 2801 N N . GLN B 1 31 ? -12.471 -56.454 -6.273 1.00 96.68 ? 25 GLN B N 1 ATOM 2802 C CA . GLN B 1 31 ? -12.449 -55.927 -7.635 1.00 95.85 ? 25 GLN B CA 1 ATOM 2803 C C . GLN B 1 31 ? -13.851 -55.308 -7.814 1.00 95.87 ? 25 GLN B C 1 ATOM 2804 O O . GLN B 1 31 ? -14.856 -55.983 -7.586 1.00 94.83 ? 25 GLN B O 1 ATOM 2805 C CB . GLN B 1 31 ? -12.188 -57.033 -8.661 1.00 97.68 ? 25 GLN B CB 1 ATOM 2806 C CG . GLN B 1 31 ? -10.831 -57.718 -8.489 1.00 110.26 ? 25 GLN B CG 1 ATOM 2807 C CD . GLN B 1 31 ? -10.658 -58.877 -9.443 1.00 126.48 ? 25 GLN B CD 1 ATOM 2808 O OE1 . GLN B 1 31 ? -10.963 -58.772 -10.639 1.00 123.34 ? 25 GLN B OE1 1 ATOM 2809 N NE2 . GLN B 1 31 ? -10.187 -60.011 -8.975 1.00 115.46 ? 25 GLN B NE2 1 ATOM 2810 N N . THR B 1 32 ? -13.908 -54.006 -8.121 1.00 90.41 ? 26 THR B N 1 ATOM 2811 C CA . THR B 1 32 ? -15.153 -53.243 -8.196 1.00 89.69 ? 26 THR B CA 1 ATOM 2812 C C . THR B 1 32 ? -15.826 -53.295 -9.571 1.00 92.12 ? 26 THR B C 1 ATOM 2813 O O . THR B 1 32 ? -15.189 -53.053 -10.589 1.00 92.13 ? 26 THR B O 1 ATOM 2814 C CB . THR B 1 32 ? -14.916 -51.781 -7.714 1.00 98.63 ? 26 THR B CB 1 ATOM 2815 O OG1 . THR B 1 32 ? -14.327 -51.707 -6.415 1.00 99.86 ? 26 THR B OG1 1 ATOM 2816 C CG2 . THR B 1 32 ? -16.142 -50.914 -7.760 1.00 96.88 ? 26 THR B CG2 1 ATOM 2817 N N . PHE B 1 33 ? -17.137 -53.563 -9.579 1.00 87.18 ? 27 PHE B N 1 ATOM 2818 C CA . PHE B 1 33 ? -17.945 -53.629 -10.801 1.00 85.34 ? 27 PHE B CA 1 ATOM 2819 C C . PHE B 1 33 ? -19.180 -52.784 -10.674 1.00 83.07 ? 27 PHE B C 1 ATOM 2820 O O . PHE B 1 33 ? -19.756 -52.666 -9.591 1.00 82.04 ? 27 PHE B O 1 ATOM 2821 C CB . PHE B 1 33 ? -18.362 -55.080 -11.114 1.00 87.45 ? 27 PHE B CB 1 ATOM 2822 C CG . PHE B 1 33 ? -17.183 -55.970 -11.361 1.00 89.83 ? 27 PHE B CG 1 ATOM 2823 C CD1 . PHE B 1 33 ? -16.657 -56.108 -12.640 1.00 93.19 ? 27 PHE B CD1 1 ATOM 2824 C CD2 . PHE B 1 33 ? -16.554 -56.621 -10.306 1.00 93.23 ? 27 PHE B CD2 1 ATOM 2825 C CE1 . PHE B 1 33 ? -15.535 -56.896 -12.864 1.00 94.75 ? 27 PHE B CE1 1 ATOM 2826 C CE2 . PHE B 1 33 ? -15.431 -57.405 -10.525 1.00 96.72 ? 27 PHE B CE2 1 ATOM 2827 C CZ . PHE B 1 33 ? -14.928 -57.537 -11.805 1.00 94.79 ? 27 PHE B CZ 1 ATOM 2828 N N . LYS B 1 34 ? -19.585 -52.198 -11.788 1.00 76.06 ? 28 LYS B N 1 ATOM 2829 C CA . LYS B 1 34 ? -20.825 -51.467 -11.903 1.00 74.38 ? 28 LYS B CA 1 ATOM 2830 C C . LYS B 1 34 ? -21.872 -52.527 -12.281 1.00 76.38 ? 28 LYS B C 1 ATOM 2831 O O . LYS B 1 34 ? -21.671 -53.293 -13.234 1.00 74.91 ? 28 LYS B O 1 ATOM 2832 C CB . LYS B 1 34 ? -20.724 -50.385 -12.987 1.00 76.24 ? 28 LYS B CB 1 ATOM 2833 C CG . LYS B 1 34 ? -19.700 -49.297 -12.671 1.00 86.87 ? 28 LYS B CG 1 ATOM 2834 C CD . LYS B 1 34 ? -19.338 -48.430 -13.882 1.00 95.28 ? 28 LYS B CD 1 ATOM 2835 C CE . LYS B 1 34 ? -18.234 -47.456 -13.468 1.00 112.27 ? 28 LYS B CE 1 ATOM 2836 N NZ . LYS B 1 34 ? -17.655 -46.696 -14.609 1.00 121.93 ? 28 LYS B NZ 1 ATOM 2837 N N . VAL B 1 35 ? -22.946 -52.630 -11.482 1.00 71.54 ? 29 VAL B N 1 ATOM 2838 C CA . VAL B 1 35 ? -23.988 -53.642 -11.703 1.00 70.15 ? 29 VAL B CA 1 ATOM 2839 C C . VAL B 1 35 ? -25.389 -53.069 -11.631 1.00 71.42 ? 29 VAL B C 1 ATOM 2840 O O . VAL B 1 35 ? -25.659 -52.149 -10.856 1.00 69.44 ? 29 VAL B O 1 ATOM 2841 C CB . VAL B 1 35 ? -23.862 -54.865 -10.749 1.00 73.71 ? 29 VAL B CB 1 ATOM 2842 C CG1 . VAL B 1 35 ? -22.599 -55.662 -11.022 1.00 74.13 ? 29 VAL B CG1 1 ATOM 2843 C CG2 . VAL B 1 35 ? -23.916 -54.441 -9.282 1.00 73.33 ? 29 VAL B CG2 1 ATOM 2844 N N . VAL B 1 36 ? -26.288 -53.651 -12.417 1.00 67.22 ? 30 VAL B N 1 ATOM 2845 C CA . VAL B 1 36 ? -27.710 -53.365 -12.352 1.00 66.34 ? 30 VAL B CA 1 ATOM 2846 C C . VAL B 1 36 ? -28.262 -54.369 -11.354 1.00 67.33 ? 30 VAL B C 1 ATOM 2847 O O . VAL B 1 36 ? -27.906 -55.550 -11.400 1.00 64.20 ? 30 VAL B O 1 ATOM 2848 C CB . VAL B 1 36 ? -28.410 -53.519 -13.722 1.00 69.91 ? 30 VAL B CB 1 ATOM 2849 C CG1 . VAL B 1 36 ? -29.929 -53.576 -13.586 1.00 70.37 ? 30 VAL B CG1 1 ATOM 2850 C CG2 . VAL B 1 36 ? -28.024 -52.385 -14.625 1.00 69.10 ? 30 VAL B CG2 1 ATOM 2851 N N . PHE B 1 37 ? -29.121 -53.896 -10.448 1.00 64.55 ? 31 PHE B N 1 ATOM 2852 C CA . PHE B 1 37 ? -29.812 -54.749 -9.490 1.00 64.04 ? 31 PHE B CA 1 ATOM 2853 C C . PHE B 1 37 ? -31.204 -54.979 -10.098 1.00 67.45 ? 31 PHE B C 1 ATOM 2854 O O . PHE B 1 37 ? -32.037 -54.062 -10.167 1.00 68.31 ? 31 PHE B O 1 ATOM 2855 C CB . PHE B 1 37 ? -29.842 -54.087 -8.126 1.00 65.75 ? 31 PHE B CB 1 ATOM 2856 C CG . PHE B 1 37 ? -28.473 -53.925 -7.507 1.00 66.84 ? 31 PHE B CG 1 ATOM 2857 C CD1 . PHE B 1 37 ? -27.694 -52.797 -7.779 1.00 69.95 ? 31 PHE B CD1 1 ATOM 2858 C CD2 . PHE B 1 37 ? -27.970 -54.889 -6.629 1.00 67.44 ? 31 PHE B CD2 1 ATOM 2859 C CE1 . PHE B 1 37 ? -26.431 -52.641 -7.191 1.00 71.09 ? 31 PHE B CE1 1 ATOM 2860 C CE2 . PHE B 1 37 ? -26.714 -54.727 -6.031 1.00 69.84 ? 31 PHE B CE2 1 ATOM 2861 C CZ . PHE B 1 37 ? -25.951 -53.608 -6.319 1.00 68.84 ? 31 PHE B CZ 1 ATOM 2862 N N . ASP B 1 38 ? -31.409 -56.202 -10.603 1.00 61.82 ? 32 ASP B N 1 ATOM 2863 C CA . ASP B 1 38 ? -32.536 -56.560 -11.442 1.00 61.12 ? 32 ASP B CA 1 ATOM 2864 C C . ASP B 1 38 ? -33.526 -57.541 -10.822 1.00 65.67 ? 32 ASP B C 1 ATOM 2865 O O . ASP B 1 38 ? -33.211 -58.715 -10.674 1.00 66.50 ? 32 ASP B O 1 ATOM 2866 C CB . ASP B 1 38 ? -31.966 -57.099 -12.761 1.00 62.61 ? 32 ASP B CB 1 ATOM 2867 C CG . ASP B 1 38 ? -32.995 -57.624 -13.737 1.00 74.31 ? 32 ASP B CG 1 ATOM 2868 O OD1 . ASP B 1 38 ? -34.134 -57.109 -13.737 1.00 75.91 ? 32 ASP B OD1 1 ATOM 2869 O OD2 . ASP B 1 38 ? -32.653 -58.525 -14.527 1.00 80.34 ? 32 ASP B OD2 1 ATOM 2870 N N . THR B 1 39 ? -34.743 -57.078 -10.507 1.00 61.48 ? 33 THR B N 1 ATOM 2871 C CA . THR B 1 39 ? -35.783 -57.939 -9.936 1.00 60.45 ? 33 THR B CA 1 ATOM 2872 C C . THR B 1 39 ? -36.397 -58.875 -10.979 1.00 64.04 ? 33 THR B C 1 ATOM 2873 O O . THR B 1 39 ? -37.121 -59.803 -10.615 1.00 63.47 ? 33 THR B O 1 ATOM 2874 C CB . THR B 1 39 ? -36.885 -57.122 -9.241 1.00 61.99 ? 33 THR B CB 1 ATOM 2875 O OG1 . THR B 1 39 ? -37.456 -56.193 -10.169 1.00 58.92 ? 33 THR B OG1 1 ATOM 2876 C CG2 . THR B 1 39 ? -36.398 -56.436 -7.992 1.00 55.93 ? 33 THR B CG2 1 ATOM 2877 N N . GLY B 1 40 ? -36.119 -58.615 -12.256 1.00 60.69 ? 34 GLY B N 1 ATOM 2878 C CA . GLY B 1 40 ? -36.616 -59.425 -13.359 1.00 61.17 ? 34 GLY B CA 1 ATOM 2879 C C . GLY B 1 40 ? -35.806 -60.681 -13.614 1.00 66.35 ? 34 GLY B C 1 ATOM 2880 O O . GLY B 1 40 ? -36.177 -61.466 -14.481 1.00 66.64 ? 34 GLY B O 1 ATOM 2881 N N . SER B 1 41 ? -34.676 -60.870 -12.895 1.00 63.43 ? 35 SER B N 1 ATOM 2882 C CA . SER B 1 41 ? -33.801 -62.039 -13.028 1.00 63.00 ? 35 SER B CA 1 ATOM 2883 C C . SER B 1 41 ? -33.190 -62.413 -11.690 1.00 69.53 ? 35 SER B C 1 ATOM 2884 O O . SER B 1 41 ? -33.328 -61.674 -10.713 1.00 67.74 ? 35 SER B O 1 ATOM 2885 C CB . SER B 1 41 ? -32.743 -61.832 -14.105 1.00 64.26 ? 35 SER B CB 1 ATOM 2886 O OG . SER B 1 41 ? -31.797 -60.855 -13.710 1.00 68.31 ? 35 SER B OG 1 ATOM 2887 N N . SER B 1 42 ? -32.523 -63.571 -11.639 1.00 69.07 ? 36 SER B N 1 ATOM 2888 C CA . SER B 1 42 ? -32.060 -64.152 -10.386 1.00 68.66 ? 36 SER B CA 1 ATOM 2889 C C . SER B 1 42 ? -30.594 -64.560 -10.326 1.00 74.01 ? 36 SER B C 1 ATOM 2890 O O . SER B 1 42 ? -30.144 -65.043 -9.282 1.00 75.42 ? 36 SER B O 1 ATOM 2891 C CB . SER B 1 42 ? -32.958 -65.332 -10.044 1.00 69.77 ? 36 SER B CB 1 ATOM 2892 O OG . SER B 1 42 ? -34.327 -64.978 -10.177 1.00 71.65 ? 36 SER B OG 1 ATOM 2893 N N . ASN B 1 43 ? -29.838 -64.334 -11.405 1.00 69.63 ? 37 ASN B N 1 ATOM 2894 C CA . ASN B 1 43 ? -28.410 -64.666 -11.429 1.00 68.84 ? 37 ASN B CA 1 ATOM 2895 C C . ASN B 1 43 ? -27.504 -63.463 -11.243 1.00 71.92 ? 37 ASN B C 1 ATOM 2896 O O . ASN B 1 43 ? -27.873 -62.356 -11.639 1.00 71.75 ? 37 ASN B O 1 ATOM 2897 C CB . ASN B 1 43 ? -28.048 -65.374 -12.728 1.00 68.71 ? 37 ASN B CB 1 ATOM 2898 C CG . ASN B 1 43 ? -28.654 -66.746 -12.844 1.00 102.11 ? 37 ASN B CG 1 ATOM 2899 O OD1 . ASN B 1 43 ? -29.842 -66.904 -13.160 1.00 97.43 ? 37 ASN B OD1 1 ATOM 2900 N ND2 . ASN B 1 43 ? -27.841 -67.767 -12.593 1.00 97.14 ? 37 ASN B ND2 1 ATOM 2901 N N . VAL B 1 44 ? -26.321 -63.686 -10.630 1.00 67.99 ? 38 VAL B N 1 ATOM 2902 C CA . VAL B 1 44 ? -25.267 -62.686 -10.495 1.00 67.88 ? 38 VAL B CA 1 ATOM 2903 C C . VAL B 1 44 ? -24.241 -63.040 -11.558 1.00 76.58 ? 38 VAL B C 1 ATOM 2904 O O . VAL B 1 44 ? -23.854 -64.202 -11.667 1.00 77.05 ? 38 VAL B O 1 ATOM 2905 C CB . VAL B 1 44 ? -24.576 -62.633 -9.110 1.00 69.76 ? 38 VAL B CB 1 ATOM 2906 C CG1 . VAL B 1 44 ? -23.441 -61.595 -9.085 1.00 68.53 ? 38 VAL B CG1 1 ATOM 2907 C CG2 . VAL B 1 44 ? -25.579 -62.338 -8.011 1.00 69.50 ? 38 VAL B CG2 1 ATOM 2908 N N . TRP B 1 45 ? -23.811 -62.052 -12.348 1.00 75.41 ? 39 TRP B N 1 ATOM 2909 C CA . TRP B 1 45 ? -22.764 -62.234 -13.339 1.00 76.23 ? 39 TRP B CA 1 ATOM 2910 C C . TRP B 1 45 ? -21.995 -60.959 -13.583 1.00 83.85 ? 39 TRP B C 1 ATOM 2911 O O . TRP B 1 45 ? -22.553 -59.870 -13.509 1.00 83.25 ? 39 TRP B O 1 ATOM 2912 C CB . TRP B 1 45 ? -23.277 -62.855 -14.657 1.00 75.10 ? 39 TRP B CB 1 ATOM 2913 C CG . TRP B 1 45 ? -24.140 -61.965 -15.499 1.00 76.66 ? 39 TRP B CG 1 ATOM 2914 C CD1 . TRP B 1 45 ? -25.505 -61.962 -15.552 1.00 79.85 ? 39 TRP B CD1 1 ATOM 2915 C CD2 . TRP B 1 45 ? -23.699 -60.981 -16.442 1.00 76.34 ? 39 TRP B CD2 1 ATOM 2916 N NE1 . TRP B 1 45 ? -25.943 -61.029 -16.458 1.00 79.57 ? 39 TRP B NE1 1 ATOM 2917 C CE2 . TRP B 1 45 ? -24.855 -60.414 -17.023 1.00 80.84 ? 39 TRP B CE2 1 ATOM 2918 C CE3 . TRP B 1 45 ? -22.439 -60.504 -16.842 1.00 77.29 ? 39 TRP B CE3 1 ATOM 2919 C CZ2 . TRP B 1 45 ? -24.788 -59.398 -17.977 1.00 80.01 ? 39 TRP B CZ2 1 ATOM 2920 C CZ3 . TRP B 1 45 ? -22.373 -59.506 -17.799 1.00 78.79 ? 39 TRP B CZ3 1 ATOM 2921 C CH2 . TRP B 1 45 ? -23.536 -58.959 -18.350 1.00 79.67 ? 39 TRP B CH2 1 ATOM 2922 N N . VAL B 1 46 ? -20.708 -61.101 -13.886 1.00 83.42 ? 40 VAL B N 1 ATOM 2923 C CA . VAL B 1 46 ? -19.812 -60.018 -14.280 1.00 84.03 ? 40 VAL B CA 1 ATOM 2924 C C . VAL B 1 46 ? -18.979 -60.512 -15.467 1.00 89.13 ? 40 VAL B C 1 ATOM 2925 O O . VAL B 1 46 ? -18.811 -61.725 -15.613 1.00 87.82 ? 40 VAL B O 1 ATOM 2926 C CB . VAL B 1 46 ? -18.917 -59.452 -13.138 1.00 88.40 ? 40 VAL B CB 1 ATOM 2927 C CG1 . VAL B 1 46 ? -19.750 -58.774 -12.059 1.00 88.51 ? 40 VAL B CG1 1 ATOM 2928 C CG2 . VAL B 1 46 ? -18.012 -60.516 -12.541 1.00 88.35 ? 40 VAL B CG2 1 ATOM 2929 N N . PRO B 1 47 ? -18.428 -59.617 -16.316 1.00 88.51 ? 41 PRO B N 1 ATOM 2930 C CA . PRO B 1 47 ? -17.548 -60.080 -17.401 1.00 89.34 ? 41 PRO B CA 1 ATOM 2931 C C . PRO B 1 47 ? -16.263 -60.677 -16.817 1.00 97.28 ? 41 PRO B C 1 ATOM 2932 O O . PRO B 1 47 ? -15.788 -60.264 -15.751 1.00 96.17 ? 41 PRO B O 1 ATOM 2933 C CB . PRO B 1 47 ? -17.255 -58.803 -18.189 1.00 90.45 ? 41 PRO B CB 1 ATOM 2934 C CG . PRO B 1 47 ? -18.314 -57.853 -17.788 1.00 94.13 ? 41 PRO B CG 1 ATOM 2935 C CD . PRO B 1 47 ? -18.539 -58.151 -16.340 1.00 89.64 ? 41 PRO B CD 1 ATOM 2936 N N . SER B 1 48 ? -15.732 -61.681 -17.502 1.00 97.50 ? 42 SER B N 1 ATOM 2937 C CA . SER B 1 48 ? -14.547 -62.413 -17.067 1.00 98.56 ? 42 SER B CA 1 ATOM 2938 C C . SER B 1 48 ? -13.306 -61.988 -17.816 1.00 102.84 ? 42 SER B C 1 ATOM 2939 O O . SER B 1 48 ? -13.391 -61.637 -18.998 1.00 101.74 ? 42 SER B O 1 ATOM 2940 C CB . SER B 1 48 ? -14.770 -63.905 -17.288 1.00 103.32 ? 42 SER B CB 1 ATOM 2941 O OG . SER B 1 48 ? -13.633 -64.659 -16.912 1.00 112.76 ? 42 SER B OG 1 ATOM 2942 N N . SER B 1 49 ? -12.135 -62.077 -17.151 1.00 100.35 ? 43 SER B N 1 ATOM 2943 C CA . SER B 1 49 ? -10.833 -61.840 -17.798 1.00 100.03 ? 43 SER B CA 1 ATOM 2944 C C . SER B 1 49 ? -10.609 -62.913 -18.911 1.00 103.15 ? 43 SER B C 1 ATOM 2945 O O . SER B 1 49 ? -9.858 -62.683 -19.855 1.00 101.82 ? 43 SER B O 1 ATOM 2946 C CB . SER B 1 49 ? -9.710 -61.884 -16.770 1.00 103.15 ? 43 SER B CB 1 ATOM 2947 O OG . SER B 1 49 ? -9.739 -63.110 -16.064 1.00 115.23 ? 43 SER B OG 1 ATOM 2948 N N . LYS B 1 50 ? -11.311 -64.055 -18.805 1.00 100.21 ? 44 LYS B N 1 ATOM 2949 C CA . LYS B 1 50 ? -11.279 -65.125 -19.793 1.00 100.62 ? 44 LYS B CA 1 ATOM 2950 C C . LYS B 1 50 ? -12.093 -64.768 -21.053 1.00 107.45 ? 44 LYS B C 1 ATOM 2951 O O . LYS B 1 50 ? -12.092 -65.544 -22.008 1.00 107.52 ? 44 LYS B O 1 ATOM 2952 C CB . LYS B 1 50 ? -11.779 -66.445 -19.188 1.00 102.68 ? 44 LYS B CB 1 ATOM 2953 C CG . LYS B 1 50 ? -10.722 -67.238 -18.429 1.00 117.80 ? 44 LYS B CG 1 ATOM 2954 C CD . LYS B 1 50 ? -10.738 -66.852 -16.953 1.00 130.62 ? 44 LYS B CD 1 ATOM 2955 C CE . LYS B 1 50 ? -9.928 -67.748 -16.058 1.00 144.13 ? 44 LYS B CE 1 ATOM 2956 N NZ . LYS B 1 50 ? -9.799 -67.179 -14.684 1.00 155.46 ? 44 LYS B NZ 1 ATOM 2957 N N . CYS B 1 51 ? -12.794 -63.613 -21.059 1.00 105.83 ? 45 CYS B N 1 ATOM 2958 C CA . CYS B 1 51 ? -13.579 -63.186 -22.221 1.00 106.26 ? 45 CYS B CA 1 ATOM 2959 C C . CYS B 1 51 ? -12.684 -62.759 -23.374 1.00 109.63 ? 45 CYS B C 1 ATOM 2960 O O . CYS B 1 51 ? -11.850 -61.865 -23.206 1.00 107.79 ? 45 CYS B O 1 ATOM 2961 C CB . CYS B 1 51 ? -14.577 -62.083 -21.863 1.00 106.76 ? 45 CYS B CB 1 ATOM 2962 S SG . CYS B 1 51 ? -15.635 -61.549 -23.252 1.00 110.75 ? 45 CYS B SG 1 ATOM 2963 N N . SER B 1 52 ? -12.903 -63.371 -24.559 1.00 107.00 ? 46 SER B N 1 ATOM 2964 C CA . SER B 1 52 ? -12.199 -63.030 -25.791 1.00 106.66 ? 46 SER B CA 1 ATOM 2965 C C . SER B 1 52 ? -12.347 -61.531 -26.085 1.00 110.80 ? 46 SER B C 1 ATOM 2966 O O . SER B 1 52 ? -13.455 -60.988 -26.042 1.00 111.65 ? 46 SER B O 1 ATOM 2967 C CB . SER B 1 52 ? -12.762 -63.833 -26.957 1.00 108.89 ? 46 SER B CB 1 ATOM 2968 O OG . SER B 1 52 ? -12.272 -63.319 -28.182 1.00 115.61 ? 46 SER B OG 1 ATOM 2969 N N . ARG B 1 53 A -11.234 -60.873 -26.401 1.00 105.64 ? 46 ARG B N 1 ATOM 2970 C CA . ARG B 1 53 A -11.240 -59.447 -26.705 1.00 104.68 ? 46 ARG B CA 1 ATOM 2971 C C . ARG B 1 53 A -11.816 -59.150 -28.094 1.00 106.45 ? 46 ARG B C 1 ATOM 2972 O O . ARG B 1 53 A -11.867 -57.996 -28.516 1.00 105.00 ? 46 ARG B O 1 ATOM 2973 C CB . ARG B 1 53 A -9.852 -58.823 -26.481 1.00 105.61 ? 46 ARG B CB 1 ATOM 2974 C CG . ARG B 1 53 A -9.222 -59.122 -25.110 1.00 115.70 ? 46 ARG B CG 1 ATOM 2975 C CD . ARG B 1 53 A -10.087 -58.732 -23.920 1.00 123.73 ? 46 ARG B CD 1 ATOM 2976 N NE . ARG B 1 53 A -9.892 -59.662 -22.806 1.00 132.89 ? 46 ARG B NE 1 ATOM 2977 C CZ . ARG B 1 53 A -9.023 -59.473 -21.818 1.00 147.60 ? 46 ARG B CZ 1 ATOM 2978 N NH1 . ARG B 1 53 A -8.289 -58.367 -21.773 1.00 135.76 ? 46 ARG B NH1 1 ATOM 2979 N NH2 . ARG B 1 53 A -8.903 -60.376 -20.849 1.00 131.22 ? 46 ARG B NH2 1 ATOM 2980 N N . LEU B 1 54 B -12.294 -60.199 -28.785 1.00 103.30 ? 46 LEU B N 1 ATOM 2981 C CA . LEU B 1 54 B -12.985 -60.072 -30.067 1.00 103.37 ? 46 LEU B CA 1 ATOM 2982 C C . LEU B 1 54 B -14.410 -59.558 -29.823 1.00 105.48 ? 46 LEU B C 1 ATOM 2983 O O . LEU B 1 54 B -15.006 -58.946 -30.713 1.00 104.51 ? 46 LEU B O 1 ATOM 2984 C CB . LEU B 1 54 B -12.930 -61.374 -30.895 1.00 103.78 ? 46 LEU B CB 1 ATOM 2985 C CG . LEU B 1 54 B -11.526 -61.709 -31.475 1.00 108.23 ? 46 LEU B CG 1 ATOM 2986 C CD1 . LEU B 1 54 B -11.434 -63.133 -31.901 1.00 108.17 ? 46 LEU B CD1 1 ATOM 2987 C CD2 . LEU B 1 54 B -11.142 -60.794 -32.634 1.00 109.88 ? 46 LEU B CD2 1 ATOM 2988 N N . TYR B 1 55 ? -14.924 -59.760 -28.582 1.00 101.36 ? 47 TYR B N 1 ATOM 2989 C CA . TYR B 1 55 ? -16.166 -59.158 -28.103 1.00 100.20 ? 47 TYR B CA 1 ATOM 2990 C C . TYR B 1 55 ? -15.762 -57.770 -27.631 1.00 103.85 ? 47 TYR B C 1 ATOM 2991 O O . TYR B 1 55 ? -15.082 -57.630 -26.600 1.00 104.50 ? 47 TYR B O 1 ATOM 2992 C CB . TYR B 1 55 ? -16.757 -59.916 -26.920 1.00 100.57 ? 47 TYR B CB 1 ATOM 2993 C CG . TYR B 1 55 ? -17.269 -61.275 -27.289 1.00 101.20 ? 47 TYR B CG 1 ATOM 2994 C CD1 . TYR B 1 55 ? -18.483 -61.428 -27.956 1.00 103.00 ? 47 TYR B CD1 1 ATOM 2995 C CD2 . TYR B 1 55 ? -16.558 -62.418 -26.949 1.00 101.68 ? 47 TYR B CD2 1 ATOM 2996 C CE1 . TYR B 1 55 ? -18.964 -62.686 -28.297 1.00 103.77 ? 47 TYR B CE1 1 ATOM 2997 C CE2 . TYR B 1 55 ? -17.029 -63.683 -27.282 1.00 102.49 ? 47 TYR B CE2 1 ATOM 2998 C CZ . TYR B 1 55 ? -18.228 -63.812 -27.962 1.00 108.82 ? 47 TYR B CZ 1 ATOM 2999 O OH . TYR B 1 55 ? -18.694 -65.056 -28.286 1.00 108.11 ? 47 TYR B OH 1 ATOM 3000 N N . THR B 1 56 ? -16.153 -56.745 -28.392 1.00 99.29 ? 48 THR B N 1 ATOM 3001 C CA . THR B 1 56 ? -15.820 -55.358 -28.070 1.00 99.24 ? 48 THR B CA 1 ATOM 3002 C C . THR B 1 56 ? -16.305 -54.975 -26.672 1.00 103.80 ? 48 THR B C 1 ATOM 3003 O O . THR B 1 56 ? -15.648 -54.176 -25.990 1.00 102.96 ? 48 THR B O 1 ATOM 3004 C CB . THR B 1 56 ? -16.360 -54.409 -29.125 1.00 104.42 ? 48 THR B CB 1 ATOM 3005 O OG1 . THR B 1 56 ? -16.193 -54.982 -30.416 1.00 106.84 ? 48 THR B OG1 1 ATOM 3006 C CG2 . THR B 1 56 ? -15.710 -53.041 -29.053 1.00 99.96 ? 48 THR B CG2 1 ATOM 3007 N N . ALA B 1 57 ? -17.437 -55.580 -26.239 1.00 100.55 ? 49 ALA B N 1 ATOM 3008 C CA . ALA B 1 57 ? -18.002 -55.361 -24.920 1.00 100.49 ? 49 ALA B CA 1 ATOM 3009 C C . ALA B 1 57 ? -17.014 -55.761 -23.798 1.00 106.48 ? 49 ALA B C 1 ATOM 3010 O O . ALA B 1 57 ? -17.028 -55.162 -22.723 1.00 105.79 ? 49 ALA B O 1 ATOM 3011 C CB . ALA B 1 57 ? -19.320 -56.108 -24.792 1.00 101.09 ? 49 ALA B CB 1 ATOM 3012 N N . CYS B 1 58 ? -16.136 -56.735 -24.065 1.00 105.15 ? 50 CYS B N 1 ATOM 3013 C CA . CYS B 1 58 ? -15.147 -57.169 -23.085 1.00 106.18 ? 50 CYS B CA 1 ATOM 3014 C C . CYS B 1 58 ? -13.892 -56.316 -23.079 1.00 112.72 ? 50 CYS B C 1 ATOM 3015 O O . CYS B 1 58 ? -13.119 -56.339 -22.112 1.00 112.61 ? 50 CYS B O 1 ATOM 3016 C CB . CYS B 1 58 ? -14.845 -58.643 -23.247 1.00 106.57 ? 50 CYS B CB 1 ATOM 3017 S SG . CYS B 1 58 ? -16.216 -59.691 -22.737 1.00 110.66 ? 50 CYS B SG 1 ATOM 3018 N N . VAL B 1 59 ? -13.712 -55.521 -24.137 1.00 110.10 ? 51 VAL B N 1 ATOM 3019 C CA . VAL B 1 59 ? -12.614 -54.563 -24.209 1.00 109.89 ? 51 VAL B CA 1 ATOM 3020 C C . VAL B 1 59 ? -13.019 -53.343 -23.374 1.00 112.39 ? 51 VAL B C 1 ATOM 3021 O O . VAL B 1 59 ? -12.189 -52.774 -22.662 1.00 111.38 ? 51 VAL B O 1 ATOM 3022 C CB . VAL B 1 59 ? -12.291 -54.155 -25.677 1.00 113.82 ? 51 VAL B CB 1 ATOM 3023 C CG1 . VAL B 1 59 ? -11.221 -53.069 -25.736 1.00 113.50 ? 51 VAL B CG1 1 ATOM 3024 C CG2 . VAL B 1 59 ? -11.870 -55.360 -26.506 1.00 113.55 ? 51 VAL B CG2 1 ATOM 3025 N N . TYR B 1 60 ? -14.302 -52.953 -23.473 1.00 108.79 ? 52 TYR B N 1 ATOM 3026 C CA . TYR B 1 60 ? -14.826 -51.754 -22.821 1.00 108.64 ? 52 TYR B CA 1 ATOM 3027 C C . TYR B 1 60 ? -15.285 -51.906 -21.374 1.00 109.37 ? 52 TYR B C 1 ATOM 3028 O O . TYR B 1 60 ? -15.312 -50.915 -20.650 1.00 109.32 ? 52 TYR B O 1 ATOM 3029 C CB . TYR B 1 60 ? -15.899 -51.087 -23.688 1.00 110.82 ? 52 TYR B CB 1 ATOM 3030 C CG . TYR B 1 60 ? -15.324 -50.316 -24.861 1.00 114.44 ? 52 TYR B CG 1 ATOM 3031 C CD1 . TYR B 1 60 ? -14.994 -50.959 -26.051 1.00 116.78 ? 52 TYR B CD1 1 ATOM 3032 C CD2 . TYR B 1 60 ? -15.117 -48.939 -24.785 1.00 115.59 ? 52 TYR B CD2 1 ATOM 3033 C CE1 . TYR B 1 60 ? -14.477 -50.254 -27.140 1.00 116.98 ? 52 TYR B CE1 1 ATOM 3034 C CE2 . TYR B 1 60 ? -14.587 -48.226 -25.866 1.00 116.65 ? 52 TYR B CE2 1 ATOM 3035 C CZ . TYR B 1 60 ? -14.282 -48.889 -27.046 1.00 121.41 ? 52 TYR B CZ 1 ATOM 3036 O OH . TYR B 1 60 ? -13.747 -48.212 -28.115 1.00 117.49 ? 52 TYR B OH 1 ATOM 3037 N N . HIS B 1 61 ? -15.631 -53.124 -20.941 1.00 102.29 ? 53 HIS B N 1 ATOM 3038 C CA . HIS B 1 61 ? -16.084 -53.320 -19.571 1.00 100.49 ? 53 HIS B CA 1 ATOM 3039 C C . HIS B 1 61 ? -15.003 -53.837 -18.658 1.00 103.50 ? 53 HIS B C 1 ATOM 3040 O O . HIS B 1 61 ? -13.969 -54.298 -19.128 1.00 105.28 ? 53 HIS B O 1 ATOM 3041 C CB . HIS B 1 61 ? -17.312 -54.230 -19.529 1.00 100.55 ? 53 HIS B CB 1 ATOM 3042 C CG . HIS B 1 61 ? -18.544 -53.592 -20.084 1.00 103.04 ? 53 HIS B CG 1 ATOM 3043 N ND1 . HIS B 1 61 ? -19.047 -53.934 -21.323 1.00 104.18 ? 53 HIS B ND1 1 ATOM 3044 C CD2 . HIS B 1 61 ? -19.332 -52.646 -19.552 1.00 104.06 ? 53 HIS B CD2 1 ATOM 3045 C CE1 . HIS B 1 61 ? -20.106 -53.172 -21.512 1.00 103.25 ? 53 HIS B CE1 1 ATOM 3046 N NE2 . HIS B 1 61 ? -20.317 -52.385 -20.477 1.00 103.61 ? 53 HIS B NE2 1 ATOM 3047 N N . LYS B 1 62 ? -15.241 -53.754 -17.346 1.00 97.37 ? 54 LYS B N 1 ATOM 3048 C CA . LYS B 1 62 ? -14.341 -54.250 -16.313 1.00 96.23 ? 54 LYS B CA 1 ATOM 3049 C C . LYS B 1 62 ? -14.464 -55.772 -16.272 1.00 101.49 ? 54 LYS B C 1 ATOM 3050 O O . LYS B 1 62 ? -15.571 -56.316 -16.341 1.00 101.55 ? 54 LYS B O 1 ATOM 3051 C CB . LYS B 1 62 ? -14.710 -53.647 -14.956 1.00 96.94 ? 54 LYS B CB 1 ATOM 3052 C CG . LYS B 1 62 ? -13.539 -53.099 -14.191 1.00 94.36 ? 54 LYS B CG 1 ATOM 3053 C CD . LYS B 1 62 ? -13.205 -53.969 -12.999 1.00 104.24 ? 54 LYS B CD 1 ATOM 3054 C CE . LYS B 1 62 ? -12.304 -53.205 -12.063 1.00 117.78 ? 54 LYS B CE 1 ATOM 3055 N NZ . LYS B 1 62 ? -12.222 -53.831 -10.713 1.00 132.81 ? 54 LYS B NZ 1 ATOM 3056 N N . LEU B 1 63 ? -13.325 -56.456 -16.191 1.00 98.39 ? 55 LEU B N 1 ATOM 3057 C CA . LEU B 1 63 ? -13.306 -57.910 -16.192 1.00 97.71 ? 55 LEU B CA 1 ATOM 3058 C C . LEU B 1 63 ? -12.829 -58.466 -14.862 1.00 99.49 ? 55 LEU B C 1 ATOM 3059 O O . LEU B 1 63 ? -11.899 -57.924 -14.263 1.00 98.69 ? 55 LEU B O 1 ATOM 3060 C CB . LEU B 1 63 ? -12.419 -58.427 -17.346 1.00 97.90 ? 55 LEU B CB 1 ATOM 3061 C CG . LEU B 1 63 ? -12.585 -57.801 -18.767 1.00 103.13 ? 55 LEU B CG 1 ATOM 3062 C CD1 . LEU B 1 63 ? -11.659 -58.457 -19.759 1.00 103.25 ? 55 LEU B CD1 1 ATOM 3063 C CD2 . LEU B 1 63 ? -14.001 -57.936 -19.304 1.00 106.38 ? 55 LEU B CD2 1 ATOM 3064 N N . PHE B 1 64 ? -13.474 -59.541 -14.394 1.00 95.29 ? 56 PHE B N 1 ATOM 3065 C CA . PHE B 1 64 ? -13.068 -60.213 -13.161 1.00 95.21 ? 56 PHE B CA 1 ATOM 3066 C C . PHE B 1 64 ? -11.892 -61.137 -13.418 1.00 104.69 ? 56 PHE B C 1 ATOM 3067 O O . PHE B 1 64 ? -11.970 -62.031 -14.274 1.00 105.10 ? 56 PHE B O 1 ATOM 3068 C CB . PHE B 1 64 ? -14.228 -61.004 -12.525 1.00 95.72 ? 56 PHE B CB 1 ATOM 3069 C CG . PHE B 1 64 ? -13.853 -61.733 -11.250 1.00 95.09 ? 56 PHE B CG 1 ATOM 3070 C CD1 . PHE B 1 64 ? -13.561 -61.028 -10.081 1.00 96.63 ? 56 PHE B CD1 1 ATOM 3071 C CD2 . PHE B 1 64 ? -13.786 -63.121 -11.220 1.00 95.32 ? 56 PHE B CD2 1 ATOM 3072 C CE1 . PHE B 1 64 ? -13.209 -61.702 -8.908 1.00 97.18 ? 56 PHE B CE1 1 ATOM 3073 C CE2 . PHE B 1 64 ? -13.437 -63.792 -10.045 1.00 97.74 ? 56 PHE B CE2 1 ATOM 3074 C CZ . PHE B 1 64 ? -13.152 -63.079 -8.897 1.00 95.91 ? 56 PHE B CZ 1 ATOM 3075 N N . ASP B 1 65 ? -10.803 -60.928 -12.667 1.00 103.78 ? 57 ASP B N 1 ATOM 3076 C CA . ASP B 1 65 ? -9.616 -61.774 -12.759 1.00 104.65 ? 57 ASP B CA 1 ATOM 3077 C C . ASP B 1 65 ? -9.515 -62.638 -11.500 1.00 109.90 ? 57 ASP B C 1 ATOM 3078 O O . ASP B 1 65 ? -9.111 -62.153 -10.428 1.00 110.30 ? 57 ASP B O 1 ATOM 3079 C CB . ASP B 1 65 ? -8.341 -60.937 -12.956 1.00 107.02 ? 57 ASP B CB 1 ATOM 3080 C CG . ASP B 1 65 ? -7.177 -61.708 -13.563 1.00 121.02 ? 57 ASP B CG 1 ATOM 3081 O OD1 . ASP B 1 65 ? -7.031 -62.918 -13.252 1.00 122.44 ? 57 ASP B OD1 1 ATOM 3082 O OD2 . ASP B 1 65 ? -6.398 -61.099 -14.329 1.00 127.02 ? 57 ASP B OD2 1 ATOM 3083 N N . ALA B 1 66 ? -9.894 -63.922 -11.638 1.00 106.24 ? 58 ALA B N 1 ATOM 3084 C CA . ALA B 1 66 ? -9.904 -64.884 -10.531 1.00 105.99 ? 58 ALA B CA 1 ATOM 3085 C C . ALA B 1 66 ? -8.542 -65.086 -9.872 1.00 110.97 ? 58 ALA B C 1 ATOM 3086 O O . ALA B 1 66 ? -8.485 -65.265 -8.655 1.00 109.58 ? 58 ALA B O 1 ATOM 3087 C CB . ALA B 1 66 ? -10.463 -66.212 -10.998 1.00 106.58 ? 58 ALA B CB 1 ATOM 3088 N N . SER B 1 67 ? -7.449 -65.052 -10.648 1.00 109.46 ? 59 SER B N 1 ATOM 3089 C CA . SER B 1 67 ? -6.096 -65.253 -10.129 1.00 109.99 ? 59 SER B CA 1 ATOM 3090 C C . SER B 1 67 ? -5.616 -64.117 -9.211 1.00 116.43 ? 59 SER B C 1 ATOM 3091 O O . SER B 1 67 ? -4.591 -64.267 -8.538 1.00 116.46 ? 59 SER B O 1 ATOM 3092 C CB . SER B 1 67 ? -5.120 -65.474 -11.277 1.00 112.44 ? 59 SER B CB 1 ATOM 3093 O OG . SER B 1 67 ? -5.015 -64.309 -12.077 1.00 118.61 ? 59 SER B OG 1 ATOM 3094 N N . ASP B 1 68 ? -6.356 -62.991 -9.184 1.00 114.10 ? 60 ASP B N 1 ATOM 3095 C CA . ASP B 1 68 ? -6.004 -61.857 -8.333 1.00 114.62 ? 60 ASP B CA 1 ATOM 3096 C C . ASP B 1 68 ? -6.749 -61.911 -6.999 1.00 118.83 ? 60 ASP B C 1 ATOM 3097 O O . ASP B 1 68 ? -6.508 -61.071 -6.118 1.00 117.98 ? 60 ASP B O 1 ATOM 3098 C CB . ASP B 1 68 ? -6.271 -60.531 -9.056 1.00 116.67 ? 60 ASP B CB 1 ATOM 3099 C CG . ASP B 1 68 ? -5.432 -60.354 -10.296 1.00 128.13 ? 60 ASP B CG 1 ATOM 3100 O OD1 . ASP B 1 68 ? -4.985 -59.227 -10.547 1.00 129.20 ? 60 ASP B OD1 1 ATOM 3101 O OD2 . ASP B 1 68 ? -5.289 -61.335 -11.060 1.00 134.28 ? 60 ASP B OD2 1 ATOM 3102 N N . SER B 1 69 ? -7.630 -62.914 -6.844 1.00 115.41 ? 61 SER B N 1 ATOM 3103 C CA . SER B 1 69 ? -8.427 -63.074 -5.635 1.00 115.32 ? 61 SER B CA 1 ATOM 3104 C C . SER B 1 69 ? -8.035 -64.304 -4.817 1.00 117.63 ? 61 SER B C 1 ATOM 3105 O O . SER B 1 69 ? -8.070 -65.432 -5.328 1.00 117.05 ? 61 SER B O 1 ATOM 3106 C CB . SER B 1 69 ? -9.914 -63.090 -5.976 1.00 119.78 ? 61 SER B CB 1 ATOM 3107 O OG . SER B 1 69 ? -10.674 -63.428 -4.824 1.00 128.81 ? 61 SER B OG 1 ATOM 3108 N N . SER B 1 70 ? -7.689 -64.077 -3.537 1.00 112.92 ? 62 SER B N 1 ATOM 3109 C CA . SER B 1 70 ? -7.287 -65.149 -2.626 1.00 112.56 ? 62 SER B CA 1 ATOM 3110 C C . SER B 1 70 ? -8.472 -65.931 -2.049 1.00 115.15 ? 62 SER B C 1 ATOM 3111 O O . SER B 1 70 ? -8.273 -67.000 -1.461 1.00 113.58 ? 62 SER B O 1 ATOM 3112 C CB . SER B 1 70 ? -6.405 -64.603 -1.509 1.00 116.79 ? 62 SER B CB 1 ATOM 3113 O OG . SER B 1 70 ? -7.068 -63.603 -0.754 1.00 125.02 ? 62 SER B OG 1 ATOM 3114 N N . SER B 1 71 ? -9.702 -65.409 -2.228 1.00 111.81 ? 63 SER B N 1 ATOM 3115 C CA . SER B 1 71 ? -10.916 -66.051 -1.725 1.00 110.85 ? 63 SER B CA 1 ATOM 3116 C C . SER B 1 71 ? -11.716 -66.771 -2.802 1.00 113.25 ? 63 SER B C 1 ATOM 3117 O O . SER B 1 71 ? -12.745 -67.379 -2.503 1.00 111.11 ? 63 SER B O 1 ATOM 3118 C CB . SER B 1 71 ? -11.773 -65.056 -0.954 1.00 114.15 ? 63 SER B CB 1 ATOM 3119 O OG . SER B 1 71 ? -11.971 -63.861 -1.689 1.00 123.84 ? 63 SER B OG 1 ATOM 3120 N N . TYR B 1 72 ? -11.223 -66.741 -4.043 1.00 111.76 ? 64 TYR B N 1 ATOM 3121 C CA . TYR B 1 72 ? -11.865 -67.403 -5.174 1.00 112.60 ? 64 TYR B CA 1 ATOM 3122 C C . TYR B 1 72 ? -11.871 -68.918 -5.037 1.00 114.80 ? 64 TYR B C 1 ATOM 3123 O O . TYR B 1 72 ? -10.859 -69.518 -4.685 1.00 114.61 ? 64 TYR B O 1 ATOM 3124 C CB . TYR B 1 72 ? -11.176 -66.982 -6.485 1.00 115.59 ? 64 TYR B CB 1 ATOM 3125 C CG . TYR B 1 72 ? -11.455 -67.872 -7.681 1.00 120.13 ? 64 TYR B CG 1 ATOM 3126 C CD1 . TYR B 1 72 ? -10.524 -68.817 -8.105 1.00 122.56 ? 64 TYR B CD1 1 ATOM 3127 C CD2 . TYR B 1 72 ? -12.626 -67.731 -8.424 1.00 121.69 ? 64 TYR B CD2 1 ATOM 3128 C CE1 . TYR B 1 72 ? -10.765 -69.623 -9.219 1.00 124.13 ? 64 TYR B CE1 1 ATOM 3129 C CE2 . TYR B 1 72 ? -12.873 -68.527 -9.544 1.00 122.81 ? 64 TYR B CE2 1 ATOM 3130 C CZ . TYR B 1 72 ? -11.937 -69.467 -9.942 1.00 130.58 ? 64 TYR B CZ 1 ATOM 3131 O OH . TYR B 1 72 ? -12.181 -70.243 -11.051 1.00 131.74 ? 64 TYR B OH 1 ATOM 3132 N N . LYS B 1 73 ? -13.010 -69.528 -5.338 1.00 110.66 ? 65 LYS B N 1 ATOM 3133 C CA . LYS B 1 73 ? -13.175 -70.976 -5.379 1.00 110.45 ? 65 LYS B CA 1 ATOM 3134 C C . LYS B 1 73 ? -13.746 -71.357 -6.742 1.00 115.99 ? 65 LYS B C 1 ATOM 3135 O O . LYS B 1 73 ? -14.810 -70.870 -7.135 1.00 115.54 ? 65 LYS B O 1 ATOM 3136 C CB . LYS B 1 73 ? -14.039 -71.506 -4.222 1.00 112.09 ? 65 LYS B CB 1 ATOM 3137 C CG . LYS B 1 73 ? -13.407 -71.283 -2.856 1.00 124.14 ? 65 LYS B CG 1 ATOM 3138 C CD . LYS B 1 73 ? -14.059 -72.083 -1.751 1.00 134.21 ? 65 LYS B CD 1 ATOM 3139 C CE . LYS B 1 73 ? -13.479 -71.758 -0.397 1.00 143.33 ? 65 LYS B CE 1 ATOM 3140 N NZ . LYS B 1 73 ? -14.024 -72.653 0.666 1.00 150.49 ? 65 LYS B NZ 1 ATOM 3141 N N . HIS B 1 74 ? -13.011 -72.191 -7.474 1.00 113.80 ? 66 HIS B N 1 ATOM 3142 C CA . HIS B 1 74 ? -13.369 -72.646 -8.808 1.00 114.22 ? 66 HIS B CA 1 ATOM 3143 C C . HIS B 1 74 ? -14.660 -73.466 -8.821 1.00 116.25 ? 66 HIS B C 1 ATOM 3144 O O . HIS B 1 74 ? -14.994 -74.128 -7.840 1.00 115.29 ? 66 HIS B O 1 ATOM 3145 C CB . HIS B 1 74 ? -12.202 -73.473 -9.383 1.00 116.04 ? 66 HIS B CB 1 ATOM 3146 C CG . HIS B 1 74 ? -12.454 -74.058 -10.743 1.00 120.34 ? 66 HIS B CG 1 ATOM 3147 N ND1 . HIS B 1 74 ? -12.848 -75.386 -10.898 1.00 122.43 ? 66 HIS B ND1 1 ATOM 3148 C CD2 . HIS B 1 74 ? -12.377 -73.476 -11.966 1.00 122.39 ? 66 HIS B CD2 1 ATOM 3149 C CE1 . HIS B 1 74 ? -12.980 -75.567 -12.205 1.00 122.00 ? 66 HIS B CE1 1 ATOM 3150 N NE2 . HIS B 1 74 ? -12.705 -74.447 -12.888 1.00 122.26 ? 66 HIS B NE2 1 ATOM 3151 N N . ASN B 1 75 ? -15.388 -73.402 -9.937 1.00 112.21 ? 67 ASN B N 1 ATOM 3152 C CA . ASN B 1 75 ? -16.547 -74.246 -10.181 1.00 112.05 ? 67 ASN B CA 1 ATOM 3153 C C . ASN B 1 75 ? -16.515 -74.713 -11.644 1.00 116.88 ? 67 ASN B C 1 ATOM 3154 O O . ASN B 1 75 ? -16.324 -75.903 -11.893 1.00 117.70 ? 67 ASN B O 1 ATOM 3155 C CB . ASN B 1 75 ? -17.859 -73.611 -9.768 1.00 111.97 ? 67 ASN B CB 1 ATOM 3156 C CG . ASN B 1 75 ? -18.995 -74.596 -9.811 1.00 134.13 ? 67 ASN B CG 1 ATOM 3157 O OD1 . ASN B 1 75 ? -19.603 -74.799 -10.864 1.00 124.60 ? 67 ASN B OD1 1 ATOM 3158 N ND2 . ASN B 1 75 ? -19.280 -75.249 -8.689 1.00 125.24 ? 67 ASN B ND2 1 ATOM 3159 N N . GLY B 1 76 ? -16.626 -73.785 -12.588 1.00 112.21 ? 68 GLY B N 1 ATOM 3160 C CA . GLY B 1 76 ? -16.496 -74.094 -14.007 1.00 111.33 ? 68 GLY B CA 1 ATOM 3161 C C . GLY B 1 76 ? -17.725 -74.569 -14.749 1.00 113.63 ? 68 GLY B C 1 ATOM 3162 O O . GLY B 1 76 ? -17.659 -74.739 -15.970 1.00 113.26 ? 68 GLY B O 1 ATOM 3163 N N . THR B 1 77 ? -18.851 -74.785 -14.048 1.00 109.63 ? 69 THR B N 1 ATOM 3164 C CA . THR B 1 77 ? -20.106 -75.192 -14.701 1.00 109.77 ? 69 THR B CA 1 ATOM 3165 C C . THR B 1 77 ? -20.554 -74.114 -15.712 1.00 114.79 ? 69 THR B C 1 ATOM 3166 O O . THR B 1 77 ? -20.674 -72.933 -15.363 1.00 113.43 ? 69 THR B O 1 ATOM 3167 C CB . THR B 1 77 ? -21.217 -75.464 -13.672 1.00 116.23 ? 69 THR B CB 1 ATOM 3168 O OG1 . THR B 1 77 ? -20.779 -76.448 -12.733 1.00 115.39 ? 69 THR B OG1 1 ATOM 3169 C CG2 . THR B 1 77 ? -22.526 -75.903 -14.322 1.00 115.11 ? 69 THR B CG2 1 ATOM 3170 N N . GLU B 1 78 ? -20.788 -74.532 -16.956 1.00 113.06 ? 70 GLU B N 1 ATOM 3171 C CA . GLU B 1 78 ? -21.194 -73.633 -18.027 1.00 113.33 ? 70 GLU B CA 1 ATOM 3172 C C . GLU B 1 78 ? -22.583 -73.070 -17.784 1.00 116.12 ? 70 GLU B C 1 ATOM 3173 O O . GLU B 1 78 ? -23.481 -73.801 -17.371 1.00 115.72 ? 70 GLU B O 1 ATOM 3174 C CB . GLU B 1 78 ? -21.096 -74.353 -19.377 1.00 115.16 ? 70 GLU B CB 1 ATOM 3175 C CG . GLU B 1 78 ? -21.486 -73.542 -20.607 1.00 129.77 ? 70 GLU B CG 1 ATOM 3176 C CD . GLU B 1 78 ? -21.002 -74.104 -21.935 1.00 160.55 ? 70 GLU B CD 1 ATOM 3177 O OE1 . GLU B 1 78 ? -19.881 -74.668 -21.986 1.00 151.54 ? 70 GLU B OE1 1 ATOM 3178 O OE2 . GLU B 1 78 ? -21.724 -73.927 -22.943 1.00 160.27 ? 70 GLU B OE2 1 ATOM 3179 N N . LEU B 1 79 ? -22.726 -71.747 -17.999 1.00 111.76 ? 71 LEU B N 1 ATOM 3180 C CA . LEU B 1 79 ? -23.971 -70.997 -17.847 1.00 110.51 ? 71 LEU B CA 1 ATOM 3181 C C . LEU B 1 79 ? -24.346 -70.281 -19.132 1.00 109.47 ? 71 LEU B C 1 ATOM 3182 O O . LEU B 1 79 ? -23.474 -69.702 -19.782 1.00 108.53 ? 71 LEU B O 1 ATOM 3183 C CB . LEU B 1 79 ? -23.799 -69.907 -16.764 1.00 111.08 ? 