data_1T7Y # _entry.id 1T7Y # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.286 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 1T7Y RCSB RCSB022424 WWPDB D_1000022424 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 1ZAG . unspecified PDB 1t7v . unspecified PDB 1t7w . unspecified PDB 1t7x . unspecified PDB 1t7z . unspecified PDB 1t80 . unspecified # _pdbx_database_status.entry_id 1T7Y _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.recvd_initial_deposition_date 2004-05-11 _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.SG_entry . _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_mr ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Delker, S.L.' 1 'West Jr., A.P.' 2 'McDermott, L.' 3 'Kennedy, M.W.' 4 'Bjorkman, P.J.' 5 # loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.journal_id_ASTM _citation.country _citation.journal_id_ISSN _citation.journal_id_CSD _citation.book_publisher _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary 'Crystallographic studies of ligand binding by Zn-alpha2-glycoprotein.' J.Struct.Biol. 148 205 213 2004 JSBIEM US 1047-8477 0803 ? 15477100 10.1016/j.jsb.2004.04.009 1 'Crystal structure of human ZAG, a fat-depleting factor related to MHC molecules' Science 283 1914 1919 1999 SCIEAS US 0036-8075 0038 ? ? 10.1126/science.283.5409.1914 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Delker, S.L.' 1 primary 'West Jr., A.P.' 2 primary 'McDermott, L.' 3 primary 'Kennedy, M.W.' 4 primary 'Bjorkman, P.J.' 5 1 'Sanchez, L.M.' 6 1 'Chirino, A.J.' 7 1 'Bjorkman, P.J.' 8 # _cell.entry_id 1T7Y _cell.length_a 121.937 _cell.length_b 121.937 _cell.length_c 64.904 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.pdbx_unique_axis ? _cell.Z_PDB 8 # _symmetry.entry_id 1T7Y _symmetry.space_group_name_H-M 'P 43 21 2' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.Int_Tables_number 96 _symmetry.cell_setting ? _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 Zinc-alpha-2-glycoprotein 32185.953 1 ? 'N89K, N92T' ? ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 3 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'Zn-alpha-2-glycoprotein, Zn-alpha-2-GP' # _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 ;QENQDGRYSLTYIYTGLSKHVEDVPAFQALGSLNDLQFFRYNSKDRKSQPMGLWRQVEGMEDWKQDSQLQKAREDIFMET LKDIVEYYKDSTGSHVLQGRFGCEIENNRSSGAFWKYYYDGKDYIEFNKEIPAWVPFDPAAQITKQKWEAEPVYVQRAKA YLEEECPATLRKYLKYSKNILDRQDPPSVVVTSHQAPGEKKKLKCLAYDFYPGKIDVHWTRAGEVQEPELRGDVLHNGNG TYQSWVVVAVPPQDTAPYSCHVQHSSLAQPLVVPWEAS ; _entity_poly.pdbx_seq_one_letter_code_can ;QENQDGRYSLTYIYTGLSKHVEDVPAFQALGSLNDLQFFRYNSKDRKSQPMGLWRQVEGMEDWKQDSQLQKAREDIFMET LKDIVEYYKDSTGSHVLQGRFGCEIENNRSSGAFWKYYYDGKDYIEFNKEIPAWVPFDPAAQITKQKWEAEPVYVQRAKA YLEEECPATLRKYLKYSKNILDRQDPPSVVVTSHQAPGEKKKLKCLAYDFYPGKIDVHWTRAGEVQEPELRGDVLHNGNG TYQSWVVVAVPPQDTAPYSCHVQHSSLAQPLVVPWEAS ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLN n 1 2 GLU n 1 3 ASN n 1 4 GLN n 1 5 ASP n 1 6 GLY n 1 7 ARG n 1 8 TYR n 1 9 SER n 1 10 LEU n 1 11 THR n 1 12 TYR n 1 13 ILE n 1 14 TYR n 1 15 THR n 1 16 GLY n 1 17 LEU n 1 18 SER n 1 19 LYS n 1 20 HIS n 1 21 VAL n 1 22 GLU n 1 23 ASP n 1 24 VAL n 1 25 PRO n 1 26 ALA n 1 27 PHE n 1 28 GLN n 1 29 ALA n 1 30 LEU n 1 31 GLY n 1 32 SER n 1 33 LEU n 1 34 ASN n 1 35 ASP n 1 36 LEU n 1 37 GLN n 1 38 PHE n 1 39 PHE n 1 40 ARG n 1 41 TYR n 1 42 ASN n 1 43 SER n 1 44 LYS n 1 45 ASP n 1 46 ARG n 1 47 LYS n 1 48 SER n 1 49 GLN n 1 50 PRO n 1 51 MET n 1 52 GLY n 1 53 LEU n 1 54 TRP n 1 55 ARG n 1 56 GLN n 1 57 VAL n 1 58 GLU n 1 59 GLY n 1 60 MET n 1 61 GLU n 1 62 ASP n 1 63 TRP n 1 64 LYS n 1 65 GLN n 1 66 ASP n 1 67 SER n 1 68 GLN n 1 69 LEU n 1 70 GLN n 1 71 LYS n 1 72 ALA n 1 73 ARG n 1 74 GLU n 1 75 ASP n 1 76 ILE n 1 77 PHE n 1 78 MET n 1 79 GLU n 1 80 THR n 1 81 LEU n 1 82 LYS n 1 83 ASP n 1 84 ILE n 1 85 VAL n 1 86 GLU n 1 87 TYR n 1 88 TYR n 1 89 LYS n 1 90 ASP n 1 91 SER n 1 92 THR n 1 93 GLY n 1 94 SER n 1 95 HIS n 1 96 VAL n 1 97 LEU n 1 98 GLN n 1 99 GLY n 1 100 ARG n 1 101 PHE n 1 102 GLY n 1 103 CYS n 1 104 GLU n 1 105 ILE n 1 106 GLU n 1 107 ASN n 1 108 ASN n 1 109 ARG n 1 110 SER n 1 111 SER n 1 112 GLY n 1 113 ALA n 1 114 PHE n 1 115 TRP n 1 116 LYS n 1 117 TYR n 1 118 TYR n 1 119 TYR n 1 120 ASP n 1 121 GLY n 1 122 LYS n 1 123 ASP n 1 124 TYR n 1 125 ILE n 1 126 GLU n 1 127 PHE n 1 128 ASN n 1 129 LYS n 1 130 GLU n 1 131 ILE n 1 132 PRO n 1 133 ALA n 1 134 TRP n 1 135 VAL n 1 136 PRO n 1 137 PHE n 1 138 ASP n 1 139 PRO n 1 140 ALA n 1 141 ALA n 1 142 GLN n 1 143 ILE n 1 144 THR n 1 145 LYS n 1 146 GLN n 1 147 LYS n 1 148 TRP n 1 149 GLU n 1 150 ALA n 1 151 GLU n 1 152 PRO n 1 153 VAL n 1 154 TYR n 1 155 VAL n 1 156 GLN n 1 157 ARG n 1 158 ALA n 1 159 LYS n 1 160 ALA n 1 161 TYR n 1 162 LEU n 1 163 GLU n 1 164 GLU n 1 165 GLU n 1 166 CYS n 1 167 PRO n 1 168 ALA n 1 169 THR n 1 170 LEU n 1 171 ARG n 1 172 LYS n 1 173 TYR n 1 174 LEU n 1 175 LYS n 1 176 TYR n 1 177 SER n 1 178 LYS n 1 179 ASN n 1 180 ILE n 1 181 LEU n 1 182 ASP n 1 183 ARG n 1 184 GLN n 1 185 ASP n 1 186 PRO n 1 187 PRO n 1 188 SER n 1 189 VAL n 1 190 VAL n 1 191 VAL n 1 192 THR n 1 193 SER n 1 194 HIS n 1 195 GLN n 1 196 ALA n 1 197 PRO n 1 198 GLY n 1 199 GLU n 1 200 LYS n 1 201 LYS n 1 202 LYS n 1 203 LEU n 1 204 LYS n 1 205 CYS n 1 206 LEU n 1 207 ALA n 1 208 TYR n 1 209 ASP n 1 210 PHE n 1 211 TYR n 1 212 PRO n 1 213 GLY n 1 214 LYS n 1 215 ILE n 1 216 ASP n 1 217 VAL n 1 218 HIS n 1 219 TRP n 1 220 THR n 1 221 ARG n 1 222 ALA n 1 223 GLY n 1 224 GLU n 1 225 VAL n 1 226 GLN n 1 227 GLU n 1 228 PRO n 1 229 GLU n 1 230 LEU n 1 231 ARG n 1 232 GLY n 1 233 ASP n 1 234 VAL n 1 235 LEU n 1 236 HIS n 1 237 ASN n 1 238 GLY n 1 239 ASN n 1 240 GLY n 1 241 THR n 1 242 TYR n 1 243 GLN n 1 244 SER n 1 245 TRP n 1 246 VAL n 1 247 VAL n 1 248 VAL n 1 249 ALA n 1 250 VAL n 1 251 PRO n 1 252 PRO n 1 253 GLN n 1 254 ASP n 1 255 THR n 1 256 ALA n 1 257 PRO n 1 258 TYR n 1 259 SER n 1 260 CYS n 1 261 HIS n 1 262 VAL n 1 263 GLN n 1 264 HIS n 1 265 SER n 1 266 SER n 1 267 LEU n 1 268 ALA n 1 269 GLN n 1 270 PRO n 1 271 LEU n 1 272 VAL n 1 273 VAL n 1 274 PRO n 1 275 TRP n 1 276 GLU n 1 277 ALA n 1 278 SER 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 Homo _entity_src_gen.pdbx_gene_src_gene 'AZGP1, ZAG, ZNGP1' _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Homo sapiens' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name 'cabbage looper' _entity_src_gen.pdbx_host_org_scientific_name 