71 LEU B CB 1 ATOM 3184 C CG . LEU B 1 79 ? -24.244 -70.135 -15.303 1.00 116.24 ? 71 LEU B CG 1 ATOM 3185 C CD1 . LEU B 1 79 ? -24.459 -68.773 -14.626 1.00 116.82 ? 71 LEU B CD1 1 ATOM 3186 C CD2 . LEU B 1 79 ? -25.525 -71.016 -15.190 1.00 116.98 ? 71 LEU B CD2 1 ATOM 3187 N N . THR B 1 80 ? -25.645 -70.284 -19.482 1.00 103.35 ? 72 THR B N 1 ATOM 3188 C CA . THR B 1 80 ? -26.196 -69.452 -20.560 1.00 102.15 ? 72 THR B CA 1 ATOM 3189 C C . THR B 1 80 ? -27.394 -68.698 -20.005 1.00 104.01 ? 72 THR B C 1 ATOM 3190 O O . THR B 1 80 ? -28.387 -69.314 -19.583 1.00 105.12 ? 72 THR B O 1 ATOM 3191 C CB . THR B 1 80 ? -26.528 -70.197 -21.838 1.00 106.34 ? 72 THR B CB 1 ATOM 3192 O OG1 . THR B 1 80 ? -25.342 -70.831 -22.302 1.00 104.74 ? 72 THR B OG1 1 ATOM 3193 C CG2 . THR B 1 80 ? -27.070 -69.260 -22.916 1.00 104.03 ? 72 THR B CG2 1 ATOM 3194 N N . LEU B 1 81 ? -27.293 -67.366 -19.988 1.00 95.87 ? 73 LEU B N 1 ATOM 3195 C CA . LEU B 1 81 ? -28.359 -66.505 -19.478 1.00 92.80 ? 73 LEU B CA 1 ATOM 3196 C C . LEU B 1 81 ? -28.993 -65.760 -20.636 1.00 93.76 ? 73 LEU B C 1 ATOM 3197 O O . LEU B 1 81 ? -28.355 -64.919 -21.267 1.00 93.72 ? 73 LEU B O 1 ATOM 3198 C CB . LEU B 1 81 ? -27.817 -65.539 -18.397 1.00 91.87 ? 73 LEU B CB 1 ATOM 3199 C CG . LEU B 1 81 ? -26.984 -66.140 -17.269 1.00 95.29 ? 73 LEU B CG 1 ATOM 3200 C CD1 . LEU B 1 81 ? -26.261 -65.080 -16.498 1.00 94.95 ? 73 LEU B CD1 1 ATOM 3201 C CD2 . LEU B 1 81 ? -27.840 -66.909 -16.345 1.00 97.95 ? 73 LEU B CD2 1 ATOM 3202 N N . ARG B 1 82 ? -30.216 -66.123 -20.971 1.00 88.76 ? 74 ARG B N 1 ATOM 3203 C CA . ARG B 1 82 ? -30.905 -65.478 -22.089 1.00 88.54 ? 74 ARG B CA 1 ATOM 3204 C C . ARG B 1 82 ? -31.968 -64.465 -21.618 1.00 89.35 ? 74 ARG B C 1 ATOM 3205 O O . ARG B 1 82 ? -32.997 -64.831 -21.042 1.00 88.65 ? 74 ARG B O 1 ATOM 3206 C CB . ARG B 1 82 ? -31.446 -66.499 -23.109 1.00 91.49 ? 74 ARG B CB 1 ATOM 3207 C CG . ARG B 1 82 ? -32.213 -67.686 -22.526 1.00 111.77 ? 74 ARG B CG 1 ATOM 3208 C CD . ARG B 1 82 ? -32.807 -68.533 -23.653 1.00 131.74 ? 74 ARG B CD 1 ATOM 3209 N NE . ARG B 1 82 ? -31.806 -69.378 -24.318 1.00 144.21 ? 74 ARG B NE 1 ATOM 3210 C CZ . ARG B 1 82 ? -31.716 -70.700 -24.183 1.00 159.22 ? 74 ARG B CZ 1 ATOM 3211 N NH1 . ARG B 1 82 ? -32.587 -71.360 -23.426 1.00 146.05 ? 74 ARG B NH1 1 ATOM 3212 N NH2 . ARG B 1 82 ? -30.765 -71.374 -24.815 1.00 144.80 ? 74 ARG B NH2 1 ATOM 3213 N N . TYR B 1 83 ? -31.680 -63.187 -21.835 1.00 82.58 ? 75 TYR B N 1 ATOM 3214 C CA . TYR B 1 83 ? -32.529 -62.078 -21.415 1.00 80.04 ? 75 TYR B CA 1 ATOM 3215 C C . TYR B 1 83 ? -33.378 -61.568 -22.556 1.00 86.81 ? 75 TYR B C 1 ATOM 3216 O O . TYR B 1 83 ? -33.146 -61.934 -23.710 1.00 88.09 ? 75 TYR B O 1 ATOM 3217 C CB . TYR B 1 83 ? -31.652 -60.948 -20.889 1.00 77.93 ? 75 TYR B CB 1 ATOM 3218 C CG . TYR B 1 83 ? -30.845 -61.311 -19.670 1.00 76.04 ? 75 TYR B CG 1 ATOM 3219 C CD1 . TYR B 1 83 ? -31.428 -61.347 -18.411 1.00 77.45 ? 75 TYR B CD1 1 ATOM 3220 C CD2 . TYR B 1 83 ? -29.486 -61.574 -19.765 1.00 76.18 ? 75 TYR B CD2 1 ATOM 3221 C CE1 . TYR B 1 83 ? -30.679 -61.637 -17.272 1.00 77.41 ? 75 TYR B CE1 1 ATOM 3222 C CE2 . TYR B 1 83 ? -28.723 -61.868 -18.631 1.00 76.48 ? 75 TYR B CE2 1 ATOM 3223 C CZ . TYR B 1 83 ? -29.324 -61.888 -17.385 1.00 79.52 ? 75 TYR B CZ 1 ATOM 3224 O OH . TYR B 1 83 ? -28.586 -62.167 -16.266 1.00 72.27 ? 75 TYR B OH 1 ATOM 3225 N N . SER B 1 84 ? -34.327 -60.678 -22.242 1.00 83.73 ? 76 SER B N 1 ATOM 3226 C CA . SER B 1 84 ? -35.228 -60.048 -23.204 1.00 83.28 ? 76 SER B CA 1 ATOM 3227 C C . SER B 1 84 ? -34.477 -59.231 -24.241 1.00 86.25 ? 76 SER B C 1 ATOM 3228 O O . SER B 1 84 ? -34.943 -59.107 -25.366 1.00 86.30 ? 76 SER B O 1 ATOM 3229 C CB . SER B 1 84 ? -36.236 -59.160 -22.474 1.00 86.44 ? 76 SER B CB 1 ATOM 3230 O OG . SER B 1 84 ? -37.100 -59.970 -21.694 1.00 98.04 ? 76 SER B OG 1 ATOM 3231 N N . THR B 1 85 ? -33.310 -58.708 -23.882 1.00 81.95 ? 77 THR B N 1 ATOM 3232 C CA . THR B 1 85 ? -32.558 -57.852 -24.784 1.00 81.61 ? 77 THR B CA 1 ATOM 3233 C C . THR B 1 85 ? -31.315 -58.481 -25.379 1.00 86.98 ? 77 THR B C 1 ATOM 3234 O O . THR B 1 85 ? -30.715 -57.899 -26.289 1.00 87.21 ? 77 THR B O 1 ATOM 3235 C CB . THR B 1 85 ? -32.245 -56.531 -24.084 1.00 81.80 ? 77 THR B CB 1 ATOM 3236 O OG1 . THR B 1 85 ? -31.482 -56.824 -22.906 1.00 77.96 ? 77 THR B OG1 1 ATOM 3237 C CG2 . THR B 1 85 ? -33.515 -55.713 -23.791 1.00 76.02 ? 77 THR B CG2 1 ATOM 3238 N N . GLY B 1 86 ? -30.914 -59.632 -24.861 1.00 83.40 ? 78 GLY B N 1 ATOM 3239 C CA . GLY B 1 86 ? -29.702 -60.281 -25.327 1.00 83.72 ? 78 GLY B CA 1 ATOM 3240 C C . GLY B 1 86 ? -29.335 -61.513 -24.546 1.00 90.52 ? 78 GLY B C 1 ATOM 3241 O O . GLY B 1 86 ? -30.086 -61.917 -23.653 1.00 90.67 ? 78 GLY B O 1 ATOM 3242 N N . THR B 1 87 ? -28.173 -62.126 -24.886 1.00 87.55 ? 79 THR B N 1 ATOM 3243 C CA . THR B 1 87 ? -27.728 -63.370 -24.251 1.00 87.05 ? 79 THR B CA 1 ATOM 3244 C C . THR B 1 87 ? -26.288 -63.306 -23.809 1.00 89.93 ? 79 THR B C 1 ATOM 3245 O O . THR B 1 87 ? -25.454 -62.777 -24.527 1.00 90.12 ? 79 THR B O 1 ATOM 3246 C CB . THR B 1 87 ? -27.966 -64.562 -25.207 1.00 94.44 ? 79 THR B CB 1 ATOM 3247 O OG1 . THR B 1 87 ? -29.319 -64.537 -25.698 1.00 98.61 ? 79 THR B OG1 1 ATOM 3248 C CG2 . THR B 1 87 ? -27.671 -65.917 -24.558 1.00 86.42 ? 79 THR B CG2 1 ATOM 3249 N N . VAL B 1 88 ? -25.993 -63.849 -22.632 1.00 85.66 ? 80 VAL B N 1 ATOM 3250 C CA . VAL B 1 88 ? -24.617 -63.971 -22.131 1.00 85.68 ? 80 VAL B CA 1 ATOM 3251 C C . VAL B 1 88 ? -24.344 -65.439 -21.816 1.00 90.53 ? 80 VAL B C 1 ATOM 3252 O O . VAL B 1 88 ? -25.255 -66.162 -21.388 1.00 89.76 ? 80 VAL B O 1 ATOM 3253 C CB . VAL B 1 88 ? -24.231 -63.071 -20.928 1.00 89.13 ? 80 VAL B CB 1 ATOM 3254 C CG1 . VAL B 1 88 ? -24.010 -61.649 -21.350 1.00 88.41 ? 80 VAL B CG1 1 ATOM 3255 C CG2 . VAL B 1 88 ? -25.249 -63.147 -19.805 1.00 89.32 ? 80 VAL B CG2 1 ATOM 3256 N N . SER B 1 89 ? -23.098 -65.878 -22.016 1.00 86.94 ? 81 SER B N 1 ATOM 3257 C CA . SER B 1 89 ? -22.685 -67.245 -21.705 1.00 86.50 ? 81 SER B CA 1 ATOM 3258 C C . SER B 1 89 ? -21.390 -67.178 -20.929 1.00 90.62 ? 81 SER B C 1 ATOM 3259 O O . SER B 1 89 ? -20.597 -66.246 -21.116 1.00 90.44 ? 81 SER B O 1 ATOM 3260 C CB . SER B 1 89 ? -22.518 -68.081 -22.969 1.00 90.25 ? 81 SER B CB 1 ATOM 3261 O OG . SER B 1 89 ? -23.669 -68.008 -23.796 1.00 102.98 ? 81 SER B OG 1 ATOM 3262 N N . GLY B 1 90 ? -21.179 -68.140 -20.051 1.00 86.34 ? 82 GLY B N 1 ATOM 3263 C CA . GLY B 1 90 ? -19.961 -68.173 -19.263 1.00 85.91 ? 82 GLY B CA 1 ATOM 3264 C C . GLY B 1 90 ? -19.920 -69.344 -18.334 1.00 91.33 ? 82 GLY B C 1 ATOM 3265 O O . GLY B 1 90 ? -20.508 -70.386 -18.621 1.00 92.08 ? 82 GLY B O 1 ATOM 3266 N N . PHE B 1 91 ? -19.218 -69.183 -17.228 1.00 87.64 ? 83 PHE B N 1 ATOM 3267 C CA . PHE B 1 91 ? -19.094 -70.262 -16.261 1.00 87.31 ? 83 PHE B CA 1 ATOM 3268 C C . PHE B 1 91 ? -19.217 -69.777 -14.823 1.00 89.26 ? 83 PHE B C 1 ATOM 3269 O O . PHE B 1 91 ? -18.884 -68.625 -14.522 1.00 86.84 ? 83 PHE B O 1 ATOM 3270 C CB . PHE B 1 91 ? -17.776 -71.037 -16.468 1.00 88.83 ? 83 PHE B CB 1 ATOM 3271 C CG . PHE B 1 91 ? -16.534 -70.193 -16.272 1.00 89.31 ? 83 PHE B CG 1 ATOM 3272 C CD1 . PHE B 1 91 ? -15.945 -70.068 -15.015 1.00 91.26 ? 83 PHE B CD1 1 ATOM 3273 C CD2 . PHE B 1 91 ? -15.972 -69.499 -17.336 1.00 90.42 ? 83 PHE B CD2 1 ATOM 3274 C CE1 . PHE B 1 91 ? -14.818 -69.258 -14.829 1.00 91.59 ? 83 PHE B CE1 1 ATOM 3275 C CE2 . PHE B 1 91 ? -14.844 -68.690 -17.150 1.00 92.68 ? 83 PHE B CE2 1 ATOM 3276 C CZ . PHE B 1 91 ? -14.269 -68.579 -15.900 1.00 90.25 ? 83 PHE B CZ 1 ATOM 3277 N N . LEU B 1 92 ? -19.651 -70.683 -13.937 1.00 85.63 ? 84 LEU B N 1 ATOM 3278 C CA . LEU B 1 92 ? -19.840 -70.392 -12.526 1.00 86.14 ? 84 LEU B CA 1 ATOM 3279 C C . LEU B 1 92 ? -18.542 -70.331 -11.731 1.00 92.61 ? 84 LEU B C 1 ATOM 3280 O O . LEU B 1 92 ? -17.620 -71.094 -11.982 1.00 93.50 ? 84 LEU B O 1 ATOM 3281 C CB . LEU B 1 92 ? -20.785 -71.418 -11.892 1.00 86.45 ? 84 LEU B CB 1 ATOM 3282 C CG . LEU B 1 92 ? -22.282 -71.331 -12.218 1.00 91.60 ? 84 LEU B CG 1 ATOM 3283 C CD1 . LEU B 1 92 ? -23.013 -72.508 -11.605 1.00 91.37 ? 84 LEU B CD1 1 ATOM 3284 C CD2 . LEU B 1 92 ? -22.891 -70.019 -11.716 1.00 94.42 ? 84 LEU B CD2 1 ATOM 3285 N N . SER B 1 93 ? -18.484 -69.421 -10.765 1.00 90.98 ? 85 SER B N 1 ATOM 3286 C CA . SER B 1 93 ? -17.363 -69.257 -9.844 1.00 91.46 ? 85 SER B CA 1 ATOM 3287 C C . SER B 1 93 ? -17.905 -68.860 -8.472 1.00 95.59 ? 85 SER B C 1 ATOM 3288 O O . SER B 1 93 ? -19.045 -68.396 -8.357 1.00 95.20 ? 85 SER B O 1 ATOM 3289 C CB . SER B 1 93 ? -16.393 -68.187 -10.338 1.00 95.33 ? 85 SER B CB 1 ATOM 3290 O OG . SER B 1 93 ? -15.862 -68.505 -11.610 1.00 107.84 ? 85 SER B OG 1 ATOM 3291 N N . GLN B 1 94 ? -17.087 -69.021 -7.439 1.00 91.40 ? 86 GLN B N 1 ATOM 3292 C CA . GLN B 1 94 ? -17.481 -68.620 -6.100 1.00 91.11 ? 86 GLN B CA 1 ATOM 3293 C C . GLN B 1 94 ? -16.466 -67.666 -5.515 1.00 93.54 ? 86 GLN B C 1 ATOM 3294 O O . GLN B 1 94 ? -15.267 -67.865 -5.657 1.00 93.16 ? 86 GLN B O 1 ATOM 3295 C CB . GLN B 1 94 ? -17.682 -69.842 -5.192 1.00 92.69 ? 86 GLN B CB 1 ATOM 3296 C CG . GLN B 1 94 ? -18.313 -69.498 -3.856 1.00 108.87 ? 86 GLN B CG 1 ATOM 3297 C CD . GLN B 1 94 ? -18.298 -70.659 -2.928 1.00 126.12 ? 86 GLN B CD 1 ATOM 3298 O OE1 . GLN B 1 94 ? -19.206 -71.501 -2.960 1.00 123.29 ? 86 GLN B OE1 1 ATOM 3299 N NE2 . GLN B 1 94 ? -17.270 -70.702 -2.075 1.00 109.41 ? 86 GLN B NE2 1 ATOM 3300 N N . ASP B 1 95 ? -16.950 -66.614 -4.875 1.00 90.23 ? 87 ASP B N 1 ATOM 3301 C CA . ASP B 1 95 ? -16.101 -65.637 -4.210 1.00 89.63 ? 87 ASP B CA 1 ATOM 3302 C C . ASP B 1 95 ? -16.920 -64.782 -3.255 1.00 90.78 ? 87 ASP B C 1 ATOM 3303 O O . ASP B 1 95 ? -18.145 -64.901 -3.196 1.00 88.84 ? 87 ASP B O 1 ATOM 3304 C CB . ASP B 1 95 ? -15.337 -64.752 -5.220 1.00 91.53 ? 87 ASP B CB 1 ATOM 3305 C CG . ASP B 1 95 ? -13.941 -64.358 -4.769 1.00 98.51 ? 87 ASP B CG 1 ATOM 3306 O OD1 . ASP B 1 95 ? -13.746 -64.128 -3.553 1.00 95.47 ? 87 ASP B OD1 1 ATOM 3307 O OD2 . ASP B 1 95 ? -13.053 -64.242 -5.635 1.00 109.96 ? 87 ASP B OD2 1 ATOM 3308 N N . ILE B 1 96 ? -16.234 -63.952 -2.482 1.00 87.06 ? 88 ILE B N 1 ATOM 3309 C CA . ILE B 1 96 ? -16.879 -63.047 -1.559 1.00 87.76 ? 88 ILE B CA 1 ATOM 3310 C C . ILE B 1 96 ? -17.310 -61.788 -2.327 1.00 94.13 ? 88 ILE B C 1 ATOM 3311 O O . ILE B 1 96 ? -16.496 -61.178 -3.048 1.00 95.25 ? 88 ILE B O 1 ATOM 3312 C CB . ILE B 1 96 ? -15.953 -62.701 -0.377 1.00 91.36 ? 88 ILE B CB 1 ATOM 3313 C CG1 . ILE B 1 96 ? -15.482 -63.973 0.349 1.00 92.22 ? 88 ILE B CG1 1 ATOM 3314 C CG2 . ILE B 1 96 ? -16.659 -61.759 0.595 1.00 92.49 ? 88 ILE B CG2 1 ATOM 3315 C CD1 . ILE B 1 96 ? -14.314 -63.748 1.322 1.00 101.03 ? 88 ILE B CD1 1 ATOM 3316 N N . ILE B 1 97 ? -18.597 -61.399 -2.161 1.00 88.78 ? 89 ILE B N 1 ATOM 3317 C CA . ILE B 1 97 ? -19.140 -60.191 -2.777 1.00 86.84 ? 89 ILE B CA 1 ATOM 3318 C C . ILE B 1 97 ? -19.479 -59.159 -1.698 1.00 90.51 ? 89 ILE B C 1 ATOM 3319 O O . ILE B 1 97 ? -20.146 -59.487 -0.719 1.00 90.23 ? 89 ILE B O 1 ATOM 3320 C CB . ILE B 1 97 ? -20.320 -60.499 -3.724 1.00 88.83 ? 89 ILE B CB 1 ATOM 3321 C CG1 . ILE B 1 97 ? -19.880 -61.463 -4.856 1.00 88.25 ? 89 ILE B CG1 1 ATOM 3322 C CG2 . ILE B 1 97 ? -20.944 -59.199 -4.266 1.00 88.75 ? 89 ILE B CG2 1 ATOM 3323 C CD1 . ILE B 1 97 ? -20.907 -61.752 -5.924 1.00 90.16 ? 89 ILE B CD1 1 ATOM 3324 N N . THR B 1 98 ? -19.009 -57.922 -1.875 1.00 87.63 ? 90 THR B N 1 ATOM 3325 C CA . THR B 1 98 ? -19.301 -56.822 -0.956 1.00 87.54 ? 90 THR B CA 1 ATOM 3326 C C . THR B 1 98 ? -20.386 -55.951 -1.577 1.00 90.15 ? 90 THR B C 1 ATOM 3327 O O . THR B 1 98 ? -20.212 -55.428 -2.680 1.00 89.14 ? 90 THR B O 1 ATOM 3328 C CB . THR B 1 98 ? -18.067 -55.949 -0.630 1.00 91.35 ? 90 THR B CB 1 ATOM 3329 O OG1 . THR B 1 98 ? -16.915 -56.760 -0.444 1.00 92.75 ? 90 THR B OG1 1 ATOM 3330 C CG2 . THR B 1 98 ? -18.300 -55.063 0.589 1.00 84.15 ? 90 THR B CG2 1 ATOM 3331 N N . VAL B 1 99 ? -21.496 -55.791 -0.856 1.00 86.17 ? 91 VAL B N 1 ATOM 3332 C CA . VAL B 1 99 ? -22.643 -54.990 -1.273 1.00 85.25 ? 91 VAL B CA 1 ATOM 3333 C C . VAL B 1 99 ? -22.950 -54.021 -0.123 1.00 90.26 ? 91 VAL B C 1 ATOM 3334 O O . VAL B 1 99 ? -23.493 -54.448 0.897 1.00 89.32 ? 91 VAL B O 1 ATOM 3335 C CB . VAL B 1 99 ? -23.890 -55.866 -1.621 1.00 87.34 ? 91 VAL B CB 1 ATOM 3336 C CG1 . VAL B 1 99 ? -24.907 -55.059 -2.396 1.00 86.79 ? 91 VAL B CG1 1 ATOM 3337 C CG2 . VAL B 1 99 ? -23.530 -57.117 -2.404 1.00 86.79 ? 91 VAL B CG2 1 ATOM 3338 N N . GLY B 1 100 ? -22.581 -52.746 -0.302 1.00 88.23 ? 92 GLY B N 1 ATOM 3339 C CA . GLY B 1 100 ? -22.736 -51.680 0.688 1.00 88.63 ? 92 GLY B CA 1 ATOM 3340 C C . GLY B 1 100 ? -22.415 -52.063 2.135 1.00 94.82 ? 92 GLY B C 1 ATOM 3341 O O . GLY B 1 100 ? -23.242 -51.909 3.030 1.00 95.09 ? 92 GLY B O 1 ATOM 3342 N N . GLY B 1 101 ? -21.234 -52.569 2.406 1.00 92.54 ? 93 GLY B N 1 ATOM 3343 C CA . GLY B 1 101 ? -20.939 -52.933 3.791 1.00 92.72 ? 93 GLY B CA 1 ATOM 3344 C C . GLY B 1 101 ? -21.321 -54.351 4.209 1.00 96.86 ? 93 GLY B C 1 ATOM 3345 O O . GLY B 1 101 ? -20.889 -54.811 5.271 1.00 96.93 ? 93 GLY B O 1 ATOM 3346 N N . ILE B 1 102 ? -22.135 -55.053 3.405 1.00 92.46 ? 94 ILE B N 1 ATOM 3347 C CA . ILE B 1 102 ? -22.464 -56.461 3.646 1.00 92.42 ? 94 ILE B CA 1 ATOM 3348 C C . ILE B 1 102 ? -21.534 -57.301 2.794 1.00 95.99 ? 94 ILE B C 1 ATOM 3349 O O . ILE B 1 102 ? -21.376 -57.031 1.610 1.00 95.81 ? 94 ILE B O 1 ATOM 3350 C CB . ILE B 1 102 ? -23.949 -56.793 3.328 1.00 96.26 ? 94 ILE B CB 1 ATOM 3351 C CG1 . ILE B 1 102 ? -24.872 -56.195 4.380 1.00 97.58 ? 94 ILE B CG1 1 ATOM 3352 C CG2 . ILE B 1 102 ? -24.203 -58.326 3.140 1.00 95.74 ? 94 ILE B CG2 1 ATOM 3353 C CD1 . ILE B 1 102 ? -26.300 -56.455 4.078 1.00 106.54 ? 94 ILE B CD1 1 ATOM 3354 N N . THR B 1 103 ? -20.953 -58.336 3.387 1.00 92.91 ? 95 THR B N 1 ATOM 3355 C CA . THR B 1 103 ? -20.031 -59.249 2.712 1.00 92.37 ? 95 THR B CA 1 ATOM 3356 C C . THR B 1 103 ? -20.658 -60.642 2.686 1.00 93.39 ? 95 THR B C 1 ATOM 3357 O O . THR B 1 103 ? -21.080 -61.131 3.729 1.00 93.04 ? 95 THR B O 1 ATOM 3358 C CB . THR B 1 103 ? -18.638 -59.145 3.372 1.00 104.10 ? 95 THR B CB 1 ATOM 3359 O OG1 . THR B 1 103 ? -17.624 -59.402 2.405 1.00 103.98 ? 95 THR B OG1 1 ATOM 3360 C CG2 . THR B 1 103 ? -18.471 -60.013 4.616 1.00 104.10 ? 95 THR B CG2 1 ATOM 3361 N N . VAL B 1 104 ? -20.741 -61.273 1.512 1.00 88.28 ? 96 VAL B N 1 ATOM 3362 C CA . VAL B 1 104 ? -21.424 -62.567 1.351 1.00 87.43 ? 96 VAL B CA 1 ATOM 3363 C C . VAL B 1 104 ? -20.729 -63.506 0.355 1.00 90.82 ? 96 VAL B C 1 ATOM 3364 O O . VAL B 1 104 ? -20.351 -63.074 -0.731 1.00 90.53 ? 96 VAL B O 1 ATOM 3365 C CB . VAL B 1 104 ? -22.953 -62.355 1.010 1.00 90.78 ? 96 VAL B CB 1 ATOM 3366 C CG1 . VAL B 1 104 ? -23.162 -61.517 -0.254 1.00 90.44 ? 96 VAL B CG1 1 ATOM 3367 C CG2 . VAL B 1 104 ? -23.709 -63.671 0.892 1.00 90.16 ? 96 VAL B CG2 1 ATOM 3368 N N . THR B 1 105 ? -20.625 -64.795 0.696 1.00 87.83 ? 97 THR B N 1 ATOM 3369 C CA . THR B 1 105 ? -20.060 -65.799 -0.207 1.00 88.25 ? 97 THR B CA 1 ATOM 3370 C C . THR B 1 105 ? -21.140 -66.104 -1.239 1.00 92.39 ? 97 THR B C 1 ATOM 3371 O O . THR B 1 105 ? -22.261 -66.489 -0.878 1.00 91.87 ? 97 THR B O 1 ATOM 3372 C CB . THR B 1 105 ? -19.580 -67.055 0.550 1.00 97.69 ? 97 THR B CB 1 ATOM 3373 O OG1 . THR B 1 105 ? -18.577 -66.677 1.502 1.00 92.13 ? 97 THR B OG1 1 ATOM 3374 C CG2 . THR B 1 105 ? -19.041 -68.123 -0.395 1.00 96.55 ? 97 THR B CG2 1 ATOM 3375 N N . GLN B 1 106 ? -20.799 -65.917 -2.517 1.00 89.36 ? 99 GLN B N 1 ATOM 3376 C CA . GLN B 1 106 ? -21.768 -66.038 -3.589 1.00 89.42 ? 99 GLN B CA 1 ATOM 3377 C C . GLN B 1 106 ? -21.269 -66.779 -4.812 1.00 97.19 ? 99 GLN B C 1 ATOM 3378 O O . GLN B 1 106 ? -20.131 -66.583 -5.233 1.00 97.47 ? 99 GLN B O 1 ATOM 3379 C CB . GLN B 1 106 ? -22.212 -64.598 -3.982 1.00 89.88 ? 99 GLN B CB 1 ATOM 3380 C CG . GLN B 1 106 ? -23.307 -64.489 -5.039 1.00 83.63 ? 99 GLN B CG 1 ATOM 3381 C CD . GLN B 1 106 ? -24.621 -65.162 -4.659 1.00 92.48 ? 99 GLN B CD 1 ATOM 3382 O OE1 . GLN B 1 106 ? -25.296 -65.788 -5.497 1.00 83.21 ? 99 GLN B OE1 1 ATOM 3383 N NE2 . GLN B 1 106 ? -25.001 -65.065 -3.387 1.00 68.52 ? 99 GLN B NE2 1 ATOM 3384 N N . MET B 1 107 ? -22.144 -67.600 -5.401 1.00 97.03 ? 100 MET B N 1 ATOM 3385 C CA . MET B 1 107 ? -21.905 -68.243 -6.679 1.00 99.01 ? 100 MET B CA 1 ATOM 3386 C C . MET B 1 107 ? -22.376 -67.271 -7.758 1.00 103.04 ? 100 MET B C 1 ATOM 3387 O O . MET B 1 107 ? -23.516 -66.784 -7.709 1.00 104.21 ? 100 MET B O 1 ATOM 3388 C CB . MET B 1 107 ? -22.651 -69.572 -6.786 1.00 102.79 ? 100 MET B CB 1 ATOM 3389 C CG . MET B 1 107 ? -21.826 -70.725 -6.290 1.00 109.16 ? 100 MET B CG 1 ATOM 3390 S SD . MET B 1 107 ? -20.722 -71.402 -7.569 1.00 116.03 ? 100 MET B SD 1 ATOM 3391 C CE . MET B 1 107 ? -19.967 -72.727 -6.645 1.00 113.13 ? 100 MET B CE 1 ATOM 3392 N N . PHE B 1 108 ? -21.492 -66.956 -8.704 1.00 97.41 ? 101 PHE B N 1 ATOM 3393 C CA . PHE B 1 108 ? -21.806 -66.024 -9.771 1.00 96.61 ? 101 PHE B CA 1 ATOM 3394 C C . PHE B 1 108 ? -21.246 -66.475 -11.105 1.00 99.19 ? 101 PHE B C 1 ATOM 3395 O O . PHE B 1 108 ? -20.357 -67.310 -11.151 1.00 98.41 ? 101 PHE B O 1 ATOM 3396 C CB . PHE B 1 108 ? -21.295 -64.618 -9.409 1.00 98.44 ? 101 PHE B CB 1 ATOM 3397 C CG . PHE B 1 108 ? -19.792 -64.494 -9.333 1.00 100.02 ? 101 PHE B CG 1 ATOM 3398 C CD1 . PHE B 1 108 ? -19.107 -64.838 -8.171 1.00 102.68 ? 101 PHE B CD1 1 ATOM 3399 C CD2 . PHE B 1 108 ? -19.058 -64.036 -10.424 1.00 102.50 ? 101 PHE B CD2 1 ATOM 3400 C CE1 . PHE B 1 108 ? -17.714 -64.742 -8.107 1.00 103.24 ? 101 PHE B CE1 1 ATOM 3401 C CE2 . PHE B 1 108 ? -17.665 -63.939 -10.359 1.00 104.91 ? 101 PHE B CE2 1 ATOM 3402 C CZ . PHE B 1 108 ? -17.002 -64.293 -9.201 1.00 102.45 ? 101 PHE B CZ 1 ATOM 3403 N N . GLY B 1 109 ? -21.754 -65.901 -12.180 1.00 95.66 ? 102 GLY B N 1 ATOM 3404 C CA . GLY B 1 109 ? -21.281 -66.189 -13.518 1.00 95.23 ? 102 GLY B CA 1 ATOM 3405 C C . GLY B 1 109 ? -20.123 -65.303 -13.927 1.00 99.09 ? 102 GLY B C 1 ATOM 3406 O O . GLY B 1 109 ? -20.131 -64.095 -13.684 1.00 97.02 ? 102 GLY B O 1 ATOM 3407 N N . GLU B 1 110 ? -19.098 -65.919 -14.526 1.00 97.42 ? 103 GLU B N 1 ATOM 3408 C CA . GLU B 1 110 ? -17.968 -65.234 -15.157 1.00 96.68 ? 103 GLU B CA 1 ATOM 3409 C C . GLU B 1 110 ? -18.292 -65.309 -16.655 1.00 100.25 ? 103 GLU B C 1 ATOM 3410 O O . GLU B 1 110 ? -18.310 -66.396 -17.242 1.00 98.79 ? 103 GLU B O 1 ATOM 3411 C CB . GLU B 1 110 ? -16.641 -65.925 -14.852 1.00 97.63 ? 103 GLU B CB 1 ATOM 3412 C CG . GLU B 1 110 ? -15.962 -65.446 -13.582 1.00 103.63 ? 103 GLU B CG 1 ATOM 3413 C CD . GLU B 1 110 ? -14.501 -65.843 -13.474 1.00 108.87 ? 103 GLU B CD 1 ATOM 3414 O OE1 . GLU B 1 110 ? -13.675 -65.360 -14.286 1.00 119.39 ? 103 GLU B OE1 1 ATOM 3415 O OE2 . GLU B 1 110 ? -14.183 -66.629 -12.555 1.00 77.66 ? 103 GLU B OE2 1 ATOM 3416 N N . VAL B 1 111 ? -18.633 -64.166 -17.245 1.00 97.88 ? 104 VAL B N 1 ATOM 3417 C CA . VAL B 1 111 ? -19.076 -64.098 -18.633 1.00 97.92 ? 104 VAL B CA 1 ATOM 3418 C C . VAL B 1 111 ? -17.922 -64.027 -19.610 1.00 102.51 ? 104 VAL B C 1 ATOM 3419 O O . VAL B 1 111 ? -17.077 -63.138 -19.523 1.00 100.66 ? 104 VAL B O 1 ATOM 3420 C CB . VAL B 1 111 ? -20.173 -63.015 -18.835 1.00 101.56 ? 104 VAL B CB 1 ATOM 3421 C CG1 . VAL B 1 111 ? -20.403 -62.703 -20.306 1.00 101.41 ? 104 VAL B CG1 1 ATOM 3422 C CG2 . VAL B 1 111 ? -21.481 -63.462 -18.198 1.00 101.34 ? 104 VAL B CG2 1 ATOM 3423 N N . THR B 1 112 ? -17.894 -64.984 -20.544 1.00 101.21 ? 105 THR B N 1 ATOM 3424 C CA . THR B 1 112 ? -16.845 -65.089 -21.561 1.00 101.20 ? 105 THR B CA 1 ATOM 3425 C C . THR B 1 112 ? -17.368 -64.731 -22.946 1.00 105.36 ? 105 THR B C 1 ATOM 3426 O O . THR B 1 112 ? -16.581 -64.572 -23.870 1.00 105.26 ? 105 THR B O 1 ATOM 3427 C CB . THR B 1 112 ? -16.199 -66.488 -21.529 1.00 104.51 ? 105 THR B CB 1 ATOM 3428 O OG1 . THR B 1 112 ? -17.217 -67.472 -21.758 1.00 99.80 ? 105 THR B OG1 1 ATOM 3429 C CG2 . THR B 1 112 ? -15.452 -66.762 -20.210 1.00 99.36 ? 105 THR B CG2 1 ATOM 3430 N N . GLU B 1 113 ? -18.691 -64.628 -23.097 1.00 101.93 ? 106 GLU B N 1 ATOM 3431 C CA . GLU B 1 113 ? -19.346 -64.301 -24.369 1.00 101.91 ? 106 GLU B CA 1 ATOM 3432 C C . GLU B 1 113 ? -20.354 -63.179 -24.127 1.00 103.66 ? 106 GLU B C 1 ATOM 3433 O O . GLU B 1 113 ? -21.373 -63.380 -23.473 1.00 102.71 ? 106 GLU B O 1 ATOM 3434 C CB . GLU B 1 113 ? -19.996 -65.546 -24.993 1.00 103.71 ? 106 GLU B CB 1 ATOM 3435 C CG . GLU B 1 113 ? -19.016 -66.685 -25.206 1.00 119.49 ? 106 GLU B CG 1 ATOM 3436 C CD . GLU B 1 113 ? -19.542 -67.942 -25.861 1.00 151.02 ? 106 GLU B CD 1 ATOM 3437 O OE1 . GLU B 1 113 ? -20.756 -68.221 -25.757 1.00 146.13 ? 106 GLU B OE1 1 ATOM 3438 O OE2 . GLU B 1 113 ? -18.731 -68.629 -26.525 1.00 152.22 ? 106 GLU B OE2 1 ATOM 3439 N N . MET B 1 114 ? -20.041 -61.993 -24.636 1.00 99.26 ? 107 MET B N 1 ATOM 3440 C CA . MET B 1 114 ? -20.772 -60.765 -24.384 1.00 98.47 ? 107 MET B CA 1 ATOM 3441 C C . MET B 1 114 ? -21.017 -59.971 -25.682 1.00 101.22 ? 107 MET B C 1 ATOM 3442 O O . MET B 1 114 ? -20.148 -59.194 -26.119 1.00 101.27 ? 107 MET B O 1 ATOM 3443 C CB . MET B 1 114 ? -19.937 -59.953 -23.387 1.00 100.83 ? 107 MET B CB 1 ATOM 3444 C CG . MET B 1 114 ? -20.737 -59.025 -22.524 1.00 104.07 ? 107 MET B CG 1 ATOM 3445 S SD . MET B 1 114 ? -19.668 -58.271 -21.283 1.00 107.33 ? 107 MET B SD 1 ATOM 3446 C CE . MET B 1 114 ? -20.790 -57.203 -20.561 1.00 104.51 ? 107 MET B CE 1 ATOM 3447 N N . PRO B 1 115 ? -22.213 -60.164 -26.290 1.00 96.50 ? 108 PRO B N 1 ATOM 3448 C CA . PRO B 1 115 ? -22.527 -59.512 -27.570 1.00 96.69 ? 108 PRO B CA 1 ATOM 3449 C C . PRO B 1 115 ? -22.599 -58.001 -27.523 1.00 102.85 ? 108 PRO B C 1 ATOM 3450 O O . PRO B 1 115 ? -23.068 -57.435 -26.535 1.00 103.86 ? 108 PRO B O 1 ATOM 3451 C CB . PRO B 1 115 ? -23.892 -60.097 -27.936 1.00 98.04 ? 108 PRO B CB 1 ATOM 3452 C CG . PRO B 1 115 ? -24.030 -61.309 -27.121 1.00 101.91 ? 108 PRO B CG 1 ATOM 3453 C CD . PRO B 1 115 ? -23.321 -61.030 -25.860 1.00 97.25 ? 108 PRO B CD 1 ATOM 3454 N N . ALA B 1 116 ? -22.144 -57.345 -28.606 1.00 99.13 ? 109 ALA B N 1 ATOM 3455 C CA . ALA B 1 116 ? -22.155 -55.879 -28.739 1.00 98.12 ? 109 ALA B CA 1 ATOM 3456 C C . ALA B 1 116 ? -23.562 -55.332 -28.539 1.00 101.15 ? 109 ALA B C 1 ATOM 3457 O O . ALA B 1 116 ? -23.720 -54.283 -27.917 1.00 101.73 ? 109 ALA B O 1 ATOM 3458 C CB . ALA B 1 116 ? -21.597 -55.448 -30.086 1.00 98.51 ? 109 ALA B CB 1 ATOM 3459 N N . LEU B 1 117 ? -24.579 -56.052 -29.032 1.00 95.95 ? 110 LEU B N 1 ATOM 3460 C CA . LEU B 1 117 ? -25.967 -55.716 -28.784 1.00 95.48 ? 110 LEU B CA 1 ATOM 3461 C C . LEU B 1 117 ? -26.464 -56.708 -27.739 1.00 97.68 ? 110 LEU B C 1 ATOM 3462 O O . LEU B 1 117 ? -26.461 -57.919 -27.987 1.00 98.33 ? 110 LEU B O 1 ATOM 3463 C CB . LEU B 1 117 ? -26.828 -55.819 -30.042 1.00 96.02 ? 110 LEU B CB 1 ATOM 3464 C CG . LEU B 1 117 ? -26.890 -54.590 -30.927 1.00 102.36 ? 110 LEU B CG 1 ATOM 3465 C CD1 . LEU B 1 117 ? -27.526 -54.929 -32.265 1.00 103.45 ? 110 LEU B CD1 1 ATOM 3466 C CD2 . LEU B 1 117 ? -27.707 -53.484 -30.267 1.00 105.99 ? 110 LEU B CD2 1 ATOM 3467 N N . PRO B 1 118 ? -26.852 -56.247 -26.534 1.00 90.82 ? 111 PRO B N 1 ATOM 3468 C CA . PRO B 1 118 ? -26.960 -54.858 -26.070 1.00 89.14 ? 111 PRO B CA 1 ATOM 3469 C C . PRO B 1 118 ? -25.791 -54.340 -25.225 1.00 90.55 ? 111 PRO B C 1 ATOM 3470 O O . PRO B 1 118 ? -25.817 -53.187 -24.800 1.00 89.66 ? 111 PRO B O 1 ATOM 3471 C CB . PRO B 1 118 ? -28.203 -54.928 -25.188 1.00 90.49 ? 111 PRO B CB 1 ATOM 3472 C CG . PRO B 1 118 ? -28.115 -56.285 -24.550 1.00 95.15 ? 111 PRO B CG 1 ATOM 3473 C CD . PRO B 1 118 ? -27.365 -57.177 -25.513 1.00 91.25 ? 111 PRO B CD 1 ATOM 3474 N N . PHE B 1 119 ? -24.791 -55.178 -24.942 1.00 84.81 ? 112 PHE B N 1 ATOM 3475 C CA . PHE B 1 119 ? -23.747 -54.862 -23.975 1.00 83.12 ? 112 PHE B CA 1 ATOM 3476 C C . PHE B 1 119 ? -22.808 -53.709 -24.258 1.00 86.57 ? 112 PHE B C 1 ATOM 3477 O O . PHE B 1 119 ? -22.248 -53.161 -23.318 1.00 85.70 ? 112 PHE B O 1 ATOM 3478 C CB . PHE B 1 119 ? -23.077 -56.122 -23.411 1.00 84.09 ? 112 PHE B CB 1 ATOM 3479 C CG . PHE B 1 119 ? -24.095 -57.090 -22.840 1.00 85.17 ? 112 PHE B CG 1 ATOM 3480 C CD1 . PHE B 1 119 ? -24.712 -56.839 -21.622 1.00 87.40 ? 112 PHE B CD1 1 ATOM 3481 C CD2 . PHE B 1 119 ? -24.482 -58.220 -23.551 1.00 87.87 ? 112 PHE B CD2 1 ATOM 3482 C CE1 . PHE B 1 119 ? -25.687 -57.712 -21.118 1.00 87.46 ? 112 PHE B CE1 1 ATOM 3483 C CE2 . PHE B 1 119 ? -25.469 -59.086 -23.051 1.00 90.33 ? 112 PHE B CE2 1 ATOM 3484 C CZ . PHE B 1 119 ? -26.070 -58.818 -21.845 1.00 87.18 ? 112 PHE B CZ 1 ATOM 3485 N N . MET B 1 120 ? -22.713 -53.262 -25.512 1.00 84.03 ? 113 MET B N 1 ATOM 3486 C CA . MET B 1 120 ? -21.936 -52.068 -25.839 1.00 84.60 ? 113 MET B CA 1 ATOM 3487 C C . MET B 1 120 ? -22.734 -50.799 -25.509 1.00 89.70 ? 113 MET B C 1 ATOM 3488 O O . MET B 1 120 ? -22.171 -49.696 -25.480 1.00 88.63 ? 113 MET B O 1 ATOM 3489 C CB . MET B 1 120 ? -21.486 -52.069 -27.300 1.00 86.64 ? 113 MET B CB 1 ATOM 3490 C CG . MET B 1 120 ? -20.177 -52.806 -27.512 1.00 90.09 ? 113 MET B CG 1 ATOM 3491 S SD . MET B 1 120 ? -18.760 -52.166 -26.527 1.00 94.61 ? 113 MET B SD 1 ATOM 3492 C CE . MET B 1 120 ? -18.520 -50.535 -27.269 1.00 91.28 ? 113 MET B CE 1 ATOM 3493 N N . LEU B 1 121 ? -24.040 -50.974 -25.222 1.00 86.45 ? 114 LEU B N 1 ATOM 3494 C CA . LEU B 1 121 ? -24.927 -49.886 -24.814 1.00 84.82 ? 114 LEU B CA 1 ATOM 3495 C C . LEU B 1 121 ? -24.948 -49.784 -23.280 1.00 85.91 ? 114 LEU B C 1 ATOM 3496 O O . LEU B 1 121 ? -25.455 -48.810 -22.754 1.00 86.05 ? 114 LEU B O 1 ATOM 3497 C CB . LEU B 1 121 ? -26.355 -50.130 -25.328 1.00 84.38 ? 114 LEU B CB 1 ATOM 3498 C CG . LEU B 1 121 ? -26.542 -50.324 -26.830 1.00 88.71 ? 114 LEU B CG 1 ATOM 3499 C CD1 . LEU B 1 121 ? -27.790 -51.126 -27.135 1.00 88.09 ? 114 LEU B CD1 1 ATOM 3500 C CD2 . LEU B 1 121 ? -26.707 -49.054 -27.491 1.00 91.74 ? 114 LEU B CD2 1 ATOM 3501 N N . ALA B 1 122 ? -24.431 -50.801 -22.579 1.00 79.20 ? 115 ALA B N 1 ATOM 3502 C CA . ALA B 1 122 ? -24.439 -50.869 -21.138 1.00 77.76 ? 115 ALA B CA 1 ATOM 3503 C C . ALA B 1 122 ? -23.303 -50.105 -20.503 1.00 81.50 ? 115 ALA B C 1 ATOM 3504 O O . ALA B 1 122 ? -22.147 -50.366 -20.791 1.00 81.83 ? 115 ALA B O 1 ATOM 3505 C CB . ALA B 1 122 ? -24.399 -52.320 -20.691 1.00 78.15 ? 115 ALA B CB 1 ATOM 3506 N N . GLU B 1 123 ? -23.634 -49.190 -19.594 1.00 76.81 ? 116 GLU B N 1 ATOM 3507 C CA . GLU B 1 123 ? -22.661 -48.448 -18.802 1.00 75.18 ? 116 GLU B CA 1 ATOM 3508 C C . GLU B 1 123 ? -22.207 -49.307 -17.617 1.00 77.92 ? 116 GLU B C 1 ATOM 3509 O O . GLU B 1 123 ? -21.153 -49.065 -17.020 1.00 79.05 ? 116 GLU B O 1 ATOM 3510 C CB . GLU B 1 123 ? -23.258 -47.126 -18.308 1.00 76.29 ? 116 GLU B CB 1 ATOM 3511 C CG . GLU B 1 123 ? -23.275 -46.047 -19.368 1.00 86.49 ? 116 GLU B CG 1 ATOM 3512 C CD . GLU B 1 123 ? -21.887 -45.617 -19.797 1.00 101.86 ? 116 GLU B CD 1 ATOM 3513 O OE1 . GLU B 1 123 ? -20.962 -45.597 -18.939 1.00 88.06 ? 116 GLU B OE1 1 ATOM 3514 O OE2 . GLU B 1 123 ? -21.723 -45.331 -21.008 1.00 87.43 ? 116 GLU B OE2 1 ATOM 3515 N N . PHE B 1 124 ? -23.015 -50.297 -17.273 1.00 71.81 ? 117 PHE B N 1 ATOM 3516 C CA . PHE B 1 124 ? -22.721 -51.221 -16.202 1.00 70.06 ? 117 PHE B CA 1 ATOM 3517 C C . PHE B 1 124 ? -21.953 -52.402 -16.758 1.00 73.76 ? 117 PHE B C 1 ATOM 3518 O O . PHE B 1 124 ? -22.023 -52.692 -17.965 1.00 71.97 ? 117 PHE B O 1 ATOM 3519 C CB . PHE B 1 124 ? -24.028 -51.692 -15.537 1.00 70.45 ? 117 PHE B CB 1 ATOM 3520 C CG . PHE B 1 124 ? -25.050 -52.262 -16.495 1.00 69.69 ? 117 PHE B CG 1 ATOM 3521 C CD1 . PHE B 1 124 ? -25.960 -51.431 -17.144 1.00 71.61 ? 117 PHE B CD1 1 ATOM 3522 C CD2 . PHE B 1 124 ? -25.104 -53.630 -16.749 1.00 69.20 ? 117 PHE B CD2 1 ATOM 3523 C CE1 . PHE B 1 124 ? -26.923 -51.959 -18.014 1.00 72.00 ? 117 PHE B CE1 1 ATOM 3524 C CE2 . PHE B 1 124 ? -26.055 -54.160 -17.628 1.00 70.93 ? 117 PHE B CE2 1 ATOM 3525 C CZ . PHE B 1 124 ? -26.959 -53.324 -18.255 1.00 69.66 ? 117 PHE B CZ 1 ATOM 3526 N N . ASP B 1 125 ? -21.261 -53.118 -15.866 1.00 71.78 ? 118 ASP B N 1 ATOM 3527 C CA . ASP B 1 125 ? -20.477 -54.302 -16.225 1.00 71.67 ? 118 ASP B CA 1 ATOM 3528 C C . ASP B 1 125 ? -21.303 -55.562 -16.130 1.00 75.97 ? 118 ASP B C 1 ATOM 3529 O O . ASP B 1 125 ? -21.247 -56.407 -17.019 1.00 75.40 ? 118 ASP B O 1 ATOM 3530 C CB . ASP B 1 125 ? -19.237 -54.415 -15.319 1.00 72.41 ? 118 ASP B CB 1 ATOM 3531 C CG . ASP B 1 125 ? -18.359 -53.189 -15.360 1.00 74.85 ? 118 ASP B CG 1 ATOM 3532 O OD1 . ASP B 1 125 ? -17.926 -52.808 -16.478 1.00 78.58 ? 118 ASP B OD1 1 ATOM 3533 O OD2 . ASP B 1 125 ? -18.113 -52.596 -14.281 1.00 68.74 ? 118 ASP B OD2 1 ATOM 3534 N N . GLY B 1 126 ? -22.044 -55.697 -15.040 1.00 72.68 ? 119 GLY B N 1 ATOM 3535 C CA . GLY B 1 126 ? -22.803 -56.909 -14.806 1.00 72.76 ? 119 GLY B CA 1 ATOM 3536 C C . GLY B 1 126 ? -24.173 -56.722 -14.207 1.00 76.85 ? 119 GLY B C 1 ATOM 3537 O O . GLY B 1 126 ? -24.732 -55.622 -14.193 1.00 77.25 ? 119 GLY B O 1 ATOM 3538 N N . VAL B 1 127 ? -24.728 -57.828 -13.742 1.00 71.26 ? 120 VAL B N 1 ATOM 3539 C CA . VAL B 1 127 ? -26.065 -57.857 -13.201 1.00 69.89 ? 120 VAL B CA 1 ATOM 3540 C C . VAL B 1 127 ? -26.060 -58.586 -11.870 1.00 75.19 ? 120 VAL B C 1 ATOM 3541 O O . VAL B 1 127 ? -25.421 -59.627 -11.720 1.00 75.61 ? 120 VAL B O 1 ATOM 3542 C CB . VAL B 1 127 ? -27.075 -58.513 -14.207 1.00 72.11 ? 120 VAL B CB 1 ATOM 3543 C CG1 . VAL B 1 127 ? -28.503 -58.527 -13.655 1.00 71.94 ? 120 VAL B CG1 1 ATOM 3544 C CG2 . VAL B 1 127 ? -27.046 -57.818 -15.562 1.00 71.03 ? 120 VAL B CG2 1 ATOM 3545 N N . VAL B 1 128 ? -26.801 -58.041 -10.915 1.00 70.82 ? 121 VAL B N 1 ATOM 3546 C CA . VAL B 1 128 ? -27.073 -58.701 -9.654 1.00 69.34 ? 121 VAL B CA 1 ATOM 3547 C C . VAL B 1 128 ? -28.600 -58.971 -9.698 1.00 74.60 ? 121 VAL B C 1 ATOM 3548 O O . VAL B 1 128 ? -29.407 -58.031 -9.614 1.00 76.01 ? 121 VAL B O 1 ATOM 3549 C CB . VAL B 1 128 ? -26.624 -57.876 -8.432 1.00 70.59 ? 121 VAL B CB 1 ATOM 3550 C CG1 . VAL B 1 128 ? -27.217 -58.439 -7.146 1.00 70.04 ? 121 VAL B CG1 1 ATOM 3551 C CG2 . VAL B 1 128 ? -25.108 -57.825 -8.350 1.00 69.31 ? 121 VAL B CG2 1 ATOM 3552 N N . GLY B 1 129 ? -28.969 -60.230 -9.903 1.00 69.11 ? 122 GLY B N 1 ATOM 3553 C CA . GLY B 1 129 ? -30.366 -60.638 -9.983 1.00 68.52 ? 122 GLY B CA 1 ATOM 3554 C C . GLY B 1 129 ? -31.013 -60.587 -8.620 1.00 72.73 ? 122 GLY B C 1 ATOM 3555 O O . GLY B 1 129 ? -30.466 -61.141 -7.658 1.00 74.65 ? 122 GLY B O 1 ATOM 3556 N N . MET B 1 130 ? -32.154 -59.890 -8.513 1.00 66.73 ? 123 MET B N 1 ATOM 3557 C CA . MET B 1 130 ? -32.877 -59.734 -7.243 1.00 64.59 ? 123 MET B CA 1 ATOM 3558 C C . MET B 1 130 ? -34.168 -60.558 -7.211 1.00 69.04 ? 123 MET B C 1 ATOM 3559 O O . MET B 1 130 ? -34.986 -60.391 -6.311 1.00 67.23 ? 123 MET B O 1 ATOM 3560 C CB . MET B 1 130 ? -33.183 -58.256 -6.966 1.00 65.64 ? 123 MET B CB 1 ATOM 3561 C CG . MET B 1 130 ? -31.954 -57.377 -6.808 1.00 67.66 ? 123 MET B CG 1 ATOM 3562 S SD . MET B 1 130 ? -30.850 -57.845 -5.474 1.00 70.75 ? 