'Trichoplusia ni' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 7111 _entity_src_gen.host_org_genus Trichoplusia _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type baculovirus _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pVL1393 _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code ZA2G_HUMAN _struct_ref.pdbx_db_accession P25311 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;QENQDGRYSLTYIYTGLSKHVEDVPAFQALGSLNDLQFFRYNSKDRKSQPMGLWRQVEGMEDWKQDSQLQKAREDIFMET LKDIVEYYNDSNGSHVLQGRFGCEIENNRSSGAFWKYYYDGKDYIEFNKEIPAWVPFDPAAQITKQKWEAEPVYVQRAKA YLEEECPATLRKYLKYSKNILDRQDPPSVVVTSHQAPGEKKKLKCLAYDFYPGKIDVHWTRAGEVQEPELRGDVLHNGNG TYQSWVVVAVPPQDTAPYSCHVQHSSLAQPLVVPWEAS ; _struct_ref.pdbx_align_begin 18 _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 1T7Y _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 278 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession P25311 _struct_ref_seq.db_align_beg 18 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 295 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 1 _struct_ref_seq.pdbx_auth_seq_align_end 278 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 1T7Y LYS A 89 ? UNP P25311 ASN 106 ENGINEERED 89 1 1 1T7Y THR A 92 ? UNP P25311 ASN 109 ENGINEERED 92 2 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 1T7Y _exptl.crystals_number 1 _exptl.method 'X-RAY DIFFRACTION' # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_percent_sol 67.18 _exptl_crystal.density_Matthews 3.75 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method MICROBATCH _exptl_crystal_grow.pH 7.5 _exptl_crystal_grow.temp 298.0 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pdbx_details 'Ammonium sulfate, PEG 200, HEPES, pH 7.5, Microbatch, temperature 298.0K' _exptl_crystal_grow.pdbx_pH_range . # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'ADSC QUANTUM 315' _diffrn_detector.pdbx_collection_date 2003-09-28 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.monochromator 'Double crystal Si(111)' _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.000 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'ALS BEAMLINE 8.2.2' _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.000 _diffrn_source.pdbx_synchrotron_site ALS _diffrn_source.pdbx_synchrotron_beamline 8.2.2 # _reflns.percent_possible_obs 97.400 _reflns.entry_id 1T7Y _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.d_resolution_high 2.8 _reflns.d_resolution_low 20.0 _reflns.number_all ? _reflns.number_obs 12197 _reflns.pdbx_Rmerge_I_obs 0.078 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 12.3 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 3.1 _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 2.8 _reflns_shell.d_res_low 2.9 _reflns_shell.percent_possible_obs 95.500 _reflns_shell.Rmerge_I_obs 0.441 _reflns_shell.percent_possible_all 94.2 _reflns_shell.meanI_over_sigI_obs 2.4 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.pdbx_redundancy ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 1T7Y _refine.ls_number_reflns_all 12500 _refine.ls_number_reflns_obs 12184 _refine.ls_percent_reflns_obs 97.5 _refine.ls_d_res_high 2.80 _refine.ls_d_res_low 20.0 _refine.B_iso_min 3.70 _refine.B_iso_max 199.52 _refine.B_iso_mean 51.35 _refine.occupancy_min 1.00 _refine.occupancy_max 1.00 _refine.aniso_B[1][1] 1.79 _refine.aniso_B[2][2] 1.79 _refine.aniso_B[3][3] -3.59 _refine.aniso_B[1][2] 0.00 _refine.aniso_B[1][3] 0.00 _refine.aniso_B[2][3] 0.00 _refine.solvent_model_param_bsol 20.6969 _refine.solvent_model_param_ksol 0.313838 _refine.solvent_model_details 'CNS bulk solvent model used' _refine.ls_R_factor_R_work 0.231 _refine.ls_R_factor_R_free 0.266 _refine.ls_R_factor_R_free_error 0.011 _refine.ls_number_reflns_R_free 624 _refine.ls_percent_reflns_R_free 5.1 _refine.details ? _refine.pdbx_ls_sigma_F ? _refine.pdbx_ls_sigma_I ? _refine.ls_R_factor_all ? _refine.ls_R_factor_obs ? _refine.ls_redundancy_reflns_obs ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.ls_R_factor_R_free_error_details ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model 'PDB Entry 1T7V' _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.pdbx_R_Free_selection_details Random _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_stereochemistry_target_values 'Engh & Huber' _refine.pdbx_isotropic_thermal_model ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.pdbx_solvent_vdw_probe_radii ? _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_SU_B ? _refine.overall_SU_ML ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_data_cutoff_high_rms_absF ? _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_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_phase_error ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_analyze.entry_id 1T7Y _refine_analyze.Luzzati_d_res_low_obs 5.00 _refine_analyze.Luzzati_coordinate_error_obs 0.37 _refine_analyze.Luzzati_sigma_a_obs 0.51 _refine_analyze.Luzzati_coordinate_error_free 0.43 _refine_analyze.Luzzati_sigma_a_free 0.67 _refine_analyze.Luzzati_d_res_low_free ? _refine_analyze.number_disordered_residues ? _refine_analyze.occupancy_sum_non_hydrogen ? _refine_analyze.occupancy_sum_hydrogen ? _refine_analyze.pdbx_Luzzati_d_res_high_obs ? _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 2232 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 42 _refine_hist.number_atoms_solvent 0 _refine_hist.number_atoms_total 2274 _refine_hist.d_res_high 2.80 _refine_hist.d_res_low 20.0 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.number _refine_ls_restr.weight _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function x_bond_d 0.007 . ? ? 'X-RAY DIFFRACTION' ? x_angle_deg 1.3 . ? ? 'X-RAY DIFFRACTION' ? x_torsion_deg 24.1 . ? ? 'X-RAY DIFFRACTION' ? x_torsion_impr_deg 0.81 . ? ? 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.number_reflns_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_work _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.number_reflns_R_free _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.pdbx_refine_id _refine_ls_shell.R_factor_all 2.80 2.90 1222 1147 1079 93.8 0.392 0.481 0.058 68 5.9 . . 'X-RAY DIFFRACTION' . 2.90 3.02 1222 1164 1115 95.3 0.336 0.424 0.061 49 4.2 . . 'X-RAY DIFFRACTION' . 3.02 3.15 1225 1180 1126 96.3 0.292 0.347 0.047 54 4.6 . . 'X-RAY DIFFRACTION' . 3.15 3.32 1235 1199 1138 97.1 0.284 0.26 0.033 61 5.1 . . 'X-RAY DIFFRACTION' . 3.32 3.52 1222 1199 1130 98.1 0.264 0.297 0.036 69 5.8 . . 'X-RAY DIFFRACTION' . 3.52 3.79 1244 1230 1169 98.9 0.215 0.275 0.035 61 5.0 . . 'X-RAY DIFFRACTION' . 3.79 4.17 1244 1235 1176 99.2 0.218 0.268 0.035 59 4.8 . . 'X-RAY DIFFRACTION' . 4.17 4.77 1265 1254 1193 99.1 0.157 0.187 0.024 61 4.9 . . 'X-RAY DIFFRACTION' . 4.77 5.98 1282 1280 1207 99.8 0.182 0.21 0.025 73 5.7 . . 'X-RAY DIFFRACTION' . 5.98 19.90 1350 1296 1227 96.0 0.227 0.247 0.030 69 5.3 . . 'X-RAY DIFFRACTION' . # _struct.entry_id 1T7Y _struct.title 'Zn-alpha-2-glycoprotein; baculo-ZAG PEG 200, no glycerol' _struct.pdbx_descriptor Zinc-alpha-2-glycoprotein _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1T7Y _struct_keywords.pdbx_keywords 'LIPID BINDING PROTEIN' _struct_keywords.text 'MHC class I homolog, LIPID BINDING PROTEIN' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 2 ? D N N 2 ? # _struct_biol.id 1 _struct_biol.pdbx_parent_biol_id ? _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLY A 52 ? VAL A 57 ? GLY A 52 VAL A 57 5 ? 6 HELX_P HELX_P2 2 ASP A 62 ? LYS A 89 ? ASP A 62 LYS A 89 1 ? 28 HELX_P HELX_P3 3 PRO A 139 ? GLU A 149 ? PRO A 139 GLU A 149 1 ? 11 HELX_P HELX_P4 4 PRO A 152 ? GLU A 164 ? PRO A 152 GLU A 164 1 ? 13 HELX_P HELX_P5 5 GLU A 164 ? ASP A 182 ? GLU A 164 ASP A 182 1 ? 19 # _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 205 SG ? ? ? 1_555 A CYS 260 SG ? ? A CYS 205 A CYS 260 1_555 ? ? ? ? ? ? ? 2.024 ? covale1 covale ? ? A ASN 108 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 108 A NAG 310 1_555 ? ? ? ? ? ? ? 1.454 ? covale2 covale ? ? A ASN 239 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 239 A NAG 320 1_555 ? ? ? ? ? ? ? 1.453 ? covale3 covale ? ? C NAG . O4 ? ? ? 1_555 D NAG . C1 ? ? A NAG 320 A NAG 321 1_555 ? ? ? ? ? ? ? 1.386 ? # 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 ILE 131 A . ? ILE 131 A PRO 132 A ? PRO 132 A 1 -0.30 2 TYR 211 A . ? TYR 211 A PRO 212 A ? PRO 212 A 1 -0.22 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 8 ? B ? 4 ? C ? 4 ? # 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 B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? 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 GLN A 49 ? PRO A 50 ? GLN A 49 PRO A 50 A 2 LEU A 36 ? ASN A 42 ? LEU A 36 ASN A 42 A 3 PHE A 27 ? LEU A 33 ? PHE A 27 LEU A 33 A 4 ARG A 7 ? LEU A 17 ? ARG A 7 LEU A 17 A 5 VAL A 96 ? GLU A 106 ? VAL A 96 GLU A 106 A 6 ARG A 109 ? TYR A 119 ? ARG A 109 TYR A 119 A 7 LYS A 122 ? ASN A 128 ? LYS A 122 ASN A 128 A 8 ALA A 133 ? PRO A 136 ? ALA A 133 PRO A 136 B 1 SER A 188 ? GLN A 195 ? SER A 188 GLN A 195 B 2 LYS A 201 ? PHE A 210 ? LYS A 201 PHE A 210 B 3 THR A 241 ? VAL A 250 ? THR A 241 VAL A 250 B 4 LEU A 230 ? HIS A 236 ? LEU A 230 HIS A 236 C 1 GLU A 224 ? VAL A 225 ? GLU A 224 VAL A 225 C 2 ASP A 216 ? ARG A 221 ? ASP A 216 ARG A 221 C 3 TYR A 258 ? GLN A 263 ? TYR A 258 GLN A 263 C 4 LEU A 271 ? PRO A 274 ? LEU A 271 PRO A 274 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 O GLN A 49 ? O GLN A 49 N ARG A 40 ? N ARG A 40 A 2 3 O TYR A 41 ? O TYR A 41 N ALA A 29 ? N ALA A 29 A 3 4 O SER A 32 ? O SER A 32 N THR A 11 ? N THR A 11 A 4 5 N