123 MET B SD 1 ATOM 3563 C CE . MET B 1 130 ? -31.749 -57.288 -4.028 1.00 67.59 ? 123 MET B CE 1 ATOM 3564 N N . GLY B 1 131 ? -34.332 -61.436 -8.192 1.00 67.69 ? 124 GLY B N 1 ATOM 3565 C CA . GLY B 1 131 ? -35.482 -62.318 -8.295 1.00 68.14 ? 124 GLY B CA 1 ATOM 3566 C C . GLY B 1 131 ? -35.344 -63.540 -7.418 1.00 76.51 ? 124 GLY B C 1 ATOM 3567 O O . GLY B 1 131 ? -34.419 -63.640 -6.593 1.00 76.23 ? 124 GLY B O 1 ATOM 3568 N N . PHE B 1 132 ? -36.278 -64.482 -7.599 1.00 76.12 ? 125 PHE B N 1 ATOM 3569 C CA . PHE B 1 132 ? -36.349 -65.697 -6.797 1.00 77.44 ? 125 PHE B CA 1 ATOM 3570 C C . PHE B 1 132 ? -35.542 -66.838 -7.368 1.00 85.73 ? 125 PHE B C 1 ATOM 3571 O O . PHE B 1 132 ? -35.354 -66.899 -8.583 1.00 87.03 ? 125 PHE B O 1 ATOM 3572 C CB . PHE B 1 132 ? -37.807 -66.139 -6.681 1.00 79.26 ? 125 PHE B CB 1 ATOM 3573 C CG . PHE B 1 132 ? -38.720 -65.201 -5.936 1.00 81.40 ? 125 PHE B CG 1 ATOM 3574 C CD1 . PHE B 1 132 ? -39.243 -64.075 -6.560 1.00 84.04 ? 125 PHE B CD1 1 ATOM 3575 C CD2 . PHE B 1 132 ? -39.098 -65.470 -4.621 1.00 83.80 ? 125 PHE B CD2 1 ATOM 3576 C CE1 . PHE B 1 132 ? -40.104 -63.220 -5.875 1.00 85.34 ? 125 PHE B CE1 1 ATOM 3577 C CE2 . PHE B 1 132 ? -39.956 -64.614 -3.933 1.00 86.58 ? 125 PHE B CE2 1 ATOM 3578 C CZ . PHE B 1 132 ? -40.437 -63.483 -4.557 1.00 84.82 ? 125 PHE B CZ 1 ATOM 3579 N N . ILE B 1 133 ? -35.134 -67.795 -6.506 1.00 83.46 ? 126 ILE B N 1 ATOM 3580 C CA . ILE B 1 133 ? -34.409 -69.006 -6.914 1.00 83.97 ? 126 ILE B CA 1 ATOM 3581 C C . ILE B 1 133 ? -35.131 -69.766 -8.038 1.00 88.87 ? 126 ILE B C 1 ATOM 3582 O O . ILE B 1 133 ? -34.471 -70.307 -8.921 1.00 89.47 ? 126 ILE B O 1 ATOM 3583 C CB . ILE B 1 133 ? -34.062 -69.912 -5.706 1.00 87.16 ? 126 ILE B CB 1 ATOM 3584 C CG1 . ILE B 1 133 ? -32.991 -70.966 -6.073 1.00 87.02 ? 126 ILE B CG1 1 ATOM 3585 C CG2 . ILE B 1 133 ? -35.324 -70.530 -5.075 1.00 88.46 ? 126 ILE B CG2 1 ATOM 3586 C CD1 . ILE B 1 133 ? -32.199 -71.499 -4.910 1.00 92.78 ? 126 ILE B CD1 1 ATOM 3587 N N . GLU B 1 134 ? -36.477 -69.744 -8.041 1.00 85.81 ? 127 GLU B N 1 ATOM 3588 C CA . GLU B 1 134 ? -37.299 -70.383 -9.068 1.00 86.31 ? 127 GLU B CA 1 ATOM 3589 C C . GLU B 1 134 ? -36.961 -69.921 -10.485 1.00 93.51 ? 127 GLU B C 1 ATOM 3590 O O . GLU B 1 134 ? -37.224 -70.654 -11.433 1.00 94.29 ? 127 GLU B O 1 ATOM 3591 C CB . GLU B 1 134 ? -38.792 -70.188 -8.785 1.00 87.67 ? 127 GLU B CB 1 ATOM 3592 C CG . GLU B 1 134 ? -39.317 -70.963 -7.582 1.00 95.85 ? 127 GLU B CG 1 ATOM 3593 C CD . GLU B 1 134 ? -39.337 -70.237 -6.247 1.00 105.93 ? 127 GLU B CD 1 ATOM 3594 O OE1 . GLU B 1 134 ? -38.513 -69.320 -6.044 1.00 99.91 ? 127 GLU B OE1 1 ATOM 3595 O OE2 . GLU B 1 134 ? -40.173 -70.598 -5.389 1.00 88.90 ? 127 GLU B OE2 1 ATOM 3596 N N . GLN B 1 135 ? -36.372 -68.727 -10.635 1.00 92.28 ? 128 GLN B N 1 ATOM 3597 C CA . GLN B 1 135 ? -35.989 -68.188 -11.946 1.00 92.99 ? 128 GLN B CA 1 ATOM 3598 C C . GLN B 1 135 ? -34.482 -68.216 -12.190 1.00 98.31 ? 128 GLN B C 1 ATOM 3599 O O . GLN B 1 135 ? -34.021 -67.774 -13.252 1.00 97.77 ? 128 GLN B O 1 ATOM 3600 C CB . GLN B 1 135 ? -36.515 -66.763 -12.136 1.00 94.35 ? 128 GLN B CB 1 ATOM 3601 C CG . GLN B 1 135 ? -38.022 -66.625 -12.122 1.00 120.04 ? 128 GLN B CG 1 ATOM 3602 C CD . GLN B 1 135 ? -38.821 -67.008 -13.331 1.00 148.52 ? 128 GLN B CD 1 ATOM 3603 O OE1 . GLN B 1 135 ? -38.934 -68.188 -13.704 1.00 143.03 ? 128 GLN B OE1 1 ATOM 3604 N NE2 . GLN B 1 135 ? -39.414 -66.003 -13.946 1.00 145.56 ? 128 GLN B NE2 1 ATOM 3605 N N . ALA B 1 136 ? -33.709 -68.715 -11.206 1.00 95.80 ? 129 ALA B N 1 ATOM 3606 C CA . ALA B 1 136 ? -32.259 -68.772 -11.325 1.00 96.40 ? 129 ALA B CA 1 ATOM 3607 C C . ALA B 1 136 ? -31.829 -69.891 -12.252 1.00 102.21 ? 129 ALA B C 1 ATOM 3608 O O . ALA B 1 136 ? -32.216 -71.043 -12.053 1.00 103.21 ? 129 ALA B O 1 ATOM 3609 C CB . ALA B 1 136 ? -31.617 -68.936 -9.959 1.00 97.04 ? 129 ALA B CB 1 ATOM 3610 N N . ILE B 1 137 ? -31.044 -69.548 -13.276 1.00 98.37 ? 130 ILE B N 1 ATOM 3611 C CA . ILE B 1 137 ? -30.507 -70.534 -14.205 1.00 98.61 ? 130 ILE B CA 1 ATOM 3612 C C . ILE B 1 137 ? -29.411 -71.308 -13.476 1.00 103.65 ? 130 ILE B C 1 ATOM 3613 O O . ILE B 1 137 ? -28.588 -70.711 -12.772 1.00 103.58 ? 130 ILE B O 1 ATOM 3614 C CB . ILE B 1 137 ? -30.051 -69.871 -15.524 1.00 101.73 ? 130 ILE B CB 1 ATOM 3615 C CG1 . ILE B 1 137 ? -31.288 -69.457 -16.330 1.00 102.63 ? 130 ILE B CG1 1 ATOM 3616 C CG2 . ILE B 1 137 ? -29.143 -70.797 -16.355 1.00 101.93 ? 130 ILE B CG2 1 ATOM 3617 C CD1 . ILE B 1 137 ? -31.102 -68.299 -17.288 1.00 114.43 ? 130 ILE B CD1 1 ATOM 3618 N N . GLY B 1 138 ? -29.468 -72.633 -13.589 1.00 100.25 ? 131 GLY B N 1 ATOM 3619 C CA . GLY B 1 138 ? -28.550 -73.516 -12.880 1.00 100.18 ? 131 GLY B CA 1 ATOM 3620 C C . GLY B 1 138 ? -28.927 -73.655 -11.417 1.00 103.87 ? 131 GLY B C 1 ATOM 3621 O O . GLY B 1 138 ? -28.134 -74.164 -10.616 1.00 103.71 ? 131 GLY B O 1 ATOM 3622 N N . ARG B 1 139 ? -30.129 -73.155 -11.051 1.00 99.47 ? 132 ARG B N 1 ATOM 3623 C CA . ARG B 1 139 ? -30.673 -73.189 -9.695 1.00 99.42 ? 132 ARG B CA 1 ATOM 3624 C C . ARG B 1 139 ? -29.703 -72.667 -8.626 1.00 103.99 ? 132 ARG B C 1 ATOM 3625 O O . ARG B 1 139 ? -29.735 -73.142 -7.484 1.00 103.86 ? 132 ARG B O 1 ATOM 3626 C CB . ARG B 1 139 ? -31.181 -74.602 -9.332 1.00 100.72 ? 132 ARG B CB 1 ATOM 3627 C CG . ARG B 1 139 ? -32.396 -75.096 -10.129 1.00 116.26 ? 132 ARG B CG 1 ATOM 3628 C CD . ARG B 1 139 ? -32.024 -75.926 -11.355 1.00 129.61 ? 132 ARG B CD 1 ATOM 3629 N NE . ARG B 1 139 ? -31.313 -77.158 -10.999 1.00 138.30 ? 132 ARG B NE 1 ATOM 3630 C CZ . ARG B 1 139 ? -30.328 -77.692 -11.712 1.00 153.20 ? 132 ARG B CZ 1 ATOM 3631 N NH1 . ARG B 1 139 ? -29.937 -77.127 -12.849 1.00 139.88 ? 132 ARG B NH1 1 ATOM 3632 N NH2 . ARG B 1 139 ? -29.724 -78.794 -11.296 1.00 141.77 ? 132 ARG B NH2 1 ATOM 3633 N N . VAL B 1 140 ? -28.847 -71.695 -8.991 1.00 100.83 ? 133 VAL B N 1 ATOM 3634 C CA . VAL B 1 140 ? -27.890 -71.107 -8.054 1.00 100.84 ? 133 VAL B CA 1 ATOM 3635 C C . VAL B 1 140 ? -28.605 -70.185 -7.087 1.00 104.78 ? 133 VAL B C 1 ATOM 3636 O O . VAL B 1 140 ? -29.502 -69.440 -7.494 1.00 105.12 ? 133 VAL B O 1 ATOM 3637 C CB . VAL B 1 140 ? -26.656 -70.440 -8.703 1.00 104.67 ? 133 VAL B CB 1 ATOM 3638 C CG1 . VAL B 1 140 ? -25.659 -71.464 -9.161 1.00 104.47 ? 133 VAL B CG1 1 ATOM 3639 C CG2 . VAL B 1 140 ? -27.034 -69.502 -9.815 1.00 104.67 ? 133 VAL B CG2 1 ATOM 3640 N N . THR B 1 141 ? -28.244 -70.271 -5.794 1.00 99.87 ? 134 THR B N 1 ATOM 3641 C CA . THR B 1 141 ? -28.856 -69.443 -4.761 1.00 98.23 ? 134 THR B CA 1 ATOM 3642 C C . THR B 1 141 ? -28.622 -67.960 -5.061 1.00 98.55 ? 134 THR B C 1 ATOM 3643 O O . THR B 1 141 ? -27.462 -67.527 -5.163 1.00 99.45 ? 134 THR B O 1 ATOM 3644 C CB . THR B 1 141 ? -28.358 -69.815 -3.348 1.00 102.53 ? 134 THR B CB 1 ATOM 3645 O OG1 . THR B 1 141 ? -28.648 -71.185 -3.092 1.00 99.03 ? 134 THR B OG1 1 ATOM 3646 C CG2 . THR B 1 141 ? -29.005 -68.977 -2.275 1.00 99.67 ? 134 THR B CG2 1 ATOM 3647 N N . PRO B 1 142 ? -29.721 -67.186 -5.206 1.00 89.81 ? 135 PRO B N 1 ATOM 3648 C CA . PRO B 1 142 ? -29.577 -65.748 -5.459 1.00 87.69 ? 135 PRO B CA 1 ATOM 3649 C C . PRO B 1 142 ? -28.915 -65.034 -4.277 1.00 85.53 ? 135 PRO B C 1 ATOM 3650 O O . PRO B 1 142 ? -29.003 -65.491 -3.140 1.00 83.94 ? 135 PRO B O 1 ATOM 3651 C CB . PRO B 1 142 ? -31.026 -65.289 -5.667 1.00 89.76 ? 135 PRO B CB 1 ATOM 3652 C CG . PRO B 1 142 ? -31.788 -66.533 -6.016 1.00 94.40 ? 135 PRO B CG 1 ATOM 3653 C CD . PRO B 1 142 ? -31.146 -67.579 -5.175 1.00 90.33 ? 135 PRO B CD 1 ATOM 3654 N N . ILE B 1 143 ? -28.256 -63.915 -4.553 1.00 79.36 ? 136 ILE B N 1 ATOM 3655 C CA . ILE B 1 143 ? -27.542 -63.150 -3.531 1.00 77.95 ? 136 ILE B CA 1 ATOM 3656 C C . ILE B 1 143 ? -28.380 -62.741 -2.327 1.00 80.63 ? 136 ILE B C 1 ATOM 3657 O O . ILE B 1 143 ? -27.884 -62.786 -1.196 1.00 79.45 ? 136 ILE B O 1 ATOM 3658 C CB . ILE B 1 143 ? -26.740 -61.966 -4.134 1.00 80.64 ? 136 ILE B CB 1 ATOM 3659 C CG1 . ILE B 1 143 ? -25.647 -61.472 -3.160 1.00 79.63 ? 136 ILE B CG1 1 ATOM 3660 C CG2 . ILE B 1 143 ? -27.670 -60.832 -4.609 1.00 82.21 ? 136 ILE B CG2 1 ATOM 3661 C CD1 . ILE B 1 143 ? -24.561 -60.627 -3.764 1.00 82.39 ? 136 ILE B CD1 1 ATOM 3662 N N . PHE B 1 144 ? -29.639 -62.327 -2.558 1.00 76.99 ? 137 PHE B N 1 ATOM 3663 C CA . PHE B 1 144 ? -30.466 -61.879 -1.442 1.00 75.70 ? 137 PHE B CA 1 ATOM 3664 C C . PHE B 1 144 ? -30.843 -63.011 -0.489 1.00 80.89 ? 137 PHE B C 1 ATOM 3665 O O . PHE B 1 144 ? -30.909 -62.788 0.723 1.00 80.99 ? 137 PHE B O 1 ATOM 3666 C CB . PHE B 1 144 ? -31.670 -61.070 -1.901 1.00 75.45 ? 137 PHE B CB 1 ATOM 3667 C CG . PHE B 1 144 ? -32.306 -60.315 -0.768 1.00 74.62 ? 137 PHE B CG 1 ATOM 3668 C CD1 . PHE B 1 144 ? -31.681 -59.201 -0.211 1.00 75.70 ? 137 PHE B CD1 1 ATOM 3669 C CD2 . PHE B 1 144 ? -33.543 -60.695 -0.276 1.00 75.25 ? 137 PHE B CD2 1 ATOM 3670 C CE1 . PHE B 1 144 ? -32.274 -58.489 0.824 1.00 75.71 ? 137 PHE B CE1 1 ATOM 3671 C CE2 . PHE B 1 144 ? -34.136 -59.985 0.765 1.00 77.35 ? 137 PHE B CE2 1 ATOM 3672 C CZ . PHE B 1 144 ? -33.495 -58.891 1.311 1.00 74.78 ? 137 PHE B CZ 1 ATOM 3673 N N . ASP B 1 145 ? -31.026 -64.222 -1.034 1.00 76.69 ? 138 ASP B N 1 ATOM 3674 C CA . ASP B 1 145 ? -31.293 -65.406 -0.233 1.00 77.71 ? 138 ASP B CA 1 ATOM 3675 C C . ASP B 1 145 ? -30.075 -65.713 0.661 1.00 83.55 ? 138 ASP B C 1 ATOM 3676 O O . ASP B 1 145 ? -30.245 -66.023 1.849 1.00 83.93 ? 138 ASP B O 1 ATOM 3677 C CB . ASP B 1 145 ? -31.637 -66.603 -1.127 1.00 79.86 ? 138 ASP B CB 1 ATOM 3678 C CG . ASP B 1 145 ? -32.892 -66.404 -1.947 1.00 92.03 ? 138 ASP B CG 1 ATOM 3679 O OD1 . ASP B 1 145 ? -33.017 -65.345 -2.595 1.00 95.17 ? 138 ASP B OD1 1 ATOM 3680 O OD2 . ASP B 1 145 ? -33.724 -67.321 -1.982 1.00 95.50 ? 138 ASP B OD2 1 ATOM 3681 N N . ASN B 1 146 ? -28.857 -65.565 0.104 1.00 78.84 ? 139 ASN B N 1 ATOM 3682 C CA . ASN B 1 146 ? -27.631 -65.761 0.865 1.00 78.67 ? 139 ASN B CA 1 ATOM 3683 C C . ASN B 1 146 ? -27.455 -64.698 1.943 1.00 83.55 ? 139 ASN B C 1 ATOM 3684 O O . ASN B 1 146 ? -26.988 -65.023 3.038 1.00 83.71 ? 139 ASN B O 1 ATOM 3685 C CB . ASN B 1 146 ? -26.416 -65.821 -0.048 1.00 78.70 ? 139 ASN B CB 1 ATOM 3686 C CG . ASN B 1 146 ? -26.234 -67.134 -0.749 1.00 92.83 ? 139 ASN B CG 1 ATOM 3687 O OD1 . ASN B 1 146 ? -25.757 -67.188 -1.885 1.00 96.00 ? 139 ASN B OD1 1 ATOM 3688 N ND2 . ASN B 1 146 ? -26.607 -68.219 -0.098 1.00 77.40 ? 139 ASN B ND2 1 ATOM 3689 N N . ILE B 1 147 ? -27.830 -63.439 1.643 1.00 81.12 ? 140 ILE B N 1 ATOM 3690 C CA . ILE B 1 147 ? -27.759 -62.337 2.615 1.00 81.83 ? 140 ILE B CA 1 ATOM 3691 C C . ILE B 1 147 ? -28.767 -62.582 3.745 1.00 88.50 ? 140 ILE B C 1 ATOM 3692 O O . ILE B 1 147 ? -28.433 -62.375 4.911 1.00 86.74 ? 140 ILE B O 1 ATOM 3693 C CB . ILE B 1 147 ? -27.915 -60.943 1.954 1.00 84.83 ? 140 ILE B CB 1 ATOM 3694 C CG1 . ILE B 1 147 ? -26.705 -60.614 1.057 1.00 84.12 ? 140 ILE B CG1 1 ATOM 3695 C CG2 . ILE B 1 147 ? -28.079 -59.853 3.030 1.00 86.13 ? 140 ILE B CG2 1 ATOM 3696 C CD1 . ILE B 1 147 ? -26.875 -59.396 0.146 1.00 77.09 ? 140 ILE B CD1 1 ATOM 3697 N N . ILE B 1 148 ? -29.990 -63.048 3.393 1.00 88.87 ? 141 ILE B N 1 ATOM 3698 C CA . ILE B 1 148 ? -31.033 -63.406 4.364 1.00 89.47 ? 141 ILE B CA 1 ATOM 3699 C C . ILE B 1 148 ? -30.486 -64.457 5.329 1.00 92.83 ? 141 ILE B C 1 ATOM 3700 O O . ILE B 1 148 ? -30.615 -64.285 6.542 1.00 92.11 ? 141 ILE B O 1 ATOM 3701 C CB . ILE B 1 148 ? -32.338 -63.903 3.673 1.00 92.58 ? 141 ILE B CB 1 ATOM 3702 C CG1 . ILE B 1 148 ? -33.120 -62.747 3.034 1.00 92.68 ? 141 ILE B CG1 1 ATOM 3703 C CG2 . ILE B 1 148 ? -33.243 -64.688 4.647 1.00 92.80 ? 141 ILE B CG2 1 ATOM 3704 C CD1 . ILE B 1 148 ? -34.224 -63.299 2.021 1.00 101.31 ? 141 ILE B CD1 1 ATOM 3705 N N . SER B 1 149 ? -29.852 -65.518 4.785 1.00 89.38 ? 142 SER B N 1 ATOM 3706 C CA . SER B 1 149 ? -29.257 -66.612 5.569 1.00 89.39 ? 142 SER B CA 1 ATOM 3707 C C . SER B 1 149 ? -28.303 -66.141 6.666 1.00 93.27 ? 142 SER B C 1 ATOM 3708 O O . SER B 1 149 ? -28.202 -66.801 7.699 1.00 93.64 ? 142 SER B O 1 ATOM 3709 C CB . SER B 1 149 ? -28.557 -67.614 4.661 1.00 92.39 ? 142 SER B CB 1 ATOM 3710 O OG . SER B 1 149 ? -29.490 -68.291 3.836 1.00 102.97 ? 142 SER B OG 1 ATOM 3711 N N . GLN B 1 150 ? -27.653 -64.990 6.465 1.00 88.83 ? 143 GLN B N 1 ATOM 3712 C CA . GLN B 1 150 ? -26.728 -64.398 7.428 1.00 89.10 ? 143 GLN B CA 1 ATOM 3713 C C . GLN B 1 150 ? -27.407 -63.886 8.698 1.00 94.77 ? 143 GLN B C 1 ATOM 3714 O O . GLN B 1 150 ? -26.733 -63.768 9.726 1.00 95.70 ? 143 GLN B O 1 ATOM 3715 C CB . GLN B 1 150 ? -25.942 -63.250 6.801 1.00 90.37 ? 143 GLN B CB 1 ATOM 3716 C CG . GLN B 1 150 ? -24.993 -63.677 5.706 1.00 105.20 ? 143 GLN B CG 1 ATOM 3717 C CD . GLN B 1 150 ? -24.041 -62.575 5.322 1.00 120.58 ? 143 GLN B CD 1 ATOM 3718 O OE1 . GLN B 1 150 ? -22.901 -62.829 4.982 1.00 118.40 ? 143 GLN B OE1 1 ATOM 3719 N NE2 . GLN B 1 150 ? -24.480 -61.324 5.335 1.00 113.65 ? 143 GLN B NE2 1 ATOM 3720 N N . GLY B 1 151 ? -28.696 -63.544 8.600 1.00 90.73 ? 144 GLY B N 1 ATOM 3721 C CA . GLY B 1 151 ? -29.500 -63.025 9.702 1.00 91.12 ? 144 GLY B CA 1 ATOM 3722 C C . GLY B 1 151 ? -29.005 -61.713 10.274 1.00 98.27 ? 144 GLY B C 1 ATOM 3723 O O . GLY B 1 151 ? -29.081 -61.495 11.483 1.00 98.48 ? 144 GLY B O 1 ATOM 3724 N N . VAL B 1 152 ? -28.498 -60.830 9.410 1.00 96.86 ? 145 VAL B N 1 ATOM 3725 C CA . VAL B 1 152 ? -27.969 -59.509 9.795 1.00 97.18 ? 145 VAL B CA 1 ATOM 3726 C C . VAL B 1 152 ? -28.958 -58.366 9.510 1.00 100.62 ? 145 VAL B C 1 ATOM 3727 O O . VAL B 1 152 ? -28.896 -57.307 10.149 1.00 100.05 ? 145 VAL B O 1 ATOM 3728 C CB . VAL B 1 152 ? -26.571 -59.217 9.184 1.00 100.75 ? 145 VAL B CB 1 ATOM 3729 C CG1 . VAL B 1 152 ? -25.527 -60.181 9.736 1.00 100.83 ? 145 VAL B CG1 1 ATOM 3730 C CG2 . VAL B 1 152 ? -26.600 -59.256 7.653 1.00 100.21 ? 145 VAL B CG2 1 ATOM 3731 N N . LEU B 1 153 ? -29.864 -58.588 8.552 1.00 95.89 ? 146 LEU B N 1 ATOM 3732 C CA . LEU B 1 153 ? -30.824 -57.580 8.119 1.00 94.89 ? 146 LEU B CA 1 ATOM 3733 C C . LEU B 1 153 ? -32.012 -57.410 9.051 1.00 96.67 ? 146 LEU B C 1 ATOM 3734 O O . LEU B 1 153 ? -32.585 -58.402 9.513 1.00 95.68 ? 146 LEU B O 1 ATOM 3735 C CB . LEU B 1 153 ? -31.326 -57.889 6.691 1.00 94.60 ? 146 LEU B CB 1 ATOM 3736 C CG . LEU B 1 153 ? -30.332 -57.872 5.531 1.00 97.98 ? 146 LEU B CG 1 ATOM 3737 C CD1 . LEU B 1 153 ? -31.062 -58.182 4.239 1.00 98.16 ? 146 LEU B CD1 1 ATOM 3738 C CD2 . LEU B 1 153 ? -29.573 -56.516 5.463 1.00 97.61 ? 146 LEU B CD2 1 ATOM 3739 N N . LYS B 1 154 ? -32.417 -56.147 9.266 1.00 92.01 ? 147 LYS B N 1 ATOM 3740 C CA . LYS B 1 154 ? -33.593 -55.836 10.073 1.00 91.62 ? 147 LYS B CA 1 ATOM 3741 C C . LYS B 1 154 ? -34.821 -56.600 9.538 1.00 93.27 ? 147 LYS B C 1 ATOM 3742 O O . LYS B 1 154 ? -35.516 -57.257 10.312 1.00 94.41 ? 147 LYS B O 1 ATOM 3743 C CB . LYS B 1 154 ? -33.888 -54.320 10.067 1.00 94.56 ? 147 LYS B CB 1 ATOM 3744 C CG . LYS B 1 154 ? -33.015 -53.475 10.978 1.00 111.11 ? 147 LYS B CG 1 ATOM 3745 C CD . LYS B 1 154 ? -33.387 -51.997 10.864 1.00 122.81 ? 147 LYS B CD 1 ATOM 3746 C CE . LYS B 1 154 ? -32.292 -51.074 11.346 1.00 136.11 ? 147 LYS B CE 1 ATOM 3747 N NZ . LYS B 1 154 ? -32.375 -50.825 12.810 1.00 145.11 ? 147 LYS B NZ 1 ATOM 3748 N N . GLU B 1 155 ? -35.057 -56.539 8.213 1.00 85.33 ? 148 GLU B N 1 ATOM 3749 C CA . GLU B 1 155 ? -36.213 -57.140 7.566 1.00 82.98 ? 148 GLU B CA 1 ATOM 3750 C C . GLU B 1 155 ? -35.828 -57.916 6.321 1.00 82.97 ? 148 GLU B C 1 ATOM 3751 O O . GLU B 1 155 ? -34.821 -57.603 5.679 1.00 82.31 ? 148 GLU B O 1 ATOM 3752 C CB . GLU B 1 155 ? -37.179 -56.027 7.148 1.00 84.40 ? 148 GLU B CB 1 ATOM 3753 C CG . GLU B 1 155 ? -38.104 -55.479 8.225 1.00 93.87 ? 148 GLU B CG 1 ATOM 3754 C CD . GLU B 1 155 ? -39.078 -54.451 7.678 1.00 112.28 ? 148 GLU B CD 1 ATOM 3755 O OE1 . GLU B 1 155 ? -38.630 -53.369 7.231 1.00 119.78 ? 148 GLU B OE1 1 ATOM 3756 O OE2 . GLU B 1 155 ? -40.289 -54.759 7.622 1.00 98.88 ? 148 GLU B OE2 1 ATOM 3757 N N . ASP B 1 156 ? -36.678 -58.894 5.941 1.00 76.71 ? 149 ASP B N 1 ATOM 3758 C CA . ASP B 1 156 ? -36.562 -59.724 4.732 1.00 75.22 ? 149 ASP B CA 1 ATOM 3759 C C . ASP B 1 156 ? -37.068 -58.943 3.514 1.00 75.79 ? 149 ASP B C 1 ATOM 3760 O O . ASP B 1 156 ? -37.894 -59.444 2.741 1.00 75.16 ? 149 ASP B O 1 ATOM 3761 C CB . ASP B 1 156 ? -37.458 -60.934 4.896 1.00 78.21 ? 149 ASP B CB 1 ATOM 3762 C CG . ASP B 1 156 ? -36.789 -62.255 4.814 1.00 95.45 ? 149 ASP B CG 1 ATOM 3763 O OD1 . ASP B 1 156 ? -35.908 -62.502 5.657 1.00 97.07 ? 149 ASP B OD1 1 ATOM 3764 O OD2 . ASP B 1 156 ? -37.337 -63.158 4.106 1.00 101.29 ? 149 ASP B OD2 1 ATOM 3765 N N . VAL B 1 157 ? -36.612 -57.693 3.365 1.00 70.73 ? 150 VAL B N 1 ATOM 3766 C CA . VAL B 1 157 ? -37.071 -56.803 2.289 1.00 69.10 ? 150 VAL B CA 1 ATOM 3767 C C . VAL B 1 157 ? -35.897 -56.012 1.672 1.00 71.64 ? 150 VAL B C 1 ATOM 3768 O O . VAL B 1 157 ? -34.854 -55.819 2.310 1.00 72.91 ? 150 VAL B O 1 ATOM 3769 C CB . VAL B 1 157 ? -38.187 -55.797 2.778 1.00 70.50 ? 150 VAL B CB 1 ATOM 3770 C CG1 . VAL B 1 157 ? -39.305 -56.490 3.549 1.00 69.25 ? 150 VAL B CG1 1 ATOM 3771 C CG2 . VAL B 1 157 ? -37.596 -54.634 3.589 1.00 69.65 ? 150 VAL B CG2 1 ATOM 3772 N N . PHE B 1 158 ? -36.120 -55.479 0.468 1.00 63.45 ? 151 PHE B N 1 ATOM 3773 C CA . PHE B 1 158 ? -35.189 -54.553 -0.164 1.00 60.64 ? 151 PHE B CA 1 ATOM 3774 C C . PHE B 1 158 ? -35.969 -53.520 -0.937 1.00 65.50 ? 151 PHE B C 1 ATOM 3775 O O . PHE B 1 158 ? -37.055 -53.817 -1.451 1.00 66.24 ? 151 PHE B O 1 ATOM 3776 C CB . PHE B 1 158 ? -34.106 -55.243 -1.002 1.00 60.58 ? 151 PHE B CB 1 ATOM 3777 C CG . PHE B 1 158 ? -34.633 -56.114 -2.118 1.00 59.28 ? 151 PHE B CG 1 ATOM 3778 C CD1 . PHE B 1 158 ? -34.892 -55.579 -3.372 1.00 60.42 ? 151 PHE B CD1 1 ATOM 3779 C CD2 . PHE B 1 158 ? -34.869 -57.468 -1.912 1.00 58.69 ? 151 PHE B CD2 1 ATOM 3780 C CE1 . PHE B 1 158 ? -35.389 -56.378 -4.402 1.00 60.89 ? 151 PHE B CE1 1 ATOM 3781 C CE2 . PHE B 1 158 ? -35.370 -58.272 -2.941 1.00 61.71 ? 151 PHE B CE2 1 ATOM 3782 C CZ . PHE B 1 158 ? -35.627 -57.722 -4.184 1.00 60.43 ? 151 PHE B CZ 1 ATOM 3783 N N . SER B 1 159 ? -35.426 -52.304 -1.008 1.00 61.70 ? 152 SER B N 1 ATOM 3784 C CA . SER B 1 159 ? -36.113 -51.167 -1.593 1.00 61.71 ? 152 SER B CA 1 ATOM 3785 C C . SER B 1 159 ? -35.320 -50.452 -2.673 1.00 64.63 ? 152 SER B C 1 ATOM 3786 O O . SER B 1 159 ? -34.101 -50.347 -2.590 1.00 65.43 ? 152 SER B O 1 ATOM 3787 C CB . SER B 1 159 ? -36.470 -50.177 -0.490 1.00 66.20 ? 152 SER B CB 1 ATOM 3788 O OG . SER B 1 159 ? -37.335 -50.771 0.458 1.00 82.34 ? 152 SER B OG 1 ATOM 3789 N N . PHE B 1 160 ? -36.031 -49.879 -3.641 1.00 58.20 ? 153 PHE B N 1 ATOM 3790 C CA . PHE B 1 160 ? -35.430 -49.135 -4.743 1.00 55.20 ? 153 PHE B CA 1 ATOM 3791 C C . PHE B 1 160 ? -35.926 -47.737 -4.821 1.00 58.25 ? 153 PHE B C 1 ATOM 3792 O O . PHE B 1 160 ? -37.132 -47.506 -4.832 1.00 59.09 ? 153 PHE B O 1 ATOM 3793 C CB . PHE B 1 160 ? -35.746 -49.824 -6.069 1.00 55.75 ? 153 PHE B CB 1 ATOM 3794 C CG . PHE B 1 160 ? -34.866 -50.987 -6.409 1.00 55.90 ? 153 PHE B CG 1 ATOM 3795 C CD1 . PHE B 1 160 ? -34.981 -52.190 -5.723 1.00 58.72 ? 153 PHE B CD1 1 ATOM 3796 C CD2 . PHE B 1 160 ? -33.946 -50.894 -7.439 1.00 56.99 ? 153 PHE B CD2 1 ATOM 3797 C CE1 . PHE B 1 160 ? -34.163 -53.263 -6.038 1.00 59.77 ? 153 PHE B CE1 1 ATOM 3798 C CE2 . PHE B 1 160 ? -33.133 -51.969 -7.759 1.00 60.07 ? 153 PHE B CE2 1 ATOM 3799 C CZ . PHE B 1 160 ? -33.242 -53.147 -7.057 1.00 58.34 ? 153 PHE B CZ 1 ATOM 3800 N N . TYR B 1 161 ? -34.992 -46.801 -4.898 1.00 54.74 ? 154 TYR B N 1 ATOM 3801 C CA . TYR B 1 161 ? -35.231 -45.393 -5.192 1.00 53.88 ? 154 TYR B CA 1 ATOM 3802 C C . TYR B 1 161 ? -34.469 -45.100 -6.501 1.00 58.85 ? 154 TYR B C 1 ATOM 3803 O O . TYR B 1 161 ? -33.270 -45.355 -6.583 1.00 59.33 ? 154 TYR B O 1 ATOM 3804 C CB . TYR B 1 161 ? -34.747 -44.452 -4.065 1.00 53.44 ? 154 TYR B CB 1 ATOM 3805 C CG . TYR B 1 161 ? -34.700 -42.986 -4.479 1.00 55.31 ? 154 TYR B CG 1 ATOM 3806 C CD1 . TYR B 1 161 ? -35.862 -42.289 -4.777 1.00 56.80 ? 154 TYR B CD1 1 ATOM 3807 C CD2 . TYR B 1 161 ? -33.483 -42.310 -4.604 1.00 56.57 ? 154 TYR B CD2 1 ATOM 3808 C CE1 . TYR B 1 161 ? -35.823 -40.958 -5.186 1.00 60.13 ? 154 TYR B CE1 1 ATOM 3809 C CE2 . TYR B 1 161 ? -33.431 -40.975 -5.006 1.00 57.75 ? 154 TYR B CE2 1 ATOM 3810 C CZ . TYR B 1 161 ? -34.604 -40.302 -5.298 1.00 69.91 ? 154 TYR B CZ 1 ATOM 3811 O OH . TYR B 1 161 ? -34.579 -38.976 -5.673 1.00 72.88 ? 154 TYR B OH 1 ATOM 3812 N N . TYR B 1 162 ? -35.155 -44.594 -7.506 1.00 54.24 ? 155 TYR B N 1 ATOM 3813 C CA . TYR B 1 162 ? -34.536 -44.171 -8.752 1.00 54.55 ? 155 TYR B CA 1 ATOM 3814 C C . TYR B 1 162 ? -34.867 -42.667 -8.920 1.00 65.23 ? 155 TYR B C 1 ATOM 3815 O O . TYR B 1 162 ? -36.059 -42.299 -8.969 1.00 65.59 ? 155 TYR B O 1 ATOM 3816 C CB . TYR B 1 162 ? -35.129 -44.940 -9.945 1.00 54.55 ? 155 TYR B CB 1 ATOM 3817 C CG . TYR B 1 162 ? -34.635 -46.354 -10.188 1.00 55.20 ? 155 TYR B CG 1 ATOM 3818 C CD1 . TYR B 1 162 ? -33.579 -46.889 -9.447 1.00 57.76 ? 155 TYR B CD1 1 ATOM 3819 C CD2 . TYR B 1 162 ? -35.187 -47.142 -11.197 1.00 54.88 ? 155 TYR B CD2 1 ATOM 3820 C CE1 . TYR B 1 162 ? -33.110 -48.190 -9.687 1.00 58.47 ? 155 TYR B CE1 1 ATOM 3821 C CE2 . TYR B 1 162 ? -34.714 -48.430 -11.457 1.00 55.39 ? 155 TYR B CE2 1 ATOM 3822 C CZ . TYR B 1 162 ? -33.670 -48.948 -10.710 1.00 60.63 ? 155 TYR B CZ 1 ATOM 3823 O OH . TYR B 1 162 ? -33.222 -50.216 -10.999 1.00 53.84 ? 155 TYR B OH 1 ATOM 3824 N N . ASN B 1 163 ? -33.839 -41.799 -8.988 1.00 62.16 ? 156 ASN B N 1 ATOM 3825 C CA . ASN B 1 163 ? -34.064 -40.362 -9.166 1.00 61.61 ? 156 ASN B CA 1 ATOM 3826 C C . ASN B 1 163 ? -34.309 -40.029 -10.632 1.00 68.86 ? 156 ASN B C 1 ATOM 3827 O O . ASN B 1 163 ? -34.065 -40.861 -11.484 1.00 66.02 ? 156 ASN B O 1 ATOM 3828 C CB . ASN B 1 163 ? -32.870 -39.570 -8.649 1.00 63.26 ? 156 ASN B CB 1 ATOM 3829 C CG . ASN B 1 163 ? -33.150 -38.107 -8.342 1.00 84.96 ? 156 ASN B CG 1 ATOM 3830 O OD1 . ASN B 1 163 ? -34.238 -37.557 -8.622 1.00 76.79 ? 156 ASN B OD1 1 ATOM 3831 N ND2 . ASN B 1 163 ? -32.179 -37.448 -7.728 1.00 78.76 ? 156 ASN B ND2 1 ATOM 3832 N N . ARG B 1 164 ? -34.699 -38.791 -10.959 1.00 73.27 ? 157 ARG B N 1 ATOM 3833 C CA . ARG B 1 164 ? -34.867 -38.340 -12.350 1.00 76.31 ? 157 ARG B CA 1 ATOM 3834 C C . ARG B 1 164 ? -33.673 -37.475 -12.765 1.00 90.88 ? 157 ARG B C 1 ATOM 3835 O O . ARG B 1 164 ? -32.770 -37.241 -11.960 1.00 90.42 ? 157 ARG B O 1 ATOM 3836 C CB . ARG B 1 164 ? -36.179 -37.570 -12.542 1.00 73.44 ? 157 ARG B CB 1 ATOM 3837 C CG . ARG B 1 164 ? -37.116 -37.697 -11.372 1.00 80.19 ? 157 ARG B CG 1 ATOM 3838 C CD . ARG B 1 164 ? -38.577 -37.747 -11.757 1.00 92.60 ? 157 ARG B CD 1 ATOM 3839 N NE . ARG B 1 164 ? -39.377 -37.745 -10.529 1.00 109.90 ? 157 ARG B NE 1 ATOM 3840 C CZ . ARG B 1 164 ? -40.610 -38.227 -10.408 1.00 119.23 ? 157 ARG B CZ 1 ATOM 3841 N NH1 . ARG B 1 164 ? -41.227 -38.769 -11.455 1.00 112.26 ? 157 ARG B NH1 1 ATOM 3842 N NH2 . ARG B 1 164 ? -41.237 -38.169 -9.242 1.00 89.85 ? 157 ARG B NH2 1 ATOM 3843 N N . ASP B 1 165 ? -33.684 -37.000 -14.023 1.00 96.57 ? 158 ASP B N 1 ATOM 3844 C CA . ASP B 1 165 ? -32.679 -36.127 -14.660 1.00 100.78 ? 158 ASP B CA 1 ATOM 3845 C C . ASP B 1 165 ? -31.210 -36.382 -14.311 1.00 110.33 ? 158 ASP B C 1 ATOM 3846 O O . ASP B 1 165 ? -30.633 -35.789 -13.382 1.00 109.86 ? 158 ASP B O 1 ATOM 3847 C CB . ASP B 1 165 ? -33.047 -34.640 -14.552 1.00 104.33 ? 158 ASP B CB 1 ATOM 3848 C CG . ASP B 1 165 ? -32.692 -33.820 -15.782 1.00 127.43 ? 158 ASP B CG 1 ATOM 3849 O OD1 . ASP B 1 165 ? -33.361 -33.999 -16.833 1.00 129.85 ? 158 ASP B OD1 1 ATOM 3850 O OD2 . ASP B 1 165 ? -31.788 -32.950 -15.679 1.00 136.79 ? 158 ASP B OD2 1 ATOM 3851 N N . SER B 1 166 ? -30.613 -37.252 -15.118 1.00 111.18 ? 159 SER B N 1 ATOM 3852 C CA . SER B 1 166 ? -29.229 -37.670 -15.022 1.00 113.16 ? 159 SER B CA 1 ATOM 3853 C C . SER B 1 166 ? -28.201 -36.564 -15.389 1.00 121.69 ? 159 SER B C 1 ATOM 3854 O O . SER B 1 166 ? -26.999 -36.689 -15.088 1.00 121.84 ? 159 SER B O 1 ATOM 3855 C CB . SER B 1 166 ? -29.046 -38.880 -15.919 1.00 117.52 ? 159 SER B CB 1 ATOM 3856 O OG . SER B 1 166 ? -27.675 -39.189 -16.079 1.00 130.92 ? 159 SER B OG 1 ATOM 3857 N N . GLU B 1 167 ? -28.675 -35.498 -16.048 1.00 120.50 ? 160 GLU B N 1 ATOM 3858 C CA . GLU B 1 167 ? -27.842 -34.402 -16.525 1.00 121.27 ? 160 GLU B CA 1 ATOM 3859 C C . GLU B 1 167 ? -27.185 -33.599 -15.397 1.00 126.61 ? 160 GLU B C 1 ATOM 3860 O O . GLU B 1 167 ? -26.221 -32.867 -15.642 1.00 126.46 ? 160 GLU B O 1 ATOM 3861 C CB . GLU B 1 167 ? -28.659 -33.512 -17.467 1.00 123.14 ? 160 GLU B CB 1 ATOM 3862 C CG . GLU B 1 167 ? -27.828 -32.743 -18.486 1.00 138.22 ? 160 GLU B CG 1 ATOM 3863 C CD . GLU B 1 167 ? -28.042 -31.236 -18.484 1.00 168.45 ? 160 GLU B CD 1 ATOM 3864 O OE1 . GLU B 1 167 ? -28.721 -30.724 -17.564 1.00 161.65 ? 160 GLU B OE1 1 ATOM 3865 O OE2 . GLU B 1 167 ? -27.503 -30.563 -19.393 1.00 167.87 ? 160 GLU B OE2 1 ATOM 3866 N N . ASN B 1 168 A -27.700 -33.731 -14.163 1.00 124.19 ? 160 ASN B N 1 ATOM 3867 C CA . ASN B 1 168 A -27.116 -33.041 -13.014 1.00 124.23 ? 160 ASN B CA 1 ATOM 3868 C C . ASN B 1 168 A -26.431 -34.018 -12.060 1.00 127.21 ? 160 ASN B C 1 ATOM 3869 O O . ASN B 1 168 A -27.103 -34.765 -11.337 1.00 127.22 ? 160 ASN B O 1 ATOM 3870 C CB . ASN B 1 168 A -28.138 -32.152 -12.290 1.00 125.97 ? 160 ASN B CB 1 ATOM 3871 C CG . ASN B 1 168 A -27.501 -31.176 -11.323 1.00 147.10 ? 160 ASN B CG 1 ATOM 3872 O OD1 . ASN B 1 168 A -27.186 -31.511 -10.181 1.00 140.76 ? 160 ASN B OD1 1 ATOM 3873 N ND2 . ASN B 1 168 A -27.309 -29.940 -11.753 1.00 138.32 ? 160 ASN B ND2 1 ATOM 3874 N N . SER B 1 169 B -25.082 -34.002 -12.067 1.00 122.24 ? 160 SER B N 1 ATOM 3875 C CA . SER B 1 169 B -24.229 -34.830 -11.198 1.00 121.31 ? 160 SER B CA 1 ATOM 3876 C C . SER B 1 169 B -24.455 -34.528 -9.702 1.00 121.68 ? 160 SER B C 1 ATOM 3877 O O . SER B 1 169 B -24.296 -35.417 -8.862 1.00 121.84 ? 160 SER B O 1 ATOM 3878 C CB . SER B 1 169 B -22.748 -34.606 -11.527 1.00 125.17 ? 160 SER B CB 1 ATOM 3879 O OG . SER B 1 169 B -22.129 -35.746 -12.102 1.00 132.46 ? 160 SER B OG 1 ATOM 3880 N N . GLN B 1 170 C -24.822 -33.279 -9.380 1.00 114.46 ? 160 GLN B N 1 ATOM 3881 C CA . GLN B 1 170 C -25.007 -32.812 -8.010 1.00 112.55 ? 160 GLN B CA 1 ATOM 3882 C C . GLN B 1 170 C -26.323 -33.251 -7.354 1.00 111.23 ? 160 GLN B C 1 ATOM 3883 O O . GLN B 1 170 C -26.741 -32.687 -6.337 1.00 110.60 ? 160 GLN B O 1 ATOM 3884 C CB . GLN B 1 170 C -24.745 -31.303 -7.910 1.00 114.08 ? 160 GLN B CB 1 ATOM 3885 C CG . GLN B 1 170 C -23.265 -30.906 -8.004 1.00 118.57 ? 160 GLN B CG 1 ATOM 3886 C CD . GLN B 1 170 C -23.080 -29.491 -8.496 1.00 131.29 ? 160 GLN B CD 1 ATOM 3887 O OE1 . GLN B 1 170 C -24.044 -28.734 -8.670 1.00 125.18 ? 160 GLN B OE1 1 ATOM 3888 N NE2 . GLN B 1 170 C -21.831 -29.103 -8.744 1.00 126.01 ? 160 GLN B NE2 1 ATOM 3889 N N . SER B 1 171 D -26.961 -34.275 -7.934 1.00 103.86 ? 160 SER B N 1 ATOM 3890 C CA . SER B 1 171 D -28.112 -34.965 -7.357 1.00 101.46 ? 160 SER B CA 1 ATOM 3891 C C . SER B 1 171 D -27.815 -36.469 -7.373 1.00 99.21 ? 160 SER B C 1 ATOM 3892 O O . SER B 1 171 D -27.278 -36.978 -8.363 1.00 99.34 ? 160 SER B O 1 ATOM 3893 C CB . SER B 1 171 D -29.417 -34.657 -8.093 1.00 104.08 ? 160 SER B CB 1 ATOM 3894 O OG . SER B 1 171 D -29.366 -34.948 -9.480 1.00 110.88 ? 160 SER B OG 1 ATOM 3895 N N . LEU B 1 172 ? -28.143 -37.171 -6.277 1.00 89.22 ? 161 LEU B N 1 ATOM 3896 C CA . LEU B 1 172 ? -28.003 -38.635 -6.169 1.00 85.61 ? 161 LEU B CA 1 ATOM 3897 C C . LEU B 1 172 ? -28.802 -39.357 -7.307 1.00 83.78 ? 161 LEU B C 1 ATOM 3898 O O . LEU B 1 172 ? -29.946 -38.992 -7.554 1.00 83.13 ? 161 LEU B O 1 ATOM 3899 C CB . LEU B 1 172 ? -28.549 -39.037 -4.790 1.00 85.30 ? 161 LEU B CB 1 ATOM 3900 C CG . LEU B 1 172 ? -28.746 -40.515 -4.455 1.00 89.66 ? 161 LEU B CG 1 ATOM 3901 C CD1 . LEU B 1 172 ? -27.424 -41.181 -4.163 1.00 90.01 ? 161 LEU B CD1 1 ATOM 3902 C CD2 . LEU B 1 172 ? -29.663 -40.655 -3.257 1.00 89.62 ? 161 LEU B CD2 1 ATOM 3903 N N . GLY B 1 173 ? -28.202 -40.345 -7.985 1.00 76.42 ? 162 GLY B N 1 ATOM 3904 C CA . GLY B 1 173 ? -28.879 -41.072 -9.063 1.00 73.76 ? 162 GLY B CA 1 ATOM 3905 C C . GLY B 1 173 ? -29.972 -42.008 -8.593 1.00 70.98 ? 162 GLY B C 1 ATOM 3906 O O . GLY B 1 173 ? -30.985 -42.203 -9.276 1.00 69.55 ? 162 GLY B O 1 ATOM 3907 N N . GLY B 1 174 ? -29.759 -42.601 -7.436 1.00 64.31 ? 163 GLY B N 1 ATOM 3908 C CA . GLY B 1 174 ? -30.698 -43.557 -6.881 1.00 63.98 ? 163 GLY B CA 1 ATOM 3909 C C . GLY B 1 174 ? -30.082 -44.288 -5.722 1.00 66.86 ? 163 GLY B C 1 ATOM 3910 O O . GLY B 1 174 ? -28.933 -44.013 -5.375 1.00 66.74 ? 163 GLY B O 1 ATOM 3911 N N . GLN B 1 175 ? -30.839 -45.232 -5.129 1.00 61.22 ? 164 GLN B N 1 ATOM 3912 C CA . GLN B 1 175 ? -30.371 -45.979 -3.979 1.00 59.90 ? 164 GLN B CA 1 ATOM 3913 C C . GLN B 1 175 ? -31.149 -47.277 -3.747 1.00 63.88 ? 164 GLN B C 1 ATOM 3914 O O . GLN B 1 175 ? -32.371 -47.287 -3.845 1.00 64.60 ? 164 GLN B O 1 ATOM 3915 C CB . GLN B 1 175 ? -30.466 -45.070 -2.736 1.00 60.48 ? 164 GLN B CB 1 ATOM 3916 C CG . GLN B 1 175 ? -29.936 -45.684 -1.463 1.00 71.95 ? 164 GLN B CG 1 ATOM 3917 C CD . GLN B 1 175 ? -30.417 -44.947 -0.255 1.00 92.93 ? 164 GLN B CD 1 ATOM 3918 O OE1 . GLN B 1 175 ? -29.607 -44.427 0.513 1.00 97.57 ? 164 GLN B OE1 1 ATOM 3919 N NE2 . GLN B 1 175 ? -31.734 -44.871 -0.067 1.00 76.16 ? 164 GLN B NE2 1 ATOM 3920 N N . ILE B 1 176 ? -30.443 -48.351 -3.395 1.00 60.37 ? 165 ILE B N 1 ATOM 3921 C CA . ILE B 1 176 ? -31.039 -49.617 -2.966 1.00 61.40 ? 165 ILE B CA 1 ATOM 3922 C C . ILE B 1 176 ? -30.783 -49.700 -1.491 1.00 68.45 ? 165 ILE B C 1 ATOM 3923 O O . ILE B 1 176 ? -29.665 -49.419 -1.046 1.00 70.71 ? 165 ILE B O 1 ATOM 3924 C CB . ILE B 1 176 ? -30.461 -50.892 -3.617 1.00 65.30 ? 165 ILE B CB 1 ATOM 3925 C CG1 . ILE B 1 176 ? -30.236 -50.771 -5.132 1.00 66.97 ? 165 ILE B CG1 1 ATOM 3926 C CG2 . ILE B 1 176 ? -31.245 -52.164 -3.233 1.00 66.39 ? 165 ILE B CG2 1 ATOM 3927 C CD1 . ILE B 1 176 ? -31.144 -50.245 -5.926 1.00 78.41 ? 165 ILE B CD1 1 ATOM 3928 N N . VAL B 1 177 ? -31.803 -50.091 -0.723 1.00 62.83 ? 166 VAL B N 1 ATOM 3929 C CA . VAL B 1 177 ? -31.666 -50.350 0.706 1.00 59.90 ? 166 VAL B CA 1 ATOM 3930 C C . VAL B 1 177 ? -31.907 -51.834 0.885 1.00 65.66 ? 166 VAL B C 1 ATOM 3931 O O . VAL B 1 177 ? -32.955 -52.347 0.496 1.00 67.06 ? 166 VAL B O 1 ATOM 3932 C CB . VAL B 1 177 ? -32.585 -49.507 1.621 1.00 60.30 ? 166 VAL B CB 1 ATOM 3933 C CG1 . VAL B 1 177 ? -32.439 -49.925 3.080 1.00 59.82 ? 166 VAL B CG1 1 ATOM 3934 C CG2 . VAL B 1 177 ? -32.316 -48.011 1.461 1.00 58.92 ? 166 VAL B CG2 1 ATOM 3935 N N . LEU B 1 178 ? -30.933 -52.531 1.436 1.00 63.84 ? 167 LEU B N 1 ATOM 3936 C CA . LEU B 1 178 ? -31.082 -53.943 1.779 1.00 64.56 ? 167 LEU B CA 1 ATOM 3937 C C . LEU B 1 178 ? -31.504 -54.007 3.262 1.00 70.42 ? 167 LEU B C 1 ATOM 3938 O O . LEU B 1 178 ? -30.855 -53.392 4.126 1.00 69.89 ? 167 LEU B O 1 ATOM 3939 C CB . LEU B 1 178 ? -29.781 -54.717 1.555 1.00 64.46 ? 167 LEU B CB 1 ATOM 3940 C CG . LEU B 1 178 ? -29.191 -54.655 0.147 1.00 69.48 ? 