GLY A 16 ? N GLY A 16 O LEU A 97 ? O LEU A 97 A 5 6 N GLN A 98 ? N GLN A 98 O TYR A 118 ? O TYR A 118 A 6 7 N TYR A 117 ? N TYR A 117 O TYR A 124 ? O TYR A 124 A 7 8 N GLU A 126 ? N GLU A 126 O VAL A 135 ? O VAL A 135 B 1 2 N THR A 192 ? N THR A 192 O LYS A 204 ? O LYS A 204 B 2 3 N ALA A 207 ? N ALA A 207 O SER A 244 ? O SER A 244 B 3 4 O THR A 241 ? O THR A 241 N HIS A 236 ? N HIS A 236 C 1 2 O GLU A 224 ? O GLU A 224 N ARG A 221 ? N ARG A 221 C 2 3 N HIS A 218 ? N HIS A 218 O HIS A 261 ? O HIS A 261 C 3 4 N VAL A 262 ? N VAL A 262 O LEU A 271 ? O LEU A 271 # 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 ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG A 310' AC2 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG A 320' AC3 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG A 321' # 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 1 ASN A 108 ? ASN A 108 . ? 1_555 ? 2 AC2 5 ASP A 209 ? ASP A 209 . ? 1_555 ? 3 AC2 5 HIS A 236 ? HIS A 236 . ? 1_555 ? 4 AC2 5 ASN A 239 ? ASN A 239 . ? 1_555 ? 5 AC2 5 GLN A 243 ? GLN A 243 . ? 1_555 ? 6 AC2 5 NAG D . ? NAG A 321 . ? 1_555 ? 7 AC3 2 GLN A 243 ? GLN A 243 . ? 1_555 ? 8 AC3 2 NAG C . ? NAG A 320 . ? 1_555 ? # _atom_sites.entry_id 1T7Y _atom_sites.fract_transf_matrix[1][1] 0.008201 _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] 0.008201 _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] 0.015407 _atom_sites.fract_transf_vector[1] 0.000000 _atom_sites.fract_transf_vector[2] 0.000000 _atom_sites.fract_transf_vector[3] 0.000000 # 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 . ASP A 1 5 ? 18.533 77.435 0.962 1.00 94.87 ? 5 ASP A N 1 ATOM 2 C CA . ASP A 1 5 ? 18.242 77.891 2.353 1.00 93.05 ? 5 ASP A CA 1 ATOM 3 C C . ASP A 1 5 ? 18.270 76.722 3.329 1.00 91.48 ? 5 ASP A C 1 ATOM 4 O O . ASP A 1 5 ? 18.485 75.574 2.937 1.00 97.31 ? 5 ASP A O 1 ATOM 5 C CB . ASP A 1 5 ? 16.873 78.572 2.409 1.00 116.85 ? 5 ASP A CB 1 ATOM 6 C CG . ASP A 1 5 ? 16.837 79.876 1.634 1.00 123.52 ? 5 ASP A CG 1 ATOM 7 O OD1 . ASP A 1 5 ? 17.563 80.814 2.027 1.00 123.37 ? 5 ASP A OD1 1 ATOM 8 O OD2 . ASP A 1 5 ? 16.086 79.961 0.636 1.00 121.29 ? 5 ASP A OD2 1 ATOM 9 N N . GLY A 1 6 ? 18.046 77.020 4.604 1.00 87.18 ? 6 GLY A N 1 ATOM 10 C CA . GLY A 1 6 ? 18.061 75.978 5.611 1.00 73.58 ? 6 GLY A CA 1 ATOM 11 C C . GLY A 1 6 ? 16.788 75.862 6.426 1.00 65.20 ? 6 GLY A C 1 ATOM 12 O O . GLY A 1 6 ? 15.734 76.386 6.053 1.00 58.07 ? 6 GLY A O 1 ATOM 13 N N . ARG A 1 7 ? 16.908 75.166 7.554 1.00 55.84 ? 7 ARG A N 1 ATOM 14 C CA . ARG A 1 7 ? 15.807 74.922 8.475 1.00 53.07 ? 7 ARG A CA 1 ATOM 15 C C . ARG A 1 7 ? 15.689 76.023 9.520 1.00 47.93 ? 7 ARG A C 1 ATOM 16 O O . ARG A 1 7 ? 16.686 76.404 10.133 1.00 43.54 ? 7 ARG A O 1 ATOM 17 C CB . ARG A 1 7 ? 16.038 73.598 9.195 1.00 76.05 ? 7 ARG A CB 1 ATOM 18 C CG . ARG A 1 7 ? 16.034 72.383 8.297 1.00 88.50 ? 7 ARG A CG 1 ATOM 19 C CD . ARG A 1 7 ? 14.666 71.742 8.309 1.00 108.43 ? 7 ARG A CD 1 ATOM 20 N NE . ARG A 1 7 ? 14.306 71.290 9.650 1.00 116.12 ? 7 ARG A NE 1 ATOM 21 C CZ . ARG A 1 7 ? 13.141 70.735 9.966 1.00 121.90 ? 7 ARG A CZ 1 ATOM 22 N NH1 . ARG A 1 7 ? 12.209 70.560 9.034 1.00 117.18 ? 7 ARG A NH1 1 ATOM 23 N NH2 . ARG A 1 7 ? 