167 LEU B CG 1 ATOM 3941 C CD1 . LEU B 1 178 ? -27.906 -55.425 0.085 1.00 69.57 ? 167 LEU B CD1 1 ATOM 3942 C CD2 . LEU B 1 178 ? -30.168 -55.183 -0.905 1.00 72.71 ? 167 LEU B CD2 1 ATOM 3943 N N . GLY B 1 179 ? -32.620 -54.691 3.533 1.00 68.19 ? 168 GLY B N 1 ATOM 3944 C CA . GLY B 1 179 ? -33.132 -54.854 4.894 1.00 68.57 ? 168 GLY B CA 1 ATOM 3945 C C . GLY B 1 179 ? -34.120 -53.813 5.387 1.00 72.62 ? 168 GLY B C 1 ATOM 3946 O O . GLY B 1 179 ? -34.491 -53.820 6.564 1.00 72.73 ? 168 GLY B O 1 ATOM 3947 N N . GLY B 1 180 ? -34.566 -52.933 4.496 1.00 66.97 ? 169 GLY B N 1 ATOM 3948 C CA . GLY B 1 180 ? -35.513 -51.908 4.866 1.00 65.58 ? 169 GLY B CA 1 ATOM 3949 C C . GLY B 1 180 ? -35.778 -50.930 3.755 1.00 70.25 ? 169 GLY B C 1 ATOM 3950 O O . GLY B 1 180 ? -35.648 -51.262 2.576 1.00 70.44 ? 169 GLY B O 1 ATOM 3951 N N . SER B 1 181 ? -36.147 -49.701 4.145 1.00 67.77 ? 170 SER B N 1 ATOM 3952 C CA . SER B 1 181 ? -36.492 -48.592 3.264 1.00 67.37 ? 170 SER B CA 1 ATOM 3953 C C . SER B 1 181 ? -35.898 -47.293 3.794 1.00 69.28 ? 170 SER B C 1 ATOM 3954 O O . SER B 1 181 ? -35.595 -47.203 4.980 1.00 68.56 ? 170 SER B O 1 ATOM 3955 C CB . SER B 1 181 ? -38.006 -48.460 3.194 1.00 72.44 ? 170 SER B CB 1 ATOM 3956 O OG . SER B 1 181 ? -38.542 -49.495 2.386 1.00 89.88 ? 170 SER B OG 1 ATOM 3957 N N . ASP B 1 182 ? -35.740 -46.292 2.920 1.00 64.73 ? 171 ASP B N 1 ATOM 3958 C CA . ASP B 1 182 ? -35.227 -44.992 3.305 1.00 64.15 ? 171 ASP B CA 1 ATOM 3959 C C . ASP B 1 182 ? -36.334 -43.937 3.237 1.00 67.18 ? 171 ASP B C 1 ATOM 3960 O O . ASP B 1 182 ? -36.679 -43.468 2.143 1.00 64.41 ? 171 ASP B O 1 ATOM 3961 C CB . ASP B 1 182 ? -33.997 -44.582 2.492 1.00 66.14 ? 171 ASP B CB 1 ATOM 3962 C CG . ASP B 1 182 ? -33.313 -43.300 2.960 1.00 80.02 ? 171 ASP B CG 1 ATOM 3963 O OD1 . ASP B 1 182 ? -33.839 -42.641 3.890 1.00 79.92 ? 171 ASP B OD1 1 ATOM 3964 O OD2 . ASP B 1 182 ? -32.252 -42.953 2.399 1.00 90.64 ? 171 ASP B OD2 1 ATOM 3965 N N . PRO B 1 183 ? -36.842 -43.541 4.442 1.00 64.70 ? 172 PRO B N 1 ATOM 3966 C CA . PRO B 1 183 ? -37.911 -42.534 4.539 1.00 64.56 ? 172 PRO B CA 1 ATOM 3967 C C . PRO B 1 183 ? -37.588 -41.200 3.890 1.00 70.75 ? 172 PRO B C 1 ATOM 3968 O O . PRO B 1 183 ? -38.501 -40.451 3.532 1.00 70.66 ? 172 PRO B O 1 ATOM 3969 C CB . PRO B 1 183 ? -38.095 -42.376 6.044 1.00 66.09 ? 172 PRO B CB 1 ATOM 3970 C CG . PRO B 1 183 ? -37.623 -43.629 6.616 1.00 70.76 ? 172 PRO B CG 1 ATOM 3971 C CD . PRO B 1 183 ? -36.494 -44.066 5.775 1.00 66.26 ? 172 PRO B CD 1 ATOM 3972 N N . GLN B 1 184 ? -36.294 -40.892 3.733 1.00 69.12 ? 173 GLN B N 1 ATOM 3973 C CA . GLN B 1 184 ? -35.876 -39.650 3.072 1.00 70.20 ? 173 GLN B CA 1 ATOM 3974 C C . GLN B 1 184 ? -36.311 -39.600 1.606 1.00 74.54 ? 173 GLN B C 1 ATOM 3975 O O . GLN B 1 184 ? -36.406 -38.512 1.043 1.00 72.56 ? 173 GLN B O 1 ATOM 3976 C CB . GLN B 1 184 ? -34.346 -39.479 3.148 1.00 72.28 ? 173 GLN B CB 1 ATOM 3977 C CG . GLN B 1 184 ? -33.813 -38.986 4.494 1.00 97.96 ? 173 GLN B CG 1 ATOM 3978 C CD . GLN B 1 184 ? -34.205 -37.555 4.850 1.00 131.00 ? 173 GLN B CD 1 ATOM 3979 O OE1 . GLN B 1 184 ? -35.087 -37.342 5.691 1.00 125.80 ? 173 GLN B OE1 1 ATOM 3980 N NE2 . GLN B 1 184 ? -33.589 -36.554 4.211 1.00 130.49 ? 173 GLN B NE2 1 ATOM 3981 N N . HIS B 1 185 ? -36.591 -40.780 1.000 1.00 73.82 ? 174 HIS B N 1 ATOM 3982 C CA . HIS B 1 185 ? -36.900 -40.909 -0.424 1.00 73.50 ? 174 HIS B CA 1 ATOM 3983 C C . HIS B 1 185 ? -38.321 -41.238 -0.807 1.00 76.51 ? 174 HIS B C 1 ATOM 3984 O O . HIS B 1 185 ? -38.621 -41.407 -1.987 1.00 76.09 ? 174 HIS B O 1 ATOM 3985 C CB . HIS B 1 185 ? -35.861 -41.790 -1.115 1.00 74.18 ? 174 HIS B CB 1 ATOM 3986 C CG . HIS B 1 185 ? -34.485 -41.181 -1.085 1.00 77.36 ? 174 HIS B CG 1 ATOM 3987 N ND1 . HIS B 1 185 ? -34.233 -39.927 -1.638 1.00 78.79 ? 174 HIS B ND1 1 ATOM 3988 C CD2 . HIS B 1 185 ? -33.332 -41.673 -0.573 1.00 79.18 ? 174 HIS B CD2 1 ATOM 3989 C CE1 . HIS B 1 185 ? -32.948 -39.700 -1.438 1.00 78.82 ? 174 HIS B CE1 1 ATOM 3990 N NE2 . HIS B 1 185 ? -32.361 -40.724 -0.809 1.00 79.31 ? 174 HIS B NE2 1 ATOM 3991 N N . TYR B 1 186 ? -39.213 -41.282 0.181 1.00 71.73 ? 175 TYR B N 1 ATOM 3992 C CA . TYR B 1 186 ? -40.623 -41.479 -0.084 1.00 69.88 ? 175 TYR B CA 1 ATOM 3993 C C . TYR B 1 186 ? -41.471 -40.658 0.867 1.00 73.29 ? 175 TYR B C 1 ATOM 3994 O O . TYR B 1 186 ? -41.003 -40.201 1.908 1.00 71.80 ? 175 TYR B O 1 ATOM 3995 C CB . TYR B 1 186 ? -41.011 -42.976 -0.110 1.00 69.86 ? 175 TYR B CB 1 ATOM 3996 C CG . TYR B 1 186 ? -40.904 -43.689 1.216 1.00 70.74 ? 175 TYR B CG 1 ATOM 3997 C CD1 . TYR B 1 186 ? -39.745 -44.354 1.578 1.00 72.72 ? 175 TYR B CD1 1 ATOM 3998 C CD2 . TYR B 1 186 ? -41.984 -43.754 2.084 1.00 71.31 ? 175 TYR B CD2 1 ATOM 3999 C CE1 . TYR B 1 186 ? -39.654 -45.047 2.786 1.00 73.99 ? 175 TYR B CE1 1 ATOM 4000 C CE2 . TYR B 1 186 ? -41.898 -44.428 3.298 1.00 71.99 ? 175 TYR B CE2 1 ATOM 4001 C CZ . TYR B 1 186 ? -40.728 -45.067 3.651 1.00 79.14 ? 175 TYR B CZ 1 ATOM 4002 O OH . TYR B 1 186 ? -40.646 -45.726 4.853 1.00 82.12 ? 175 TYR B OH 1 ATOM 4003 N N . GLU B 1 187 ? -42.710 -40.438 0.492 1.00 72.11 ? 176 GLU B N 1 ATOM 4004 C CA . GLU B 1 187 ? -43.657 -39.756 1.357 1.00 72.43 ? 176 GLU B CA 1 ATOM 4005 C C . GLU B 1 187 ? -44.926 -40.565 1.510 1.00 75.17 ? 176 GLU B C 1 ATOM 4006 O O . GLU B 1 187 ? -45.287 -41.371 0.644 1.00 76.08 ? 176 GLU B O 1 ATOM 4007 C CB . GLU B 1 187 ? -43.924 -38.311 0.942 1.00 73.82 ? 176 GLU B CB 1 ATOM 4008 C CG . GLU B 1 187 ? -44.359 -38.129 -0.487 1.00 86.64 ? 176 GLU B CG 1 ATOM 4009 C CD . GLU B 1 187 ? -44.470 -36.665 -0.837 1.00 120.76 ? 176 GLU B CD 1 ATOM 4010 O OE1 . GLU B 1 187 ? -43.692 -36.181 -1.688 1.00 116.74 ? 176 GLU B OE1 1 ATOM 4011 O OE2 . GLU B 1 187 ? -45.376 -36.004 -0.285 1.00 125.13 ? 176 GLU B OE2 1 ATOM 4012 N N . GLY B 1 188 ? -45.557 -40.385 2.647 1.00 69.47 ? 177 GLY B N 1 ATOM 4013 C CA . GLY B 1 188 ? -46.741 -41.145 2.977 1.00 68.85 ? 177 GLY B CA 1 ATOM 4014 C C . GLY B 1 188 ? -46.352 -42.542 3.405 1.00 71.51 ? 177 GLY B C 1 ATOM 4015 O O . GLY B 1 188 ? -45.217 -42.797 3.837 1.00 68.55 ? 177 GLY B O 1 ATOM 4016 N N . ASN B 1 189 ? -47.310 -43.456 3.280 1.00 67.87 ? 178 ASN B N 1 ATOM 4017 C CA . ASN B 1 189 ? -47.106 -44.834 3.675 1.00 66.14 ? 178 ASN B CA 1 ATOM 4018 C C . ASN B 1 189 ? -47.154 -45.745 2.481 1.00 67.00 ? 178 ASN B C 1 ATOM 4019 O O . ASN B 1 189 ? -47.735 -45.423 1.438 1.00 65.71 ? 178 ASN B O 1 ATOM 4020 C CB . ASN B 1 189 ? -48.149 -45.252 4.724 1.00 67.69 ? 178 ASN B CB 1 ATOM 4021 C CG . ASN B 1 189 ? -48.148 -44.360 5.943 1.00 85.91 ? 178 ASN B CG 1 ATOM 4022 O OD1 . ASN B 1 189 ? -47.146 -44.274 6.689 1.00 71.28 ? 178 ASN B OD1 1 ATOM 4023 N ND2 . ASN B 1 189 ? -49.260 -43.638 6.133 1.00 77.44 ? 178 ASN B ND2 1 ATOM 4024 N N . PHE B 1 190 ? -46.536 -46.900 2.641 1.00 63.03 ? 179 PHE B N 1 ATOM 4025 C CA . PHE B 1 190 ? -46.555 -47.922 1.617 1.00 62.93 ? 179 PHE B CA 1 ATOM 4026 C C . PHE B 1 190 ? -47.931 -48.534 1.544 1.00 63.59 ? 179 PHE B C 1 ATOM 4027 O O . PHE B 1 190 ? -48.602 -48.685 2.568 1.00 62.40 ? 179 PHE B O 1 ATOM 4028 C CB . PHE B 1 190 ? -45.549 -49.032 1.970 1.00 65.51 ? 179 PHE B CB 1 ATOM 4029 C CG . PHE B 1 190 ? -44.124 -48.689 1.642 1.00 67.95 ? 179 PHE B CG 1 ATOM 4030 C CD1 . PHE B 1 190 ? -43.688 -48.652 0.326 1.00 71.43 ? 179 PHE B CD1 1 ATOM 4031 C CD2 . PHE B 1 190 ? -43.214 -48.400 2.648 1.00 70.66 ? 179 PHE B CD2 1 ATOM 4032 C CE1 . PHE B 1 190 ? -42.368 -48.322 0.025 1.00 72.00 ? 179 PHE B CE1 1 ATOM 4033 C CE2 . PHE B 1 190 ? -41.895 -48.071 2.342 1.00 73.04 ? 179 PHE B CE2 1 ATOM 4034 C CZ . PHE B 1 190 ? -41.482 -48.039 1.035 1.00 70.51 ? 179 PHE B CZ 1 ATOM 4035 N N . HIS B 1 191 ? -48.363 -48.849 0.337 1.00 59.10 ? 180 HIS B N 1 ATOM 4036 C CA . HIS B 1 191 ? -49.525 -49.659 0.043 1.00 58.31 ? 180 HIS B CA 1 ATOM 4037 C C . HIS B 1 191 ? -48.950 -50.860 -0.713 1.00 59.92 ? 180 HIS B C 1 ATOM 4038 O O . HIS B 1 191 ? -48.156 -50.688 -1.655 1.00 59.17 ? 180 HIS B O 1 ATOM 4039 C CB . HIS B 1 191 ? -50.622 -48.942 -0.760 1.00 59.71 ? 180 HIS B CB 1 ATOM 4040 C CG . HIS B 1 191 ? -51.733 -49.887 -1.162 1.00 64.08 ? 180 HIS B CG 1 ATOM 4041 N ND1 . HIS B 1 191 ? -52.727 -50.273 -0.250 1.00 66.24 ? 180 HIS B ND1 1 ATOM 4042 C CD2 . HIS B 1 191 ? -51.938 -50.556 -2.331 1.00 64.85 ? 180 HIS B CD2 1 ATOM 4043 C CE1 . HIS B 1 191 ? -53.496 -51.140 -0.903 1.00 64.83 ? 180 HIS B CE1 1 ATOM 4044 N NE2 . HIS B 1 191 ? -53.061 -51.342 -2.154 1.00 64.46 ? 180 HIS B NE2 1 ATOM 4045 N N . TYR B 1 192 ? -49.353 -52.068 -0.308 1.00 54.71 ? 181 TYR B N 1 ATOM 4046 C CA . TYR B 1 192 ? -48.796 -53.300 -0.852 1.00 54.25 ? 181 TYR B CA 1 ATOM 4047 C C . TYR B 1 192 ? -49.734 -54.041 -1.764 1.00 61.19 ? 181 TYR B C 1 ATOM 4048 O O . TYR B 1 192 ? -50.945 -53.906 -1.643 1.00 61.97 ? 181 TYR B O 1 ATOM 4049 C CB . TYR B 1 192 ? -48.328 -54.223 0.296 1.00 54.62 ? 181 TYR B CB 1 ATOM 4050 C CG . TYR B 1 192 ? -47.272 -53.607 1.194 1.00 55.56 ? 181 TYR B CG 1 ATOM 4051 C CD1 . TYR B 1 192 ? -45.915 -53.786 0.932 1.00 56.57 ? 181 TYR B CD1 1 ATOM 4052 C CD2 . TYR B 1 192 ? -47.626 -52.847 2.310 1.00 56.24 ? 181 TYR B CD2 1 ATOM 4053 C CE1 . TYR B 1 192 ? -44.938 -53.231 1.756 1.00 54.72 ? 181 TYR B CE1 1 ATOM 4054 C CE2 . TYR B 1 192 ? -46.657 -52.268 3.130 1.00 56.73 ? 181 TYR B CE2 1 ATOM 4055 C CZ . TYR B 1 192 ? -45.313 -52.461 2.845 1.00 61.92 ? 181 TYR B CZ 1 ATOM 4056 O OH . TYR B 1 192 ? -44.351 -51.897 3.643 1.00 64.67 ? 181 TYR B OH 1 ATOM 4057 N N . ILE B 1 193 ? -49.173 -54.812 -2.687 1.00 59.09 ? 182 ILE B N 1 ATOM 4058 C CA . ILE B 1 193 ? -49.880 -55.673 -3.642 1.00 59.23 ? 182 ILE B CA 1 ATOM 4059 C C . ILE B 1 193 ? -49.221 -57.026 -3.571 1.00 65.66 ? 182 ILE B C 1 ATOM 4060 O O . ILE B 1 193 ? -48.004 -57.123 -3.732 1.00 64.67 ? 182 ILE B O 1 ATOM 4061 C CB . ILE B 1 193 ? -49.901 -55.117 -5.090 1.00 61.51 ? 182 ILE B CB 1 ATOM 4062 C CG1 . ILE B 1 193 ? -50.496 -53.719 -5.126 1.00 61.09 ? 182 ILE B CG1 1 ATOM 4063 C CG2 . ILE B 1 193 ? -50.707 -56.011 -5.993 1.00 61.88 ? 182 ILE B CG2 1 ATOM 4064 C CD1 . ILE B 1 193 ? -49.548 -52.660 -5.284 1.00 67.32 ? 182 ILE B CD1 1 ATOM 4065 N N . ASN B 1 194 ? -50.019 -58.064 -3.297 1.00 65.40 ? 183 ASN B N 1 ATOM 4066 C CA . ASN B 1 194 ? -49.509 -59.429 -3.167 1.00 66.30 ? 183 ASN B CA 1 ATOM 4067 C C . ASN B 1 194 ? -49.135 -59.998 -4.509 1.00 70.78 ? 183 ASN B C 1 ATOM 4068 O O . ASN B 1 194 ? -49.772 -59.678 -5.521 1.00 69.50 ? 183 ASN B O 1 ATOM 4069 C CB . ASN B 1 194 ? -50.528 -60.337 -2.457 1.00 67.99 ? 183 ASN B CB 1 ATOM 4070 C CG . ASN B 1 194 ? -50.863 -59.917 -1.050 1.00 90.07 ? 183 ASN B CG 1 ATOM 4071 O OD1 . ASN B 1 194 ? -52.011 -59.980 -0.625 1.00 95.39 ? 183 ASN B OD1 1 ATOM 4072 N ND2 . ASN B 1 194 ? -49.883 -59.454 -0.292 1.00 78.38 ? 183 ASN B ND2 1 ATOM 4073 N N . LEU B 1 195 ? -48.099 -60.839 -4.522 1.00 69.43 ? 184 LEU B N 1 ATOM 4074 C CA . LEU B 1 195 ? -47.662 -61.499 -5.751 1.00 70.63 ? 184 LEU B CA 1 ATOM 4075 C C . LEU B 1 195 ? -48.719 -62.514 -6.173 1.00 76.69 ? 184 LEU B C 1 ATOM 4076 O O . LEU B 1 195 ? -49.372 -63.112 -5.311 1.00 74.79 ? 184 LEU B O 1 ATOM 4077 C CB . LEU B 1 195 ? -46.298 -62.216 -5.555 1.00 70.44 ? 184 LEU B CB 1 ATOM 4078 C CG . LEU B 1 195 ? -45.109 -61.367 -5.095 1.00 74.77 ? 184 LEU B CG 1 ATOM 4079 C CD1 . LEU B 1 195 ? -43.852 -62.172 -5.064 1.00 74.85 ? 184 LEU B CD1 1 ATOM 4080 C CD2 . LEU B 1 195 ? -44.925 -60.127 -5.960 1.00 76.49 ? 184 LEU B CD2 1 ATOM 4081 N N . ILE B 1 196 ? -48.884 -62.708 -7.491 1.00 76.17 ? 185 ILE B N 1 ATOM 4082 C CA . ILE B 1 196 ? -49.769 -63.743 -8.033 1.00 77.96 ? 185 ILE B CA 1 ATOM 4083 C C . ILE B 1 196 ? -49.279 -65.103 -7.477 1.00 85.77 ? 185 ILE B C 1 ATOM 4084 O O . ILE B 1 196 ? -50.081 -65.937 -7.055 1.00 85.88 ? 185 ILE B O 1 ATOM 4085 C CB . ILE B 1 196 ? -49.718 -63.749 -9.579 1.00 81.41 ? 185 ILE B CB 1 ATOM 4086 C CG1 . ILE B 1 196 ? -50.249 -62.443 -10.180 1.00 82.38 ? 185 ILE B CG1 1 ATOM 4087 C CG2 . ILE B 1 196 ? -50.395 -65.007 -10.169 1.00 82.23 ? 185 ILE B CG2 1 ATOM 4088 C CD1 . ILE B 1 196 ? -51.665 -62.253 -10.215 1.00 100.28 ? 185 ILE B CD1 1 ATOM 4089 N N . LYS B 1 197 ? -47.955 -65.299 -7.479 1.00 83.73 ? 186 LYS B N 1 ATOM 4090 C CA . LYS B 1 197 ? -47.299 -66.491 -6.967 1.00 83.54 ? 186 LYS B CA 1 ATOM 4091 C C . LYS B 1 197 ? -45.876 -66.184 -6.582 1.00 89.28 ? 186 LYS B C 1 ATOM 4092 O O . LYS B 1 197 ? -45.292 -65.211 -7.076 1.00 90.25 ? 186 LYS B O 1 ATOM 4093 C CB . LYS B 1 197 ? -47.306 -67.608 -8.018 1.00 85.98 ? 186 LYS B CB 1 ATOM 4094 C CG . LYS B 1 197 ? -46.644 -67.245 -9.342 1.00 101.46 ? 186 LYS B CG 1 ATOM 4095 C CD . LYS B 1 197 ? -46.660 -68.424 -10.291 1.00 107.07 ? 186 LYS B CD 1 ATOM 4096 C CE . LYS B 1 197 ? -46.043 -68.088 -11.620 1.00 114.33 ? 186 LYS B CE 1 ATOM 4097 N NZ . LYS B 1 197 ? -45.566 -69.321 -12.291 1.00 124.79 ? 186 LYS B NZ 1 ATOM 4098 N N . THR B 1 198 ? -45.295 -67.038 -5.725 1.00 86.23 ? 187 THR B N 1 ATOM 4099 C CA . THR B 1 198 ? -43.893 -66.923 -5.339 1.00 85.80 ? 187 THR B CA 1 ATOM 4100 C C . THR B 1 198 ? -43.051 -67.300 -6.578 1.00 88.69 ? 187 THR B C 1 ATOM 4101 O O . THR B 1 198 ? -43.557 -67.980 -7.496 1.00 88.33 ? 187 THR B O 1 ATOM 4102 C CB . THR B 1 198 ? -43.573 -67.791 -4.108 1.00 90.17 ? 187 THR B CB 1 ATOM 4103 O OG1 . THR B 1 198 ? -42.289 -67.389 -3.612 1.00 91.62 ? 187 THR B OG1 1 ATOM 4104 C CG2 . THR B 1 198 ? -43.649 -69.303 -4.383 1.00 86.20 ? 187 THR B CG2 1 ATOM 4105 N N . GLY B 1 199 ? -41.802 -66.844 -6.596 1.00 82.61 ? 188 GLY B N 1 ATOM 4106 C CA . GLY B 1 199 ? -40.899 -67.176 -7.686 1.00 81.20 ? 188 GLY B CA 1 ATOM 4107 C C . GLY B 1 199 ? -40.730 -66.094 -8.728 1.00 81.70 ? 188 GLY B C 1 ATOM 4108 O O . GLY B 1 199 ? -39.779 -66.138 -9.503 1.00 82.27 ? 188 GLY B O 1 ATOM 4109 N N . VAL B 1 200 ? -41.628 -65.102 -8.740 1.00 74.39 ? 189 VAL B N 1 ATOM 4110 C CA . VAL B 1 200 ? -41.591 -63.998 -9.704 1.00 71.97 ? 189 VAL B CA 1 ATOM 4111 C C . VAL B 1 200 ? -42.198 -62.718 -9.095 1.00 72.55 ? 189 VAL B C 1 ATOM 4112 O O . VAL B 1 200 ? -43.259 -62.774 -8.463 1.00 72.51 ? 189 VAL B O 1 ATOM 4113 C CB . VAL B 1 200 ? -42.226 -64.409 -11.078 1.00 74.68 ? 189 VAL B CB 1 ATOM 4114 C CG1 . VAL B 1 200 ? -43.700 -64.748 -10.938 1.00 74.28 ? 189 VAL B CG1 1 ATOM 4115 C CG2 . VAL B 1 200 ? -42.018 -63.356 -12.157 1.00 74.48 ? 189 VAL B CG2 1 ATOM 4116 N N . TRP B 1 201 ? -41.512 -61.572 -9.264 1.00 64.83 ? 190 TRP B N 1 ATOM 4117 C CA . TRP B 1 201 ? -42.001 -60.293 -8.757 1.00 62.22 ? 190 TRP B CA 1 ATOM 4118 C C . TRP B 1 201 ? -43.065 -59.763 -9.728 1.00 67.99 ? 190 TRP B C 1 ATOM 4119 O O . TRP B 1 201 ? -42.874 -58.766 -10.425 1.00 69.06 ? 190 TRP B O 1 ATOM 4120 C CB . TRP B 1 201 ? -40.855 -59.304 -8.571 1.00 59.36 ? 190 TRP B CB 1 ATOM 4121 C CG . TRP B 1 201 ? -39.878 -59.660 -7.486 1.00 59.54 ? 190 TRP B CG 1 ATOM 4122 C CD1 . TRP B 1 201 ? -38.566 -59.985 -7.644 1.00 61.66 ? 190 TRP B CD1 1 ATOM 4123 C CD2 . TRP B 1 201 ? -40.114 -59.628 -6.067 1.00 59.97 ? 190 TRP B CD2 1 ATOM 4124 N NE1 . TRP B 1 201 ? -37.970 -60.169 -6.415 1.00 60.82 ? 190 TRP B NE1 1 ATOM 4125 C CE2 . TRP B 1 201 ? -38.897 -59.971 -5.432 1.00 63.19 ? 190 TRP B CE2 1 ATOM 4126 C CE3 . TRP B 1 201 ? -41.238 -59.336 -5.267 1.00 61.65 ? 190 TRP B CE3 1 ATOM 4127 C CZ2 . TRP B 1 201 ? -38.767 -60.038 -4.043 1.00 63.35 ? 190 TRP B CZ2 1 ATOM 4128 C CZ3 . TRP B 1 201 ? -41.108 -59.407 -3.889 1.00 63.85 ? 190 TRP B CZ3 1 ATOM 4129 C CH2 . TRP B 1 201 ? -39.887 -59.756 -3.290 1.00 64.67 ? 190 TRP B CH2 1 ATOM 4130 N N . GLN B 1 202 ? -44.197 -60.452 -9.769 1.00 64.99 ? 191 GLN B N 1 ATOM 4131 C CA . GLN B 1 202 ? -45.296 -60.157 -10.686 1.00 64.13 ? 191 GLN B CA 1 ATOM 4132 C C . GLN B 1 202 ? -46.612 -60.064 -9.932 1.00 65.74 ? 191 GLN B C 1 ATOM 4133 O O . GLN B 1 202 ? -46.890 -60.891 -9.050 1.00 67.20 ? 191 GLN B O 1 ATOM 4134 C CB . GLN B 1 202 ? -45.347 -61.241 -11.766 1.00 64.81 ? 191 GLN B CB 1 ATOM 4135 C CG . GLN B 1 202 ? -46.249 -60.912 -12.940 1.00 63.91 ? 191 GLN B CG 1 ATOM 4136 C CD . GLN B 1 202 ? -46.084 -61.915 -14.040 1.00 72.08 ? 191 GLN B CD 1 ATOM 4137 O OE1 . GLN B 1 202 ? -45.865 -61.554 -15.190 1.00 66.54 ? 191 GLN B OE1 1 ATOM 4138 N NE2 . GLN B 1 202 ? -46.157 -63.195 -13.704 1.00 65.68 ? 191 GLN B NE2 1 ATOM 4139 N N . ILE B 1 203 ? -47.400 -59.049 -10.266 1.00 58.51 ? 192 ILE B N 1 ATOM 4140 C CA . ILE B 1 203 ? -48.658 -58.767 -9.586 1.00 58.45 ? 192 ILE B CA 1 ATOM 4141 C C . ILE B 1 203 ? -49.813 -58.670 -10.569 1.00 66.38 ? 192 ILE B C 1 ATOM 4142 O O . ILE B 1 203 ? -49.591 -58.537 -11.773 1.00 66.17 ? 192 ILE B O 1 ATOM 4143 C CB . ILE B 1 203 ? -48.528 -57.483 -8.707 1.00 60.46 ? 192 ILE B CB 1 ATOM 4144 C CG1 . ILE B 1 203 ? -48.089 -56.250 -9.549 1.00 59.64 ? 192 ILE B CG1 1 ATOM 4145 C CG2 . ILE B 1 203 ? -47.593 -57.710 -7.486 1.00 59.54 ? 192 ILE B CG2 1 ATOM 4146 C CD1 . ILE B 1 203 ? -48.179 -54.914 -8.862 1.00 56.37 ? 192 ILE B CD1 1 ATOM 4147 N N . GLN B 1 204 ? -51.046 -58.744 -10.057 1.00 65.53 ? 193 GLN B N 1 ATOM 4148 C CA . GLN B 1 204 ? -52.223 -58.580 -10.888 1.00 66.39 ? 193 GLN B CA 1 ATOM 4149 C C . GLN B 1 204 ? -52.456 -57.085 -11.114 1.00 69.16 ? 193 GLN B C 1 ATOM 4150 O O . GLN B 1 204 ? -52.369 -56.288 -10.172 1.00 66.91 ? 193 GLN B O 1 ATOM 4151 C CB . GLN B 1 204 ? -53.467 -59.217 -10.213 1.00 68.35 ? 193 GLN B CB 1 ATOM 4152 C CG . GLN B 1 204 ? -54.769 -59.195 -11.061 1.00 81.54 ? 193 GLN B CG 1 ATOM 4153 C CD . GLN B 1 204 ? -54.735 -60.137 -12.248 1.00 108.89 ? 193 GLN B CD 1 ATOM 4154 O OE1 . GLN B 1 204 ? -54.118 -61.208 -12.230 1.00 111.48 ? 193 GLN B OE1 1 ATOM 4155 N NE2 . GLN B 1 204 ? -55.417 -59.772 -13.311 1.00 96.97 ? 193 GLN B NE2 1 ATOM 4156 N N . MET B 1 205 ? -52.749 -56.722 -12.360 1.00 67.35 ? 194 MET B N 1 ATOM 4157 C CA . MET B 1 205 ? -53.118 -55.349 -12.715 1.00 68.91 ? 194 MET B CA 1 ATOM 4158 C C . MET B 1 205 ? -54.583 -55.391 -13.191 1.00 80.24 ? 194 MET B C 1 ATOM 4159 O O . MET B 1 205 ? -54.948 -56.246 -14.012 1.00 82.30 ? 194 MET B O 1 ATOM 4160 C CB . MET B 1 205 ? -52.187 -54.767 -13.786 1.00 70.27 ? 194 MET B CB 1 ATOM 4161 C CG . MET B 1 205 ? -52.495 -53.314 -14.134 1.00 72.25 ? 194 MET B CG 1 ATOM 4162 S SD . MET B 1 205 ? -51.045 -52.394 -14.713 1.00 73.47 ? 194 MET B SD 1 ATOM 4163 C CE . MET B 1 205 ? -50.652 -53.273 -16.156 1.00 69.14 ? 194 MET B CE 1 ATOM 4164 N N . LYS B 1 206 ? -55.411 -54.473 -12.690 1.00 77.86 ? 195 LYS B N 1 ATOM 4165 C CA . LYS B 1 206 ? -56.841 -54.494 -12.973 1.00 78.53 ? 195 LYS B CA 1 ATOM 4166 C C . LYS B 1 206 ? -57.320 -53.469 -13.971 1.00 84.39 ? 195 LYS B C 1 ATOM 4167 O O . LYS B 1 206 ? -58.530 -53.271 -14.122 1.00 86.37 ? 195 LYS B O 1 ATOM 4168 C CB . LYS B 1 206 ? -57.637 -54.429 -11.668 1.00 81.54 ? 195 LYS B CB 1 ATOM 4169 C CG . LYS B 1 206 ? -57.412 -55.639 -10.761 1.00 100.74 ? 195 LYS B CG 1 ATOM 4170 C CD . LYS B 1 206 ? -58.054 -55.436 -9.383 1.00 115.22 ? 195 LYS B CD 1 ATOM 4171 C CE . LYS B 1 206 ? -57.113 -54.847 -8.347 1.00 122.84 ? 195 LYS B CE 1 ATOM 4172 N NZ . LYS B 1 206 ? -56.692 -53.452 -8.670 1.00 123.94 ? 195 LYS B NZ 1 ATOM 4173 N N . GLY B 1 207 ? -56.377 -52.816 -14.626 1.00 80.05 ? 196 GLY B N 1 ATOM 4174 C CA . GLY B 1 207 ? -56.694 -51.856 -15.668 1.00 80.01 ? 196 GLY B CA 1 ATOM 4175 C C . GLY B 1 207 ? -55.652 -50.785 -15.902 1.00 84.43 ? 196 GLY B C 1 ATOM 4176 O O . GLY B 1 207 ? -54.909 -50.422 -14.989 1.00 84.75 ? 196 GLY B O 1 ATOM 4177 N N . VAL B 1 208 ? -55.573 -50.288 -17.145 1.00 79.20 ? 197 VAL B N 1 ATOM 4178 C CA . VAL B 1 208 ? -54.694 -49.185 -17.524 1.00 77.90 ? 197 VAL B CA 1 ATOM 4179 C C . VAL B 1 208 ? -55.569 -48.062 -18.110 1.00 84.57 ? 197 VAL B C 1 ATOM 4180 O O . VAL B 1 208 ? -56.220 -48.240 -19.143 1.00 83.12 ? 197 VAL B O 1 ATOM 4181 C CB . VAL B 1 208 ? -53.536 -49.589 -18.456 1.00 79.89 ? 197 VAL B CB 1 ATOM 4182 C CG1 . VAL B 1 208 ? -52.699 -48.378 -18.828 1.00 78.94 ? 197 VAL B CG1 1 ATOM 4183 C CG2 . VAL B 1 208 ? -52.664 -50.644 -17.807 1.00 79.70 ? 197 VAL B CG2 1 ATOM 4184 N N . SER B 1 209 ? -55.594 -46.919 -17.429 1.00 83.48 ? 198 SER B N 1 ATOM 4185 C CA . SER B 1 209 ? -56.411 -45.797 -17.835 1.00 84.52 ? 198 SER B CA 1 ATOM 4186 C C . SER B 1 209 ? -55.610 -44.722 -18.535 1.00 92.09 ? 198 SER B C 1 ATOM 4187 O O . SER B 1 209 ? -54.506 -44.389 -18.111 1.00 92.40 ? 198 SER B O 1 ATOM 4188 C CB . SER B 1 209 ? -57.109 -45.186 -16.621 1.00 87.87 ? 198 SER B CB 1 ATOM 4189 O OG . SER B 1 209 ? -57.900 -46.150 -15.951 1.00 97.20 ? 198 SER B OG 1 ATOM 4190 N N . VAL B 1 210 ? -56.187 -44.158 -19.596 1.00 90.02 ? 199 VAL B N 1 ATOM 4191 C CA . VAL B 1 210 ? -55.638 -43.007 -20.306 1.00 89.69 ? 199 VAL B CA 1 ATOM 4192 C C . VAL B 1 210 ? -56.666 -41.908 -20.053 1.00 97.89 ? 199 VAL B C 1 ATOM 4193 O O . VAL B 1 210 ? -57.758 -41.936 -20.615 1.00 98.21 ? 199 VAL B O 1 ATOM 4194 C CB . VAL B 1 210 ? -55.395 -43.283 -21.799 1.00 91.58 ? 199 VAL B CB 1 ATOM 4195 C CG1 . VAL B 1 210 ? -54.853 -42.049 -22.474 1.00 90.89 ? 199 VAL B CG1 1 ATOM 4196 C CG2 . VAL B 1 210 ? -54.439 -44.446 -21.989 1.00 91.03 ? 199 VAL B CG2 1 ATOM 4197 N N . GLY B 1 211 ? -56.336 -40.994 -19.158 1.00 97.92 ? 200 GLY B N 1 ATOM 4198 C CA . GLY B 1 211 ? -57.284 -39.992 -18.700 1.00 99.82 ? 200 GLY B CA 1 ATOM 4199 C C . GLY B 1 211 ? -58.187 -40.650 -17.674 1.00 109.55 ? 200 GLY B C 1 ATOM 4200 O O . GLY B 1 211 ? -57.707 -41.430 -16.842 1.00 111.30 ? 200 GLY B O 1 ATOM 4201 N N . SER B 1 212 ? -59.498 -40.382 -17.733 1.00 107.61 ? 201 SER B N 1 ATOM 4202 C CA . SER B 1 212 ? -60.449 -40.968 -16.778 1.00 107.55 ? 201 SER B CA 1 ATOM 4203 C C . SER B 1 212 ? -61.022 -42.310 -17.236 1.00 110.14 ? 201 SER B C 1 ATOM 4204 O O . SER B 1 212 ? -61.656 -43.002 -16.437 1.00 109.95 ? 201 SER B O 1 ATOM 4205 C CB . SER B 1 212 ? -61.572 -39.985 -16.462 1.00 112.36 ? 201 SER B CB 1 ATOM 4206 O OG . SER B 1 212 ? -62.298 -39.617 -17.623 1.00 125.87 ? 201 SER B OG 1 ATOM 4207 N N . SER B 1 213 ? -60.769 -42.698 -18.496 1.00 105.69 ? 202 SER B N 1 ATOM 4208 C CA . SER B 1 213 ? -61.314 -43.924 -19.062 1.00 105.15 ? 202 SER B CA 1 ATOM 4209 C C . SER B 1 213 ? -60.324 -45.094 -19.158 1.00 108.55 ? 202 SER B C 1 ATOM 4210 O O . SER B 1 213 ? -59.214 -44.934 -19.681 1.00 108.83 ? 202 SER B O 1 ATOM 4211 C CB . SER B 1 213 ? -61.953 -43.636 -20.418 1.00 107.46 ? 202 SER B CB 1 ATOM 4212 O OG . SER B 1 213 ? -61.036 -43.031 -21.317 1.00 113.58 ? 202 SER B OG 1 ATOM 4213 N N . THR B 1 214 ? -60.754 -46.282 -18.672 1.00 102.82 ? 203 THR B N 1 ATOM 4214 C CA . THR B 1 214 ? -59.969 -47.515 -18.732 1.00 101.41 ? 203 THR B CA 1 ATOM 4215 C C . THR B 1 214 ? -60.010 -48.114 -20.148 1.00 102.61 ? 203 THR B C 1 ATOM 4216 O O . THR B 1 214 ? -60.865 -48.947 -20.455 1.00 102.30 ? 203 THR B O 1 ATOM 4217 C CB . THR B 1 214 ? -60.411 -48.511 -17.654 1.00 107.40 ? 203 THR B CB 1 ATOM 4218 O OG1 . THR B 1 214 ? -60.438 -47.851 -16.386 1.00 111.24 ? 203 THR B OG1 1 ATOM 4219 C CG2 . THR B 1 214 ? -59.505 -49.728 -17.584 1.00 102.76 ? 203 THR B CG2 1 ATOM 4220 N N . LEU B 1 215 ? -59.077 -47.697 -20.991 1.00 96.60 ? 204 LEU B N 1 ATOM 4221 C CA . LEU B 1 215 ? -58.994 -48.180 -22.357 1.00 95.83 ? 204 LEU B CA 1 ATOM 4222 C C . LEU B 1 215 ? -58.333 -49.540 -22.449 1.00 96.13 ? 204 LEU B C 1 ATOM 4223 O O . LEU B 1 215 ? -58.604 -50.287 -23.391 1.00 95.79 ? 204 LEU B O 1 ATOM 4224 C CB . LEU B 1 215 ? -58.228 -47.172 -23.227 1.00 96.59 ? 204 LEU B CB 1 ATOM 4225 C CG . LEU B 1 215 ? -58.760 -45.700 -23.250 1.00 102.34 ? 204 LEU B CG 1 ATOM 4226 C CD1 . LEU B 1 215 ? -58.099 -44.932 -24.314 1.00 103.31 ? 204 LEU B CD1 1 ATOM 4227 C CD2 . LEU B 1 215 ? -60.300 -45.529 -23.380 1.00 104.38 ? 204 LEU B CD2 1 ATOM 4228 N N . LEU B 1 216 ? -57.439 -49.851 -21.513 1.00 90.72 ? 205 LEU B N 1 ATOM 4229 C CA . LEU B 1 216 ? -56.664 -51.092 -21.573 1.00 90.22 ? 205 LEU B CA 1 ATOM 4230 C C . LEU B 1 216 ? -56.737 -51.947 -20.323 1.00 90.90 ? 205 LEU B C 1 ATOM 4231 O O . LEU B 1 216 ? -57.072 -51.452 -19.246 1.00 88.94 ? 205 LEU B O 1 ATOM 4232 C CB . LEU B 1 216 ? -55.180 -50.780 -21.889 1.00 90.77 ? 205 LEU B CB 1 ATOM 4233 C CG . LEU B 1 216 ? -54.868 -50.050 -23.200 1.00 96.63 ? 205 LEU B CG 1 ATOM 4234 C CD1 . LEU B 1 216 ? -53.515 -49.380 -23.142 1.00 97.65 ? 205 LEU B CD1 1 ATOM 4235 C CD2 . LEU B 1 216 ? -54.868 -51.013 -24.346 1.00 99.76 ? 205 LEU B CD2 1 ATOM 4236 N N . CYS B 1 217 ? -56.406 -53.244 -20.476 1.00 86.82 ? 206 CYS B N 1 ATOM 4237 C CA . CYS B 1 217 ? -56.309 -54.211 -19.380 1.00 86.60 ? 206 CYS B CA 1 ATOM 4238 C C . CYS B 1 217 ? -57.599 -54.349 -18.533 1.00 94.91 ? 206 CYS B C 1 ATOM 4239 O O . CYS B 1 217 ? -57.543 -54.735 -17.361 1.00 95.10 ? 206 CYS B O 1 ATOM 4240 C CB . CYS B 1 217 ? -55.063 -53.916 -18.531 1.00 85.94 ? 206 CYS B CB 1 ATOM 4241 S SG . CYS B 1 217 ? -54.791 -55.033 -17.124 1.00 88.90 ? 206 CYS B SG 1 ATOM 4242 N N . GLU B 1 218 ? -58.777 -54.049 -19.126 1.00 93.47 ? 207 GLU B N 1 ATOM 4243 C CA . GLU B 1 218 ? -60.051 -54.302 -18.439 1.00 92.98 ? 207 GLU B CA 1 ATOM 4244 C C . GLU B 1 218 ? -60.196 -55.818 -18.506 1.00 96.08 ? 207 GLU B C 1 ATOM 4245 O O . GLU B 1 218 ? -59.832 -56.419 -19.528 1.00 95.43 ? 207 GLU B O 1 ATOM 4246 C CB . GLU B 1 218 ? -61.231 -53.558 -19.078 1.00 94.64 ? 207 GLU B CB 1 ATOM 4247 C CG . GLU B 1 218 ? -61.523 -53.883 -20.535 1.00 111.46 ? 207 GLU B CG 1 ATOM 4248 C CD . GLU B 1 218 ? -60.744 -53.065 -21.541 1.00 147.22 ? 207 GLU B CD 1 ATOM 4249 O OE1 . GLU B 1 218 ? -61.305 -52.059 -22.035 1.00 154.82 ? 207 GLU B OE1 1 ATOM 4250 O OE2 . GLU B 1 218 ? -59.579 -53.424 -21.837 1.00 140.16 ? 207 GLU B OE2 1 ATOM 4251 N N . ASP B 1 219 ? -60.615 -56.446 -17.398 1.00 92.90 ? 208 ASP B N 1 ATOM 4252 C CA . ASP B 1 219 ? -60.662 -57.918 -17.237 1.00 93.24 ? 208 ASP B CA 1 ATOM 4253 C C . ASP B 1 219 ? -59.316 -58.442 -16.717 1.00 94.89 ? 208 ASP B C 1 ATOM 4254 O O . ASP B 1 219 ? -59.094 -59.658 -16.684 1.00 94.29 ? 208 ASP B O 1 ATOM 4255 C CB . ASP B 1 219 ? -61.084 -58.693 -18.522 1.00 95.98 ? 208 ASP B CB 1 ATOM 4256 C CG . ASP B 1 219 ? -62.429 -58.305 -19.108 1.00 111.05 ? 208 ASP B CG 1 ATOM 4257 O OD1 . ASP B 1 219 ? -63.394 -58.129 -18.320 1.00 113.58 ? 208 ASP B OD1 1 ATOM 4258 O OD2 . ASP B 1 219 ? -62.518 -58.174 -20.357 1.00 114.20 ? 208 ASP B OD2 1 ATOM 4259 N N . GLY B 1 220 ? -58.438 -57.517 -16.320 1.00 89.84 ? 209 GLY B N 1 ATOM 4260 C CA . GLY B 1 220 ? -57.147 -57.826 -15.715 1.00 88.48 ? 209 GLY B CA 1 ATOM 4261 C C . GLY B 1 220 ? -56.026 -58.254 -16.631 1.00 88.90 ? 209 GLY B C 1 ATOM 4262 O O . GLY B 1 220 ? -56.252 -58.701 -17.756 1.00 88.25 ? 209 GLY B O 1 ATOM 4263 N N . CYS B 1 221 ? -54.799 -58.074 -16.141 1.00 83.27 ? 210 CYS B N 1 ATOM 4264 C CA . CYS B 1 221 ? -53.564 -58.463 -16.803 1.00 82.19 ? 210 CYS B CA 1 ATOM 4265 C C . CYS B 1 221 ? -52.443 -58.568 -15.780 1.00 78.76 ? 210 CYS B C 1 ATOM 4266 O O . CYS B 1 221 ? -52.671 -58.357 -14.584 1.00 77.05 ? 210 CYS B O 1 ATOM 4267 C CB . CYS B 1 221 ? -53.211 -57.522 -17.953 1.00 83.70 ? 210 CYS B CB 1 ATOM 4268 S SG . CYS B 1 221 ? -52.950 -55.820 -17.450 1.00 88.62 ? 210 CYS B SG 1 ATOM 4269 N N . LEU B 1 222 ? -51.249 -58.934 -16.238 1.00 71.73 ? 211 LEU B N 1 ATOM 4270 C CA . LEU B 1 222 ? -50.114 -59.102 -15.348 1.00 70.34 ? 211 LEU B CA 1 ATOM 4271 C C . LEU B 1 222 ? -49.132 -57.926 -15.434 1.00 73.87 ? 211 LEU B C 1 ATOM 4272 O O . LEU B 1 222 ? -48.995 -57.274 -16.488 1.00 73.45 ? 211 LEU B O 1 ATOM 4273 C CB . LEU B 1 222 ? -49.399 -60.412 -15.645 1.00 69.81 ? 211 LEU B CB 1 ATOM 4274 C CG . LEU B 1 222 ? -50.211 -61.696 -15.648 1.00 72.52 ? 211 LEU B CG 1 ATOM 4275 C CD1 . LEU B 1 222 ? -49.522 -62.772 -16.472 1.00 71.55 ? 211 LEU B CD1 1 ATOM 4276 C CD2 . LEU B 1 222 ? -50.448 -62.189 -14.240 1.00 73.45 ? 211 LEU B CD2 1 ATOM 4277 N N . ALA B 1 223 ? -48.466 -57.643 -14.296 1.00 67.91 ? 212 ALA B N 1 ATOM 4278 C CA . ALA B 1 223 ? -47.471 -56.581 -14.208 1.00 64.44 ? 212 ALA B CA 1 ATOM 4279 C C . ALA B 1 223 ? -46.219 -57.064 -13.492 1.00 64.92 ? 212 ALA B C 1 ATOM 4280 O O . ALA B 1 223 ? -46.248 -57.364 -12.296 1.00 62.59 ? 212 ALA B O 1 ATOM 4281 C CB . ALA B 1 223 ? -48.052 -55.366 -13.522 1.00 64.24 ? 212 ALA B CB 1 ATOM 4282 N N . LEU B 1 224 ? -45.127 -57.177 -14.249 1.00 61.98 ? 213 LEU B N 1 ATOM 4283 C CA . LEU B 1 224 ? -43.823 -57.530 -13.711 1.00 61.55 ? 213 LEU B CA 1 ATOM 4284 C C . LEU B 1 224 ? -43.192 -56.214 -13.207 1.00 64.66 ? 213 LEU B C 1 ATOM 4285 O O . LEU B 1 224 ? -43.143 -55.233 -13.955 1.00 65.07 ? 213 LEU B O 1 ATOM 4286 C CB . LEU B 1 224 ? -42.971 -58.173 -14.812 1.00 61.35 ? 213 LEU B CB 1 ATOM 4287 C CG . LEU B 1 224 ? -41.581 -58.708 -14.433 1.00 66.18 ? 213 LEU B CG 1 ATOM 4288 C CD1 . LEU B 1 224 ? -41.647 -59.906 -13.473 1.00 66.60 ? 213 LEU B CD1 1 ATOM 4289 C CD2 . LEU B 1 224 ? -40.818 -59.089 -15.666 1.00 66.70 ? 213 LEU B CD2 1 ATOM 4290 N N . VAL B 1 225 ? -42.787 -56.175 -11.924 1.00 57.60 ? 214 VAL B N 1 ATOM 4291 C CA . VAL B 1 225 ? -42.157 -54.988 -11.334 1.00 55.92 ? 214 VAL B CA 1 ATOM 4292 C C . VAL B 1 225 ? -40.658 -55.233 -11.500 1.00 58.81 ? 214 VAL B C 1 ATOM 4293 O O . VAL B 1 225 ? -40.036 -56.002 -10.750 1.00 56.55 ? 214 VAL B O 1 ATOM 4294 C CB . VAL B 1 225 ? -42.614 -54.733 -9.883 1.00 58.99 ? 214 VAL B CB 1 ATOM 4295 C CG1 . VAL B 1 225 ? -42.029 -53.434 -9.354 1.00 58.10 ? 214 VAL B CG1 1 ATOM 4296 C CG2 . VAL B 1 225 ? -44.143 -54.699 -9.805 1.00 59.15 ? 214 VAL B CG2 1 ATOM 4297 N N . ASP B 1 226 ? -40.105 -54.628 -12.553 1.00 55.49 ? 215 ASP B N 1 ATOM 4298 C CA . ASP B 1 226 ? -38.792 -54.927 -13.062 1.00 55.70 ? 215 ASP B CA 1 ATOM 4299 C C . ASP B 1 226 ? -37.816 -53.791 -12.980 1.00 61.25 ? 215 ASP B C 1 ATOM 4300 O O . ASP B 1 226 ? -37.807 -52.920 -13.847 1.00 62.81 ? 215 ASP B O 1 ATOM 4301 C CB . ASP B 1 226 ? -38.979 -55.363 -14.517 1.00 58.19 ? 215 ASP B CB 1 ATOM 4302 C CG . ASP B 1 226 ? -37.770 -56.056 -15.108 1.00 73.20 ? 215 ASP B CG 1 ATOM 4303 O OD1 . ASP B 1 226 ? -36.726 -56.149 -14.407 1.00 73.53 ? 215 ASP B OD1 1 ATOM 4304 O OD2 . ASP B 1 226 ? -37.866 -56.516 -16.260 1.00 81.30 ? 215 ASP B OD2 1 ATOM 4305 N N . THR B 1 227 ? -36.936 -53.841 -11.981 1.00 56.70 ? 216 THR B N 1 ATOM 4306 C CA . THR B 1 227 ? -35.964 -52.791 -11.718 1.00 55.59 ? 216 THR B CA 1 ATOM 4307 C C . THR B 1 227 ? -34.868 -52.718 -12.760 1.00 60.30 ? 216 THR B C 1 ATOM 4308 O O . THR B 1 227 ? -34.206 -51.690 -12.839 1.00 61.61 ? 216 THR B O 1 ATOM 4309 C CB . THR B 1 227 ? -35.401 -52.933 -10.311 1.00 62.24 ? 216 THR B CB 1 ATOM 4310 O OG1 . THR B 1 227 ? -34.678 -54.154 -10.225 1.00 66.53 ? 216 THR B OG1 1 ATOM 4311 C CG2 . THR B 1 227 ? -36.470 -52.910 -9.251 1.00 55.48 ? 216 THR B CG2 1 ATOM 4312 N N . GLY B 1 228 ? -34.686 -53.797 -13.529 1.00 56.17 ? 217 GLY B N 1 ATOM 4313 C CA . GLY B 1 228 ? -33.695 -53.902 -14.591 1.00 55.63 ? 217 GLY B CA 1 ATOM 4314 C C . GLY B 1 228 ? -34.183 -53.422 -15.944 1.00 60.13 ? 217 GLY B C 1 ATOM 4315 O O . GLY B 1 228 ? -33.405 -53.399 -16.899 1.00 61.02 ? 217 GLY B O 1 ATOM 4316 N N . ALA B 1 229 ? -35.468 -53.032 -16.055 1.00 55.21 ? 218 ALA B N 1 ATOM 4317 C CA . ALA B 1 229 ? -36.062 -52.536 -17.312 1.00 53.54 ? 