12.911 70.350 11.215 1.00 120.95 ? 7 ARG A NH2 1 ATOM 24 N N . TYR A 1 8 ? 14.468 76.522 9.721 1.00 29.26 ? 8 TYR A N 1 ATOM 25 C CA . TYR A 1 8 ? 14.193 77.567 10.712 1.00 26.89 ? 8 TYR A CA 1 ATOM 26 C C . TYR A 1 8 ? 12.873 77.233 11.375 1.00 27.54 ? 8 TYR A C 1 ATOM 27 O O . TYR A 1 8 ? 11.967 76.731 10.720 1.00 28.93 ? 8 TYR A O 1 ATOM 28 C CB . TYR A 1 8 ? 14.119 78.943 10.047 1.00 42.13 ? 8 TYR A CB 1 ATOM 29 C CG . TYR A 1 8 ? 15.440 79.363 9.454 1.00 53.99 ? 8 TYR A CG 1 ATOM 30 C CD1 . TYR A 1 8 ? 16.456 79.881 10.255 1.00 49.70 ? 8 TYR A CD1 1 ATOM 31 C CD2 . TYR A 1 8 ? 15.704 79.167 8.097 1.00 48.30 ? 8 TYR A CD2 1 ATOM 32 C CE1 . TYR A 1 8 ? 17.700 80.186 9.714 1.00 49.30 ? 8 TYR A CE1 1 ATOM 33 C CE2 . TYR A 1 8 ? 16.939 79.466 7.550 1.00 56.40 ? 8 TYR A CE2 1 ATOM 34 C CZ . TYR A 1 8 ? 17.931 79.972 8.357 1.00 54.36 ? 8 TYR A CZ 1 ATOM 35 O OH . TYR A 1 8 ? 19.152 80.251 7.795 1.00 51.20 ? 8 TYR A OH 1 ATOM 36 N N . SER A 1 9 ? 12.758 77.513 12.669 1.00 34.70 ? 9 SER A N 1 ATOM 37 C CA . SER A 1 9 ? 11.535 77.201 13.398 1.00 35.06 ? 9 SER A CA 1 ATOM 38 C C . SER A 1 9 ? 11.180 78.242 14.445 1.00 41.02 ? 9 SER A C 1 ATOM 39 O O . SER A 1 9 ? 12.038 78.689 15.197 1.00 43.19 ? 9 SER A O 1 ATOM 40 C CB . SER A 1 9 ? 11.685 75.841 14.075 1.00 30.50 ? 9 SER A CB 1 ATOM 41 O OG . SER A 1 9 ? 12.781 75.847 14.970 1.00 40.17 ? 9 SER A OG 1 ATOM 42 N N . LEU A 1 10 ? 9.909 78.625 14.481 1.00 27.92 ? 10 LEU A N 1 ATOM 43 C CA . LEU A 1 10 ? 9.405 79.593 15.450 1.00 27.51 ? 10 LEU A CA 1 ATOM 44 C C . LEU A 1 10 ? 8.520 78.807 16.405 1.00 33.85 ? 10 LEU A C 1 ATOM 45 O O . LEU A 1 10 ? 7.531 78.207 15.995 1.00 29.87 ? 10 LEU A O 1 ATOM 46 C CB . LEU A 1 10 ? 8.587 80.683 14.755 1.00 25.45 ? 10 LEU A CB 1 ATOM 47 C CG . LEU A 1 10 ? 7.754 81.593 15.668 1.00 25.75 ? 10 LEU A CG 1 ATOM 48 C CD1 . LEU A 1 10 ? 8.659 82.322 16.627 1.00 26.94 ? 10 LEU A CD1 1 ATOM 49 C CD2 . LEU A 1 10 ? 6.966 82.586 14.836 1.00 25.48 ? 10 LEU A CD2 1 ATOM 50 N N . THR A 1 11 ? 8.890 78.799 17.679 1.00 29.05 ? 11 THR A N 1 ATOM 51 C CA . THR A 1 11 ? 8.140 78.069 18.684 1.00 34.57 ? 11 THR A CA 1 ATOM 52 C C . THR A 1 11 ? 7.771 78.935 19.876 1.00 30.95 ? 11 THR A C 1 ATOM 53 O O . THR A 1 11 ? 8.581 79.729 20.358 1.00 29.65 ? 11 THR A O 1 ATOM 54 C CB . THR A 1 11 ? 8.947 76.865 19.197 1.00 24.68 ? 11 THR A CB 1 ATOM 55 O OG1 . THR A 1 11 ? 9.202 75.958 18.115 1.00 30.35 ? 11 THR A OG1 1 ATOM 56 C CG2 . THR A 1 11 ? 8.177 76.136 20.282 1.00 30.56 ? 11 THR A CG2 1 ATOM 57 N N . TYR A 1 12 ? 6.540 78.766 20.346 1.00 28.93 ? 12 TYR A N 1 ATOM 58 C CA . TYR A 1 12 ? 6.023 79.494 21.491 1.00 28.93 ? 12 TYR A CA 1 ATOM 59 C C . TYR A 1 12 ? 5.599 78.506 22.571 1.00 30.63 ? 12 TYR A C 1 ATOM 60 O O . TYR A 1 12 ? 5.110 77.430 22.265 1.00 28.93 ? 12 TYR A O 1 ATOM 61 C CB . TYR A 1 12 ? 4.813 80.305 21.081 1.00 23.01 ? 12 TYR A CB 1 ATOM 62 C CG . TYR A 1 12 ? 5.114 81.397 20.107 1.00 23.53 ? 12 TYR A CG 1 ATOM 63 C CD1 . TYR A 1 12 ? 5.030 81.178 18.735 1.00 26.85 ? 12 TYR A CD1 1 ATOM 64 C CD2 . TYR A 1 12 ? 5.427 82.678 20.555 1.00 29.97 ? 12 TYR A CD2 1 ATOM 65 C CE1 . TYR A 1 12 ? 5.236 82.219 17.826 1.00 32.53 ? 12 TYR A CE1 1 ATOM 66 C CE2 . TYR A 1 12 ? 