218 ALA B CA 1 ATOM 4318 C C . ALA B 1 229 ? -36.075 -51.029 -17.287 1.00 59.69 ? 218 ALA B C 1 ATOM 4319 O O . ALA B 1 229 ? -36.426 -50.444 -16.258 1.00 61.77 ? 218 ALA B O 1 ATOM 4320 C CB . ALA B 1 229 ? -37.477 -53.057 -17.456 1.00 53.56 ? 218 ALA B CB 1 ATOM 4321 N N . SER B 1 230 ? -35.694 -50.383 -18.395 1.00 55.61 ? 219 SER B N 1 ATOM 4322 C CA . SER B 1 230 ? -35.642 -48.916 -18.459 1.00 56.24 ? 219 SER B CA 1 ATOM 4323 C C . SER B 1 230 ? -37.013 -48.244 -18.465 1.00 63.88 ? 219 SER B C 1 ATOM 4324 O O . SER B 1 230 ? -37.177 -47.161 -17.909 1.00 64.85 ? 219 SER B O 1 ATOM 4325 C CB . SER B 1 230 ? -34.857 -48.458 -19.682 1.00 58.45 ? 219 SER B CB 1 ATOM 4326 O OG . SER B 1 230 ? -33.534 -48.973 -19.669 1.00 61.14 ? 219 SER B OG 1 ATOM 4327 N N . TYR B 1 231 ? -37.984 -48.863 -19.122 1.00 60.74 ? 220 TYR B N 1 ATOM 4328 C CA . TYR B 1 231 ? -39.280 -48.238 -19.317 1.00 61.59 ? 220 TYR B CA 1 ATOM 4329 C C . TYR B 1 231 ? -40.437 -49.033 -18.772 1.00 67.52 ? 220 TYR B C 1 ATOM 4330 O O . TYR B 1 231 ? -40.276 -50.121 -18.203 1.00 68.77 ? 220 TYR B O 1 ATOM 4331 C CB . TYR B 1 231 ? -39.502 -48.012 -20.839 1.00 64.14 ? 220 TYR B CB 1 ATOM 4332 C CG . TYR B 1 231 ? -38.299 -47.468 -21.577 1.00 67.48 ? 220 TYR B CG 1 ATOM 4333 C CD1 . TYR B 1 231 ? -37.874 -46.154 -21.387 1.00 70.12 ? 220 TYR B CD1 1 ATOM 4334 C CD2 . TYR B 1 231 ? -37.572 -48.276 -22.446 1.00 67.86 ? 220 TYR B CD2 1 ATOM 4335 C CE1 . TYR B 1 231 ? -36.763 -45.655 -22.050 1.00 72.29 ? 220 TYR B CE1 1 ATOM 4336 C CE2 . TYR B 1 231 ? -36.445 -47.796 -23.101 1.00 68.64 ? 220 TYR B CE2 1 ATOM 4337 C CZ . TYR B 1 231 ? -36.045 -46.484 -22.899 1.00 81.73 ? 220 TYR B CZ 1 ATOM 4338 O OH . TYR B 1 231 ? -34.926 -46.007 -23.535 1.00 83.96 ? 220 TYR B OH 1 ATOM 4339 N N . ILE B 1 232 ? -41.630 -48.477 -18.960 1.00 63.31 ? 221 ILE B N 1 ATOM 4340 C CA . ILE B 1 232 ? -42.871 -49.191 -18.750 1.00 62.31 ? 221 ILE B CA 1 ATOM 4341 C C . ILE B 1 232 ? -43.096 -49.856 -20.108 1.00 66.94 ? 221 ILE B C 1 ATOM 4342 O O . ILE B 1 232 ? -43.014 -49.182 -21.146 1.00 66.04 ? 221 ILE B O 1 ATOM 4343 C CB . ILE B 1 232 ? -44.064 -48.268 -18.369 1.00 63.62 ? 221 ILE B CB 1 ATOM 4344 C CG1 . ILE B 1 232 ? -43.907 -47.783 -16.938 1.00 62.26 ? 221 ILE B CG1 1 ATOM 4345 C CG2 . ILE B 1 232 ? -45.391 -49.016 -18.538 1.00 63.21 ? 221 ILE B CG2 1 ATOM 4346 C CD1 . ILE B 1 232 ? -44.746 -46.642 -16.591 1.00 63.41 ? 221 ILE B CD1 1 ATOM 4347 N N . SER B 1 233 ? -43.328 -51.172 -20.099 1.00 64.32 ? 222 SER B N 1 ATOM 4348 C CA . SER B 1 233 ? -43.616 -51.886 -21.330 1.00 64.98 ? 222 SER B CA 1 ATOM 4349 C C . SER B 1 233 ? -44.918 -52.666 -21.242 1.00 73.57 ? 222 SER B C 1 ATOM 4350 O O . SER B 1 233 ? -45.338 -53.093 -20.164 1.00 72.75 ? 222 SER B O 1 ATOM 4351 C CB . SER B 1 233 ? -42.465 -52.799 -21.741 1.00 66.49 ? 222 SER B CB 1 ATOM 4352 O OG . SER B 1 233 ? -42.323 -53.923 -20.889 1.00 72.23 ? 222 SER B OG 1 ATOM 4353 N N . GLY B 1 234 ? -45.554 -52.810 -22.386 1.00 72.40 ? 223 GLY B N 1 ATOM 4354 C CA . GLY B 1 234 ? -46.727 -53.635 -22.566 1.00 72.49 ? 223 GLY B CA 1 ATOM 4355 C C . GLY B 1 234 ? -46.539 -54.403 -23.855 1.00 78.09 ? 223 GLY B C 1 ATOM 4356 O O . GLY B 1 234 ? -45.537 -54.229 -24.552 1.00 78.39 ? 223 GLY B O 1 ATOM 4357 N N . SER B 1 235 ? -47.516 -55.221 -24.209 1.00 76.40 ? 224 SER B N 1 ATOM 4358 C CA . SER B 1 235 ? -47.484 -55.976 -25.463 1.00 76.09 ? 224 SER B CA 1 ATOM 4359 C C . SER B 1 235 ? -47.586 -55.003 -26.640 1.00 79.99 ? 224 SER B C 1 ATOM 4360 O O . SER B 1 235 ? -48.144 -53.910 -26.474 1.00 79.98 ? 224 SER B O 1 ATOM 4361 C CB . SER B 1 235 ? -48.648 -56.956 -25.502 1.00 78.37 ? 224 SER B CB 1 ATOM 4362 O OG . SER B 1 235 ? -49.873 -56.245 -25.567 1.00 84.69 ? 224 SER B OG 1 ATOM 4363 N N . THR B 1 236 ? -47.077 -55.404 -27.824 1.00 75.92 ? 225 THR B N 1 ATOM 4364 C CA . THR B 1 236 ? -47.138 -54.557 -29.035 1.00 75.65 ? 225 THR B CA 1 ATOM 4365 C C . THR B 1 236 ? -48.562 -54.014 -29.264 1.00 80.40 ? 225 THR B C 1 ATOM 4366 O O . THR B 1 236 ? -48.747 -52.823 -29.526 1.00 78.65 ? 225 THR B O 1 ATOM 4367 C CB . THR B 1 236 ? -46.609 -55.313 -30.265 1.00 77.51 ? 225 THR B CB 1 ATOM 4368 O OG1 . THR B 1 236 ? -45.258 -55.717 -30.053 1.00 79.47 ? 225 THR B OG1 1 ATOM 4369 C CG2 . THR B 1 236 ? -46.664 -54.469 -31.519 1.00 69.54 ? 225 THR B CG2 1 ATOM 4370 N N . SER B 1 237 ? -49.555 -54.902 -29.101 1.00 78.82 ? 226 SER B N 1 ATOM 4371 C CA . SER B 1 237 ? -50.964 -54.578 -29.248 1.00 78.91 ? 226 SER B CA 1 ATOM 4372 C C . SER B 1 237 ? -51.419 -53.522 -28.223 1.00 83.17 ? 226 SER B C 1 ATOM 4373 O O . SER B 1 237 ? -52.052 -52.529 -28.595 1.00 83.79 ? 226 SER B O 1 ATOM 4374 C CB . SER B 1 237 ? -51.804 -55.846 -29.145 1.00 81.89 ? 226 SER B CB 1 ATOM 4375 O OG . SER B 1 237 ? -53.177 -55.512 -29.049 1.00 93.82 ? 226 SER B OG 1 ATOM 4376 N N . SER B 1 238 ? -51.092 -53.731 -26.946 1.00 78.42 ? 227 SER B N 1 ATOM 4377 C CA . SER B 1 238 ? -51.474 -52.798 -25.889 1.00 77.57 ? 227 SER B CA 1 ATOM 4378 C C . SER B 1 238 ? -50.873 -51.420 -26.120 1.00 78.31 ? 227 SER B C 1 ATOM 4379 O O . SER B 1 238 ? -51.572 -50.416 -26.009 1.00 75.46 ? 227 SER B O 1 ATOM 4380 C CB . SER B 1 238 ? -51.048 -53.325 -24.526 1.00 80.80 ? 227 SER B CB 1 ATOM 4381 O OG . SER B 1 238 ? -51.791 -54.478 -24.166 1.00 91.62 ? 227 SER B OG 1 ATOM 4382 N N . ILE B 1 239 ? -49.572 -51.381 -26.446 1.00 75.22 ? 228 ILE B N 1 ATOM 4383 C CA . ILE B 1 239 ? -48.834 -50.141 -26.678 1.00 74.75 ? 228 ILE B CA 1 ATOM 4384 C C . ILE B 1 239 ? -49.343 -49.386 -27.893 1.00 80.06 ? 228 ILE B C 1 ATOM 4385 O O . ILE B 1 239 ? -49.537 -48.163 -27.823 1.00 79.51 ? 228 ILE B O 1 ATOM 4386 C CB . ILE B 1 239 ? -47.298 -50.380 -26.651 1.00 77.14 ? 228 ILE B CB 1 ATOM 4387 C CG1 . ILE B 1 239 ? -46.847 -50.909 -25.252 1.00 77.52 ? 228 ILE B CG1 1 ATOM 4388 C CG2 . ILE B 1 239 ? -46.517 -49.117 -27.088 1.00 77.43 ? 228 ILE B CG2 1 ATOM 4389 C CD1 . ILE B 1 239 ? -47.349 -50.102 -24.014 1.00 80.72 ? 228 ILE B CD1 1 ATOM 4390 N N . GLU B 1 240 ? -49.621 -50.115 -28.985 1.00 76.54 ? 229 GLU B N 1 ATOM 4391 C CA . GLU B 1 240 ? -50.169 -49.463 -30.164 1.00 76.43 ? 229 GLU B CA 1 ATOM 4392 C C . GLU B 1 240 ? -51.536 -48.818 -29.898 1.00 79.20 ? 229 GLU B C 1 ATOM 4393 O O . GLU B 1 240 ? -51.782 -47.696 -30.344 1.00 78.04 ? 229 GLU B O 1 ATOM 4394 C CB . GLU B 1 240 ? -50.062 -50.310 -31.414 1.00 78.18 ? 229 GLU B CB 1 ATOM 4395 C CG . GLU B 1 240 ? -50.906 -51.556 -31.486 1.00 94.03 ? 229 GLU B CG 1 ATOM 4396 C CD . GLU B 1 240 ? -50.622 -52.422 -32.693 1.00 122.59 ? 229 GLU B CD 1 ATOM 4397 O OE1 . GLU B 1 240 ? -49.641 -52.143 -33.424 1.00 110.67 ? 229 GLU B OE1 1 ATOM 4398 O OE2 . GLU B 1 240 ? -51.409 -53.369 -32.922 1.00 119.87 ? 229 GLU B OE2 1 ATOM 4399 N N . LYS B 1 241 ? -52.354 -49.452 -29.048 1.00 75.61 ? 230 LYS B N 1 ATOM 4400 C CA . LYS B 1 241 ? -53.618 -48.887 -28.611 1.00 75.94 ? 230 LYS B CA 1 ATOM 4401 C C . LYS B 1 241 ? -53.386 -47.697 -27.691 1.00 81.01 ? 230 LYS B C 1 ATOM 4402 O O . LYS B 1 241 ? -54.061 -46.679 -27.837 1.00 79.68 ? 230 LYS B O 1 ATOM 4403 C CB . LYS B 1 241 ? -54.474 -49.934 -27.889 1.00 79.45 ? 230 LYS B CB 1 ATOM 4404 C CG . LYS B 1 241 ? -55.112 -50.964 -28.808 1.00 108.91 ? 230 LYS B CG 1 ATOM 4405 C CD . LYS B 1 241 ? -55.988 -51.933 -28.005 1.00 126.40 ? 230 LYS B CD 1 ATOM 4406 C CE . LYS B 1 241 ? -56.692 -52.958 -28.873 1.00 145.81 ? 230 LYS B CE 1 ATOM 4407 N NZ . LYS B 1 241 ? -57.727 -52.356 -29.767 1.00 159.71 ? 230 LYS B NZ 1 ATOM 4408 N N . LEU B 1 242 ? -52.433 -47.826 -26.735 1.00 79.40 ? 231 LEU B N 1 ATOM 4409 C CA . LEU B 1 242 ? -52.084 -46.759 -25.791 1.00 78.91 ? 231 LEU B CA 1 ATOM 4410 C C . LEU B 1 242 ? -51.647 -45.508 -26.556 1.00 82.09 ? 231 LEU B C 1 ATOM 4411 O O . LEU B 1 242 ? -52.120 -44.412 -26.277 1.00 81.99 ? 231 LEU B O 1 ATOM 4412 C CB . LEU B 1 242 ? -50.954 -47.237 -24.855 1.00 78.81 ? 231 LEU B CB 1 ATOM 4413 C CG . LEU B 1 242 ? -50.501 -46.281 -23.743 1.00 82.45 ? 231 LEU B CG 1 ATOM 4414 C CD1 . LEU B 1 242 ? -51.457 -46.307 -22.585 1.00 82.67 ? 231 LEU B CD1 1 ATOM 4415 C CD2 . LEU B 1 242 ? -49.153 -46.682 -23.224 1.00 82.89 ? 231 LEU B CD2 1 ATOM 4416 N N . MET B 1 243 ? -50.768 -45.685 -27.535 1.00 77.53 ? 232 MET B N 1 ATOM 4417 C CA . MET B 1 243 ? -50.197 -44.582 -28.298 1.00 77.07 ? 232 MET B CA 1 ATOM 4418 C C . MET B 1 243 ? -51.188 -43.885 -29.201 1.00 83.68 ? 232 MET B C 1 ATOM 4419 O O . MET B 1 243 ? -51.133 -42.654 -29.334 1.00 83.19 ? 232 MET B O 1 ATOM 4420 C CB . MET B 1 243 ? -48.960 -45.058 -29.051 1.00 78.82 ? 232 MET B CB 1 ATOM 4421 C CG . MET B 1 243 ? -47.833 -45.531 -28.122 1.00 81.77 ? 232 MET B CG 1 ATOM 4422 S SD . MET B 1 243 ? -47.141 -44.213 -27.088 1.00 84.61 ? 232 MET B SD 1 ATOM 4423 C CE . MET B 1 243 ? -45.996 -45.138 -26.122 1.00 81.05 ? 232 MET B CE 1 ATOM 4424 N N . GLU B 1 244 ? -52.118 -44.690 -29.797 1.00 81.70 ? 233 GLU B N 1 ATOM 4425 C CA . GLU B 1 244 ? -53.244 -44.202 -30.593 1.00 81.17 ? 233 GLU B CA 1 ATOM 4426 C C . GLU B 1 244 ? -53.996 -43.165 -29.752 1.00 81.78 ? 233 GLU B C 1 ATOM 4427 O O . GLU B 1 244 ? -54.239 -42.075 -30.242 1.00 81.60 ? 233 GLU B O 1 ATOM 4428 C CB . GLU B 1 244 ? -54.230 -45.340 -30.894 1.00 83.23 ? 233 GLU B CB 1 ATOM 4429 C CG . GLU B 1 244 ? -53.995 -46.145 -32.163 1.00 99.61 ? 233 GLU B CG 1 ATOM 4430 C CD . GLU B 1 244 ? -54.792 -47.443 -32.250 1.00 127.25 ? 233 GLU B CD 1 ATOM 4431 O OE1 . GLU B 1 244 ? -55.948 -47.478 -31.767 1.00 120.97 ? 233 GLU B OE1 1 ATOM 4432 O OE2 . GLU B 1 244 ? -54.260 -48.427 -32.814 1.00 123.90 ? 233 GLU B OE2 1 ATOM 4433 N N . ALA B 1 245 ? -54.332 -43.510 -28.484 1.00 76.73 ? 234 ALA B N 1 ATOM 4434 C CA . ALA B 1 245 ? -55.061 -42.680 -27.529 1.00 76.66 ? 234 ALA B CA 1 ATOM 4435 C C . ALA B 1 245 ? -54.309 -41.419 -27.130 1.00 85.60 ? 234 ALA B C 1 ATOM 4436 O O . ALA B 1 245 ? -54.945 -40.400 -26.835 1.00 85.55 ? 234 ALA B O 1 ATOM 4437 C CB . ALA B 1 245 ? -55.403 -43.489 -26.296 1.00 76.79 ? 234 ALA B CB 1 ATOM 4438 N N . LEU B 1 246 ? -52.960 -41.482 -27.098 1.00 84.44 ? 235 LEU B N 1 ATOM 4439 C CA . LEU B 1 246 ? -52.138 -40.325 -26.738 1.00 84.57 ? 235 LEU B CA 1 ATOM 4440 C C . LEU B 1 246 ? -51.908 -39.394 -27.930 1.00 89.34 ? 235 LEU B C 1 ATOM 4441 O O . LEU B 1 246 ? -51.581 -38.218 -27.750 1.00 89.38 ? 235 LEU B O 1 ATOM 4442 C CB . LEU B 1 246 ? -50.785 -40.778 -26.156 1.00 84.63 ? 235 LEU B CB 1 ATOM 4443 C CG . LEU B 1 246 ? -50.795 -41.599 -24.872 1.00 88.86 ? 235 LEU B CG 1 ATOM 4444 C CD1 . LEU B 1 246 ? -49.390 -42.070 -24.520 1.00 88.30 ? 235 LEU B CD1 1 ATOM 4445 C CD2 . LEU B 1 246 ? -51.396 -40.806 -23.720 1.00 90.97 ? 235 LEU B CD2 1 ATOM 4446 N N . GLY B 1 247 ? -52.072 -39.920 -29.132 1.00 86.04 ? 236 GLY B N 1 ATOM 4447 C CA . GLY B 1 247 ? -51.814 -39.160 -30.345 1.00 86.27 ? 236 GLY B CA 1 ATOM 4448 C C . GLY B 1 247 ? -50.334 -39.172 -30.680 1.00 90.88 ? 236 GLY B C 1 ATOM 4449 O O . GLY B 1 247 ? -49.845 -38.298 -31.404 1.00 91.38 ? 236 GLY B O 1 ATOM 4450 N N . ALA B 1 248 ? -49.602 -40.171 -30.130 1.00 86.32 ? 237 ALA B N 1 ATOM 4451 C CA . ALA B 1 248 ? -48.179 -40.365 -30.369 1.00 85.06 ? 237 ALA B CA 1 ATOM 4452 C C . ALA B 1 248 ? -47.980 -41.145 -31.645 1.00 89.59 ? 237 ALA B C 1 ATOM 4453 O O . ALA B 1 248 ? -48.768 -42.037 -31.968 1.00 89.33 ? 237 ALA B O 1 ATOM 4454 C CB . ALA B 1 248 ? -47.538 -41.099 -29.210 1.00 85.22 ? 237 ALA B CB 1 ATOM 4455 N N . LYS B 1 249 ? -46.933 -40.797 -32.390 1.00 86.85 ? 238 LYS B N 1 ATOM 4456 C CA . LYS B 1 249 ? -46.635 -41.488 -33.636 1.00 86.94 ? 238 LYS B CA 1 ATOM 4457 C C . LYS B 1 249 ? -45.323 -42.200 -33.524 1.00 94.12 ? 238 LYS B C 1 ATOM 4458 O O . LYS B 1 249 ? -44.422 -41.712 -32.861 1.00 94.43 ? 238 LYS B O 1 ATOM 4459 C CB . LYS B 1 249 ? -46.657 -40.532 -34.839 1.00 88.90 ? 238 LYS B CB 1 ATOM 4460 C CG . LYS B 1 249 ? -48.060 -40.062 -35.175 1.00 97.97 ? 238 LYS B CG 1 ATOM 4461 C CD . LYS B 1 249 ? -48.062 -38.897 -36.128 1.00 112.43 ? 238 LYS B CD 1 ATOM 4462 C CE . LYS B 1 249 ? -49.421 -38.733 -36.754 1.00 130.40 ? 238 LYS B CE 1 ATOM 4463 N NZ . LYS B 1 249 ? -49.617 -39.677 -37.889 1.00 141.39 ? 238 LYS B NZ 1 ATOM 4464 N N . LYS B 1 250 ? -45.187 -43.353 -34.155 1.00 93.17 ? 239 LYS B N 1 ATOM 4465 C CA . LYS B 1 250 ? -43.912 -44.047 -34.162 1.00 94.37 ? 239 LYS B CA 1 ATOM 4466 C C . LYS B 1 250 ? -43.153 -43.435 -35.333 1.00 103.00 ? 239 LYS B C 1 ATOM 4467 O O . LYS B 1 250 ? -43.615 -43.546 -36.479 1.00 103.25 ? 239 LYS B O 1 ATOM 4468 C CB . LYS B 1 250 ? -44.123 -45.551 -34.383 1.00 96.48 ? 239 LYS B CB 1 ATOM 4469 C CG . LYS B 1 250 ? -42.899 -46.419 -34.069 1.00 112.22 ? 239 LYS B CG 1 ATOM 4470 C CD . LYS B 1 250 ? -43.234 -47.905 -34.161 1.00 121.77 ? 239 LYS B CD 1 ATOM 4471 C CE . LYS B 1 250 ? -43.199 -48.453 -35.582 1.00 128.58 ? 239 LYS B CE 1 ATOM 4472 N NZ . LYS B 1 250 ? -41.812 -48.665 -36.089 1.00 134.15 ? 239 LYS B NZ 1 ATOM 4473 N N . ARG B 1 251 ? -42.031 -42.733 -35.059 1.00 101.84 ? 240 ARG B N 1 ATOM 4474 C CA . ARG B 1 251 ? -41.270 -42.160 -36.162 1.00 102.57 ? 240 ARG B CA 1 ATOM 4475 C C . ARG B 1 251 ? -40.589 -43.264 -36.978 1.00 108.95 ? 240 ARG B C 1 ATOM 4476 O O . ARG B 1 251 ? -41.050 -43.576 -38.088 1.00 109.13 ? 240 ARG B O 1 ATOM 4477 C CB . ARG B 1 251 ? -40.337 -40.993 -35.753 1.00 102.32 ? 240 ARG B CB 1 ATOM 4478 C CG . ARG B 1 251 ? -39.465 -41.164 -34.520 1.00 104.10 ? 240 ARG B CG 1 ATOM 4479 C CD . ARG B 1 251 ? -38.284 -40.200 -34.579 1.00 98.43 ? 240 ARG B CD 1 ATOM 4480 N NE . ARG B 1 251 ? -37.356 -40.406 -33.462 1.00 99.73 ? 240 ARG B NE 1 ATOM 4481 C CZ . ARG B 1 251 ? -36.937 -39.456 -32.627 1.00 106.04 ? 240 ARG B CZ 1 ATOM 4482 N NH1 . ARG B 1 251 ? -37.330 -38.198 -32.788 1.00 91.61 ? 240 ARG B NH1 1 ATOM 4483 N NH2 . ARG B 1 251 ? -36.111 -39.755 -31.633 1.00 87.03 ? 240 ARG B NH2 1 ATOM 4484 N N . LEU B 1 252 ? -39.564 -43.906 -36.403 1.00 105.87 ? 242 LEU B N 1 ATOM 4485 C CA . LEU B 1 252 ? -38.866 -45.003 -37.067 1.00 106.07 ? 242 LEU B CA 1 ATOM 4486 C C . LEU B 1 252 ? -38.664 -46.127 -36.096 1.00 109.66 ? 242 LEU B C 1 ATOM 4487 O O . LEU B 1 252 ? -38.984 -47.277 -36.401 1.00 110.32 ? 242 LEU B O 1 ATOM 4488 C CB . LEU B 1 252 ? -37.485 -44.573 -37.597 1.00 106.36 ? 242 LEU B CB 1 ATOM 4489 C CG . LEU B 1 252 ? -37.381 -43.584 -38.752 1.00 110.89 ? 242 LEU B CG 1 ATOM 4490 C CD1 . LEU B 1 252 ? -35.989 -43.093 -38.841 1.00 110.92 ? 242 LEU B CD1 1 ATOM 4491 C CD2 . LEU B 1 252 ? -37.785 -44.215 -40.075 1.00 113.26 ? 242 LEU B CD2 1 ATOM 4492 N N . PHE B 1 253 ? -38.095 -45.804 -34.940 1.00 104.31 ? 243 PHE B N 1 ATOM 4493 C CA . PHE B 1 253 ? -37.793 -46.783 -33.920 1.00 103.24 ? 243 PHE B CA 1 ATOM 4494 C C . PHE B 1 253 ? -38.720 -46.629 -32.716 1.00 107.15 ? 243 PHE B C 1 ATOM 4495 O O . PHE B 1 253 ? -39.268 -47.622 -32.239 1.00 108.75 ? 243 PHE B O 1 ATOM 4496 C CB . PHE B 1 253 ? -36.316 -46.653 -33.499 1.00 104.67 ? 243 PHE B CB 1 ATOM 4497 C CG . PHE B 1 253 ? -35.312 -46.678 -34.632 1.00 105.76 ? 243 PHE B CG 1 ATOM 4498 C CD1 . PHE B 1 253 ? -34.788 -47.880 -35.091 1.00 108.22 ? 243 PHE B CD1 1 ATOM 4499 C CD2 . PHE B 1 253 ? -34.879 -45.497 -35.227 1.00 107.52 ? 243 PHE B CD2 1 ATOM 4500 C CE1 . PHE B 1 253 ? -33.851 -47.900 -36.127 1.00 109.10 ? 243 PHE B CE1 1 ATOM 4501 C CE2 . PHE B 1 253 ? -33.952 -45.519 -36.272 1.00 110.09 ? 243 PHE B CE2 1 ATOM 4502 C CZ . PHE B 1 253 ? -33.437 -46.718 -36.709 1.00 108.22 ? 243 PHE B CZ 1 ATOM 4503 N N . ASP B 1 254 ? -38.906 -45.387 -32.235 1.00 101.20 ? 244 ASP B N 1 ATOM 4504 C CA . ASP B 1 254 ? -39.665 -45.072 -31.028 1.00 99.20 ? 244 ASP B CA 1 ATOM 4505 C C . ASP B 1 254 ? -40.912 -44.235 -31.254 1.00 98.46 ? 244 ASP B C 1 ATOM 4506 O O . ASP B 1 254 ? -41.089 -43.669 -32.334 1.00 98.73 ? 244 ASP B O 1 ATOM 4507 C CB . ASP B 1 254 ? -38.740 -44.335 -30.056 1.00 101.41 ? 244 ASP B CB 1 ATOM 4508 C CG . ASP B 1 254 ? -37.644 -45.198 -29.456 1.00 121.85 ? 244 ASP B CG 1 ATOM 4509 O OD1 . ASP B 1 254 ? -37.446 -45.130 -28.219 1.00 125.39 ? 244 ASP B OD1 1 ATOM 4510 O OD2 . ASP B 1 254 ? -36.973 -45.944 -30.222 1.00 128.08 ? 244 ASP B OD2 1 ATOM 4511 N N . TYR B 1 255 ? -41.769 -44.139 -30.206 1.00 90.33 ? 245 TYR B N 1 ATOM 4512 C CA . TYR B 1 255 ? -42.977 -43.301 -30.227 1.00 87.42 ? 245 TYR B CA 1 ATOM 4513 C C . TYR B 1 255 ? -42.649 -41.906 -29.773 1.00 89.18 ? 245 TYR B C 1 ATOM 4514 O O . TYR B 1 255 ? -41.938 -41.723 -28.774 1.00 89.47 ? 245 TYR B O 1 ATOM 4515 C CB . TYR B 1 255 ? -44.120 -43.849 -29.373 1.00 87.17 ? 245 TYR B CB 1 ATOM 4516 C CG . TYR B 1 255 ? -44.812 -45.041 -29.983 1.00 86.44 ? 245 TYR B CG 1 ATOM 4517 C CD1 . TYR B 1 255 ? -45.831 -44.877 -30.915 1.00 86.99 ? 245 TYR B CD1 1 ATOM 4518 C CD2 . TYR B 1 255 ? -44.466 -46.336 -29.609 1.00 86.99 ? 245 TYR B CD2 1 ATOM 4519 C CE1 . TYR B 1 255 ? -46.480 -45.974 -31.469 1.00 87.02 ? 245 TYR B CE1 1 ATOM 4520 C CE2 . TYR B 1 255 ? -45.106 -47.442 -30.156 1.00 87.63 ? 245 TYR B CE2 1 ATOM 4521 C CZ . TYR B 1 255 ? -46.117 -47.260 -31.082 1.00 95.41 ? 245 TYR B CZ 1 ATOM 4522 O OH . TYR B 1 255 ? -46.726 -48.374 -31.613 1.00 100.42 ? 245 TYR B OH 1 ATOM 4523 N N . VAL B 1 256 ? -43.155 -40.914 -30.514 1.00 84.18 ? 246 VAL B N 1 ATOM 4524 C CA . VAL B 1 256 ? -42.892 -39.501 -30.225 1.00 83.85 ? 246 VAL B CA 1 ATOM 4525 C C . VAL B 1 256 ? -44.142 -38.643 -30.213 1.00 86.40 ? 246 VAL B C 1 ATOM 4526 O O . VAL B 1 256 ? -45.163 -38.997 -30.810 1.00 85.75 ? 246 VAL B O 1 ATOM 4527 C CB . VAL B 1 256 ? -41.838 -38.883 -31.188 1.00 87.67 ? 246 VAL B CB 1 ATOM 4528 C CG1 . VAL B 1 256 ? -40.438 -39.439 -30.924 1.00 87.34 ? 246 VAL B CG1 1 ATOM 4529 C CG2 . VAL B 1 256 ? -42.247 -39.068 -32.649 1.00 87.28 ? 246 VAL B CG2 1 ATOM 4530 N N . VAL B 1 257 ? -44.024 -37.483 -29.563 1.00 81.38 ? 247 VAL B N 1 ATOM 4531 C CA . VAL B 1 257 ? -45.036 -36.443 -29.522 1.00 80.91 ? 247 VAL B CA 1 ATOM 4532 C C . VAL B 1 257 ? -44.288 -35.121 -29.773 1.00 85.31 ? 247 VAL B C 1 ATOM 4533 O O . VAL B 1 257 ? -43.082 -35.045 -29.516 1.00 83.49 ? 247 VAL B O 1 ATOM 4534 C CB . VAL B 1 257 ? -45.804 -36.463 -28.169 1.00 84.07 ? 247 VAL B CB 1 ATOM 4535 C CG1 . VAL B 1 257 ? -45.080 -35.712 -27.060 1.00 83.27 ? 247 VAL B CG1 1 ATOM 4536 C CG2 . VAL B 1 257 ? -47.204 -35.917 -28.324 1.00 84.22 ? 247 VAL B CG2 1 ATOM 4537 N N . LYS B 1 258 ? -44.979 -34.097 -30.288 1.00 83.63 ? 248 LYS B N 1 ATOM 4538 C CA . LYS B 1 258 ? -44.370 -32.765 -30.436 1.00 83.61 ? 248 LYS B CA 1 ATOM 4539 C C . LYS B 1 258 ? -44.123 -32.279 -29.004 1.00 84.14 ? 248 LYS B C 1 ATOM 4540 O O . LYS B 1 258 ? -45.018 -32.395 -28.172 1.00 83.66 ? 248 LYS B O 1 ATOM 4541 C CB . LYS B 1 258 ? -45.308 -31.788 -31.167 1.00 86.94 ? 248 LYS B CB 1 ATOM 4542 C CG . LYS B 1 258 ? -45.325 -31.917 -32.673 1.00 99.08 ? 248 LYS B CG 1 ATOM 4543 C CD . LYS B 1 258 ? -45.495 -30.546 -33.376 1.00 108.82 ? 248 LYS B CD 1 ATOM 4544 C CE . LYS B 1 258 ? -46.834 -29.848 -33.194 1.00 119.48 ? 248 LYS B CE 1 ATOM 4545 N NZ . LYS B 1 258 ? -47.175 -29.030 -34.386 1.00 126.96 ? 248 LYS B NZ 1 ATOM 4546 N N . CYS B 1 259 ? -42.915 -31.795 -28.708 1.00 78.55 ? 249 CYS B N 1 ATOM 4547 C CA . CYS B 1 259 ? -42.518 -31.398 -27.355 1.00 77.97 ? 249 CYS B CA 1 ATOM 4548 C C . CYS B 1 259 ? -43.451 -30.434 -26.658 1.00 81.64 ? 249 CYS B C 1 ATOM 4549 O O . CYS B 1 259 ? -43.754 -30.614 -25.481 1.00 80.78 ? 249 CYS B O 1 ATOM 4550 C CB . CYS B 1 259 ? -41.075 -30.917 -27.311 1.00 78.42 ? 249 CYS B CB 1 ATOM 4551 S SG . CYS B 1 259 ? -39.866 -32.193 -27.741 1.00 82.56 ? 249 CYS B SG 1 ATOM 4552 N N . ASN B 1 260 ? -43.917 -29.419 -27.377 1.00 79.59 ? 250 ASN B N 1 ATOM 4553 C CA . ASN B 1 260 ? -44.850 -28.442 -26.822 1.00 79.65 ? 250 ASN B CA 1 ATOM 4554 C C . ASN B 1 260 ? -46.158 -29.097 -26.369 1.00 83.69 ? 250 ASN B C 1 ATOM 4555 O O . ASN B 1 260 ? -46.758 -28.601 -25.420 1.00 82.53 ? 250 ASN B O 1 ATOM 4556 C CB . ASN B 1 260 ? -45.127 -27.300 -27.823 1.00 79.50 ? 250 ASN B CB 1 ATOM 4557 C CG . ASN B 1 260 ? -45.882 -27.709 -29.057 1.00 88.30 ? 250 ASN B CG 1 ATOM 4558 O OD1 . ASN B 1 260 ? -45.552 -28.691 -29.748 1.00 81.12 ? 250 ASN B OD1 1 ATOM 4559 N ND2 . ASN B 1 260 ? -46.906 -26.947 -29.354 1.00 73.62 ? 250 ASN B ND2 1 ATOM 4560 N N . GLU B 1 261 ? -46.592 -30.200 -27.049 1.00 81.20 ? 251 GLU B N 1 ATOM 4561 C CA . GLU B 1 261 ? -47.834 -30.935 -26.778 1.00 80.79 ? 251 GLU B CA 1 ATOM 4562 C C . GLU B 1 261 ? -47.725 -31.935 -25.626 1.00 84.38 ? 251 GLU B C 1 ATOM 4563 O O . GLU B 1 261 ? -48.749 -32.396 -25.119 1.00 83.31 ? 251 GLU B O 1 ATOM 4564 C CB . GLU B 1 261 ? -48.341 -31.595 -28.046 1.00 81.94 ? 251 GLU B CB 1 ATOM 4565 C CG . GLU B 1 261 ? -48.898 -30.590 -29.043 1.00 91.36 ? 251 GLU B CG 1 ATOM 4566 C CD . GLU B 1 261 ? -49.262 -31.163 -30.399 1.00 120.81 ? 251 GLU B CD 1 ATOM 4567 O OE1 . GLU B 1 261 ? -50.081 -30.526 -31.094 1.00 113.81 ? 251 GLU B OE1 1 ATOM 4568 O OE2 . GLU B 1 261 ? -48.743 -32.241 -30.772 1.00 122.19 ? 251 GLU B OE2 1 ATOM 4569 N N . GLY B 1 262 ? -46.488 -32.208 -25.192 1.00 80.95 ? 252 GLY B N 1 ATOM 4570 C CA . GLY B 1 262 ? -46.174 -33.053 -24.036 1.00 80.67 ? 252 GLY B CA 1 ATOM 4571 C C . GLY B 1 262 ? -47.012 -32.723 -22.813 1.00 84.37 ? 252 GLY B C 1 ATOM 4572 O O . GLY B 1 262 ? -47.719 -33.604 -22.332 1.00 84.06 ? 252 GLY B O 1 ATOM 4573 N N . PRO B 1 263 ? -47.020 -31.445 -22.335 1.00 79.77 ? 253 PRO B N 1 ATOM 4574 C CA . PRO B 1 263 ? -47.856 -31.067 -21.186 1.00 79.25 ? 253 PRO B CA 1 ATOM 4575 C C . PRO B 1 263 ? -49.371 -31.195 -21.371 1.00 82.70 ? 253 PRO B C 1 ATOM 4576 O O . PRO B 1 263 ? -50.094 -31.092 -20.384 1.00 82.76 ? 253 PRO B O 1 ATOM 4577 C CB . PRO B 1 263 ? -47.464 -29.604 -20.946 1.00 81.16 ? 253 PRO B CB 1 ATOM 4578 C CG . PRO B 1 263 ? -46.124 -29.460 -21.552 1.00 85.96 ? 253 PRO B CG 1 ATOM 4579 C CD . PRO B 1 263 ? -46.191 -30.306 -22.764 1.00 81.68 ? 253 PRO B CD 1 ATOM 4580 N N . THR B 1 264 ? -49.857 -31.411 -22.596 1.00 79.04 ? 254 THR B N 1 ATOM 4581 C CA . THR B 1 264 ? -51.302 -31.562 -22.869 1.00 78.96 ? 254 THR B CA 1 ATOM 4582 C C . THR B 1 264 ? -51.740 -33.029 -22.825 1.00 84.25 ? 254 THR B C 1 ATOM 4583 O O . THR B 1 264 ? -52.943 -33.309 -22.818 1.00 83.95 ? 254 THR B O 1 ATOM 4584 C CB . THR B 1 264 ? -51.705 -30.961 -24.238 1.00 85.06 ? 254 THR B CB 1 ATOM 4585 O OG1 . THR B 1 264 ? -51.328 -31.855 -25.300 1.00 78.61 ? 254 THR B OG1 1 ATOM 4586 C CG2 . THR B 1 264 ? -51.136 -29.572 -24.460 1.00 84.93 ? 254 THR B CG2 1 ATOM 4587 N N . LEU B 1 265 ? -50.769 -33.966 -22.869 1.00 81.06 ? 255 LEU B N 1 ATOM 4588 C CA . LEU B 1 265 ? -51.028 -35.406 -22.853 1.00 79.40 ? 255 LEU B CA 1 ATOM 4589 C C . LEU B 1 265 ? -51.732 -35.819 -21.537 1.00 81.04 ? 255 LEU B C 1 ATOM 4590 O O . LEU B 1 265 ? -51.456 -35.258 -20.468 1.00 80.24 ? 255 LEU B O 1 ATOM 4591 C CB . LEU B 1 265 ? -49.713 -36.166 -23.007 1.00 79.05 ? 255 LEU B CB 1 ATOM 4592 C CG . LEU B 1 265 ? -49.321 -36.768 -24.343 1.00 82.85 ? 255 LEU B CG 1 ATOM 4593 C CD1 . LEU B 1 265 ? -49.741 -35.947 -25.515 1.00 82.35 ? 255 LEU B CD1 1 ATOM 4594 C CD2 . LEU B 1 265 ? -47.851 -37.069 -24.381 1.00 85.15 ? 255 LEU B CD2 1 ATOM 4595 N N . PRO B 1 266 ? -52.673 -36.773 -21.615 1.00 75.74 ? 256 PRO B N 1 ATOM 4596 C CA . PRO B 1 266 ? -53.390 -37.188 -20.403 1.00 74.07 ? 256 PRO B CA 1 ATOM 4597 C C . PRO B 1 266 ? -52.551 -38.036 -19.455 1.00 76.28 ? 256 PRO B C 1 ATOM 4598 O O . PRO B 1 266 ? -51.528 -38.598 -19.839 1.00 76.02 ? 256 PRO B O 1 ATOM 4599 C CB . PRO B 1 266 ? -54.561 -37.997 -20.953 1.00 75.50 ? 256 PRO B CB 1 ATOM 4600 C CG . PRO B 1 266 ? -54.078 -38.527 -22.246 1.00 80.41 ? 256 PRO B CG 1 ATOM 4601 C CD . PRO B 1 266 ? -53.133 -37.523 -22.803 1.00 76.77 ? 256 PRO B CD 1 ATOM 4602 N N . ASP B 1 267 ? -53.014 -38.140 -18.208 1.00 70.77 ? 257 ASP B N 1 ATOM 4603 C CA . ASP B 1 267 ? -52.406 -38.977 -17.205 1.00 68.30 ? 257 ASP B CA 1 ATOM 4604 C C . ASP B 1 267 ? -52.628 -40.422 -17.599 1.00 72.01 ? 257 ASP B C 1 ATOM 4605 O O . ASP B 1 267 ? -53.643 -40.746 -18.222 1.00 72.51 ? 257 ASP B O 1 ATOM 4606 C CB . ASP B 1 267 ? -53.068 -38.720 -15.863 1.00 68.97 ? 257 ASP B CB 1 ATOM 4607 C CG . ASP B 1 267 ? -52.802 -37.353 -15.278 1.00 80.16 ? 257 ASP B CG 1 ATOM 4608 O OD1 . ASP B 1 267 ? -51.998 -36.609 -15.855 1.00 81.58 ? 257 ASP B OD1 1 ATOM 4609 O OD2 . ASP B 1 267 ? -53.383 -37.037 -14.223 1.00 90.67 ? 257 ASP B OD2 1 ATOM 4610 N N . ILE B 1 268 ? -51.671 -41.290 -17.248 1.00 67.51 ? 258 ILE B N 1 ATOM 4611 C CA . ILE B 1 268 ? -51.793 -42.730 -17.441 1.00 66.45 ? 258 ILE B CA 1 ATOM 4612 C C . ILE B 1 268 ? -51.818 -43.346 -16.065 1.00 68.80 ? 258 ILE B C 1 ATOM 4613 O O . ILE B 1 268 ? -50.920 -43.096 -15.258 1.00 69.52 ? 258 ILE B O 1 ATOM 4614 C CB . ILE B 1 268 ? -50.734 -43.355 -18.368 1.00 69.57 ? 258 ILE B CB 1 ATOM 4615 C CG1 . ILE B 1 268 ? -50.841 -42.769 -19.776 1.00 69.62 ? 258 ILE B CG1 1 ATOM 4616 C CG2 . ILE B 1 268 ? -50.868 -44.894 -18.394 1.00 69.26 ? 258 ILE B CG2 1 ATOM 4617 C CD1 . ILE B 1 268 ? -49.646 -43.023 -20.645 1.00 75.07 ? 258 ILE B CD1 1 ATOM 4618 N N . SER B 1 269 ? -52.878 -44.113 -15.781 1.00 63.39 ? 259 SER B N 1 ATOM 4619 C CA . SER B 1 269 ? -53.078 -44.715 -14.480 1.00 61.96 ? 259 SER B CA 1 ATOM 4620 C C . SER B 1 269 ? -53.028 -46.208 -14.546 1.00 64.68 ? 259 SER B C 1 ATOM 4621 O O . SER B 1 269 ? -53.622 -46.812 -15.433 1.00 64.91 ? 259 SER B O 1 ATOM 4622 C CB . SER B 1 269 ? -54.392 -44.248 -13.874 1.00 65.08 ? 259 SER B CB 1 ATOM 4623 O OG . SER B 1 269 ? -54.320 -42.881 -13.501 1.00 75.88 ? 259 SER B OG 1 ATOM 4624 N N . PHE B 1 270 ? -52.311 -46.807 -13.597 1.00 60.15 ? 260 PHE B N 1 ATOM 4625 C CA . PHE B 1 270 ? -52.175 -48.250 -13.477 1.00 59.12 ? 260 PHE B CA 1 ATOM 4626 C C . PHE B 1 270 ? -52.929 -48.670 -12.223 1.00 67.13 ? 260 PHE B C 1 ATOM 4627 O O . PHE B 1 270 ? -52.666 -48.146 -11.131 1.00 65.64 ? 260 PHE B O 1 ATOM 4628 C CB . PHE B 1 270 ? -50.691 -48.659 -13.427 1.00 58.74 ? 260 PHE B CB 1 ATOM 4629 C CG . PHE B 1 270 ? -49.912 -48.215 -14.645 1.00 56.35 ? 260 PHE B CG 1 ATOM 4630 C CD1 . PHE B 1 270 ? -49.753 -49.063 -15.735 1.00 53.83 ? 260 PHE B CD1 1 ATOM 4631 C CD2 . PHE B 1 270 ? -49.348 -46.932 -14.708 1.00 55.08 ? 260 PHE B CD2 1 ATOM 4632 C CE1 . PHE B 1 270 ? -49.031 -48.651 -16.853 1.00 53.22 ? 260 PHE B CE1 1 ATOM 4633 C CE2 . PHE B 1 270 ? -48.644 -46.511 -15.844 1.00 54.71 ? 260 PHE B CE2 1 ATOM 4634 C CZ . PHE B 1 270 ? -48.487 -47.372 -16.903 1.00 52.11 ? 260 PHE B CZ 1 ATOM 4635 N N . HIS B 1 271 ? -53.904 -49.568 -12.390 1.00 68.14 ? 261 HIS B N 1 ATOM 4636 C CA . HIS B 1 271 ? -54.754 -50.013 -11.294 1.00 70.33 ? 261 HIS B CA 1 ATOM 4637 C C . HIS B 1 271 ? -54.166 -51.250 -10.643 1.00 71.13 ? 261 HIS B C 1 ATOM 4638 O O . HIS B 1 271 ? -54.205 -52.355 -11.209 1.00 69.59 ? 261 HIS B O 1 ATOM 4639 C CB . HIS B 1 271 ? -56.218 -50.212 -11.761 1.00 73.65 ? 261 HIS B CB 1 ATOM 4640 C CG . HIS B 1 271 ? -57.214 -50.266 -10.643 1.00 79.56 ? 261 HIS B CG 1 ATOM 4641 N ND1 . HIS B 1 271 ? -57.008 -49.583 -9.450 1.00 83.42 ? 261 HIS B ND1 1 ATOM 4642 C CD2 . HIS B 1 271 ? -58.409 -50.885 -10.577 1.00 82.87 ? 261 HIS B CD2 1 ATOM 4643 C CE1 . HIS B 1 271 ? -58.069 -49.823 -8.698 1.00 83.14 ? 261 HIS B CE1 1 ATOM 4644 N NE2 . HIS B 1 271 ? -58.943 -50.587 -9.334 1.00 83.42 ? 261 HIS B NE2 1 ATOM 4645 N N . LEU B 1 272 ? -53.577 -51.045 -9.462 1.00 66.26 ? 262 LEU B N 1 ATOM 4646 C CA . LEU B 1 272 ? -52.883 -52.101 -8.734 1.00 65.18 ? 262 LEU B CA 1 ATOM 4647 C C . LEU B 1 272 ? -53.357 -52.102 -7.294 1.00 69.74 ? 262 LEU B C 1 ATOM 4648 O O . LEU B 1 272 ? -53.328 -51.057 -6.633 1.00 67.78 ? 262 LEU B O 1 ATOM 4649 C CB . LEU B 1 272 ? -51.339 -51.873 -8.775 1.00 64.71 ? 262 LEU B CB 1 ATOM 4650 C CG . LEU B 1 272 ? -50.647 -51.634 -10.127 1.00 67.80 ? 262 LEU B CG 1 ATOM 4651 C CD1 . LEU B 1 272 ? -49.291 -51.029 -9.916 1.00 68.25 ? 262 LEU B CD1 1 ATOM 4652 C CD2 . LEU B 1 272 ? -50.559 -52.908 -10.965 1.00 66.05 ? 262 LEU B CD2 1 ATOM 4653 N N . GLY B 1 273 ? -53.757 -53.279 -6.811 1.00 68.22 ? 263 GLY B N 1 ATOM 4654 C CA . GLY B 1 273 ? -54.211 -53.477 -5.436 1.00 68.79 ? 263 GLY B CA 1 ATOM 4655 C C . GLY B 1 273 ? -55.296 -52.527 -4.959 1.00 75.33 ? 263 GLY B C 1 ATOM 4656 O O . GLY B 1 273 ? -55.238 -52.048 -3.828 1.00 75.06 ? 263 GLY B O 1 ATOM 4657 N N . GLY B 1 274 ? -56.256 -52.222 -5.833 1.00 74.82 ? 264 GLY B N 1 ATOM 4658 C CA . GLY B 1 274 ? -57.374 -51.344 -5.514 1.00 76.20 ? 264 GLY B CA 1 ATOM 4659 C C . GLY B 1 274 ? -57.071 -49.861 -5.572 1.00 83.63 ? 264 GLY B C 1 ATOM 4660 O O . GLY B 1 274 ? -58.003 -49.043 -5.536 1.00 85.56 ? 264 GLY B O 1 ATOM 4661 N N . LYS B 1 275 ? -55.768 -49.498 -5.682 1.00 77.85 ? 265 LYS B N 1 ATOM 4662 C CA . LYS B 1 275 ? -55.303 -48.113 -5.777 1.00 74.67 ? 265 LYS B CA 1 ATOM 4663 C C . LYS B 1 275 ? -54.953 -47.802 -7.238 1.00 73.03 ? 265 LYS B C 1 ATOM 4664 O O . LYS B 1 275 ? -54.662 -48.704 -8.038 1.00 70.35 ? 265 LYS B O 1 ATOM 4665 C CB . LYS B 1 275 ? -54.102 -47.872 -4.837 1.00 76.42 ? 265 LYS B CB 1 ATOM 4666 C CG . LYS B 1 275 ? -53.870 -46.404 -4.451 1.00 96.12 ? 265 LYS B CG 1 ATOM 4667 C CD . LYS B 1 275 ? -52.362 -45.971 -4.349 1.00 103.74 ? 265 LYS B CD 1 ATOM 4668 C CE . LYS B 1 275 ? -52.119 -44.459 -4.528 1.00 86.25 ? 265 LYS B CE 1 ATOM 4669 N NZ . LYS B 1 275 ? -50.681 -44.056 -4.673 1.00 71.33 ? 265 LYS B NZ 1 ATOM 4670 N N . GLU B 1 276 ? -55.005 -46.529 -7.588 1.00 69.12 ? 266 GLU B N 1 ATOM 4671 C CA . GLU B 1 276 ? -54.667 -46.090 -8.926 1.00 68.57 ? 266 GLU B CA 1 ATOM 4672 C C . GLU B 1 276 ? -53.287 -45.383 -8.892 1.00 69.42 ? 266 GLU B C 1 ATOM 4673 O O . GLU B 1 276 ? -53.095 -44.412 -8.144 1.00 68.43 ? 266 GLU B O 1 ATOM 4674 C CB . GLU B 1 276 ? -55.780 -45.198 -9.484 1.00 69.90 ? 266 GLU B CB 1 ATOM 4675 C CG . GLU B 1 276 ? -55.908 -45.295 -10.992 1.00 83.28 ? 266 GLU B CG 1 ATOM 4676 C CD . GLU B 1 276 ? -56.719 -46.456 -11.537 1.00 107.84 ? 266 GLU B CD 1 ATOM 4677 O OE1 . GLU B 1 276 ? -56.531 -46.821 -12.724 1.00 95.04 ? 266 GLU B OE1 1 ATOM 4678 O OE2 . GLU B 1 276 ? -57.568 -46.983 -10.782 1.00 104.05 ? 266 GLU B OE2 1 ATOM 4679 N N . TYR B 1 277 ? -52.316 -45.924 -9.658 1.00 63.18 ? 267 TYR B N 1 ATOM 4680 C CA . TYR B 1 277 ? -50.957 -45.373 -9.727 1.00 61.33 ? 267 TYR B CA 1 ATOM 4681 C C . TYR B 1 277 ? -50.839 -44.537 -10.961 1.00 65.95 ? 267 TYR B C 1 ATOM 4682 O O . TYR B 1 277 ? -50.817 -45.056 -12.093 1.00 65.53 ? 267 TYR B O 1 ATOM 4683 C CB . TYR B 1 277 ? -49.910 -46.486 -9.633 1.00 60.93 ? 267 TYR B CB 1 ATOM 4684 C CG . TYR B 1 277 ? -49.913 -47.102 -8.255 1.00 59.85 ? 267 TYR B CG 1 ATOM 4685 C CD1 . TYR B 1 277 ? -49.092 -46.602 -7.249 1.00 59.62 ? 267 TYR B CD1 1 ATOM 4686 C CD2 . TYR B 1 277 ? -50.799 -48.132 -7.929 1.00 59.72 ? 267 TYR B CD2 1 ATOM 4687 C CE1 . TYR B 1 277 ? -49.136 -47.119 -5.962 1.00 55.96 ? 267 TYR B CE1 1 ATOM 4688 C CE2 . TYR B 1 277 ? -50.853 -48.656 -6.639 1.00 59.48 ? 267 TYR B CE2 1 ATOM 4689 C CZ . TYR B 1 277 ? -50.018 -48.146 -5.662 1.00 62.80 ? 267 TYR B CZ 1 ATOM 4690 O OH . TYR B 1 277 ? -50.063 -48.666 -4.402 1.00 68.50 ? 267 TYR B OH 1 ATOM 4691 N N . THR B 1 278 ? -50.839 -43.218 -10.741 1.00 61.76 ? 268 THR B N 1 ATOM 4692 C CA . THR B 1 278 ? -50.904 -42.259 -11.826 1.00 61.40 ? 268 THR B CA 1 ATOM 4693 C C . THR B 1 278 ? -49.578 -41.631 -12.196 1.00 62.45 ? 268 THR B C 1 ATOM 4694 O O . THR B 1 278 ? -48.893 -41.060 -11.343 1.00 62.42 ? 268 THR B O 1 ATOM 4695 C CB . THR B 1 278 ? -51.994 -41.186 -11.498 1.00 70.18 ? 268 THR B CB 1 ATOM 4696 O OG1 . THR B 1 278 ? -53.245 -41.830 -11.224 1.00 75.23 ? 268 THR B OG1 1 ATOM 4697 C CG2 . THR B 1 278 ? -52.221 -40.227 -12.630 1.00 62.60 ? 268 THR B CG2 1 ATOM 4698 N N . LEU B 1 279 ? -49.279 -41.663 -13.486 1.00 56.63 ? 269 LEU B N 1 ATOM 4699 C CA . LEU B 1 279 ? -48.152 -40.955 -14.051 1.00 56.84 ? 269 LEU B CA 1 ATOM 4700 C C . LEU B 1 279 ? -48.715 -39.846 -14.918 1.00 64.09 ? 269 LEU B C 1 ATOM 4701 O O . LEU B 1 279 ? -49.535 -40.100 -15.807 1.00 62.23 ? 269 LEU B O 1 ATOM 4702 C CB . LEU B 1 279 ? -47.244 -41.847 -14.948 1.00 56.51 ? 269 LEU B CB 1 ATOM 4703 C CG . LEU B 1 279 ? -46.543 -43.141 -14.447 1.00 58.83 ? 269 LEU B CG 1 ATOM 4704 C CD1 . LEU B 1 279 ? -45.278 -43.371 -15.140 1.00 57.26 ? 269 LEU B CD1 1 ATOM 4705 C CD2 . LEU B 1 279 ? -46.260 -43.153 -13.004 1.00 59.09 ? 269 LEU B CD2 1 ATOM 4706 N N . THR B 1 280 ? -48.277 -38.606 -14.659 1.00 65.83 ? 270 THR B N 1 ATOM 4707 C CA . THR B 1 280 ? -48.624 -37.452 -15.487 1.00 67.11 ? 270 THR B CA 1 ATOM 4708 C C . THR B 1 280 ? -47.677 -37.476 -16.694 1.00 74.51 ? 270 THR B C 1 ATOM 4709 O O . THR B 1 280 ? -46.707 -38.249 -16.722 1.00 73.31 ? 270 THR B O 1 ATOM 4710 C CB . THR B 1 280 ? -48.486 -36.130 -14.722 1.00 79.75 ? 270 THR B CB 1 ATOM 4711 O OG1 . THR B 1 280 ? -47.110 -35.849 -14.458 1.00 82.02 ? 270 THR B OG1 1 ATOM 4712 C CG2 . THR B 1 280 ? -49.316 -36.086 -13.451 1.00 78.33 ? 270 THR B CG2 1 ATOM 4713 N N . SER B 1 281 ? -47.942 -36.613 -17.683 1.00 73.65 ? 271 SER B N 1 ATOM 4714 C CA . SER B 1 281 ? -47.108 -36.547 -18.882 1.00 73.13 ? 271 SER B CA 1 ATOM 4715 C C . SER B 1 281 ? -45.639 -36.214 -18.535 1.00 73.89 ? 271 SER B C 1 ATOM 4716 O O . SER B 1 281 ? -44.735 -36.734 -19.179 1.00 74.86 ? 271 SER B O 1 ATOM 4717 C CB . SER B 1 281 ? -47.704 -35.564 -19.876 1.00 76.58 ? 271 SER B CB 1 ATOM 4718 O OG . SER B 1 281 ? -47.673 -34.251 -19.342 1.00 92.56 ? 271 SER B OG 1 ATOM 4719 N N . ALA B 1 282 ? -45.412 -35.408 -17.484 1.00 65.87 ? 272 ALA B N 1 ATOM 4720 C CA . ALA B 1 282 ? -44.075 -35.077 -17.004 1.00 64.27 ? 272 ALA B CA 1 ATOM 4721 C C . ALA B 1 282 ? -43.325 -36.332 -16.522 1.00 67.32 ? 272 ALA B C 1 ATOM 4722 O O . ALA B 1 282 ? -42.107 -36.358 -16.560 1.00 66.27 ? 272 ALA B O 1 ATOM 4723 C CB . ALA B 1 282 ? -44.163 -34.063 -15.876 1.00 64.83 ? 272 ALA B CB 1 ATOM 4724 N N . ASP B 1 283 ? -44.052 -37.372 -16.081 1.00 64.28 ? 273 ASP B N 1 ATOM 4725 C CA . ASP B 1 283 ? -43.469 -38.629 -15.606 1.00 63.10 ? 273 ASP B CA 1 ATOM 4726 C C . ASP B 1 283 ? -43.157 -39.610 -16.733 1.00 65.82 ? 273 ASP B C 1 ATOM 4727 O O . ASP B 1 283 ? -42.364 -40.530 -16.523 1.00 66.06 ? 273 ASP B O 1 ATOM 4728 C CB . ASP B 1 283 ? -44.413 -39.320 -14.611 1.00 64.92 ? 273 ASP B CB 1 ATOM 4729 C CG . ASP B 1 283 ? -44.761 -38.495 -13.395 1.00 75.38 ? 273 ASP B CG 1 ATOM 4730 O OD1 . ASP B 1 283 ? -43.837 -37.895 -12.798 1.00 77.07 ? 273 ASP B OD1 1 ATOM 4731 O OD2 . ASP B 1 283 ? -45.950 -38.468 -13.020 1.00 79.27 ? 273 ASP B OD2 1 ATOM 4732 N N . TYR B 1 284 ? -43.802 -39.480 -17.899 1.00 61.09 ? 274 TYR B N 1 ATOM 4733 C CA . TYR B 1 284 ? -43.574 -40.444 -18.974 1.00 61.31 ? 274 TYR B CA 1 ATOM 4734 C C . TYR B 1 284 ? -43.052 -39.878 -20.300 1.00 68.38 ? 274 TYR B C 1 ATOM 4735 O O . TYR B 1 284 ? -42.740 -40.642 -21.221 1.00 67.73 ? 274 TYR B O 1 ATOM 4736 C CB . TYR B 1 284 ? -44.779 -41.386 -19.164 1.00 62.75 ? 274 TYR B CB 1 ATOM 4737 C CG . TYR B 1 284 ? -46.033 -40.744 -19.735 1.00 65.89 ? 274 TYR B CG 1 ATOM 4738 C CD1 . TYR B 1 284 ? -46.171 -40.534 -21.101 1.00 69.18 ? 274 TYR B CD1 1 ATOM 4739 C CD2 . TYR B 1 284 ? -47.109 -40.412 -18.916 1.00 66.27 ? 274 TYR B CD2 1 ATOM 4740 C CE1 . TYR B 1 284 ? -47.331 -39.965 -21.636 1.00 70.45 ? 274 TYR B CE1 1 ATOM 4741 C CE2 . TYR B 1 284 ? -48.276 -39.853 -19.440 1.00 66.94 ? 274 TYR B CE2 1 ATOM 4742 C CZ . TYR B 1 284 ? -48.384 -39.632 -20.803 1.00 76.80 ? 274 TYR B CZ 1 ATOM 4743 O OH . TYR B 1 284 ? -49.531 -39.097 -21.348 1.00 81.76 ? 274 TYR B OH 1 ATOM 4744 N N . VAL B 1 285 ? -42.939 -38.549 -20.397 1.00 67.94 ? 275 VAL B N 1 ATOM 4745 C CA . VAL B 1 285 ? -42.404 -37.894 -21.595 1.00 69.63 ? 275 VAL B CA 1 ATOM 4746 C C . VAL B 1 285 ? -41.009 -37.416 -21.269 1.00 73.67 ? 275 VAL B C 1 ATOM 4747 O O . VAL B 1 285 ? -40.823 -36.762 -20.241 1.00 74.22 ? 275 VAL B O 1 ATOM 4748 C CB . VAL B 1 285 ? -43.283 -36.687 -22.073 1.00 74.59 ? 275 VAL B CB 1 ATOM 4749 C CG1 . VAL B 1 285 ? -42.630 -35.932 -23.208 1.00 74.31 ? 275 VAL B CG1 1 ATOM 4750 C CG2 . VAL B 1 285 ? -44.688 -37.119 -22.467 1.00 74.44 ? 275 VAL B CG2 1 ATOM 4751 N N . PHE B 1 286 ? -40.034 -37.710 -22.136 1.00 69.40 ? 276 PHE B N 1 ATOM 4752 C CA . PHE B 1 286 ? -38.680 -37.173 -21.982 1.00 68.89 ? 276 PHE B CA 1 ATOM 4753 C C . PHE B 1 286 ? -38.752 -35.738 -22.528 1.00 77.00 ? 276 PHE B C 1 ATOM 4754 O O . PHE B 1 286 ? -38.608 -35.502 -23.731 1.00 76.28 ? 276 PHE B O 1 ATOM 4755 C CB . PHE B 1 286 ? -37.675 -38.023 -22.735 1.00 69.37 ? 276 PHE B CB 1 ATOM 4756 C CG . PHE B 1 286 ? -37.318 -39.316 -22.040 1.00 69.74 ? 276 PHE B CG 1 ATOM 4757 C CD1 . PHE B 1 286 ? -36.572 -39.316 -20.853 1.00 70.90 ? 276 PHE B CD1 1 ATOM 4758 C CD2 . PHE B 1 286 ? -37.687 -40.543 -22.588 1.00 69.67 ? 276 PHE B CD2 1 ATOM 4759 C CE1 . PHE B 1 286 ? -36.221 -40.518 -20.230 1.00 70.82 ? 276 PHE B CE1 1 ATOM 4760 C CE2 . PHE B 1 286 ? -37.301 -41.747 -21.981 1.00 71.28 ? 276 PHE B CE2 1 ATOM 4761 C CZ . PHE B 1 286 ? -36.567 -41.726 -20.814 1.00 69.55 ? 276 PHE B CZ 1 ATOM 4762 N N . GLN B 1 287 ? -39.019 -34.794 -21.616 1.00 76.65 ? 277 GLN B N 1 ATOM 4763 C CA . GLN B 1 287 ? -39.324 -33.409 -21.919 1.00 78.01 ? 277 GLN B CA 1 ATOM 4764 C C . GLN B 1 287 ? -38.108 -32.500 -21.928 1.00 89.91 ? 277 GLN B C 1 ATOM 4765 O O . GLN B 1 287 ? -37.969 -31.620 -21.065 1.00 90.95 ? 277 GLN B O 1 ATOM 4766 C CB . GLN B 1 287 ? -40.431 -32.931 -20.966 1.00 78.28 ? 277 GLN B CB 1 ATOM 4767 C CG . GLN B 1 287 ? -41.286 -31.800 -21.495 1.00 78.46 ? 277 GLN B CG 1 ATOM 4768 C CD . GLN B 1 287 ? -42.333 -32.203 -22.487 1.00 88.22 ? 277 GLN B CD 1 ATOM 4769 O OE1 . GLN B 1 287 ? -42.165 -31.997 -23.687 1.00 87.82 ? 277 GLN B OE1 1 ATOM 4770 N NE2 . GLN B 1 287 ? -43.441 -32.756 -22.003 1.00 72.87 ? 277 GLN B NE2 1 ATOM 4771 N N . GLU B 1 288 ? -37.224 -32.720 -22.925 1.00 90.94 ? 278 GLU B N 1 ATOM 4772 C CA . GLU B 1 288 ? -35.987 -31.955 -23.129 1.00 93.16 ? 278 GLU B CA 1 ATOM 4773 C C . GLU B 1 288 ? -36.332 -30.481 -23.354 1.00 100.09 ? 278 GLU B C 1 ATOM 4774 O O . GLU B 1 288 ? -35.791 -29.601 -22.672 1.00 99.74 ? 278 GLU B O 1 ATOM 4775 C CB . GLU B 1 288 ? -35.188 -32.518 -24.319 1.00 95.04 ? 278 GLU B CB 1 ATOM 4776 C CG . GLU B 1 288 ? -35.127 -34.041 -24.375 1.00 109.50 ? 278 GLU B CG 1 ATOM 4777 C CD . GLU B 1 288 ? -33.976 -34.730 -23.656 1.00 141.20 ? 278 GLU B CD 1 ATOM 4778 O OE1 . GLU B 1 288 ? -34.030 -34.852 -22.411 1.00 135.14 ? 278 GLU B OE1 1 ATOM 4779 O OE2 . GLU B 1 288 ? -33.053 -35.215 -24.349 1.00 142.51 ? 278 GLU B OE2 1 ATOM 4780 N N . SER B 1 289 ? -37.276 -30.230 -24.280 1.00 98.29 ? 279 SER B N 1 ATOM 4781 C CA . SER B 1 289 ? -37.773 -28.889 -24.562 1.00 98.02 ? 279 SER B CA 1 ATOM 4782 C C . SER B 1 289 ? -39.289 -28.933 -24.569 1.00 101.99 ? 279 SER B C 1 ATOM 4783 O O . SER B 1 289 ? -39.894 -29.999 -24.429 1.00 100.78 ? 279 SER B O 1 ATOM 4784 C CB . SER B 1 289 ? -37.236 -28.383 -25.908 1.00 100.42 ? 279 SER B CB 1 ATOM 4785 O OG . SER B 1 289 ? -37.578 -29.230 -26.990 1.00 105.11 ? 279 SER B OG 1 ATOM 4786 N N . TYR B 1 290 A -39.910 -27.769 -24.710 1.00 99.07 ? 279 TYR B N 1 ATOM 4787 C CA . TYR B 1 290 A -41.352 -27.643 -24.899 1.00 98.92 ? 279 TYR B CA 1 ATOM 4788 C C . TYR B 1 290 A -41.518 -26.909 -26.231 1.00 100.89 ? 279 TYR B C 1 ATOM 4789 O O . TYR B 1 290 A -42.463 -26.148 -26.443 1.00 99.10 ? 279 TYR B O 1 ATOM 4790 C CB . TYR B 1 290 A -42.006 -26.908 -23.725 1.00 100.71 ? 279 TYR B CB 1 ATOM 4791 C CG . TYR B 1 290 A -41.799 -27.611 -22.404 1.00 103.12 ? 279 TYR B CG 1 ATOM 4792 C CD1 . TYR B 1 290 A -42.831 -28.324 -21.804 1.00 105.10 ? 279 TYR B CD1 1 ATOM 4793 C CD2 . TYR B 1 290 A -40.559 -27.593 -21.769 1.00 104.26 ? 279 TYR B CD2 1 ATOM 4794 C CE1 . TYR B 1 290 A -42.648 -28.964 -20.580 1.00 106.60 ? 279 TYR B CE1 1 ATOM 4795 C CE2 . TYR B 1 290 A -40.351 -28.266 -20.572 1.00 105.47 ? 279 TYR B CE2 1 ATOM 4796 C CZ . TYR B 1 290 A -41.402 -28.931 -19.967 1.00 114.39 ? 279 TYR B CZ 1 ATOM 4797 O OH . TYR B 1 290 A -41.169 -29.589 -18.785 1.00 118.04 ? 279 TYR B OH 1 ATOM 4798 N N . SER B 1 291 B -40.548 -27.146 -27.126 1.00 97.77 ? 279 SER B N 1 ATOM 4799 C CA . SER B 1 291 B -40.491 -26.547 -28.446 1.00 97.90 ? 279 SER B CA 1 ATOM 4800 C C . SER B 1 291 B -41.484 -27.180 -29.396 1.00 101.26 ? 279 SER B C 1 ATOM 4801 O O . SER B 1 291 B -41.604 -28.402 -29.470 1.00 100.40 ? 279 SER B O 1 ATOM 4802 C CB . SER B 1 291 B -39.079 -26.643 -29.022 1.00 101.96 ? 279 SER B CB 1 ATOM 4803 O OG . SER B 1 291 B -38.968 -25.985 -30.275 1.00 111.09 ? 279 SER B OG 1 ATOM 4804 N N . SER B 1 292 C -42.157 -26.338 -30.161 1.00 98.23 ? 279 SER B N 1 ATOM 4805 C CA . SER B 1 292 C -43.099 -26.779 -31.180 1.00 98.40 ? 279 SER B CA 1 ATOM 4806 C C . SER B 1 292 C -42.361 -27.303 -32.432 1.00 100.64 ? 279 SER B C 1 ATOM 4807 O O . SER B 1 292 C -42.998 -27.864 -33.324 1.00 100.59 ? 279 SER B O 1 ATOM 4808 C CB . SER B 1 292 C -44.053 -25.641 -31.543 1.00 103.52 ? 279 SER B CB 1 ATOM 4809 O OG . SER B 1 292 C -43.350 -24.510 -32.039 1.00 113.07 ? 279 SER B OG 1 ATOM 4810 N N . LYS B 1 293 D -41.023 -27.152 -32.477 1.00 95.41 ? 279 LYS B N 1 ATOM 4811 C CA . LYS B 1 293 D -40.179 -27.575 -33.607 1.00 93.76 ? 279 LYS B CA 1 ATOM 4812 C C . LYS B 1 293 D -39.446 -28.905 -33.349 1.00 96.49 ? 279 LYS B C 1 ATOM 4813 O O . LYS B 1 293 D -38.770 -29.423 -34.248 1.00 96.36 ? 279 LYS B O 1 ATOM 4814 C CB . LYS B 1 293 D -39.146 -26.485 -33.952 1.00 94.64 ? 279 LYS B CB 1 ATOM 4815 C CG . LYS B 1 293 D -39.656 -25.059 -33.901 1.00 89.78 ? 279 LYS B CG 1 ATOM 4816 C CD . LYS B 1 293 D -38.505 -24.064 -33.843 1.00 82.38 ? 279 LYS B CD 1 ATOM 4817 C CE . LYS B 1 293 D -38.774 -22.915 -32.897 1.00 82.22 ? 279 LYS B CE 1 ATOM 4818 N NZ . LYS B 1 293 D -39.963 -22.090 -33.292 1.00 83.36 ? 279 LYS B NZ 1 ATOM 4819 N N . LYS B 1 294 ? -39.570 -29.454 -32.126 1.00 91.34 ? 280 LYS B N 1 ATOM 4820 C CA . LYS B 1 294 ? -38.881 -30.679 -31.730 1.00 89.49 ? 280 LYS B CA 1 ATOM 4821 C C . LYS B 1 294 ? -39.848 -31.809 -31.387 1.00 88.62 ? 280 LYS B C 1 ATOM 4822 O O . LYS B 1 294 ? -40.995 -31.573 -31.000 1.00 86.26 ? 280 LYS B O 1 ATOM 4823 C CB . LYS B 1 294 ? -37.949 -30.407 -30.534 1.00 91.40 ? 280 LYS B CB 1 ATOM 4824 C CG . LYS B 1 294 ? -36.949 -29.301 -30.760 1.00 103.08 ? 280 LYS B CG 1 ATOM 4825 C CD . LYS B 1 294 ? -35.681 -29.867 -31.278 1.00 116.71 ? 280 LYS B CD 1 ATOM 4826 C CE . LYS B 1 294 ? -34.614 -29.703 -30.258 1.00 131.83 ? 280 LYS B CE 1 ATOM 4827 N NZ . LYS B 1 294 ? -33.919 -28.397 -30.417 1.00 139.12 ? 280 LYS B NZ 1 ATOM 4828 N N . LEU B 1 295 ? -39.362 -33.049 -31.529 1.00 83.43 ? 281 LEU B N 1 ATOM 4829 C CA . LEU B 1 295 ? -40.088 -34.259 -31.162 1.00 81.17 ? 281 LEU B CA 1 ATOM 4830 C C . LEU B 1 295 ? -39.525 -34.810 -29.855 1.00 84.05 ? 281 LEU B C 1 ATOM 4831 O O . LEU B 1 295 ? -38.305 -34.823 -29.657 1.00 84.34 ? 281 LEU B O 1 ATOM 4832 C CB . LEU B 1 295 ? -40.005 -35.310 -32.258 1.00 80.19 ? 281 LEU B CB 1 ATOM 4833 C CG . LEU B 1 295 ? -40.652 -34.946 -33.583 1.00 83.82 ? 281 LEU B CG 1 ATOM 4834 C CD1 . LEU B 1 295 ? -40.290 -35.962 -34.648 1.00 84.16 ? 281 LEU B CD1 1 ATOM 4835 C CD2 . LEU B 1 295 ? -42.163 -34.840 -33.463 1.00 85.42 ? 281 LEU B CD2 1 ATOM 4836 N N . CYS B 1 296 ? -40.420 -35.199 -28.946 1.00 78.94 ? 282 CYS B N 1 ATOM 4837 C CA . CYS B 1 296 ? -40.065 -35.727 -27.633 1.00 78.04 ? 282 CYS B CA 1 ATOM 4838 C C . CYS B 1 296 ? -40.462 -37.200 -27.529 1.00 80.45 ? 282 CYS B C 1 ATOM 4839 O O . CYS B 1 296 ? -41.582 -37.575 -27.906 1.00 81.21 ? 282 CYS B O 1 ATOM 4840 C CB . CYS B 1 296 ? -40.702 -34.886 -26.532 1.00 78.33 ? 282 CYS B CB 1 ATOM 4841 S SG . CYS B 1 296 ? -39.781 -33.387 -26.101 1.00 82.51 ? 282 CYS B SG 1 ATOM 4842 N N . THR B 1 297 ? -39.535 -38.038 -27.053 1.00 74.07 ? 283 THR B N 1 ATOM 4843 C CA . THR B 1 297 ? -39.790 -39.473 -26.936 1.00 72.50 ? 283 THR B CA 1 ATOM 4844 C C . THR B 1 297 ? -40.500 -39.804 -25.648 1.00 71.57 ? 283 THR B C 1 ATOM 4845 O O . THR B 1 297 ? -40.364 -39.075 -24.662 1.00 69.99 ? 283 THR B O 1 ATOM 4846 C CB . THR B 1 297 ? -38.502 -40.273 -27.021 1.00 83.63 ? 283 THR B CB 1 ATOM 4847 O OG1 . THR B 1 297 ? -37.688 -39.911 -25.926 1.00 89.87 ? 283 THR B OG1 1 ATOM 4848 C CG2 . THR B 1 297 ? -37.776 -40.059 -28.332 1.00 80.25 ? 283 THR B CG2 1 ATOM 4849 N N . LEU B 1 298 ? -41.232 -40.936 -25.648 1.00 66.44 ? 284 LEU B N 1 ATOM 4850 C CA . LEU B 1 298 ? -41.940 -41.391 -24.456 1.00 66.12 ? 284 LEU B CA 1 ATOM 4851 C C . LEU B 1 298 ? -41.190 -42.523 -23.766 1.00 70.72 ? 284 LEU B C 1 ATOM 4852 O O . LEU B 1 298 ? -40.562 -43.351 -24.420 1.00 71.42 ? 284 LEU B O 1 ATOM 4853 C CB . LEU B 1 298 ? -43.358 -41.849 -24.776 1.00 66.39 ? 284 LEU B CB 1 ATOM 4854 C CG . LEU B 1 298 ? -44.360 -40.932 -25.540 1.00 70.79 ? 284 LEU B CG 1 ATOM 4855 C CD1 . LEU B 1 298 ? -45.757 -41.318 -25.202 1.00 70.34 ? 284 LEU B CD1 1 ATOM 4856 C CD2 . LEU B 1 298 ? -44.232 -39.471 -25.209 1.00 72.91 ? 284 LEU B CD2 1 ATOM 4857 N N . ALA B 1 299 ? -41.265 -42.569 -22.432 1.00 66.96 ? 285 ALA B N 1 ATOM 4858 C CA . ALA B 1 299 ? -40.596 -43.594 -21.617 1.00 65.76 ? 285 ALA B CA 1 ATOM 4859 C C . ALA B 1 299 ? -41.474 -44.826 -21.446 1.00 67.93 ? 285 ALA B C 1 ATOM 4860 O O . ALA B 1 299 ? -41.535 -45.422 -20.368 1.00 66.97 ? 285 ALA B O 1 ATOM 4861 C CB . ALA B 1 299 ? -40.227 -43.012 -20.270 1.00 66.26 ? 285 ALA B CB 1 ATOM 4862 N N . ILE B 1 300 ? -42.159 -45.195 -22.535 1.00 64.85 ? 286 ILE B N 1 ATOM 4863 C CA . ILE B 1 300 ? -43.064 -46.345 -22.643 1.00 65.45 ? 286 ILE B CA 1 ATOM 4864 C C . ILE B 1 300 ? -42.763 -46.993 -23.983 1.00 71.80 ? 286 ILE B C 1 ATOM 4865 O O . ILE B 1 300 ? -42.694 -46.298 -25.005 1.00 71.31 ? 286 ILE B O 1 ATOM 4866 C CB . ILE B 1 300 ? -44.573 -45.941 -22.512 1.00 67.95 ? 286 ILE B CB 1 ATOM 4867 C CG1 . ILE B 1 300 ? -44.860 -45.208 -21.171 1.00 67.83 ? 286 ILE B CG1 1 ATOM 4868 C CG2 . ILE B 1 300 ? -45.484 -47.157 -22.666 1.00 66.90 ? 286 ILE B CG2 1 ATOM 4869 C CD1 . ILE B 1 300 ? -46.198 -44.485 -21.082 1.00 68.74 ? 286 ILE B CD1 1 ATOM 4870 N N . HIS B 1 301 ? -42.506 -48.307 -23.957 1.00 71.97 ? 287 HIS B N 1 ATOM 4871 C CA . HIS B 1 301 ? -42.136 -49.095 -25.128 1.00 75.56 ? 287 HIS B CA 1 ATOM 4872 C C . HIS B 1 301 ? -42.899 -50.410 -25.215 1.00 81.99 ? 287 HIS B C 1 ATOM 4873 O O . HIS B 1 301 ? -43.411 -50.898 -24.211 1.00 83.43 ? 287 HIS B O 1 ATOM 4874 C CB . HIS B 1 301 ? -40.635 -49.408 -25.104 1.00 78.85 ? 287 HIS B CB 1 ATOM 4875 C CG . HIS B 1 301 ? -39.761 -48.267 -25.534 1.00 85.23 ? 287 HIS B CG 1 ATOM 4876 N ND1 . HIS B 1 301 ? -39.615 -47.114 -24.751 1.00 89.01 ? 287 HIS B ND1 1 ATOM 4877 C CD2 . HIS B 1 301 ? -38.962 -48.148 -26.620 1.00 88.42 ? 287 HIS B CD2 1 ATOM 4878 C CE1 . HIS B 1 301 ? -38.767 -46.324 -25.405 1.00 88.62 ? 287 HIS B CE1 1 ATOM 4879 N NE2 . HIS B 1 301 ? -38.344 -46.898 -26.532 1.00 88.66 ? 287 HIS B NE2 1 ATOM 4880 N N . ALA B 1 302 ? -42.969 -50.999 -26.421 1.00 77.36 ? 288 ALA B N 1 ATOM 4881 C CA . ALA B 1 302 ? -43.562 -52.317 -26.581 1.00 75.66 ? 288 ALA B CA 1 ATOM 4882 C C . ALA B 1 302 ? -42.487 -53.362 -26.314 1.00 76.02 ? 288 ALA B C 1 ATOM 4883 O O . ALA B 1 302 ? -41.344 -53.227 -26.770 1.00 74.35 ? 288 ALA B O 1 ATOM 4884 C CB . ALA B 1 302 ? -44.105 -52.492 -27.983 1.00 76.36 ? 288 ALA B CB 1 ATOM 4885 N N . MET B 1 303 ? -42.850 -54.382 -25.536 1.00 71.64 ? 289 MET B N 1 ATOM 4886 C CA . MET B 1 303 ? -42.005 -55.523 -25.265 1.00 71.29 ? 289 MET B CA 1 ATOM 4887 C C . MET B 1 303 ? -42.860 -56.754 -25.077 1.00 75.83 ? 289 MET B C 1 ATOM 4888 O O . MET B 1 303 ? -43.629 -56.842 -24.122 1.00 75.85 ? 289 MET B O 1 ATOM 4889 C CB . MET B 1 303 ? -41.020 -55.298 -24.115 1.00 73.66 ? 289 MET B CB 1 ATOM 4890 C CG . MET B 1 303 ? -39.899 -56.280 -24.182 1.00 77.90 ? 289 MET B CG 1 ATOM 4891 S SD . MET B 1 303 ? -38.261 -55.929 -23.697 1.00 83.40 ? 289 MET B SD 1 ATOM 4892 C CE . MET B 1 303 ? -37.453 -56.355 -25.176 1.00 80.88 ? 289 MET B CE 1 ATOM 4893 N N . ASP B 1 304 ? -42.761 -57.690 -26.025 1.00 72.81 ? 290 ASP B N 1 ATOM 4894 C CA . ASP B 1 304 ? -43.507 -58.943 -25.954 1.00 72.43 ? 290 ASP B CA 1 ATOM 4895 C C . ASP B 1 304 ? -42.687 -59.980 -25.183 1.00 78.74 ? 290 ASP B C 1 ATOM 4896 O O . ASP B 1 304 ? -41.706 -60.528 -25.703 1.00 78.90 ? 290 ASP B O 1 ATOM 4897 C CB . ASP B 1 304 ? -43.913 -59.423 -27.350 1.00 73.12 ? 290 ASP B CB 1 ATOM 4898 C CG . ASP B 1 304 ? -44.880 -58.479 -28.033 1.00 82.14 ? 290 ASP B CG 1 ATOM 4899 O OD1 . ASP B 1 304 ? -46.015 -58.335 -27.537 1.00 83.38 ? 290 ASP B OD1 1 ATOM 4900 O OD2 . ASP B 1 304 ? -44.500 -57.875 -29.062 1.00 86.72 ? 290 ASP B OD2 1 ATOM 4901 N N . ILE B 1 305 ? -43.044 -60.184 -23.911 1.00 75.67 ? 291 ILE B N 1 ATOM 4902 C CA . ILE B 1 305 ? -42.354 -61.146 -23.049 1.00 75.41 ? 291 ILE B CA 1 ATOM 4903 C C . ILE B 1 305 ? -43.050 -62.498 -23.216 1.00 80.37 ? 291 ILE B C 1 ATOM 4904 O O . ILE B 1 305 ? -44.262 -62.586 -23.050 1.00 79.95 ? 291 ILE B O 1 ATOM 4905 C CB . ILE B 1 305 ? -42.284 -60.665 -21.576 1.00 78.15 ? 291 ILE B CB 1 ATOM 4906 C CG1 . ILE B 1 305 ? -41.511 -59.329 -21.472 1.00 78.65 ? 291 ILE B CG1 1 ATOM 4907 C CG2 . ILE B 1 305 ? -41.666 -61.717 -20.673 1.00 77.38 ? 291 ILE B CG2 1 ATOM 4908 C CD1 . ILE B 1 305 ? -41.978 -58.443 -20.282 1.00 87.54 ? 291 ILE B CD1 1 ATOM 4909 N N . PRO B 1 306 ? -42.294 -63.542 -23.599 1.00 78.81 ? 292 PRO B N 1 ATOM 4910 C CA . PRO B 1 306 ? -42.900 -64.852 -23.847 1.00 79.32 ? 292 PRO B CA 1 ATOM 4911 C C . PRO B 1 306 ? -43.313 -65.611 -22.584 1.00 86.40 ? 292 PRO B C 1 ATOM 4912 O O . PRO B 1 306 ? -42.789 -65.320 -21.497 1.00 86.42 ? 292 PRO B O 1 ATOM 4913 C CB . PRO B 1 306 ? -41.773 -65.603 -24.561 1.00 80.82 ? 292 PRO B CB 1 ATOM 4914 C CG . PRO B 1 306 ? -40.538 -65.024 -23.999 1.00 85.13 ? 292 PRO B CG 1 ATOM 4915 C CD . PRO B 1 306 ? -40.843 -63.571 -23.866 1.00 80.93 ? 292 PRO B CD 1 ATOM 4916 N N . PRO B 1 307 ? -44.202 -66.641 -22.735 1.00 83.83 ? 293 PRO B N 1 ATOM 4917 C CA . PRO B 1 307 ? -44.544 -67.508 -21.591 1.00 82.82 ? 293 PRO B CA 1 ATOM 4918 C C . PRO B 1 307 ? -43.301 -68.200 -21.010 1.00 84.71 ? 293 PRO B C 1 ATOM 4919 O O . PRO B 1 307 ? -42.296 -68.359 -21.715 1.00 82.35 ? 293 PRO B O 1 ATOM 4920 C CB . PRO B 1 307 ? -45.508 -68.530 -22.202 1.00 84.51 ? 293 PRO B CB 1 ATOM 4921 C CG . PRO B 1 307 ? -46.069 -67.857 -23.401 1.00 88.83 ? 293 PRO B CG 1 ATOM 4922 C CD . PRO B 1 307 ? -44.931 -67.064 -23.952 1.00 84.62 ? 293 PRO B CD 1 ATOM 4923 N N . PRO B 1 308 ? -43.324 -68.578 -19.715 1.00 82.59 ? 294 PRO B N 1 ATOM 4924 C CA . PRO B 1 308 ? -44.444 -68.459 -18.767 1.00 83.27 ? 294 PRO B CA 1 ATOM 4925 C C . PRO B 1 308 ? -44.634 -67.076 -18.136 1.00 89.70 ? 294 PRO B C 1 ATOM 4926 O O . PRO B 1 308 ? -45.765 -66.748 -17.745 1.00 89.11 ? 294 PRO B O 1 ATOM 4927 C CB . PRO B 1 308 ? -44.120 -69.539 -17.728 1.00 84.40 ? 294 PRO B CB 1 ATOM 4928 C CG . PRO B 1 308 ? -42.624 -69.605 -17.703 1.00 87.69 ? 294 PRO B CG 1 ATOM 4929 C CD . PRO B 1 308 ? -42.151 -69.222 -19.087 1.00 83.30 ? 294 PRO B CD 1 ATOM 4930 N N . THR B 1 309 ? -43.539 -66.275 -18.028 1.00 87.18 ? 295 THR B N 1 ATOM 4931 C CA . THR B 1 309 ? -43.589 -64.946 -17.412 1.00 87.22 ? 295 THR B CA 1 ATOM 4932 C C . THR B 1 309 ? -44.608 -64.050 -18.102 1.00 92.58 ? 295 THR B C 1 ATOM 4933 O O . THR B 1 309 ? -45.473 -63.487 -17.442 1.00 92.25 ? 295 THR B O 1 ATOM 4934 C CB . THR B 1 309 ? -42.208 -64.274 -17.334 1.00 89.99 ? 295 THR B CB 1 ATOM 4935 O OG1 . THR B 1 309 ? -41.227 -65.192 -16.851 1.00 87.89 ? 295 THR B OG1 1 ATOM 4936 C CG2 . THR B 1 309 ? -42.232 -63.043 -16.438 1.00 87.08 ? 295 THR B CG2 1 ATOM 4937 N N . GLY B 1 310 ? -44.510 -63.961 -19.420 1.00 90.68 ? 296 GLY B N 1 ATOM 4938 C CA . GLY B 1 310 ? -45.417 -63.152 -20.213 1.00 91.09 ? 296 GLY B CA 1 ATOM 4939 C C . GLY B 1 310 ? -46.543 -63.943 -20.851 1.00 96.19 ? 296 GLY B C 1 ATOM 4940 O O . GLY B 1 310 ? -46.632 -65.163 -20.668 1.00 98.06 ? 296 GLY B O 1 ATOM 4941 N N . PRO B 1 311 ? -47.428 -63.272 -21.615 1.00 90.37 ? 297 PRO B N 1 ATOM 4942 C CA . PRO B 1 311 ? -47.440 -61.830 -21.890 1.00 89.57 ? 297 PRO B CA 1 ATOM 4943 C C . PRO B 1 311 ? -47.715 -61.034 -20.619 1.00 89.74 ? 297 PRO B C 1 ATOM 4944 O O . PRO B 1 311 ? -48.580 -61.403 -19.826 1.00 89.07 ? 297 PRO B O 1 ATOM 4945 C CB . PRO B 1 311 ? -48.568 -61.674 -22.932 1.00 91.51 ? 297 PRO B CB 1 ATOM 4946 C CG . PRO B 1 311 ? -48.788 -63.054 -23.477 1.00 96.02 ? 297 PRO B CG 1 ATOM 4947 C CD . PRO B 1 311 ? -48.543 -63.943 -22.298 1.00 91.52 ? 297 PRO B CD 1 ATOM 4948 N N . THR B 1 312 ? -46.926 -59.978 -20.408 1.00 83.83 ? 298 THR B N 1 ATOM 4949 C CA . THR B 1 312 ? -47.080 -59.089 -19.267 1.00 82.19 ? 298 THR B CA 1 ATOM 4950 C C . THR B 1 312 ? -46.619 -57.713 -19.566 1.00 81.89 ? 298 THR B C 1 ATOM 4951 O O . THR B 1 312 ? -45.748 -57.492 -20.413 1.00 80.74 ? 298 THR B O 1 ATOM 4952 C CB . THR B 1 312 ? -46.274 -59.535 -18.024 1.00 90.87 ? 298 THR B CB 1 ATOM 4953 O OG1 . THR B 1 312 ? -44.923 -59.788 -18.392 1.00 88.65 ? 298 THR B OG1 1 ATOM 4954 C CG2 . THR B 1 312 ? -46.819 -60.732 -17.404 1.00 93.56 ? 298 THR B CG2 1 ATOM 4955 N N . TRP B 1 313 ? -47.146 -56.786 -18.767 1.00 75.67 ? 299 TRP B N 1 ATOM 4956 C CA . TRP B 1 313 ? -46.660 -55.437 -18.712 1.00 72.46 ? 299 TRP B CA 1 ATOM 4957 C C . TRP B 1 313 ? -45.428 -55.525 -17.801 1.00 68.93 ? 299 TRP B C 1 ATOM 4958 O O . TRP B 1 313 ? -45.317 -56.429 -16.950 1.00 66.48 ? 299 TRP B O 1 ATOM 4959 C CB . TRP B 1 313 ? -47.689 -54.521 -18.057 1.00 70.68 ? 299 TRP B CB 1 ATOM 4960 C CG . TRP B 1 313 ? -48.850 -54.187 -18.931 1.00 71.36 ? 299 TRP B CG 1 ATOM 4961 C CD1 . TRP B 1 313 ? -49.926 -54.977 -19.198 1.00 74.26 ? 299 TRP B CD1 1 ATOM 4962 C CD2 . TRP B 1 313 ? -49.095 -52.932 -19.591 1.00 70.89 ? 299 TRP B CD2 1 ATOM 4963 N NE1 . TRP B 1 313 ? -50.820 -54.299 -20.002 1.00 73.78 ? 299 TRP B NE1 1 ATOM 4964 C CE2 . TRP B 1 313 ? -50.332 -53.042 -20.257 1.00 74.82 ? 299 TRP B CE2 1 ATOM 4965 C CE3 . TRP B 1 313 ? -48.375 -51.733 -19.707 1.00 71.48 ? 299 TRP B CE3 1 ATOM 4966 C CZ2 . TRP B 1 313 ? -50.867 -51.992 -21.024 1.00 73.75 ? 299 TRP B CZ2 1 ATOM 4967 C CZ3 . TRP B 1 313 ? -48.907 -50.701 -20.466 1.00 72.41 ? 299 TRP B CZ3 1 ATOM 4968 C CH2 . TRP B 1 313 ? -50.134 -50.835 -21.113 1.00 73.02 ? 299 TRP B CH2 1 ATOM 4969 N N . ALA B 1 314 ? -44.494 -54.605 -17.995 1.00 61.74 ? 300 ALA B N 1 ATOM 4970 C CA . ALA B 1 314 ? -43.349 -54.534 -17.114 1.00 59.84 ? 300 ALA B CA 1 ATOM 4971 C C . ALA B 1 314 ? -43.279 -53.110 -16.626 1.00 61.41 ? 300 ALA B C 1 ATOM 4972 O O . ALA B 1 314 ? -43.353 -52.178 -17.429 1.00 61.43 ? 300 ALA B O 1 ATOM 4973 C CB . ALA B 1 314 ? -42.074 -54.936 -17.833 1.00 60.39 ? 300 ALA B CB 1 ATOM 4974 N N . LEU B 1 315 ? -43.209 -52.938 -15.301 1.00 56.69 ? 301 LEU B N 1 ATOM 4975 C CA . LEU B 1 315 ? -43.092 -51.630 -14.673 1.00 54.69 ? 301 LEU B CA 1 ATOM 4976 C C . LEU B 1 315 ? -41.635 -51.441 -14.298 1.00 56.65 ? 301 LEU B C 1 ATOM 4977 O O . LEU B 1 315 ? -41.181 -51.941 -13.256 1.00 57.00 ? 301 LEU B O 1 ATOM 4978 C CB . LEU B 1 315 ? -44.032 -51.508 -13.452 1.00 54.52 ? 301 LEU B CB 1 ATOM 4979 C CG . LEU B 1 315 ? -45.546 -51.779 -13.710 1.00 57.33 ? 301 LEU B CG 1 ATOM 4980 C CD1 . LEU B 1 315 ? -46.346 -51.705 -12.417 1.00 54.86 ? 301 LEU B CD1 1 ATOM 4981 C CD2 . LEU B 1 315 ? -46.106 -50.849 -14.807 1.00 57.49 ? 301 LEU B CD2 1 ATOM 4982 N N . GLY B 1 316 ? -40.905 -50.785 -15.200 1.00 50.90 ? 302 GLY B N 1 ATOM 4983 C CA . GLY B 1 316 ? -39.484 -50.525 -15.061 1.00 50.31 ? 302 GLY B CA 1 ATOM 4984 C C . GLY B 1 316 ? -39.191 -49.181 -14.455 1.00 56.91 ? 302 GLY B C 1 ATOM 4985 O O . GLY B 1 316 ? -40.012 -48.645 -13.702 1.00 55.99 ? 302 GLY B O 1 ATOM 4986 N N . ALA B 1 317 ? -38.004 -48.638 -14.775 1.00 56.01 ? 303 ALA B N 1 ATOM 4987 C CA . ALA B 1 317 ? -37.513 -47.380 -14.214 1.00 55.91 ? 303 ALA B CA 1 ATOM 4988 C C . ALA B 1 317 ? -38.514 -46.218 -14.277 1.00 60.80 ? 303 ALA B C 1 ATOM 4989 O O . ALA B 1 317 ? -38.652 -45.492 -13.280 1.00 61.41 ? 303 ALA B O 1 ATOM 4990 C CB . ALA B 1 317 ? -36.198 -47.001 -14.850 1.00 56.63 ? 303 ALA B CB 1 ATOM 4991 N N . THR B 1 318 ? -39.256 -46.073 -15.413 1.00 55.95 ? 304 THR B N 1 ATOM 4992 C CA . THR B 1 318 ? -40.278 -45.016 -15.579 1.00 54.77 ? 304 THR B CA 1 ATOM 4993 C C . THR B 1 318 ? -41.262 -45.005 -14.407 1.00 57.83 ? 304 THR B C 1 ATOM 4994 O O . THR B 1 318 ? -41.582 -43.934 -13.893 1.00 57.46 ? 304 THR B O 1 ATOM 4995 C CB . THR B 1 318 ? -41.076 -45.185 -16.887 1.00 53.62 ? 304 THR B CB 1 ATOM 4996 O OG1 . THR B 1 318 ? -40.174 -45.324 -17.981 1.00 50.70 ? 304 THR B OG1 1 ATOM 4997 C CG2 . THR B 1 318 ? -42.044 -44.012 -17.140 1.00 48.09 ? 304 THR B CG2 1 ATOM 4998 N N . PHE B 1 319 ? -41.732 -46.203 -13.992 1.00 52.76 ? 305 PHE B N 1 ATOM 4999 C CA . PHE B 1 319 ? -42.666 -46.372 -12.897 1.00 51.78 ? 305 PHE B CA 1 ATOM 5000 C C . PHE B 1 319 ? -41.979 -46.175 -11.556 1.00 57.79 ? 305 PHE B C 1 ATOM 5001 O O . PHE B 1 319 ? -42.523 -45.477 -10.686 1.00 58.72 ? 305 PHE B O 1 ATOM 5002 C CB . PHE B 1 319 ? -43.317 -47.754 -12.955 1.00 53.09 ? 305 PHE B CB 1 ATOM 5003 C CG . PHE B 1 319 ? -44.519 -47.902 -12.052 1.00 54.03 ? 305 PHE B CG 1 ATOM 5004 C CD1 . PHE B 1 319 ? -44.387 -48.428 -10.779 1.00 56.52 ? 305 PHE B CD1 1 ATOM 5005 C CD2 . PHE B 1 319 ? -45.784 -47.509 -12.473 1.00 54.60 ? 305 PHE B CD2 1 ATOM 5006 C CE1 . PHE B 1 319 ? -45.499 -48.542 -9.931 1.00 57.53 ? 305 PHE B CE1 1 ATOM 5007 C CE2 . PHE B 1 319 ? -46.897 -47.636 -11.625 1.00 57.45 ? 305 PHE B CE2 1 ATOM 5008 C CZ . PHE B 1 319 ? -46.748 -48.152 -10.364 1.00 55.80 ? 305 PHE B CZ 1 ATOM 5009 N N . ILE B 1 320 ? -40.784 -46.788 -11.378 1.00 52.96 ? 306 ILE B N 1 ATOM 5010 C CA . ILE B 1 320 ? -40.028 -46.693 -10.123 1.00 51.47 ? 306 ILE B CA 1 ATOM 5011 C C . ILE B 1 320 ? -39.613 -45.262 -9.752 1.00 56.97 ? 306 ILE B C 1 ATOM 5012 O O . ILE B 1 320 ? -39.600 -44.904 -8.556 1.00 56.04 ? 306 ILE B O 1 ATOM 5013 C CB . ILE B 1 320 ? -38.895 -47.725 -10.042 1.00 53.46 ? 306 ILE B CB 1 ATOM 5014 C CG1 . ILE B 1 320 ? -39.469 -49.179 -10.145 1.00 52.63 ? 306 ILE B CG1 1 ATOM 5015 C CG2 . ILE B 1 320 ? -38.061 -47.534 -8.756 1.00 52.38 ? 306 ILE B CG2 1 ATOM 5016 C CD1 . ILE B 1 320 ? -38.538 -50.157 -10.698 1.00 57.39 ? 306 ILE B CD1 1 ATOM 5017 N N . ARG B 1 321 ? -39.345 -44.419 -10.778 1.00 54.91 ? 307 ARG B N 1 ATOM 5018 C CA . ARG B 1 321 ? -39.018 -43.006 -10.561 1.00 55.48 ? 307 ARG B CA 1 ATOM 5019 C C . ARG B 1 321 ? -40.133 -42.291 -9.804 1.00 59.61 ? 307 ARG B C 1 ATOM 5020 O O . ARG B 1 321 ? -39.839 -41.485 -8.916 1.00 59.98 ? 307 ARG B O 1 ATOM 5021 C CB . ARG B 1 321 ? -38.752 -42.272 -11.871 1.00 55.00 ? 307 ARG B CB 1 ATOM 5022 C CG . ARG B 1 321 ? -37.323 -42.392 -12.360 1.00 53.43 ? 307 ARG B CG 1 ATOM 5023 C CD . ARG B 1 321 ? -37.015 -41.359 -13.446 1.00 43.96 ? 307 ARG B CD 1 ATOM 5024 N NE . ARG B 1 321 ? -37.669 -41.673 -14.708 1.00 46.11 ? 307 ARG B NE 1 ATOM 5025 C CZ . ARG B 1 321 ? -37.204 -42.544 -15.600 1.00 66.05 ? 307 ARG B CZ 1 ATOM 5026 N NH1 . ARG B 1 321 ? -36.068 -43.199 -15.373 1.00 61.05 ? 307 ARG B NH1 1 ATOM 5027 N NH2 . ARG B 1 321 ? -37.871 -42.772 -16.722 1.00 44.44 ? 307 ARG B NH2 1 ATOM 5028 N N . LYS B 1 322 ? -41.397 -42.574 -10.164 1.00 54.82 ? 308 LYS B N 1 ATOM 5029 C CA . LYS B 1 322 ? -42.555 -41.979 -9.495 1.00 54.09 ? 308 LYS B CA 1 ATOM 5030 C C . LYS B 1 322 ? -42.845 -42.672 -8.182 1.00 54.25 ? 308 LYS B C 1 ATOM 5031 O O . LYS B 1 322 ? -43.119 -42.002 -7.193 1.00 52.42 ? 308 LYS B O 1 ATOM 5032 C CB . LYS B 1 322 ? -43.784 -42.068 -10.405 1.00 56.48 ? 308 LYS B CB 1 ATOM 5033 C CG . LYS B 1 322 ? -45.038 -41.352 -9.899 1.00 58.28 ? 308 LYS B CG 1 ATOM 5034 C CD . LYS B 1 322 ? -45.041 -39.861 -10.073 1.00 59.11 ? 308 LYS B CD 1 ATOM 5035 C CE . LYS B 1 322 ? -46.273 -39.228 -9.545 1.00 56.69 ? 308 LYS B CE 1 ATOM 5036 N NZ . LYS B 1 322 ? -47.212 -38.896 -10.623 1.00 72.91 ? 308 LYS B NZ 1 ATOM 5037 N N . PHE B 1 323 ? -42.748 -44.011 -8.166 1.00 50.86 ? 309 PHE B N 1 ATOM 5038 C CA . PHE B 1 323 ? -43.074 -44.803 -6.989 1.00 51.02 ? 309 PHE B CA 1 ATOM 5039 C C . PHE B 1 323 ? -41.932 -45.588 -6.403 1.00 57.59 ? 309 PHE B C 1 ATOM 5040 O O . PHE B 1 323 ? -41.513 -46.600 -6.969 1.00 56.46 ? 309 PHE B O 1 ATOM 5041 C CB . PHE B 1 323 ? -44.297 -45.712 -7.273 1.00 51.65 ? 309 PHE B CB 1 ATOM 5042 C CG . PHE B 1 323 ? -45.506 -44.942 -7.714 1.00 51.75 ? 309 PHE B CG 1 ATOM 5043 C CD1 . PHE B 1 323 ? -46.225 -44.176 -6.809 1.00 54.33 ? 309 PHE B CD1 1 ATOM 5044 C CD2 . PHE B 1 323 ? -45.887 -44.927 -9.040 1.00 53.17 ? 309 PHE B CD2 1 ATOM 5045 C CE1 . PHE B 1 323 ? -47.315 -43.437 -7.208 1.00 55.44 ? 309 PHE B CE1 1 ATOM 5046 C CE2 . PHE B 1 323 ? -46.994 -44.201 -9.440 1.00 55.96 ? 309 PHE B CE2 1 ATOM 5047 C CZ . PHE B 1 323 ? -47.699 -43.456 -8.522 1.00 54.57 ? 309 PHE B CZ 1 ATOM 5048 N N . TYR B 1 324 ? -41.436 -45.118 -5.248 1.00 56.98 ? 310 TYR B N 1 ATOM 5049 C CA . TYR B 1 324 ? -40.421 -45.790 -4.435 1.00 57.10 ? 310 TYR B CA 1 ATOM 5050 C C . TYR B 1 324 ? -40.976 -47.196 -4.160 1.00 61.29 ? 310 TYR B C 1 ATOM 5051 O O . TYR B 1 324 ? -42.143 -47.335 -3.779 1.00 62.38 ? 310 TYR B O 1 ATOM 5052 C CB . TYR B 1 324 ? -40.233 -45.019 -3.124 1.00 58.47 ? 310 TYR B CB 1 ATOM 5053 C CG . TYR B 1 324 ? -39.117 -45.545 -2.259 1.00 60.19 ? 310 TYR B CG 1 ATOM 5054 C CD1 . TYR B 1 324 ? -39.304 -46.662 -1.446 1.00 61.92 ? 310 TYR B CD1 1 ATOM 5055 C CD2 . TYR B 1 324 ? -37.884 -44.905 -2.219 1.00 61.05 ? 310 TYR B CD2 1 ATOM 5056 C CE1 . TYR B 1 324 ? -38.279 -47.149 -0.644 1.00 61.84 ? 310 TYR B CE1 1 ATOM 5057 C CE2 . TYR B 1 324 ? -36.845 -45.389 -1.431 1.00 61.76 ? 310 TYR B CE2 1 ATOM 5058 C CZ . TYR B 1 324 ? -37.049 -46.510 -0.644 1.00 68.73 ? 310 TYR B CZ 1 ATOM 5059 O OH . TYR B 1 324 ? -36.032 -46.971 0.146 1.00 70.08 ? 310 TYR B OH 1 ATOM 5060 N N . THR B 1 325 ? -40.156 -48.227 -4.389 1.00 56.89 ? 311 THR B N 1 ATOM 5061 C CA . THR B 1 325 ? -40.605 -49.614 -4.351 1.00 55.75 ? 311 THR B CA 1 ATOM 5062 C C . THR B 1 325 ? -39.936 -50.471 -3.316 1.00 60.67 ? 311 THR B C 1 ATOM 5063 O O . THR B 1 325 ? -38.714 -50.534 -3.276 1.00 61.87 ? 311 THR B O 1 ATOM 5064 C CB . THR B 1 325 ? -40.475 -50.240 -5.764 1.00 55.68 ? 311 THR B CB 1 ATOM 5065 O OG1 . THR B 1 325 ? -41.107 -49.405 -6.741 1.00 58.99 ? 311 THR B OG1 1 ATOM 5066 C CG2 . THR B 1 325 ? -41.090 -51.627 -5.848 1.00 48.86 ? 311 THR B CG2 1 ATOM 5067 N N . GLU B 1 326 ? -40.734 -51.177 -2.505 1.00 56.28 ? 312 GLU B N 1 ATOM 5068 C CA . GLU B 1 326 ? -40.226 -52.115 -1.500 1.00 55.91 ? 312 GLU B CA 1 ATOM 5069 C C . GLU B 1 326 ? -40.605 -53.527 -1.906 1.00 61.02 ? 312 GLU B C 1 ATOM 5070 O O . GLU B 1 326 ? -41.779 -53.832 -2.106 1.00 62.23 ? 312 GLU B O 1 ATOM 5071 C CB . GLU B 1 326 ? -40.754 -51.799 -0.085 1.00 56.96 ? 312 GLU B CB 1 ATOM 5072 C CG . GLU B 1 326 ? -40.266 -52.753 0.974 1.00 58.72 ? 312 GLU B CG 1 ATOM 5073 C CD . GLU B 1 326 ? -40.786 -52.455 2.353 1.00 71.24 ? 312 GLU B CD 1 ATOM 5074 O OE1 . GLU B 1 326 ? -41.887 -52.944 2.684 1.00 67.25 ? 312 GLU B OE1 1 ATOM 5075 O OE2 . GLU B 1 326 ? -40.091 -51.739 3.106 1.00 72.61 ? 312 GLU B OE2 1 ATOM 5076 N N . PHE B 1 327 ? -39.611 -54.389 -2.030 1.00 58.13 ? 313 PHE B N 1 ATOM 5077 C CA . PHE B 1 327 ? -39.819 -55.789 -2.410 1.00 57.43 ? 313 PHE B CA 1 ATOM 5078 C C . PHE B 1 327 ? -39.758 -56.600 -1.146 1.00 65.54 ? 313 PHE B C 1 ATOM 5079 O O . PHE B 1 327 ? -38.703 -56.676 -0.499 1.00 66.16 ? 313 PHE B O 1 ATOM 5080 C CB . PHE B 1 327 ? -38.781 -56.241 -3.440 1.00 57.10 ? 313 PHE B CB 1 ATOM 5081 C CG . PHE B 1 327 ? -38.874 -55.508 -4.759 1.00 55.91 ? 313 PHE B CG 1 ATOM 5082 C CD1 . PHE B 1 327 ? -39.653 -56.011 -5.794 1.00 57.01 ? 313 PHE B CD1 1 ATOM 5083 C CD2 . PHE B 1 327 ? -38.188 -54.308 -4.960 1.00 56.29 ? 313 PHE B CD2 1 ATOM 5084 C CE1 . PHE B 1 327 ? -39.747 -55.341 -7.014 1.00 58.46 ? 313 PHE B CE1 1 ATOM 5085 C CE2 . PHE B 1 327 ? -38.283 -53.630 -6.178 1.00 59.05 ? 313 PHE B CE2 1 ATOM 5086 C CZ . PHE B 1 327 ? -39.070 -54.149 -7.202 1.00 57.66 ? 313 PHE B CZ 1 ATOM 5087 N N . ASP B 1 328 ? -40.920 -57.154 -0.760 1.00 62.61 ? 314 ASP B N 1 ATOM 5088 C CA . ASP B 1 328 ? -41.093 -57.851 0.501 1.00 62.29 ? 314 ASP B CA 1 ATOM 5089 C C . ASP B 1 328 ? -41.082 -59.356 0.322 1.00 68.53 ? 314 ASP B C 1 ATOM 5090 O O . ASP B 1 328 ? -42.077 -59.953 -0.095 1.00 68.44 ? 314 ASP B O 1 ATOM 5091 C CB . ASP B 1 328 ? -42.372 -57.349 1.184 1.00 63.13 ? 314 ASP B CB 1 ATOM 5092 C CG . ASP B 1 328 ? -42.658 -57.884 2.566 1.00 76.64 ? 314 ASP B CG 1 ATOM 5093 O OD1 . ASP B 1 328 ? -41.950 -58.822 3.006 1.00 81.17 ? 314 ASP B OD1 1 ATOM 5094 O OD2 . ASP B 1 328 ? -43.583 -57.365 3.217 1.00 77.84 ? 314 ASP B OD2 1 ATOM 5095 N N . ARG B 1 329 ? -39.950 -59.970 0.657 1.00 66.18 ? 315 ARG B N 1 ATOM 5096 C CA . ARG B 1 329 ? -39.783 -61.416 0.543 1.00 66.53 ? 315 ARG B CA 1 ATOM 5097 C C . ARG B 1 329 ? -40.529 -62.203 1.634 1.00 67.85 ? 315 ARG B C 1 ATOM 5098 O O . ARG B 1 329 ? -40.984 -63.328 1.373 1.00 67.00 ? 315 ARG B O 1 ATOM 5099 C CB . ARG B 1 329 ? -38.290 -61.786 0.540 1.00 68.27 ? 315 ARG B CB 1 ATOM 5100 C CG . ARG B 1 329 ? -37.596 -61.624 -0.804 1.00 71.15 ? 315 ARG B CG 1 ATOM 5101 C CD . ARG B 1 329 ? -38.043 -62.667 -1.815 1.00 76.28 ? 315 ARG B CD 1 ATOM 5102 N NE . ARG B 1 329 ? -37.773 -64.036 -1.382 1.00 91.29 ? 315 ARG B NE 1 ATOM 5103 C CZ . ARG B 1 329 ? -36.641 -64.690 -1.615 1.00 113.85 ? 315 ARG B CZ 1 ATOM 5104 N NH1 . ARG B 1 329 ? -35.658 -64.109 -2.290 1.00 103.71 ? 315 ARG B NH1 1 ATOM 5105 N NH2 . ARG B 1 329 ? -36.486 -65.932 -1.184 1.00 109.72 ? 315 ARG B NH2 1 ATOM 5106 N N . ARG B 1 330 ? -40.625 -61.615 2.842 1.00 61.86 ? 316 ARG B N 1 ATOM 5107 C CA . ARG B 1 330 ? -41.299 -62.215 3.981 1.00 62.07 ? 316 ARG B CA 1 ATOM 5108 C C . ARG B 1 330 ? -42.784 -62.494 3.683 1.00 66.25 ? 316 ARG B C 1 ATOM 5109 O O . ARG B 1 330 ? -43.285 -63.574 4.029 1.00 65.98 ? 316 ARG B O 1 ATOM 5110 C CB . ARG B 1 330 ? -41.146 -61.324 5.237 1.00 62.88 ? 316 ARG B CB 1 ATOM 5111 C CG . ARG B 1 330 ? -41.979 -61.745 6.470 1.00 69.75 ? 316 ARG B CG 1 ATOM 5112 C CD . ARG B 1 330 ? -41.642 -63.134 7.022 1.00 81.28 ? 316 ARG B CD 1 ATOM 5113 N NE . ARG B 1 330 ? -42.581 -63.512 8.083 1.00 96.73 ? 316 ARG B NE 1 ATOM 5114 C CZ . ARG B 1 330 ? -43.741 -64.140 7.879 1.00 106.98 ? 316 ARG B CZ 1 ATOM 5115 N NH1 . ARG B 1 330 ? -44.103 -64.504 6.649 1.00 86.37 ? 316 ARG B NH1 1 ATOM 5116 N NH2 . ARG B 1 330 ? -44.557 -64.384 8.896 1.00 88.14 ? 316 ARG B NH2 1 ATOM 5117 N N . ASN B 1 331 ? -43.472 -61.524 3.046 1.00 60.59 ? 317 ASN B N 1 ATOM 5118 C CA . ASN B 1 331 ? -44.902 -61.631 2.787 1.00 58.84 ? 317 ASN B CA 1 ATOM 5119 C C . ASN B 1 331 ? -45.254 -61.840 1.320 1.00 65.16 ? 317 ASN B C 1 ATOM 5120 O O . ASN B 1 331 ? -46.448 -61.897 0.991 1.00 66.26 ? 317 ASN B O 1 ATOM 5121 C CB . ASN B 1 331 ? -45.615 -60.402 3.325 1.00 51.31 ? 317 ASN B CB 1 ATOM 5122 C CG . ASN B 1 331 ? -45.412 -60.140 4.779 1.00 69.06 ? 317 ASN B CG 1 ATOM 5123 O OD1 . ASN B 1 331 ? -45.016 -59.060 5.200 1.00 68.24 ? 317 ASN B OD1 1 ATOM 5124 N ND2 . ASN B 1 331 ? -45.702 -61.109 5.584 1.00 58.15 ? 317 ASN B ND2 1 ATOM 5125 N N . ASN B 1 332 ? -44.240 -61.998 0.437 1.00 61.45 ? 318 ASN B N 1 ATOM 5126 C CA . ASN B 1 332 ? -44.449 -62.116 -1.014 1.00 61.46 ? 318 ASN B CA 1 ATOM 5127 C C . ASN B 1 332 ? -45.394 -61.022 -1.557 1.00 65.59 ? 318 ASN B C 1 ATOM 5128 O O . ASN B 1 332 ? -46.477 -61.305 -2.091 1.00 66.76 ? 318 ASN B O 1 ATOM 5129 C CB . ASN B 1 332 ? -44.877 -63.505 -1.441 1.00 59.23 ? 318 ASN B CB 1 ATOM 5130 C CG . ASN B 1 332 ? -43.753 -64.503 -1.460 1.00 90.68 ? 318 ASN B CG 1 ATOM 5131 O OD1 . ASN B 1 332 ? -42.573 -64.202 -1.704 1.00 81.29 ? 318 ASN B OD1 1 ATOM 5132 N ND2 . ASN B 1 332 ? -44.102 -65.730 -1.160 1.00 96.04 ? 318 ASN B ND2 1 ATOM 5133 N N . ARG B 1 333 ? -44.972 -59.767 -1.378 1.00 58.34 ? 319 ARG B N 1 ATOM 5134 C CA . ARG B 1 333 ? -45.726 -58.603 -1.782 1.00 56.95 ? 319 ARG B CA 1 ATOM 5135 C C . ARG B 1 333 ? -44.774 -57.484 -2.195 1.00 61.13 ? 319 ARG B C 1 ATOM 5136 O O . ARG B 1 333 ? -43.581 -57.509 -1.863 1.00 62.74 ? 319 ARG B O 1 ATOM 5137 C CB . ARG B 1 333 ? -46.638 -58.111 -0.633 1.00 55.42 ? 319 ARG B CB 1 ATOM 5138 C CG . ARG B 1 333 ? -45.945 -58.116 0.691 1.00 57.93 ? 319 ARG B CG 1 ATOM 5139 C CD . ARG B 1 333 ? -46.018 -56.967 1.644 1.00 58.44 ? 319 ARG B CD 1 ATOM 5140 N NE . ARG B 1 333 ? -47.260 -56.887 2.359 1.00 59.68 ? 319 ARG B NE 1 ATOM 5141 C CZ . ARG B 1 333 ? -47.469 -56.209 3.482 1.00 75.26 ? 319 ARG B CZ 1 ATOM 5142 N NH1 . ARG B 1 333 ? -46.463 -55.621 4.114 1.00 47.08 ? 319 ARG B NH1 1 ATOM 5143 N NH2 . ARG B 1 333 ? -48.680 -56.125 3.987 1.00 78.96 ? 319 ARG B NH2 1 ATOM 5144 N N . ILE B 1 334 ? -45.319 -56.479 -2.892 1.00 53.11 ? 320 ILE B N 1 ATOM 5145 C CA . ILE B 1 334 ? -44.573 -55.314 -3.327 1.00 50.63 ? 320 ILE B CA 1 ATOM 5146 C C . ILE B 1 334 ? -45.280 -54.085 -2.789 1.00 58.71 ? 320 ILE B C 1 ATOM 5147 O O . ILE B 1 334 ? -46.495 -53.952 -2.965 1.00 60.82 ? 320 ILE B O 1 ATOM 5148 C CB . ILE B 1 334 ? -44.443 -55.286 -4.868 1.00 51.75 ? 320 ILE B CB 1 ATOM 5149 C CG1 . ILE B 1 334 ? -43.637 -56.491 -5.389 1.00 50.05 ? 320 ILE B CG1 1 ATOM 5150 C CG2 . ILE B 1 334 ? -43.854 -53.953 -5.348 1.00 52.44 ? 320 ILE B CG2 1 ATOM 5151 C CD1 . ILE B 1 334 ? -43.701 -56.725 -6.832 1.00 44.92 ? 320 ILE B CD1 1 ATOM 5152 N N . GLY B 1 335 ? -44.528 -53.199 -2.148 1.00 54.72 ? 321 GLY B N 1 ATOM 5153 C CA . GLY B 1 335 ? -45.051 -51.945 -1.634 1.00 54.40 ? 321 GLY B CA 1 ATOM 5154 C C . GLY B 1 335 ? -44.628 -50.748 -2.452 1.00 60.29 ? 321 GLY B C 1 ATOM 5155 O O . GLY B 1 335 ? -43.488 -50.668 -2.898 1.00 60.86 ? 321 GLY B O 1 ATOM 5156 N N . PHE B 1 336 ? -45.552 -49.810 -2.656 1.00 57.35 ? 322 PHE B N 1 ATOM 5157 C CA . PHE B 1 336 ? -45.300 -48.578 -3.375 1.00 55.75 ? 322 PHE B CA 1 ATOM 5158 C C . PHE B 1 336 ? -45.615 -47.368 -2.509 1.00 63.14 ? 322 PHE B C 1 ATOM 5159 O O . PHE B 1 336 ? -46.610 -47.357 -1.781 1.00 66.79 ? 322 PHE B O 1 ATOM 5160 C CB . PHE B 1 336 ? -46.133 -48.519 -4.644 1.00 56.02 ? 322 PHE B CB 1 ATOM 5161 C CG . PHE B 1 336 ? -45.789 -49.550 -5.691 1.00 57.79 ? 322 PHE B CG 1 ATOM 5162 C CD1 . PHE B 1 336 ? -44.518 -49.595 -6.269 1.00 61.16 ? 322 PHE B CD1 1 ATOM 5163 C CD2 . PHE B 1 336 ? -46.745 -50.442 -6.147 1.00 59.27 ? 322 PHE B CD2 1 ATOM 5164 C CE1 . PHE B 1 336 ? -44.218 -50.536 -7.266 1.00 61.36 ? 322 PHE B CE1 1 ATOM 5165 C CE2 . PHE B 1 336 ? -46.441 -51.384 -7.135 1.00 61.22 ? 322 PHE B CE2 1 ATOM 5166 C CZ . PHE B 1 336 ? -45.181 -51.431 -7.680 1.00 59.60 ? 322 PHE B CZ 1 ATOM 5167 N N . ALA B 1 337 ? -44.779 -46.343 -2.597 1.00 57.81 ? 323 ALA B N 1 ATOM 5168 C CA . ALA B 1 337 ? -45.022 -45.072 -1.945 1.00 58.91 ? 323 ALA B CA 1 ATOM 5169 C C . ALA B 1 337 ? -44.521 -44.005 -2.891 1.00 69.13 ? 323 ALA B C 1 ATOM 5170 O O . ALA B 1 337 ? -43.641 -44.289 -3.713 1.00 71.34 ? 323 ALA B O 1 ATOM 5171 C CB . ALA B 1 337 ? -44.299 -44.992 -0.616 1.00 59.61 ? 323 ALA B CB 1 ATOM 5172 N N . LEU B 1 338 ? -45.084 -42.781 -2.817 1.00 66.70 ? 324 LEU B N 1 ATOM 5173 C CA . LEU B 1 338 ? -44.660 -41.668 -3.676 1.00 66.16 ? 324 LEU B CA 1 ATOM 5174 C C . LEU B 1 338 ? -43.211 -41.344 -3.404 1.00 70.81 ? 324 LEU B C 1 ATOM 5175 O O . LEU B 1 338 ? -42.858 -41.035 -2.261 1.00 69.27 ? 324 LEU B O 1 ATOM 5176 C CB . LEU B 1 338 ? -45.498 -40.424 -3.401 1.00 65.82 ? 324 LEU B CB 1 ATOM 5177 C CG . LEU B 1 338 ? -46.426 -39.900 -4.482 1.00 70.25 ? 324 LEU B CG 1 ATOM 5178 C CD1 . LEU B 1 338 ? -46.902 -38.503 -4.123 1.00 71.82 ? 324 LEU B CD1 1 ATOM 5179 C CD2 . LEU B 1 338 ? -45.784 -39.867 -5.846 1.00 68.35 ? 324 LEU B CD2 1 ATOM 5180 N N . ALA B 1 339 ? -42.367 -41.437 -4.443 1.00 69.12 ? 325 ALA B N 1 ATOM 5181 C CA . ALA B 1 339 ? -40.943 -41.119 -4.313 1.00 69.41 ? 325 ALA B CA 1 ATOM 5182 C C . ALA B 1 339 ? -40.709 -39.635 -4.140 1.00 72.36 ? 325 ALA B C 1 ATOM 5183 O O . ALA B 1 339 ? -41.479 -38.831 -4.662 1.00 72.73 ? 325 ALA B O 1 ATOM 5184 C CB . ALA B 1 339 ? -40.192 -41.599 -5.528 1.00 70.11 ? 325 ALA B CB 1 ATOM 5185 N N . ARG B 1 340 ? -39.635 -39.265 -3.439 1.00 67.79 ? 326 ARG B N 1 ATOM 5186 C CA . ARG B 1 340 ? -39.259 -37.847 -3.293 1.00 69.27 ? 326 ARG B CA 1 ATOM 5187 C C . ARG B 1 340 ? -37.738 -37.632 -3.381 1.00 88.82 ? 326 ARG B C 1 ATOM 5188 O O . ARG B 1 340 ? -36.951 -38.504 -2.921 1.00 87.42 ? 326 ARG B O 1 ATOM 5189 C CB . ARG B 1 340 ? -39.919 -37.151 -2.075 1.00 66.74 ? 326 ARG B CB 1 ATOM 5190 C CG . ARG B 1 340 ? -39.582 -37.772 -0.751 1.00 75.91 ? 326 ARG B CG 1 ATOM 5191 C CD . ARG B 1 340 ? -39.923 -36.847 0.378 1.00 91.07 ? 326 ARG B CD 1 ATOM 5192 N NE . ARG B 1 340 ? -39.256 -37.272 1.609 1.00 114.65 ? 326 ARG B NE 1 ATOM 5193 C CZ . ARG B 1 340 ? -39.792 -37.253 2.825 1.00 140.26 ? 326 ARG B CZ 1 ATOM 5194 N NH1 . ARG B 1 340 ? -41.045 -36.853 3.000 1.00 129.44 ? 326 ARG B NH1 1 ATOM 5195 N NH2 . ARG B 1 340 ? -39.086 -37.650 3.874 1.00 135.28 ? 326 ARG B NH2 1 ATOM 5196 O OXT . ARG B 1 340 ? -37.349 -36.663 -4.073 1.00 113.68 ? 326 ARG B OXT 1 HETATM 5197 C C1 . NAG C 2 . ? -1.215 -11.805 22.258 1.00 102.69 ? 367 NAG A C1 1 HETATM 5198 C C2 . NAG C 2 . ? -0.405 -11.013 23.261 1.00 104.37 ? 367 NAG A C2 1 HETATM 5199 C C3 . NAG C 2 . ? 0.831 -11.863 23.549 1.00 106.03 ? 367 NAG A C3 1 HETATM 5200 C C4 . NAG C 2 . ? 0.330 -13.150 24.273 1.00 106.69 ? 367 NAG A C4 1 HETATM 5201 C C5 . NAG C 2 . ? -0.549 -13.951 23.336 1.00 105.86 ? 367 NAG A C5 1 HETATM 5202 C C6 . NAG C 2 . ? -1.228 -15.047 24.224 1.00 107.17 ? 367 NAG A C6 1 HETATM 5203 C C7 . NAG C 2 . ? -0.710 -8.531 23.351 1.00 106.47 ? 367 NAG A C7 1 HETATM 5204 C C8 . NAG C 2 . ? -0.052 -7.264 22.846 1.00 107.23 ? 367 NAG A C8 1 HETATM 5205 N N2 . NAG C 2 . ? -0.041 -9.659 22.905 1.00 105.11 ? 367 NAG A N2 1 HETATM 5206 O O3 . NAG C 2 . ? 1.799 -11.149 24.356 1.00 108.29 ? 367 NAG A O3 1 HETATM 5207 O O4 . NAG C 2 . ? 1.384 -13.927 24.818 1.00 109.42 ? 367 NAG A O4 1 HETATM 5208 O O5 . NAG C 2 . ? -1.582 -13.108 22.748 1.00 104.15 ? 367 NAG A O5 1 HETATM 5209 O O6 . NAG C 2 . ? -1.888 -16.030 23.449 1.00 109.54 ? 367 NAG A O6 1 HETATM 5210 O O7 . NAG C 2 . ? -1.733 -8.507 24.077 1.00 108.20 ? 367 NAG A O7 1 HETATM 5211 C C1 . S52 D 3 . ? -13.562 -20.862 -2.856 1.00 41.82 ? 327 S52 A C1 1 HETATM 5212 O O1 . S52 D 3 . ? -9.615 -21.918 0.133 1.00 49.96 ? 327 S52 A O1 1 HETATM 5213 C C2 . S52 D 3 . ? -13.719 -22.256 -2.900 1.00 41.41 ? 327 S52 A C2 1 HETATM 5214 C C3 . S52 D 3 . ? -12.667 -23.082 -2.469 1.00 43.84 ? 327 S52 A C3 1 HETATM 5215 C C4 . S52 D 3 . ? -11.424 -22.560 -2.004 1.00 47.22 ? 327 S52 A C4 1 HETATM 5216 C C5 . S52 D 3 . ? -11.321 -21.137 -2.016 1.00 40.24 ? 327 S52 A C5 1 HETATM 5217 C C6 . S52 D 3 . ? -12.359 -20.299 -2.411 1.00 39.86 ? 327 S52 A C6 1 HETATM 5218 N N12 . S52 D 3 . ? -10.343 -23.309 -1.635 1.00 50.59 ? 327 S52 A N12 1 HETATM 5219 C C13 . S52 D 3 . ? -9.882 -24.372 -2.346 1.00 48.48 ? 327 S52 A C13 1 HETATM 5220 C C14 . S52 D 3 . ? -8.655 -24.756 -1.731 1.00 48.63 ? 327 S52 A C14 1 HETATM 5221 C C15 . S52 D 3 . ? -8.426 -23.870 -0.678 1.00 50.19 ? 327 S52 A C15 1 HETATM 5222 C C16 . S52 D 3 . ? -9.451 -22.957 -0.719 1.00 48.54 ? 327 S52 A C16 1 HETATM 5223 C C17 . S52 D 3 . ? -10.390 -25.119 -3.418 1.00 43.94 ? 327 S52 A C17 1 HETATM 5224 C C18 . S52 D 3 . ? -9.665 -26.229 -3.868 1.00 47.58 ? 327 S52 A C18 1 HETATM 5225 C C19 . S52 D 3 . ? -8.458 -26.601 -3.247 1.00 45.86 ? 327 S52 A C19 1 HETATM 5226 C C20 . S52 D 3 . ? -7.939 -25.864 -2.178 1.00 44.23 ? 327 S52 A C20 1 HETATM 5227 C C26 . S52 D 3 . ? -9.358 -22.038 1.467 1.00 51.37 ? 327 S52 A C26 1 HETATM 5228 C C29 . S52 D 3 . ? -8.524 -21.075 2.065 1.00 54.03 ? 327 S52 A C29 1 HETATM 5229 C C30 . S52 D 3 . ? -8.251 -21.199 3.435 1.00 55.48 ? 327 S52 A C30 1 HETATM 5230 C C31 . S52 D 3 . ? -8.781 -22.261 4.192 1.00 49.39 ? 327 S52 A C31 1 HETATM 5231 C C32 . S52 D 3 . ? -9.595 -23.200 3.566 1.00 47.92 ? 327 S52 A C32 1 HETATM 5232 C C33 . S52 D 3 . ? -9.894 -23.101 2.204 1.00 47.40 ? 327 S52 A C33 1 HETATM 5233 C C39 . S52 D 3 . ? -7.189 -23.815 0.181 1.00 52.77 ? 327 S52 A C39 1 HETATM 5234 N N40 . S52 D 3 . ? -6.702 -24.817 0.952 1.00 47.92 ? 327 S52 A N40 1 HETATM 5235 O O41 . S52 D 3 . ? -6.603 -22.702 0.116 1.00 52.93 ? 327 S52 A O41 1 HETATM 5236 C C42 . S52 D 3 . ? -7.286 -26.154 1.100 1.00 42.87 ? 327 S52 A C42 1 HETATM 5237 C C43 . S52 D 3 . ? -7.597 -26.381 2.576 1.00 41.24 ? 327 S52 A C43 1 HETATM 5238 N N44 . S52 D 3 . ? -6.555 -25.906 3.456 1.00 44.98 ? 327 S52 A N44 1 HETATM 5239 C C45 . S52 D 3 . ? -5.919 -24.628 3.180 1.00 46.88 ? 327 S52 A C45 1 HETATM 5240 C C46 . S52 D 3 . ? -5.477 -24.580 1.722 1.00 48.05 ? 327 S52 A C46 1 HETATM 5241 C C1 . NAG E 2 . ? -20.396 -76.207 -8.750 1.00 149.21 ? 367 NAG B C1 1 HETATM 5242 C C2 . NAG E 2 . ? -20.114 -77.755 -8.726 1.00 150.96 ? 367 NAG B C2 1 HETATM 5243 C C3 . NAG E 2 . ? -21.497 -78.361 -9.066 1.00 152.37 ? 367 NAG B C3 1 HETATM 5244 C C4 . NAG E 2 . ? -22.495 -78.010 -7.949 1.00 152.99 ? 367 NAG B C4 1 HETATM 5245 C C5 . NAG E 2 . ? -22.580 -76.463 -7.799 1.00 152.23 ? 367 NAG B C5 1 HETATM 5246 C C6 . NAG E 2 . ? -23.318 -76.105 -6.506 1.00 153.52 ? 367 NAG B C6 1 HETATM 5247 C C7 . NAG E 2 . ? -17.868 -78.456 -9.560 1.00 153.51 ? 367 NAG B C7 1 HETATM 5248 C C8 . NAG E 2 . ? -17.088 -78.805 -10.808 1.00 154.34 ? 367 NAG B C8 1 HETATM 5249 N N2 . NAG E 2 . ? -19.160 -78.137 -9.774 1.00 151.98 ? 367 NAG B N2 1 HETATM 5250 O O3 . NAG E 2 . ? -21.418 -79.753 -9.266 1.00 154.33 ? 367 NAG B O3 1 HETATM 5251 O O4 . NAG E 2 . ? -23.826 -78.460 -8.312 1.00 155.33 ? 367 NAG B O4 1 HETATM 5252 O O5 . NAG E 2 . ? -21.291 -75.815 -7.725 1.00 150.54 ? 367 NAG B O5 1 HETATM 5253 O O6 . NAG E 2 . ? -23.815 -74.772 -6.547 1.00 155.81 ? 367 NAG B O6 1 HETATM 5254 O O7 . NAG E 2 . ? -17.348 -78.486 -8.448 1.00 155.54 ? 367 NAG B O7 1 HETATM 5255 C C1 . S52 F 3 . ? -28.766 -50.892 -21.587 1.00 67.13 ? 327 S52 B C1 1 HETATM 5256 O O1 . S52 F 3 . ? -30.734 -55.401 -20.291 1.00 61.63 ? 327 S52 B O1 1 HETATM 5257 C C2 . S52 F 3 . ? -29.926 -50.418 -20.949 1.00 68.88 ? 327 S52 B C2 1 HETATM 5258 C C3 . S52 F 3 . ? -31.026 -51.265 -20.725 1.00 67.35 ? 327 S52 B C3 1 HETATM 5259 C C4 . S52 F 3 . ? -31.023 -52.625 -21.127 1.00 64.34 ? 327 S52 B C4 1 HETATM 5260 C C5 . S52 F 3 . ? -29.822 -53.052 -21.768 1.00 62.68 ? 327 S52 B C5 1 HETATM 5261 C C6 . S52 F 3 . ? -28.715 -52.227 -21.999 1.00 64.03 ? 327 S52 B C6 1 HETATM 5262 N N12 . S52 F 3 . ? -32.066 -53.471 -20.924 1.00 60.70 ? 327 S52 B N12 1 HETATM 5263 C C13 . S52 F 3 . ? -33.377 -53.174 -21.065 1.00 54.92 ? 327 S52 B C13 1 HETATM 5264 C C14 . S52 F 3 . ? -34.104 -54.367 -20.759 1.00 54.12 ? 327 S52 B C14 1 HETATM 5265 C C15 . S52 F 3 . ? -33.172 -55.341 -20.415 1.00 59.14 ? 327 S52 B C15 1 HETATM 5266 C C16 . S52 F 3 . ? -31.925 -54.759 -20.561 1.00 61.52 ? 327 S52 B C16 1 HETATM 5267 C C17 . S52 F 3 . ? -34.092 -52.027 -21.414 1.00 51.09 ? 327 S52 B C17 1 HETATM 5268 C C18 . S52 F 3 . ? -35.502 -52.089 -21.456 1.00 51.04 ? 327 S52 B C18 1 HETATM 5269 C C19 . S52 F 3 . ? -36.206 -53.269 -21.158 1.00 49.79 ? 327 S52 B C19 1 HETATM 5270 C C20 . S52 F 3 . ? -35.504 -54.421 -20.804 1.00 50.44 ? 327 S52 B C20 1 HETATM 5271 C C26 . S52 F 3 . ? -30.569 -56.084 -19.117 1.00 60.47 ? 327 S52 B C26 1 HETATM 5272 C C29 . S52 F 3 . ? -30.154 -57.427 -19.178 1.00 63.36 ? 327 S52 B C29 1 HETATM 5273 C C30 . S52 F 3 . ? -29.974 -58.187 -18.013 1.00 65.54 ? 327 S52 B C30 1 HETATM 5274 C C31 . S52 F 3 . ? -30.230 -57.572 -16.776 1.00 67.87 ? 327 S52 B C31 1 HETATM 5275 C C32 . S52 F 3 . ? -30.650 -56.222 -16.718 1.00 65.53 ? 327 S52 B C32 1 HETATM 5276 C C33 . S52 F 3 . ? -30.826 -55.465 -17.890 1.00 59.94 ? 327 S52 B C33 1 HETATM 5277 C C39 . S52 F 3 . ? -33.521 -56.766 -20.080 1.00 64.01 ? 327 S52 B C39 1 HETATM 5278 N N40 . S52 F 3 . ? -34.300 -57.175 -19.062 1.00 65.03 ? 327 S52 B N40 1 HETATM 5279 O O41 . S52 F 3 . ? -33.015 -57.589 -20.831 1.00 66.97 ? 327 S52 B O41 1 HETATM 5280 C C42 . S52 F 3 . ? -34.952 -56.270 -18.109 1.00 66.07 ? 327 S52 B C42 1 HETATM 5281 C C43 . S52 F 3 . ? -34.473 -56.675 -16.719 1.00 65.56 ? 327 S52 B C43 1 HETATM 5282 N N44 . S52 F 3 . ? -34.732 -58.080 -16.445 1.00 64.51 ? 327 S52 B N44 1 HETATM 5283 C C45 . S52 F 3 . ? -34.255 -59.029 -17.418 1.00 64.91 ? 327 S52 B C45 1 HETATM 5284 C C46 . S52 F 3 . ? -34.564 -58.610 -18.862 1.00 65.09 ? 327 S52 B C46 1 HETATM 5285 C C1 . GOL G 4 . ? -30.997 -51.794 -16.534 1.00 51.58 ? 328 GOL B C1 1 HETATM 5286 O O1 . GOL G 4 . ? -31.400 -50.821 -17.560 1.00 56.87 ? 328 GOL B O1 1 HETATM 5287 C C2 . GOL G 4 . ? -31.176 -51.262 -15.192 1.00 49.34 ? 328 GOL B C2 1 HETATM 5288 O O2 . GOL G 4 . ? -30.462 -50.092 -15.150 1.00 48.32 ? 328 GOL B O2 1 HETATM 5289 C C3 . GOL G 4 . ? -32.546 -50.918 -15.153 1.00 49.34 ? 328 GOL B C3 1 HETATM 5290 O O3 . GOL G 4 . ? -32.849 -49.905 -16.044 1.00 50.65 ? 328 GOL B O3 1 HETATM 5291 O O . HOH H 5 . ? -7.935 -7.623 -4.149 1.00 51.25 ? 328 HOH A O 1 HETATM 5292 O O . HOH H 5 . ? -12.084 1.805 3.664 1.00 50.72 ? 329 HOH A O 1 HETATM 5293 O O . HOH H 5 . ? -10.718 -8.425 -2.275 1.00 51.96 ? 330 HOH A O 1 HETATM 5294 O O . HOH H 5 . ? -6.808 -7.523 18.800 1.00 61.75 ? 331 HOH A O 1 HETATM 5295 O O . HOH H 5 . ? -14.208 -2.587 -3.487 1.00 48.94 ? 332 HOH A O 1 HETATM 5296 O O . HOH H 5 . ? -13.031 -5.192 14.656 1.00 47.21 ? 333 HOH A O 1 HETATM 5297 O O . HOH H 5 . ? -6.835 -2.818 4.909 1.00 39.26 ? 334 HOH A O 1 HETATM 5298 O O . HOH H 5 . ? -0.476 -18.185 -0.102 1.00 39.85 ? 335 HOH A O 1 HETATM 5299 O O . HOH H 5 . ? -8.345 -23.475 14.986 1.00 58.15 ? 336 HOH A O 1 HETATM 5300 O O . HOH H 5 . ? -10.279 -5.154 16.679 1.00 62.12 ? 337 HOH A O 1 HETATM 5301 O O . HOH H 5 . ? -7.215 -18.850 -5.745 1.00 48.98 ? 338 HOH A O 1 HETATM 5302 O O . HOH H 5 . ? -20.965 -36.488 10.813 1.00 55.74 ? 339 HOH A O 1 HETATM 5303 O O . HOH H 5 . ? -6.670 -19.692 21.315 1.00 70.73 ? 340 HOH A O 1 HETATM 5304 O O . HOH H 5 . ? -19.421 -37.952 3.476 1.00 67.29 ? 341 HOH A O 1 HETATM 5305 O O . HOH H 5 . ? -14.134 -15.738 2.347 1.00 56.66 ? 342 HOH A O 1 HETATM 5306 O O . HOH H 5 . ? -25.157 -26.343 13.526 1.00 72.43 ? 343 HOH A O 1 HETATM 5307 O O . HOH H 5 . ? 2.659 -14.545 10.314 1.00 59.25 ? 344 HOH A O 1 HETATM 5308 O O . HOH H 5 . ? -18.461 -30.167 -15.804 1.00 68.18 ? 345 HOH A O 1 HETATM 5309 O O . HOH H 5 . ? -16.293 -27.385 5.952 1.00 48.64 ? 346 HOH A O 1 HETATM 5310 O O . HOH H 5 . ? -5.343 -21.383 15.913 1.00 65.59 ? 347 HOH A O 1 HETATM 5311 O O . HOH H 5 . ? -2.343 -24.162 2.344 1.00 70.01 ? 348 HOH A O 1 HETATM 5312 O O . HOH H 5 . ? -25.726 -25.685 -4.517 1.00 56.56 ? 349 HOH A O 1 HETATM 5313 O O . HOH H 5 . ? -21.168 -8.490 19.124 1.00 54.47 ? 350 HOH A O 1 HETATM 5314 O O . HOH H 5 . ? -11.999 -49.368 -14.238 1.00 72.32 ? 351 HOH A O 1 HETATM 5315 O O . HOH H 5 . ? -5.328 -17.337 14.130 1.00 68.06 ? 352 HOH A O 1 HETATM 5316 O O . HOH H 5 . ? -8.957 -26.865 16.048 1.00 61.01 ? 353 HOH A O 1 HETATM 5317 O O . HOH H 5 . ? -15.654 -31.103 -5.379 1.00 50.57 ? 354 HOH A O 1 HETATM 5318 O O . HOH H 5 . ? -10.090 -6.096 -4.479 1.00 67.56 ? 355 HOH A O 1 HETATM 5319 O O . HOH H 5 . ? -6.332 -21.591 9.179 1.00 48.49 ? 356 HOH A O 1 HETATM 5320 O O . HOH H 5 . ? 4.092 -30.746 -5.193 1.00 67.07 ? 357 HOH A O 1 HETATM 5321 O O . HOH H 5 . ? -22.185 -6.128 14.932 1.00 68.34 ? 358 HOH A O 1 HETATM 5322 O O . HOH H 5 . ? -20.732 -7.034 7.865 1.00 57.77 ? 359 HOH A O 1 HETATM 5323 O O . HOH H 5 . ? -6.607 -19.230 15.605 1.00 50.22 ? 360 HOH A O 1 HETATM 5324 O O . HOH H 5 . ? -1.589 -31.629 -3.949 1.00 54.80 ? 361 HOH A O 1 HETATM 5325 O O . HOH H 5 . ? -3.460 -31.138 9.477 1.00 54.22 ? 362 HOH A O 1 HETATM 5326 O O . HOH H 5 . ? -6.670 -11.372 -6.453 1.00 55.85 ? 363 HOH A O 1 HETATM 5327 O O . HOH H 5 . ? -15.444 -22.894 -6.189 1.00 49.17 ? 364 HOH A O 1 HETATM 5328 O O . HOH H 5 . ? -22.961 -24.186 14.534 1.00 66.90 ? 365 HOH A O 1 HETATM 5329 O O . HOH H 5 . ? -27.170 -27.911 0.895 1.00 62.24 ? 366 HOH A O 1 HETATM 5330 O O . HOH H 5 . ? -15.406 -45.162 -13.829 1.00 65.67 ? 368 HOH A O 1 HETATM 5331 O O . HOH H 5 . ? -24.872 -11.216 13.257 1.00 69.22 ? 369 HOH A O 1 HETATM 5332 O O . HOH H 5 . ? -24.081 -24.355 11.025 1.00 58.65 ? 370 HOH A O 1 HETATM 5333 O O . HOH H 5 . ? 4.222 -37.547 -1.174 1.00 70.91 ? 371 HOH A O 1 HETATM 5334 O O . HOH H 5 . ? -19.489 -6.201 4.962 1.00 50.13 ? 372 HOH A O 1 HETATM 5335 O O . HOH H 5 . ? -2.351 -29.182 11.284 1.00 44.23 ? 373 HOH A O 1 HETATM 5336 O O . HOH H 5 . ? -17.269 -37.413 -4.857 1.00 57.57 ? 374 HOH A O 1 HETATM 5337 O O . HOH H 5 . ? -9.685 -22.962 -16.313 1.00 81.05 ? 375 HOH A O 1 HETATM 5338 O O . HOH H 5 . ? -20.280 -43.558 0.125 1.00 76.51 ? 376 HOH A O 1 HETATM 5339 O O . HOH H 5 . ? -20.855 -15.929 20.459 1.00 67.51 ? 377 HOH A O 1 HETATM 5340 O O . HOH H 5 . ? -8.118 -29.862 -3.935 1.00 64.93 ? 378 HOH A O 1 HETATM 5341 O O . HOH H 5 . ? -28.224 -27.744 4.653 1.00 71.30 ? 379 HOH A O 1 HETATM 5342 O O . HOH H 5 . ? -19.423 -13.833 -2.264 1.00 36.59 ? 380 HOH A O 1 HETATM 5343 O O . HOH H 5 . ? -13.887 -48.436 -2.128 1.00 68.15 ? 381 HOH A O 1 HETATM 5344 O O . HOH H 5 . ? -21.938 -38.764 0.779 1.00 76.88 ? 382 HOH A O 1 HETATM 5345 O O . HOH H 5 . ? -14.292 -31.508 25.895 1.00 61.96 ? 383 HOH A O 1 HETATM 5346 O O . HOH H 5 . ? -4.709 -11.066 24.373 1.00 59.06 ? 384 HOH A O 1 HETATM 5347 O O . HOH H 5 . ? -9.923 -28.504 -9.919 1.00 66.07 ? 385 HOH A O 1 HETATM 5348 O O . HOH H 5 . ? 0.147 -43.652 7.257 1.00 68.72 ? 386 HOH A O 1 HETATM 5349 O O . HOH H 5 . ? -17.289 -48.955 5.656 1.00 64.00 ? 387 HOH A O 1 HETATM 5350 O O . HOH H 5 . ? -23.118 -7.336 17.445 1.00 60.19 ? 388 HOH A O 1 HETATM 5351 O O . HOH H 5 . ? -2.727 -23.087 10.137 1.00 52.34 ? 389 HOH A O 1 HETATM 5352 O O . HOH H 5 . ? -20.548 -40.546 -14.682 1.00 76.70 ? 390 HOH A O 1 HETATM 5353 O O . HOH H 5 . ? -12.562 -12.865 25.306 1.00 71.85 ? 391 HOH A O 1 HETATM 5354 O O . HOH H 5 . ? -9.805 -30.357 -12.472 1.00 74.24 ? 392 HOH A O 1 HETATM 5355 O O . HOH H 5 . ? 2.834 -7.527 15.471 1.00 70.02 ? 393 HOH A O 1 HETATM 5356 O O . HOH H 5 . ? -23.471 -40.746 -15.910 1.00 69.67 ? 394 HOH A O 1 HETATM 5357 O O . HOH H 5 . ? -23.545 -21.930 16.197 1.00 54.61 ? 395 HOH A O 1 HETATM 5358 O O . HOH H 5 . ? -8.842 -2.992 19.921 1.00 69.76 ? 396 HOH A O 1 HETATM 5359 O O . HOH H 5 . ? -14.106 -1.398 14.046 1.00 75.54 ? 397 HOH A O 1 HETATM 5360 O O . HOH H 5 . ? -9.696 2.637 2.678 1.00 60.24 ? 398 HOH A O 1 HETATM 5361 O O . HOH H 5 . ? 3.663 -40.221 -8.647 1.00 79.41 ? 399 HOH A O 1 HETATM 5362 O O . HOH H 5 . ? 2.882 -39.700 -6.026 1.00 61.31 ? 400 HOH A O 1 HETATM 5363 O O . HOH H 5 . ? 1.124 -7.543 5.110 1.00 58.35 ? 401 HOH A O 1 HETATM 5364 O O . HOH H 5 . ? -3.021 -5.030 9.647 1.00 53.96 ? 402 HOH A O 1 HETATM 5365 O O . HOH H 5 . ? -1.484 -6.672 8.580 1.00 61.72 ? 403 HOH A O 1 HETATM 5366 O O . HOH H 5 . ? -19.636 -9.968 28.278 1.00 71.70 ? 404 HOH A O 1 HETATM 5367 O O . HOH H 5 . ? -7.592 -2.740 17.014 1.00 68.85 ? 405 HOH A O 1 HETATM 5368 O O . HOH H 5 . ? -2.293 -24.400 4.603 1.00 56.12 ? 406 HOH A O 1 HETATM 5369 O O . HOH H 5 . ? -0.828 -21.511 6.630 1.00 42.01 ? 407 HOH A O 1 HETATM 5370 O O . HOH H 5 . ? -18.505 -39.833 -4.232 1.00 64.76 ? 408 HOH A O 1 HETATM 5371 O O . HOH H 5 . ? -19.920 -1.568 6.554 1.00 73.02 ? 409 HOH A O 1 HETATM 5372 O O . HOH H 5 . ? -24.140 -19.120 15.380 1.00 70.60 ? 410 HOH A O 1 HETATM 5373 O O . HOH H 5 . ? -25.648 -22.131 -0.825 1.00 69.08 ? 411 HOH A O 1 HETATM 5374 O O . HOH H 5 . ? -5.164 -3.152 15.951 1.00 65.20 ? 412 HOH A O 1 HETATM 5375 O O . HOH H 5 . ? -16.028 -0.552 10.293 1.00 66.55 ? 413 HOH A O 1 HETATM 5376 O O . HOH I 5 . ? -37.187 -43.007 -33.422 1.00 61.61 ? 329 HOH B O 1 HETATM 5377 O O . HOH I 5 . ? -30.957 -61.551 -5.055 1.00 73.90 ? 330 HOH B O 1 HETATM 5378 O O . HOH I 5 . ? -37.858 -43.770 -6.897 1.00 63.36 ? 331 HOH B O 1 HETATM 5379 O O . HOH I 5 . ? -36.637 -44.013 -18.436 1.00 51.97 ? 332 HOH B O 1 HETATM 5380 O O . HOH I 5 . ? -37.676 -64.177 -9.965 1.00 80.03 ? 333 HOH B O 1 HETATM 5381 O O . HOH I 5 . ? -53.277 -57.604 -2.949 1.00 55.72 ? 334 HOH B O 1 HETATM 5382 O O . HOH I 5 . ? -33.744 -46.628 -1.236 1.00 71.61 ? 335 HOH B O 1 HETATM 5383 O O . HOH I 5 . ? -48.413 -34.899 -30.728 1.00 68.61 ? 336 HOH B O 1 HETATM 5384 O O . HOH I 5 . ? -50.837 -57.709 1.615 1.00 55.75 ? 337 HOH B O 1 HETATM 5385 O O . HOH I 5 . ? -44.291 -55.721 -21.758 1.00 73.45 ? 338 HOH B O 1 HETATM 5386 O O . HOH I 5 . ? -47.139 -42.857 -0.293 1.00 69.05 ? 339 HOH B O 1 HETATM 5387 O O . HOH I 5 . ? -22.753 -46.537 -1.218 1.00 52.15 ? 340 HOH B O 1 HETATM 5388 O O . HOH I 5 . ? -35.343 -67.459 -3.954 1.00 58.07 ? 341 HOH B O 1 HETATM 5389 O O . HOH I 5 . ? -53.952 -55.699 -8.162 1.00 76.84 ? 342 HOH B O 1 HETATM 5390 O O . HOH I 5 . ? -39.020 -61.688 -10.519 1.00 76.19 ? 343 HOH B O 1 HETATM 5391 O O . HOH I 5 . ? -29.547 -62.205 -13.583 1.00 74.24 ? 344 HOH B O 1 HETATM 5392 O O . HOH I 5 . ? -44.897 -46.945 5.428 1.00 77.27 ? 345 HOH B O 1 HETATM 5393 O O . HOH I 5 . ? -50.927 -35.786 -18.064 1.00 53.79 ? 346 HOH B O 1 HETATM 5394 O O . HOH I 5 . ? -51.969 -59.336 -7.184 1.00 59.19 ? 347 HOH B O 1 HETATM 5395 O O . HOH I 5 . ? -30.150 -51.219 -10.898 1.00 53.13 ? 348 HOH B O 1 HETATM 5396 O O . HOH I 5 . ? -16.054 -50.707 -12.555 1.00 70.89 ? 349 HOH B O 1 HETATM 5397 O O . HOH I 5 . ? -47.801 -48.958 5.063 1.00 56.60 ? 350 HOH B O 1 HETATM 5398 O O . HOH I 5 . ? -51.119 -42.090 -8.020 1.00 63.83 ? 351 HOH B O 1 HETATM 5399 O O . HOH I 5 . ? -39.238 -52.026 -20.021 1.00 70.25 ? 352 HOH B O 1 HETATM 5400 O O . HOH I 5 . ? -41.012 -41.290 -14.192 1.00 65.06 ? 353 HOH B O 1 HETATM 5401 O O . HOH I 5 . ? -43.092 -55.364 5.178 1.00 62.10 ? 354 HOH B O 1 HETATM 5402 O O . HOH I 5 . ? -35.336 -61.890 -3.997 1.00 72.13 ? 355 HOH B O 1 HETATM 5403 O O . HOH I 5 . ? -36.538 -33.687 -32.713 1.00 74.42 ? 356 HOH B O 1 HETATM 5404 O O . HOH I 5 . ? -28.612 -66.976 -8.800 1.00 76.04 ? 357 HOH B O 1 HETATM 5405 O O . HOH I 5 . ? -32.212 -65.400 -13.653 1.00 71.11 ? 358 HOH B O 1 HETATM 5406 O O . HOH I 5 . ? -29.072 -61.163 6.807 1.00 73.59 ? 359 HOH B O 1 HETATM 5407 O O . HOH I 5 . ? -48.794 -60.843 1.884 1.00 79.38 ? 360 HOH B O 1 HETATM 5408 O O . HOH I 5 . ? -56.218 -44.287 -5.718 1.00 67.97 ? 361 HOH B O 1 HETATM 5409 O O . HOH I 5 . ? -53.505 -55.265 -2.392 1.00 57.54 ? 362 HOH B O 1 HETATM 5410 O O . HOH I 5 . ? -42.873 -39.334 -7.366 1.00 61.54 ? 363 HOH B O 1 HETATM 5411 O O . HOH I 5 . ? -48.381 -32.490 -17.064 1.00 79.79 ? 364 HOH B O 1 HETATM 5412 O O . HOH I 5 . ? -41.948 -57.577 6.974 1.00 61.18 ? 365 HOH B O 1 HETATM 5413 O O . HOH I 5 . ? -35.766 -51.607 8.150 1.00 59.66 ? 366 HOH B O 1 HETATM 5414 O O . HOH I 5 . ? -22.541 -48.094 -3.370 1.00 71.91 ? 368 HOH B O 1 HETATM 5415 O O . HOH I 5 . ? -40.953 -50.628 5.383 1.00 58.07 ? 369 HOH B O 1 HETATM 5416 O O . HOH I 5 . ? -15.703 -49.043 -4.213 1.00 70.17 ? 370 HOH B O 1 HETATM 5417 O O . HOH I 5 . ? -36.413 -48.898 7.477 1.00 79.05 ? 371 HOH B O 1 HETATM 5418 O O . HOH I 5 . ? -32.908 -63.273 -4.055 1.00 74.33 ? 372 HOH B O 1 HETATM 5419 O O . HOH I 5 . ? -25.645 -44.519 -24.275 1.00 66.35 ? 373 HOH B O 1 HETATM 5420 O O . HOH I 5 . ? -54.105 -58.044 -5.663 1.00 71.46 ? 374 HOH B O 1 HETATM 5421 O O . HOH I 5 . ? -41.148 -53.219 5.829 1.00 59.15 ? 375 HOH B O 1 HETATM 5422 O O . HOH I 5 . ? -40.108 -69.080 -2.987 1.00 79.87 ? 376 HOH B O 1 HETATM 5423 O O . HOH I 5 . ? -43.763 -36.846 -8.387 1.00 77.75 ? 377 HOH B O 1 HETATM 5424 O O . HOH I 5 . ? -53.874 -41.089 -8.633 1.00 77.50 ? 378 HOH B O 1 HETATM 5425 O O . HOH I 5 . ? -18.400 -51.092 -2.172 1.00 59.80 ? 379 HOH B O 1 HETATM 5426 O O . HOH I 5 . ? -25.079 -40.684 -7.545 1.00 70.68 ? 380 HOH B O 1 HETATM 5427 O O . HOH I 5 . ? -53.750 -61.767 -5.936 1.00 75.26 ? 381 HOH B O 1 HETATM 5428 O O . HOH I 5 . ? -30.725 -38.142 -10.886 1.00 68.30 ? 382 HOH B O 1 HETATM 5429 O O . HOH I 5 . ? -51.270 -56.628 -22.255 1.00 75.62 ? 383 HOH B O 1 HETATM 5430 O O . HOH I 5 . ? -21.705 -50.898 -2.545 1.00 62.80 ? 384 HOH B O 1 HETATM 5431 O O . HOH I 5 . ? -20.436 -46.340 -2.325 1.00 73.79 ? 385 HOH B O 1 HETATM 5432 O O . HOH I 5 . ? -34.349 -71.915 -14.284 1.00 70.41 ? 386 HOH B O 1 HETATM 5433 O O . HOH I 5 . ? -50.417 -58.893 -21.280 1.00 76.35 ? 387 HOH B O 1 HETATM 5434 O O . HOH I 5 . ? -48.975 -64.167 -2.550 1.00 58.01 ? 388 HOH B O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 LEU 1 -5 ? ? ? A . n A 1 2 THR 2 -4 ? ? ? A . n A 1 3 LEU 3 -3 ? ? ? A . n A 1 4 GLY 4 -2 -2 GLY GLY A . n A 1 5 ASN 5 -1 -1 ASN ASN A . n A 1 6 THR 6 0 0 THR THR A . n A 1 7 THR 7 1 1 THR THR A . n A 1 8 SER 8 2 2 SER SER A . n A 1 9 SER 9 3 3 SER SER A . n A 1 10 VAL 10 4 4 VAL VAL A . n A 1 11 ILE 11 5 5 ILE ILE A . n A 1 12 LEU 12 6 6 LEU LEU A . n A 1 13 THR 13 7 7 THR THR A . n A 1 14 ASN 14 8 8 ASN ASN A . n A 1 15 TYR 15 9 9 TYR TYR A . n A 1 16 MET 16 10 10 MET MET A . n A 1 17 ASP 17 11 11 ASP ASP A . n A 1 18 THR 18 12 12 THR THR A . n A 1 19 GLN 19 13 13 GLN GLN A . n A 1 20 TYR 20 14 14 TYR TYR A . n A 1 21 TYR 21 15 15 TYR TYR A . n A 1 22 GLY 22 16 16 GLY GLY A . n A 1 23 GLU 23 17 17 GLU GLU A . n A 1 24 ILE 24 18 18 ILE ILE A . n A 1 25 GLY 25 19 19 GLY GLY A . n A 1 26 ILE 26 20 20 ILE ILE A . n A 1 27 GLY 27 21 21 GLY GLY A . n A 1 28 THR 28 22 22 THR THR A . n A 1 29 PRO 29 23 23 PRO PRO A . n A 1 30 PRO 30 24 24 PRO PRO A . n A 1 31 GLN 31 25 25 GLN GLN A . n A 1 32 THR 32 26 26 THR THR A . n A 1 33 PHE 33 27 27 PHE PHE A . n A 1 34 LYS 34 28 28 LYS LYS A . n A 1 35 VAL 35 29 29 VAL VAL A . n A 1 36 VAL 36 30 30 VAL VAL A . n A 1 37 PHE 37 31 31 PHE PHE A . n A 1 38 ASP 38 32 32 ASP ASP A . n A 1 39 THR 39 33 33 THR THR A . n A 1 40 GLY 40 34 34 GLY GLY A . n A 1 41 SER 41 35 35 SER SER A . n A 1 42 SER 42 36 36 SER SER A . n A 1 43 ASN 43 37 37 ASN ASN A . n A 1 44 VAL 44 38 38 VAL VAL A . n A 1 45 TRP 45 39 39 TRP TRP A . n A 1 46 VAL 46 40 40 VAL VAL A . n A 1 47 PRO 47 41 41 PRO PRO A . n A 1 48 SER 48 42 42 SER SER A . n A 1 49 SER 49 43 43 SER SER A . n A 1 50 LYS 50 44 44 LYS LYS A . n A 1 51 CYS 51 45 45 CYS CYS A . n A 1 52 SER 52 46 46 SER SER A . n A 1 53 ARG 53 46 46 ARG ARG A A n A 1 54 LEU 54 46 46 LEU LEU A B n A 1 55 TYR 55 47 47 TYR TYR A . n A 1 56 THR 56 48 48 THR THR A . n A 1 57 ALA 57 49 49 ALA ALA A . n A 1 58 CYS 58 50 50 CYS CYS A . n A 1 59 VAL 59 51 51 VAL VAL A . n A 1 60 TYR 60 52 52 TYR TYR A . n A 1 61 HIS 61 53 53 HIS HIS A . n A 1 62 LYS 62 54 54 LYS LYS A . n A 1 63 LEU 63 55 55 LEU LEU A . n A 1 64 PHE 64 56 56 PHE PHE A . n A 1 65 ASP 65 57 57 ASP ASP A . n A 1 66 ALA 66 58 58 ALA ALA A . n A 1 67 SER 67 59 59 SER SER A . n A 1 68 ASP 68 60 60 ASP ASP A . n A 1 69 SER 69 61 61 SER SER A . n A 1 70 SER 70 62 62 SER SER A . n A 1 71 SER 71 63 63 SER SER A . n A 1 72 TYR 72 64 64 TYR TYR A . n A 1 73 LYS 73 65 65 LYS LYS A . n A 1 74 HIS 74 66 66 HIS HIS A . n A 1 75 ASN 75 67 67 ASN ASN A . n A 1 76 GLY 76 68 68 GLY GLY A . n A 1 77 THR 77 69 69 THR THR A . n A 1 78 GLU 78 70 70 GLU GLU A . n A 1 79 LEU 79 71 71 LEU LEU A . n A 1 80 THR 80 72 72 THR THR A . n A 1 81 LEU 81 73 73 LEU LEU A . n A 1 82 ARG 82 74 74 ARG ARG A . n A 1 83 TYR 83 75 75 TYR TYR A . n A 1 84 SER 84 76 76 SER SER A . n A 1 85 THR 85 77 77 THR THR A . n A 1 86 GLY 86 78 78 GLY GLY A . n A 1 87 THR 87 79 79 THR THR A . n A 1 88 VAL 88 80 80 VAL VAL A . n A 1 89 SER 89 81 81 SER SER A . n A 1 90 GLY 90 82 82 GLY GLY A . n A 1 91 PHE 91 83 83 PHE PHE A . n A 1 92 LEU 92 84 84 LEU LEU A . n A 1 93 SER 93 85 85 SER SER A . n A 1 94 GLN 94 86 86 GLN GLN A . n A 1 95 ASP 95 87 87 ASP ASP A . n A 1 96 ILE 96 88 88 ILE ILE A . n A 1 97 ILE 97 89 89 ILE ILE A . n A 1 98 THR 98 90 90 THR THR A . n A 1 99 VAL 99 91 91 VAL VAL A . n A 1 100 GLY 100 92 92 GLY GLY A . n A 1 101 GLY 101 93 93 GLY GLY A . n A 1 102 ILE 102 94 94 ILE ILE A . n A 1 103 THR 103 95 95 THR THR A . n A 1 104 VAL 104 96 96 VAL VAL A . n A 1 105 THR 105 97 97 THR THR A . n A 1 106 GLN 106 99 99 GLN GLN A . n A 1 107 MET 107 100 100 MET MET A . n A 1 108 PHE 108 101 101 PHE PHE A . n A 1 109 GLY 109 102 102 GLY GLY A . n A 1 110 GLU 110 103 103 GLU GLU A . n A 1 111 VAL 111 104 104 VAL VAL A . n A 1 112 THR 112 105 105 THR THR A . n A 1 113 GLU 113 106 106 GLU GLU A . n A 1 114 MET 114 107 107 MET MET A . n A 1 115 PRO 115 108 108 PRO PRO A . n A 1 116 ALA 116 109 109 ALA ALA A . n A 1 117 LEU 117 110 110 LEU LEU A . n A 1 118 PRO 118 111 111 PRO PRO A . n A 1 119 PHE 119 112 112 PHE PHE A . n A 1 120 MET 120 113 113 MET MET A . n A 1 121 LEU 121 114 114 LEU LEU A . n A 1 122 ALA 122 115 115 ALA ALA A . n A 1 123 GLU 123 116 116 GLU GLU A . n A 1 124 PHE 124 117 117 PHE PHE A . n A 1 125 ASP 125 118 118 ASP ASP A . n A 1 126 GLY 126 119 119 GLY GLY A . n A 1 127 VAL 127 120 120 VAL VAL A . n A 1 128 VAL 128 121 121 VAL VAL A . n A 1 129 GLY 129 122 122 GLY GLY A . n A 1 130 MET 130 123 123 MET MET A . n A 1 131 GLY 131 124 124 GLY GLY A . n A 1 132 PHE 132 125 125 PHE PHE A . n A 1 133 ILE 133 126 126 ILE ILE A . n A 1 134 GLU 134 127 127 GLU GLU A . n A 1 135 GLN 135 128 128 GLN GLN A . n A 1 136 ALA 136 129 129 ALA ALA A . n A 1 137 ILE 137 130 130 ILE ILE A . n A 1 138 GLY 138 131 131 GLY GLY A . n A 1 139 ARG 139 132 132 ARG ARG A . n A 1 140 VAL 140 133 133 VAL VAL A . n A 1 141 THR 141 134 134 THR THR A . n A 1 142 PRO 142 135 135 PRO PRO A . n A 1 143 ILE 143 136 136 ILE ILE A . n A 1 144 PHE 144 137 137 PHE PHE A . n A 1 145 ASP 145 138 138 ASP ASP A . n A 1 146 ASN 146 139 139 ASN ASN A . n A 1 147 ILE 147 140 140 ILE ILE A . n A 1 148 ILE 148 141 141 ILE ILE A . n A 1 149 SER 149 142 142 SER SER A . n A 1 150 GLN 150 143 143 GLN GLN A . n A 1 151 GLY 151 144 144 GLY GLY A . n A 1 152 VAL 152 145 145 VAL VAL A . n A 1 153 LEU 153 146 146 LEU LEU A . n A 1 154 LYS 154 147 147 LYS LYS A . n A 1 155 GLU 155 148 148 GLU GLU A . n A 1 156 ASP 156 149 149 ASP ASP A . n A 1 157 VAL 157 150 150 VAL VAL A . n A 1 158 PHE 158 151 151 PHE PHE A . n A 1 159 SER 159 152 152 SER SER A . n A 1 160 PHE 160 153 153 PHE PHE A . n A 1 161 TYR 161 154 154 TYR TYR A . n A 1 162 TYR 162 155 155 TYR TYR A . n A 1 163 ASN 163 156 156 ASN ASN A . n A 1 164 ARG 164 157 157 ARG ARG A . n A 1 165 ASP 165 158 158 ASP ASP A . n A 1 166 SER 166 159 159 SER SER A . n A 1 167 GLU 167 160 160 GLU GLU A . n A 1 168 ASN 168 160 160 ASN ASN A A n A 1 169 SER 169 160 160 SER SER A B n A 1 170 GLN 170 160 160 GLN GLN A C n A 1 171 SER 171 160 160 SER SER A D n A 1 172 LEU 172 161 161 LEU LEU A . n A 1 173 GLY 173 162 162 GLY GLY A . n A 1 174 GLY 174 163 163 GLY GLY A . n A 1 175 GLN 175 164 164 GLN GLN A . n A 1 176 ILE 176 165 165 ILE ILE A . n A 1 177 VAL 177 166 166 VAL VAL A . n A 1 178 LEU 178 167 167 LEU LEU A . n A 1 179 GLY 179 168 168 GLY GLY A . n A 1 180 GLY 180 169 169 GLY GLY A . n A 1 181 SER 181 170 170 SER SER A . n A 1 182 ASP 182 171 171 ASP ASP A . n A 1 183 PRO 183 172 172 PRO PRO A . n A 1 184 GLN 184 173 173 GLN GLN A . n A 1 185 HIS 185 174 174 HIS HIS A . n A 1 186 TYR 186 175 175 TYR TYR A . n A 1 187 GLU 187 176 176 GLU GLU A . n A 1 188 GLY 188 177 177 GLY GLY A . n A 1 189 ASN 189 178 178 ASN ASN A . n A 1 190 PHE 190 179 179 PHE PHE A . n A 1 191 HIS 191 180 180 HIS HIS A . n A 1 192 TYR 192 181 181 TYR TYR A . n A 1 193 ILE 193 182 182 ILE ILE A . n A 1 194 ASN 194 183 183 ASN ASN A . n A 1 195 LEU 195 184 184 LEU LEU A . n A 1 196 ILE 196 185 185 ILE ILE A . n A 1 197 LYS 197 186 186 LYS LYS A . n A 1 198 THR 198 187 187 THR THR A . n A 1 199 GLY 199 188 188 GLY GLY A . n A 1 200 VAL 200 189 189 VAL VAL A . n A 1 201 TRP 201 190 190 TRP TRP A . n A 1 202 GLN 202 191 191 GLN GLN A . n A 1 203 ILE 203 192 192 ILE ILE A . n A 1 204 GLN 204 193 193 GLN GLN A . n A 1 205 MET 205 194 194 MET MET A . n A 1 206 LYS 206 195 195 LYS LYS A . n A 1 207 GLY 207 196 196 GLY GLY A . n A 1 208 VAL 208 197 197 VAL VAL A . n A 1 209 SER 209 198 198 SER SER A . n A 1 210 VAL 210 199 199 VAL VAL A . n A 1 211 GLY 211 200 200 GLY GLY A . n A 1 212 SER 212 201 201 SER SER A . n A 1 213 SER 213 202 202 SER SER A . n A 1 214 THR 214 203 203 THR THR A . n A 1 215 LEU 215 204 204 LEU LEU A . n A 1 216 LEU 216 205 205 LEU LEU A . n A 1 217 CYS 217 206 206 CYS CYS A . n A 1 218 GLU 218 207 207 GLU GLU A . n A 1 219 ASP 219 208 208 ASP ASP A . n A 1 220 GLY 220 209 209 GLY GLY A . n A 1 221 CYS 221 210 210 CYS CYS A . n A 1 222 LEU 222 211 211 LEU LEU A . n A 1 223 ALA 223 212 212 ALA ALA A . n A 1 224 LEU 224 213 213 LEU LEU A . n A 1 225 VAL 225 214 214 VAL VAL A . n A 1 226 ASP 226 215 215 ASP ASP A . n A 1 227 THR 227 216 216 THR THR A . n A 1 228 GLY 228 217 217 GLY GLY A . n A 1 229 ALA 229 218 218 ALA ALA A . n A 1 230 SER 230 219 219 SER SER A . n A 1 231 TYR 231 220 220 TYR TYR A . n A 1 232 ILE 232 221 221 ILE ILE A . n A 1 233 SER 233 222 222 SER SER A . n A 1 234 GLY 234 223 223 GLY GLY A . n A 1 235 SER 235 224 224 SER SER A . n A 1 236 THR 236 225 225 THR THR A . n A 1 237 SER 237 226 226 SER SER A . n A 1 238 SER 238 227 227 SER SER A . n A 1 239 ILE 239 228 228 ILE ILE A . n A 1 240 GLU 240 229 229 GLU GLU A . n A 1 241 LYS 241 230 230 LYS LYS A . n A 1 242 LEU 242 231 231 LEU LEU A . n A 1 243 MET 243 232 232 MET MET A . n A 1 244 GLU 244 233 233 GLU GLU A . n A 1 245 ALA 245 234 234 ALA ALA A . n A 1 246 LEU 246 235 235 LEU LEU A . n A 1 247 GLY 247 236 236 GLY GLY A . n A 1 248 ALA 248 237 237 ALA ALA A . n A 1 249 LYS 249 238 238 LYS LYS A . n A 1 250 LYS 250 239 239 LYS LYS A . n A 1 251 ARG 251 240 240 ARG ARG A . n A 1 252 LEU 252 242 242 LEU LEU A . n A 1 253 PHE 253 243 243 PHE PHE A . n A 1 254 ASP 254 244 244 ASP ASP A . n A 1 255 TYR 255 245 245 TYR TYR A . n A 1 256 VAL 256 246 246 VAL VAL A . n A 1 257 VAL 257 247 247 VAL VAL A . n A 1 258 LYS 258 248 248 LYS LYS A . n A 1 259 CYS 259 249 249 CYS CYS A . n A 1 260 ASN 260 250 250 ASN ASN A . n A 1 261 GLU 261 251 251 GLU GLU A . n A 1 262 GLY 262 252 252 GLY GLY A . n A 1 263 PRO 263 253 253 PRO PRO A . n A 1 264 THR 264 254 254 THR THR A . n A 1 265 LEU 265 255 255 LEU LEU A . n A 1 266 PRO 266 256 256 PRO PRO A . n A 1 267 ASP 267 257 257 ASP ASP A . n A 1 268 ILE 268 258 258 ILE ILE A . n A 1 269 SER 269 259 259 SER SER A . n A 1 270 PHE 270 260 260 PHE PHE A . n A 1 271 HIS 271 261 261 HIS HIS A . n A 1 272 LEU 272 262 262 LEU LEU A . n A 1 273 GLY 273 263 263 GLY GLY A . n A 1 274 GLY 274 264 264 GLY GLY A . n A 1 275 LYS 275 265 265 LYS LYS A . n A 1 276 GLU 276 266 266 GLU GLU A . n A 1 277 TYR 277 267 267 TYR TYR A . n A 1 278 THR 278 268 268 THR THR A . n A 1 279 LEU 279 269 269 LEU LEU A . n A 1 280 THR 280 270 270 THR THR A . n A 1 281 SER 281 271 271 SER SER A . n A 1 282 ALA 282 272 272 ALA ALA A . n A 1 283 ASP 283 273 273 ASP ASP A . n A 1 284 TYR 284 274 274 TYR TYR A . n A 1 285 VAL 285 275 275 VAL VAL A . n A 1 286 PHE 286 276 276 PHE PHE A . n A 1 287 GLN 287 277 277 GLN GLN A . n A 1 288 GLU 288 278 278 GLU GLU A . n A 1 289 SER 289 279 279 SER SER A . n A 1 290 TYR 290 279 279 TYR TYR A A n A 1 291 SER 291 279 279 SER SER A B n A 1 292 SER 292 279 279 SER SER A C n A 1 293 LYS 293 279 279 LYS LYS A D n A 1 294 LYS 294 280 280 LYS LYS A . n A 1 295 LEU 295 281 281 LEU LEU A . n A 1 296 CYS 296 282 282 CYS CYS A . n A 1 297 THR 297 283 283 THR THR A . n A 1 298 LEU 298 284 284 LEU LEU A . n A 1 299 ALA 299 285 285 ALA ALA A . n A 1 300 ILE 300 286 286 ILE ILE A . n A 1 301 HIS 301 287 287 HIS HIS A . n A 1 302 ALA 302 288 288 ALA ALA A . n A 1 303 MET 303 289 289 MET MET A . n A 1 304 ASP 304 290 290 ASP ASP A . n A 1 305 ILE 305 291 291 ILE ILE A . n A 1 306 PRO 306 292 292 PRO PRO A . n A 1 307 PRO 307 293 293 PRO PRO A . n A 1 308 PRO 308 294 294 PRO PRO A . n A 1 309 THR 309 295 295 THR THR A . n A 1 310 GLY 310 296 296 GLY GLY A . n A 1 311 PRO 311 297 297 PRO PRO A . n A 1 312 THR 312 298 298 THR THR A . n A 1 313 TRP 313 299 299 TRP TRP A . n A 1 314 ALA 314 300 300 ALA ALA A . n A 1 315 LEU 315 301 301 LEU LEU A . n A 1 316 GLY 316 302 302 GLY GLY A . n A 1 317 ALA 317 303 303 ALA ALA A . n A 1 318 THR 318 304 304 THR THR A . n A 1 319 PHE 319 305 305 PHE PHE A . n A 1 320 ILE 320 306 306 ILE ILE A . n A 1 321 ARG 321 307 307 ARG ARG A . n A 1 322 LYS 322 308 308 LYS LYS A . n A 1 323 PHE 323 309 309 PHE PHE A . n A 1 324 TYR 324 310 310 TYR TYR A . n A 1 325 THR 325 311 311 THR THR A . n A 1 326 GLU 326 312 312 GLU GLU A . n A 1 327 PHE 327 313 313 PHE PHE A . n A 1 328 ASP 328 314 314 ASP ASP A . n A 1 329 ARG 329 315 315 ARG ARG A . n A 1 330 ARG 330 316 316 ARG ARG A . n A 1 331 ASN 331 317 317 ASN ASN A . n A 1 332 ASN 332 318 318 ASN ASN A . n A 1 333 ARG 333 319 319 ARG ARG A . n A 1 334 ILE 334 320 320 ILE ILE A . n A 1 335 GLY 335 321 321 GLY GLY A . n A 1 336 PHE 336 322 322 PHE PHE A . n A 1 337 ALA 337 323 323 ALA ALA A . n A 1 338 LEU 338 324 324 LEU LEU A . n A 1 339 ALA 339 325 325 ALA ALA A . n A 1 340 ARG 340 326 326 ARG ARG A . n B 1 1 LEU 1 -5 ? ? ? B . n B 1 2 THR 2 -4 ? ? ? B . n B 1 3 LEU 3 -3 ? ? ? B . n B 1 4 GLY 4 -2 -2 GLY GLY B . n B 1 5 ASN 5 -1 -1 ASN ASN B . n B 1 6 THR 6 0 0 THR THR B . n B 1 7 THR 7 1 1 THR THR B . n B 1 8 SER 8 2 2 SER SER B . n B 1 9 SER 9 3 3 SER SER B . n B 1 10 VAL 10 4 4 VAL VAL B . n B 1 11 ILE 11 5 5 ILE ILE B . n B 1 12 LEU 12 6 6 LEU LEU B . n B 1 13 THR 13 7 7 THR THR B . n B 1 14 ASN 14 8 8 ASN ASN B . n B 1 15 TYR 15 9 9 TYR TYR B . n B 1 16 MET 16 10 10 MET MET B . n B 1 17 ASP 17 11 11 ASP ASP B . n B 1 18 THR 18 12 12 THR THR B . n B 1 19 GLN 19 13 13 GLN GLN B . n B 1 20 TYR 20 14 14 TYR TYR B . n B 1 21 TYR 21 15 15 TYR TYR B . n B 1 22 GLY 22 16 16 GLY GLY B . n B 1 23 GLU 23 17 17 GLU GLU B . n B 1 24 ILE 24 18 18 ILE ILE B . n B 1 25 GLY 25 19 19 GLY GLY B . n B 1 26 ILE 26 20 20 ILE ILE B . n B 1 27 GLY 27 21 21 GLY GLY B . n B 1 28 THR 28 22 22 THR THR B . n B 1 29 PRO 29 23 23 PRO PRO B . n B 1 30 PRO 30 24 24 PRO PRO B . n B 1 31 GLN 31 25 25 GLN GLN B . n B 1 32 THR 32 26 26 THR THR B . n B 1 33 PHE 33 27 27 PHE PHE B . n B 1 34 LYS 34 28 28 LYS LYS B . n B 1 35 VAL 35 29 29 VAL VAL B . n B 1 36 VAL 36 30 30 VAL VAL B . n B 1 37 PHE 37 31 31 PHE PHE B . n B 1 38 ASP 38 32 32 ASP ASP B . n B 1 39 THR 39 33 33 THR THR B . n B 1 40 GLY 40 34 34 GLY GLY B . n B 1 41 SER 41 35 35 SER SER B . n B 1 42 SER 42 36 36 SER SER B . n B 1 43 ASN 43 37 37 ASN ASN B . n B 1 44 VAL 44 38 38 VAL VAL B . n B 1 45 TRP 45 39 39 TRP TRP B . n B 1 46 VAL 46 40 40 VAL VAL B . n B 1 47 PRO 47 41 41 PRO PRO B . n B 1 48 SER 48 42 42 SER SER B . n B 1 49 SER 49 43 43 SER SER B . n B 1 50 LYS 50 44 44 LYS LYS B . n B 1 51 CYS 51 45 45 CYS CYS B . n B 1 52 SER 52 46 46 SER SER B . n B 1 53 ARG 53 46 46 ARG ARG B A n B 1 54 LEU 54 46 46 LEU LEU B B n B 1 55 TYR 55 47 47 TYR TYR B . n B 1 56 THR 56 48 48 THR THR B . n B 1 57 ALA 57 49 49 ALA ALA B . n B 1 58 CYS 58 50 50 CYS CYS B . n B 1 59 VAL 59 51 51 VAL VAL B . n B 1 60 TYR 60 52 52 TYR TYR B . n B 1 61 HIS 61 53 53 HIS HIS B . n B 1 62 LYS 62 54 54 LYS LYS B . n B 1 63 LEU 63 55 55 LEU LEU B . n B 1 64 PHE 64 56 56 PHE PHE B . n B 1 65 ASP 65 57 57 ASP ASP B . n B 1 66 ALA 66 58 58 ALA ALA B . n B 1 67 SER 67 59 59 SER SER B . n B 1 68 ASP 68 60 60 ASP ASP B . n B 1 69 SER 69 61 61 SER SER B . n B 1 70 SER 70 62 62 SER SER B . n B 1 71 SER 71 63 63 SER SER B . n B 1 72 TYR 72 64 64 TYR TYR B . n B 1 73 LYS 73 65 65 LYS LYS B . n B 1 74 HIS 74 66 66 HIS HIS B . n B 1 75 ASN 75 67 67 ASN ASN B . n B 1 76 GLY 76 68 68 GLY GLY B . n B 1 77 THR 77 69 69 THR THR B . n B 1 78 GLU 78 70 70 GLU GLU B . n B 1 79 LEU 79 71 71 LEU LEU B . n B 1 80 THR 80 72 72 THR THR B . n B 1 81 LEU 81 73 73 LEU LEU B . n B 1 82 ARG 82 74 74 ARG ARG B . n B 1 83 TYR 83 75 75 TYR TYR B . n B 1 84 SER 84 76 76 SER SER B . n B 1 85 THR 85 77 77 THR THR B . n B 1 86 GLY 86 78 78 GLY GLY B . n B 1 87 THR 87 79 79 THR THR B . n B 1 88 VAL 88 80 80 VAL VAL B . n B 1 89 SER 89 81 81 SER SER B . n B 1 90 GLY 90 82 82 GLY GLY B . n B 1 91 PHE 91 83 83 PHE PHE B . n B 1 92 LEU 92 84 84 LEU LEU B . n B 1 93 SER 93 85 85 SER SER B . n B 1 94 GLN 94 86 86 GLN GLN B . n B 1 95 ASP 95 87 87 ASP ASP B . n B 1 96 ILE 96 88 88 ILE ILE B . n B 1 97 ILE 97 89 89 ILE ILE B . n B 1 98 THR 98 90 90 THR THR B . n B 1 99 VAL 99 91 91 VAL VAL B . n B 1 100 GLY 100 92 92 GLY GLY B . n B 1 101 GLY 101 93 93 GLY GLY B . n B 1 102 ILE 102 94 94 ILE ILE B . n B 1 103 THR 103 95 95 THR THR B . n B 1 104 VAL 104 96 96 VAL VAL B . n B 1 105 THR 105 97 97 THR THR B . n B 1 106 GLN 106 99 99 GLN GLN B . n B 1 107 MET 107 100 100 MET MET B . n B 1 108 PHE 108 101 101 PHE PHE B . n B 1 109 GLY 109 102 102 GLY GLY B . n B 1 110 GLU 110 103 103 GLU GLU B . n B 1 111 VAL 111 104 104 VAL VAL B . n B 1 112 THR 112 105 105 THR THR B . n B 1 113 GLU 113 106 106 GLU GLU B . n B 1 114 MET 114 107 107 MET MET B . n B 1 115 PRO 115 108 108 PRO PRO B . n B 1 116 ALA 116 109 109 ALA ALA B . n B 1 117 LEU 117 110 110 LEU LEU B . n B 1 118 PRO 118 111 111 PRO PRO B . n B 1 119 PHE 119 112 112 PHE PHE B . n B 1 120 MET 120 113 113 MET MET B . n B 1 121 LEU 121 114 114 LEU LEU B . n B 1 122 ALA 122 115 115 ALA ALA B . n B 1 123 GLU 123 116 116 GLU GLU B . n B 1 124 PHE 124 117 117 PHE PHE B . n B 1 125 ASP 125 118 118 ASP ASP B . n B 1 126 GLY 126 119 119 GLY GLY B . n B 1 127 VAL 127 120 120 VAL VAL B . n B 1 128 VAL 128 121 121 VAL VAL B . n B 1 129 GLY 129 122 122 GLY GLY B . n B 1 130 MET 130 123 123 MET MET B . n B 1 131 GLY 131 124 124 GLY GLY B . n B 1 132 PHE 132 125 125 PHE PHE B . n B 1 133 ILE 133 126 126 ILE ILE B . n B 1 134 GLU 134 127 127 GLU GLU B . n B 1 135 GLN 135 128 128 GLN GLN B . n B 1 136 ALA 136 129 129 ALA ALA B . n B 1 137 ILE 137 130 130 ILE ILE B . n B 1 138 GLY 138 131 131 GLY GLY B . n B 1 139 ARG 139 132 132 ARG ARG B . n B 1 140 VAL 140 133 133 VAL VAL B . n B 1 141 THR 141 134 134 THR THR B . n B 1 142 PRO 142 135 135 PRO PRO B . n B 1 143 ILE 143 136 136 ILE ILE B . n B 1 144 PHE 144 137 137 PHE PHE B . n B 1 145 ASP 145 138 138 ASP ASP B . n B 1 146 ASN 146 139 139 ASN ASN B . n B 1 147 ILE 147 140 140 ILE ILE B . n B 1 148 ILE 148 141 141 ILE ILE B . n B 1 149 SER 149 142 142 SER SER B . n B 1 150 GLN 150 143 143 GLN GLN B . n B 1 151 GLY 151 144 144 GLY GLY B . n B 1 152 VAL 152 145 145 VAL VAL B . n B 1 153 LEU 153 146 146 LEU LEU B . n B 1 154 LYS 154 147 147 LYS LYS B . n B 1 155 GLU 155 148 148 GLU GLU B . n B 1 156 ASP 156 149 149 ASP ASP B . n B 1 157 VAL 157 150 150 VAL VAL B . n B 1 158 PHE 158 151 151 PHE PHE B . n B 1 159 SER 159 152 152 SER SER B . n B 1 160 PHE 160 153 153 PHE PHE B . n B 1 161 TYR 161 154 154 TYR TYR B . n B 1 162 TYR 162 155 155 TYR TYR B . n B 1 163 ASN 163 156 156 ASN ASN B . n B 1 164 ARG 164 157 157 ARG ARG B . n B 1 165 ASP 165 158 158 ASP ASP B . n B 1 166 SER 166 159 159 SER SER B . n B 1 167 GLU 167 160 160 GLU GLU B . n B 1 168 ASN 168 160 160 ASN ASN B A n B 1 169 SER 169 160 160 SER SER B B n B 1 170 GLN 170 160 160 GLN GLN B C n B 1 171 SER 171 160 160 SER SER B D n B 1 172 LEU 172 161 161 LEU LEU B . n B 1 173 GLY 173 162 162 GLY GLY B . n B 1 174 GLY 174 163 163 GLY GLY B . n B 1 175 GLN 175 164 164 GLN GLN B . n B 1 176 ILE 176 165 165 ILE ILE B . n B 1 177 VAL 177 166 166 VAL VAL B . n B 1 178 LEU 178 167 167 LEU LEU B . n B 1 179 GLY 179 168 168 GLY GLY B . n B 1 180 GLY 180 169 169 GLY GLY B . n B 1 181 SER 181 170 170 SER SER B . n B 1 182 ASP 182 171 171 ASP ASP B . n B 1 183 PRO 183 172 172 PRO PRO B . n B 1 184 GLN 184 173 173 GLN GLN B . n B 1 185 HIS 185 174 174 HIS HIS B . n B 1 186 TYR 186 175 175 TYR TYR B . n B 1 187 GLU 187 176 176 GLU GLU B . n B 1 188 GLY 188 177 177 GLY GLY B . n B 1 189 ASN 189 178 178 ASN ASN B . n B 1 190 PHE 190 179 179 PHE PHE B . n B 1 191 HIS 191 180 180 HIS HIS B . n B 1 192 TYR 192 181 181 TYR TYR B . n B 1 193 ILE 193 182 182 ILE ILE B . n B 1 194 ASN 194 183 183 ASN ASN B . n B 1 195 LEU 195 184 184 LEU LEU B . n B 1 196 ILE 196 185 185 ILE ILE B . n B 1 197 LYS 197 186 186 LYS LYS B . n B 1 198 THR 198 187 187 THR THR B . n B 1 199 GLY 199 188 188 GLY GLY B . n B 1 200 VAL 200 189 189 VAL VAL B . n B 1 201 TRP 201 190 190 TRP TRP B . n B 1 202 GLN 202 191 191 GLN GLN B . n B 1 203 ILE 203 192 192 ILE ILE B . n B 1 204 GLN 204 193 193 GLN GLN B . n B 1 205 MET 205 194 194 MET MET B . n B 1 206 LYS 206 195 195 LYS LYS B . n B 1 207 GLY 207 196 196 GLY GLY B . n B 1 208 VAL 208 197 197 VAL VAL B . n B 1 209 SER 209 198 198 SER SER B . n B 1 210 VAL 210 199 199 VAL VAL B . n B 1 211 GLY 211 200 200 GLY GLY B . n B 1 212 SER 212 201 201 SER SER B . n B 1 213 SER 213 202 202 SER SER B . n B 1 214 THR 214 203 203 THR THR B . n B 1 215 LEU 215 204 204 LEU LEU B . n B 1 216 LEU 216 205 205 LEU LEU B . n B 1 217 CYS 217 206 206 CYS CYS B . n B 1 218 GLU 218 207 207 GLU GLU B . n B 1 219 ASP 219 208 208 ASP ASP B . n B 1 220 GLY 220 209 209 GLY GLY B . n B 1 221 CYS 221 210 210 CYS CYS B . n B 1 222 LEU 222 211 211 LEU LEU B . n B 1 223 ALA 223 212 212 ALA ALA B . n B 1 224 LEU 224 213 213 LEU LEU B . n B 1 225 VAL 225 214 214 VAL VAL B . n B 1 226 ASP 226 215 215 ASP ASP B . n B 1 227 THR 227 216 216 THR THR B . n B 1 228 GLY 228 217 217 GLY GLY B . n B 1 229 ALA 229 218 218 ALA ALA B . n B 1 230 SER 230 219 219 SER SER B . n B 1 231 TYR 231 220 220 TYR TYR B . n B 1 232 ILE 232 221 221 ILE ILE B . n B 1 233 SER 233 222 222 SER SER B . n B 1 234 GLY 234 223 223 GLY GLY B . n B 1 235 SER 235 224 224 SER SER B . n B 1 236 THR 236 225 225 THR THR B . n B 1 237 SER 237 226 226 SER SER B . n B 1 238 SER 238 227 227 SER SER B . n B 1 239 ILE 239 228 228 ILE ILE B . n B 1 240 GLU 240 229 229 GLU GLU B . n B 1 241 LYS 241 230 230 LYS LYS B . n B 1 242 LEU 242 231 231 LEU LEU B . n B 1 243 MET 243 232 232 MET MET B . n B 1 244 GLU 244 233 233 GLU GLU B . n B 1 245 ALA 245 234 234 ALA ALA B . n B 1 246 LEU 246 235 235 LEU LEU B . n B 1 247 GLY 247 236 236 GLY GLY B . n B 1 248 ALA 248 237 237 ALA ALA B . n B 1 249 LYS 249 238 238 LYS LYS B . n B 1 250 LYS 250 239 239 LYS LYS B . n B 1 251 ARG 251 240 240 ARG ARG B . n B 1 252 LEU 252 242 242 LEU LEU B . n B 1 253 PHE 253 243 243 PHE PHE B . n B 1 254 ASP 254 244 244 ASP ASP B . n B 1 255 TYR 255 245 245 TYR TYR B . n B 1 256 VAL 256 246 246 VAL VAL B . n B 1 257 VAL 257 247 247 VAL VAL B . n B 1 258 LYS 258 248 248 LYS LYS B . n B 1 259 CYS 259 249 249 CYS CYS B . n B 1 260 ASN 260 250 250 ASN ASN B . n B 1 261 GLU 261 251 251 GLU GLU B . n B 1 262 GLY 262 252 252 GLY GLY B . n B 1 263 PRO 263 253 253 PRO PRO B . n B 1 264 THR 264 254 254 THR THR B . n B 1 265 LEU 265 255 255 LEU LEU B . n B 1 266 PRO 266 256 256 PRO PRO B . n B 1 267 ASP 267 257 257 ASP ASP B . n B 1 268 ILE 268 258 258 ILE ILE B . n B 1 269 SER 269 259 259 SER SER B . n B 1 270 PHE 270 260 260 PHE PHE B . n B 1 271 HIS 271 261 261 HIS HIS B . n B 1 272 LEU 272 262 262 LEU LEU B . n B 1 273 GLY 273 263 263 GLY GLY B . n B 1 274 GLY 274 264 264 GLY GLY B . n B 1 275 LYS 275 265 265 LYS LYS B . n B 1 276 GLU 276 266 266 GLU GLU B . n B 1 277 TYR 277 267 267 TYR TYR B . n B 1 278 THR 278 268 268 THR THR B . n B 1 279 LEU 279 269 269 LEU LEU B . n B 1 280 THR 280 270 270 THR THR B . n B 1 281 SER 281 271 271 SER SER B . n B 1 282 ALA 282 272 272 ALA ALA B . n B 1 283 ASP 283 273 273 ASP ASP B . n B 1 284 TYR 284 274 274 TYR TYR B . n B 1 285 VAL 285 275 275 VAL VAL B . n B 1 286 PHE 286 276 276 PHE PHE B . n B 1 287 GLN 287 277 277 GLN GLN B . n B 1 288 GLU 288 278 278 GLU GLU B . n B 1 289 SER 289 279 279 SER SER B . n B 1 290 TYR 290 279 279 TYR TYR B A n B 1 291 SER 291 279 279 SER SER B B n B 1 292 SER 292 279 279 SER SER B C n B 1 293 LYS 293 279 279 LYS LYS B D n B 1 294 LYS 294 280 280 LYS LYS B . n B 1 295 LEU 295 281 281 LEU LEU B . n B 1 296 CYS 296 282 282 CYS CYS B . n B 1 297 THR 297 283 283 THR THR B . n B 1 298 LEU 298 284 284 LEU LEU B . n B 1 299 ALA 299 285 285 ALA ALA B . n B 1 300 ILE 300 286 286 ILE ILE B . n B 1 301 HIS 301 287 287 HIS HIS B . n B 1 302 ALA 302 288 288 ALA ALA B . n B 1 303 MET 303 289 289 MET MET B . n B 1 304 ASP 304 290 290 ASP ASP B . n B 1 305 ILE 305 291 291 ILE ILE B . n B 1 306 PRO 306 292 292 PRO PRO B . n B 1 307 PRO 307 293 293 PRO PRO B . n B 1 308 PRO 308 294 294 PRO PRO B . n B 1 309 THR 309 295 295 THR THR B . n B 1 310 GLY 310 296 296 GLY GLY B . n B 1 311 PRO 311 297 297 PRO PRO B . n B 1 312 THR 312 298 298 THR THR B . n B 1 313 TRP 313 299 299 TRP TRP B . n B 1 314 ALA 314 300 300 ALA ALA B . n B 1 315 LEU 315 301 301 LEU LEU B . n B 1 316 GLY 316 302 302 GLY GLY B . n B 1 317 ALA 317 303 303 ALA ALA B . n B 1 318 THR 318 304 304 THR THR B . n B 1 319 PHE 319 305 305 PHE PHE B . n B 1 320 ILE 320 306 306 ILE ILE B . n B 1 321 ARG 321 307 307 ARG ARG B . n B 1 322 LYS 322 308 308 LYS LYS B . n B 1 323 PHE 323 309 309 PHE PHE B . n B 1 324 TYR 324 310 310 TYR TYR B . n B 1 325 THR 325 311 311 THR THR B . n B 1 326 GLU 326 312 312 GLU GLU B . n B 1 327 PHE 327 313 313 PHE PHE B . n B 1 328 ASP 328 314 314 ASP ASP B . n B 1 329 ARG 329 315 315 ARG ARG B . n B 1 330 ARG 330 316 316 ARG ARG B . n B 1 331 ASN 331 317 317 ASN ASN B . n B 1 332 ASN 332 318 318 ASN ASN B . n B 1 333 ARG 333 319 319 ARG ARG B . n B 1 334 ILE 334 320 320 ILE ILE B . n B 1 335 GLY 335 321 321 GLY GLY B . n B 1 336 PHE 336 322 322 PHE PHE B . n B 1 337 ALA 337 323 323 ALA ALA B . n B 1 338 LEU 338 324 324 LEU LEU B . n B 1 339 ALA 339 325 325 ALA ALA B . n B 1 340 ARG 340 326 326 ARG ARG B . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code C 2 NAG 1 367 367 NAG NAG A . D 3 S52 1 327 327 S52 S52 A . E 2 NAG 1 367 367 NAG NAG B . F 3 S52 1 327 327 S52 S52 B . G 4 GOL 1 328 328 GOL GOL B . H 5 HOH 1 328 328 HOH HOH A . H 5 HOH 2 329 329 HOH HOH A . H 5 HOH 3 330 330 HOH HOH A . H 5 HOH 4 331 331 HOH HOH A . H 5 HOH 5 332 332 HOH HOH A . H 5 HOH 6 333 333 HOH HOH A . H 5 HOH 7 334 334 HOH HOH A . H 5 HOH 8 335 335 HOH HOH A . H 5 HOH 9 336 336 HOH HOH A . H 5 HOH 10 337 337 HOH HOH A . H 5 HOH 11 338 338 HOH HOH A . H 5 HOH 12 339 339 HOH HOH A . H 5 HOH 13 340 340 HOH HOH A . H 5 HOH 14 341 341 HOH HOH A . H 5 HOH 15 342 342 HOH HOH A . H 5 HOH 16 343 343 HOH HOH A . H 5 HOH 17 344 344 HOH HOH A . H 5 HOH 18 345 345 HOH HOH A . H 5 HOH 19 346 346 HOH HOH A . H 5 HOH 20 347 347 HOH HOH A . H 5 HOH 21 348 348 HOH HOH A . H 5 HOH 22 349 349 HOH HOH A . H 5 HOH 23 350 350 HOH HOH A . H 5 HOH 24 351 351 HOH HOH A . H 5 HOH 25 352 352 HOH HOH A . H 5 HOH 26 353 353 HOH HOH A . H 5 HOH 27 354 354 HOH HOH A . H 5 HOH 28 355 355 HOH HOH A . H 5 HOH 29 356 356 HOH HOH A . H 5 HOH 30 357 357 HOH HOH A . H 5 HOH 31 358 358 HOH HOH A . H 5 HOH 32 359 359 HOH HOH A . H 5 HOH 33 360 360 HOH HOH A . H 5 HOH 34 361 361 HOH HOH A . H 5 HOH 35 362 362 HOH HOH A . H 5 HOH 36 363 363 HOH HOH A . H 5 HOH 37 364 364 HOH HOH A . H 5 HOH 38 365 365 HOH HOH A . H 5 HOH 39 366 366 HOH HOH A . H 5 HOH 40 368 368 HOH HOH A . H 5 HOH 41 369 369 HOH HOH A . H 5 HOH 42 370 370 HOH HOH A . H 5 HOH 43 371 371 HOH HOH A . H 5 HOH 44 372 372 HOH HOH A . H 5 HOH 45 373 373 HOH HOH A . H 5 HOH 46 374 374 HOH HOH A . H 5 HOH 47 375 375 HOH HOH A . H 5 HOH 48 376 376 HOH HOH A . H 5 HOH 49 377 377 HOH HOH A . H 5 HOH 50 378 378 HOH HOH A . H 5 HOH 51 379 379 HOH HOH A . H 5 HOH 52 380 380 HOH HOH A . H 5 HOH 53 381 381 HOH HOH A . H 5 HOH 54 382 382 HOH HOH A . H 5 HOH 55 383 383 HOH HOH A . H 5 HOH 56 384 384 HOH HOH A . H 5 HOH 57 385 385 HOH HOH A . H 5 HOH 58 386 386 HOH HOH A . H 5 HOH 59 387 387 HOH HOH A . H 5 HOH 60 388 388 HOH HOH A . H 5 HOH 61 389 389 HOH HOH A . H 5 HOH 62 390 390 HOH HOH A . H 5 HOH 63 391 391 HOH HOH A . H 5 HOH 64 392 392 HOH HOH A . H 5 HOH 65 393 393 HOH HOH A . H 5 HOH 66 394 394 HOH HOH A . H 5 HOH 67 395 395 HOH HOH A . H 5 HOH 68 396 396 HOH HOH A . H 5 HOH 69 397 397 HOH HOH A . H 5 HOH 70 398 398 HOH HOH A . H 5 HOH 71 399 399 HOH HOH A . H 5 HOH 72 400 400 HOH HOH A . H 5 HOH 73 401 401 HOH HOH A . H 5 HOH 74 402 402 HOH HOH A . H 5 HOH 75 403 403 HOH HOH A . H 5 HOH 76 404 404 HOH HOH A . H 5 HOH 77 405 405 HOH HOH A . H 5 HOH 78 406 406 HOH HOH A . H 5 HOH 79 407 407 HOH HOH A . H 5 HOH 80 408 408 HOH HOH A . H 5 HOH 81 409 409 HOH HOH A . H 5 HOH 82 410 410 HOH HOH A . H 5 HOH 83 411 411 HOH HOH A . H 5 HOH 84 412 412 HOH HOH A . H 5 HOH 85 413 413 HOH HOH A . I 5 HOH 1 329 329 HOH HOH B . I 5 HOH 2 330 330 HOH HOH B . I 5 HOH 3 331 331 HOH HOH B . I 5 HOH 4 332 332 HOH HOH B . I 5 HOH 5 333 333 HOH HOH B . I 5 HOH 6 334 334 HOH HOH B . I 5 HOH 7 335 335 HOH HOH B . I 5 HOH 8 336 336 HOH HOH B . I 5 HOH 9 337 337 HOH HOH B . I 5 HOH 10 338 338 HOH HOH B . I 5 HOH 11 339 339 HOH HOH B . I 5 HOH 12 340 340 HOH HOH B . I 5 HOH 13 341 341 HOH HOH B . I 5 HOH 14 342 342 HOH HOH B . I 5 HOH 15 343 343 HOH HOH B . I 5 HOH 16 344 344 HOH HOH B . I 5 HOH 17 345 345 HOH HOH B . I 5 HOH 18 346 346 HOH HOH B . I 5 HOH 19 347 347 HOH HOH B . I 5 HOH 20 348 348 HOH HOH B . I 5 HOH 21 349 349 HOH HOH B . I 5 HOH 22 350 350 HOH HOH B . I 5 HOH 23 351 351 HOH HOH B . I 5 HOH 24 352 352 HOH HOH B . I 5 HOH 25 353 353 HOH HOH B . I 5 HOH 26 354 354 HOH HOH B . I 5 HOH 27 355 355 HOH HOH B . I 5 HOH 28 356 356 HOH HOH B . I 5 HOH 29 357 357 HOH HOH B . I 5 HOH 30 358 358 HOH HOH B . I 5 HOH 31 359 359 HOH HOH B . I 5 HOH 32 360 360 HOH HOH B . I 5 HOH 33 361 361 HOH HOH B . I 5 HOH 34 362 362 HOH HOH B . I 5 HOH 35 363 363 HOH HOH B . I 5 HOH 36 364 364 HOH HOH B . I 5 HOH 37 365 365 HOH HOH B . I 5 HOH 38 366 366 HOH HOH B . I 5 HOH 39 368 368 HOH HOH B . I 5 HOH 40 369 369 HOH HOH B . I 5 HOH 41 370 370 HOH HOH B . I 5 HOH 42 371 371 HOH HOH B . I 5 HOH 43 372 372 HOH HOH B . I 5 HOH 44 373 373 HOH HOH B . I 5 HOH 45 374 374 HOH HOH B . I 5 HOH 46 375 375 HOH HOH B . I 5 HOH 47 376 376 HOH HOH B . I 5 HOH 48 377 377 HOH HOH B . I 5 HOH 49 378 378 HOH HOH B . I 5 HOH 50 379 379 HOH HOH B . I 5 HOH 51 380 380 HOH HOH B . I 5 HOH 52 381 381 HOH HOH B . I 5 HOH 53 382 382 HOH HOH B . I 5 HOH 54 383 383 HOH HOH B . I 5 HOH 55 384 384 HOH HOH B . I 5 HOH 56 385 385 HOH HOH B . I 5 HOH 57 386 386 HOH HOH B . I 5 HOH 58 387 387 HOH HOH B . I 5 HOH 59 388 388 HOH HOH B . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 B ASN 75 B ASN 67 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 75 A ASN 67 ? ASN 'GLYCOSYLATION SITE' # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_defined_assembly ? monomeric 1 2 author_defined_assembly ? monomeric 1 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,C,D,H 2 1 B,E,F,G,I # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2010-10-27 2 'Structure model' 1 1 2011-07-13 3 'Structure model' 1 2 2017-11-08 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Version format compliance' 2 3 'Structure model' 'Refinement description' # _pdbx_audit_revision_category.ordinal 1 _pdbx_audit_revision_category.revision_ordinal 3 _pdbx_audit_revision_category.data_content_type 'Structure model' _pdbx_audit_revision_category.category software # loop_ _software.pdbx_ordinal _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id 1 DENZO . ? package 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data reduction' http://www.hkl-xray.com/ ? ? 2 SCALEPACK . ? package 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data scaling' http://www.hkl-xray.com/ ? ? 3 BUSTER-TNT . ? program 'Gerard Bricogne' buster-develop@GlobalPhasing.com refinement http://www.globalphasing.com/buster/ ? ? 4 PDB_EXTRACT 3.10 'June 10, 2010' package PDB deposit@deposit.rcsb.org 'data extraction' http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? 5 CrystalClear . ? ? ? ? 'data collection' ? ? ? 6 BUSTER 2.9.5 ? ? ? ? refinement ? ? ? # 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 ASN A 67 ? ? -138.60 -65.09 2 1 ASP A 149 ? ? -84.27 49.99 3 1 GLU A 160 ? ? -78.99 -94.29 4 1 LEU A 161 ? ? 85.02 109.83 5 1 ASP A 208 ? ? 85.23 10.71 6 1 ARG A 240 ? ? -121.57 -169.30 7 1 ALA A 285 ? ? -87.91 37.37 8 1 ASN B 67 ? ? -138.72 -64.06 9 1 ASP B 149 ? ? -79.52 47.97 10 1 ASP B 158 ? ? 38.01 89.82 11 1 ASP B 208 ? ? 87.71 9.49 12 1 ARG B 240 ? ? -69.74 -70.75 13 1 LEU B 242 ? ? -134.88 -52.13 14 1 ALA B 285 ? ? -87.90 39.82 # 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 LEU -5 ? A LEU 1 2 1 Y 1 A THR -4 ? A THR 2 3 1 Y 1 A LEU -3 ? A LEU 3 4 1 Y 1 B LEU -5 ? B LEU 1 5 1 Y 1 B THR -4 ? B THR 2 6 1 Y 1 B LEU -3 ? B LEU 3 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 '2-phenoxy-1-phenyl-3-(piperazin-1-ylcarbonyl)-1H-indole' S52 4 GLYCEROL GOL 5 water HOH #