5.638 83.717 19.668 1.00 27.41 ? 12 TYR A CE2 1 ATOM 67 C CZ . TYR A 1 12 ? 5.534 83.488 18.305 1.00 29.34 ? 12 TYR A CZ 1 ATOM 68 O OH . TYR A 1 12 ? 5.678 84.543 17.434 1.00 30.43 ? 12 TYR A OH 1 ATOM 69 N N . ILE A 1 13 ? 5.768 78.863 23.836 1.00 29.49 ? 13 ILE A N 1 ATOM 70 C CA . ILE A 1 13 ? 5.366 77.969 24.911 1.00 29.49 ? 13 ILE A CA 1 ATOM 71 C C . ILE A 1 13 ? 4.699 78.758 26.029 1.00 29.49 ? 13 ILE A C 1 ATOM 72 O O . ILE A 1 13 ? 5.245 79.746 26.509 1.00 29.49 ? 13 ILE A O 1 ATOM 73 C CB . ILE A 1 13 ? 6.572 77.187 25.481 1.00 17.18 ? 13 ILE A CB 1 ATOM 74 C CG1 . ILE A 1 13 ? 7.174 76.289 24.400 1.00 23.61 ? 13 ILE A CG1 1 ATOM 75 C CG2 . ILE A 1 13 ? 6.134 76.318 26.643 1.00 16.78 ? 13 ILE A CG2 1 ATOM 76 C CD1 . ILE A 1 13 ? 8.292 75.434 24.910 1.00 31.28 ? 13 ILE A CD1 1 ATOM 77 N N . TYR A 1 14 ? 3.505 78.314 26.419 1.00 29.30 ? 14 TYR A N 1 ATOM 78 C CA . TYR A 1 14 ? 2.728 78.946 27.474 1.00 29.30 ? 14 TYR A CA 1 ATOM 79 C C . TYR A 1 14 ? 2.575 78.030 28.684 1.00 30.94 ? 14 TYR A C 1 ATOM 80 O O . TYR A 1 14 ? 2.213 76.860 28.562 1.00 29.30 ? 14 TYR A O 1 ATOM 81 C CB . TYR A 1 14 ? 1.324 79.324 26.978 1.00 16.94 ? 14 TYR A CB 1 ATOM 82 C CG . TYR A 1 14 ? 1.253 80.510 26.043 1.00 17.47 ? 14 TYR A CG 1 ATOM 83 C CD1 . TYR A 1 14 ? 2.379 81.274 25.755 1.00 22.81 ? 14 TYR A CD1 1 ATOM 84 C CD2 . TYR A 1 14 ? 0.060 80.843 25.418 1.00 25.06 ? 14 TYR A CD2 1 ATOM 85 C CE1 . TYR A 1 14 ? 2.312 82.342 24.856 1.00 24.24 ? 14 TYR A CE1 1 ATOM 86 C CE2 . TYR A 1 14 ? -0.018 81.904 24.520 1.00 24.69 ? 14 TYR A CE2 1 ATOM 87 C CZ . TYR A 1 14 ? 1.109 82.652 24.241 1.00 26.19 ? 14 TYR A CZ 1 ATOM 88 O OH . TYR A 1 14 ? 1.027 83.715 23.361 1.00 29.62 ? 14 TYR A OH 1 ATOM 89 N N . THR A 1 15 ? 2.829 78.588 29.858 1.00 28.19 ? 15 THR A N 1 ATOM 90 C CA . THR A 1 15 ? 2.719 77.840 31.083 1.00 28.19 ? 15 THR A CA 1 ATOM 91 C C . THR A 1 15 ? 1.796 78.563 32.042 1.00 28.32 ? 15 THR A C 1 ATOM 92 O O . THR A 1 15 ? 2.037 79.711 32.393 1.00 29.41 ? 15 THR A O 1 ATOM 93 C CB . THR A 1 15 ? 4.085 77.680 31.717 1.00 35.56 ? 15 THR A CB 1 ATOM 94 O OG1 . THR A 1 15 ? 4.905 76.871 30.866 1.00 34.98 ? 15 THR A OG1 1 ATOM 95 C CG2 . THR A 1 15 ? 3.963 77.006 33.058 1.00 35.79 ? 15 THR A CG2 1 ATOM 96 N N . GLY A 1 16 ? 0.730 77.892 32.454 1.00 23.79 ? 16 GLY A N 1 ATOM 97 C CA . GLY A 1 16 ? -0.204 78.505 33.373 1.00 23.79 ? 16 GLY A CA 1 ATOM 98 C C . GLY A 1 16 ? -0.396 77.637 34.604 1.00 26.19 ? 16 GLY A C 1 ATOM 99 O O . GLY A 1 16 ? -0.484 76.407 34.480 1.00 23.79 ? 16 GLY A O 1 ATOM 100 N N . LEU A 1 17 ? -0.454 78.261 35.787 1.00 27.42 ? 17 LEU A N 1 ATOM 101 C CA . LEU A 1 17 ? -0.651 77.534 37.044 1.00 30.86 ? 17 LEU A CA 1 ATOM 102 C C . LEU A 1 17 ? -1.958 77.982 37.690 1.00 36.70 ? 17 LEU A C 1 ATOM 103 O O . LEU A 1 17 ? -2.201 79.185 37.839 1.00 30.49 ? 17 LEU A O 1 ATOM 104 C CB . LEU A 1 17 ? 0.517 77.794 37.993 1.00 28.06 ? 17 LEU A CB 1 ATOM 105 C CG . LEU A 1 17 ? 1.898 77.413 37.449 1.00 34.69 ? 17 LEU A CG 1 ATOM 106 C CD1 . LEU A 1 17 ? 2.975 77.969 38.349 1.00 34.60 ? 17 LEU A CD1 1 ATOM 107 C CD2 . LEU A 1 17 ? 2.016 75.909 37.349 1.00 30.98 ? 17 LEU A CD2 1 ATOM 108 N N . SER A 1 18 ? -2.799 77.023 38.074 1.00 22.57 ? 18 SER A N 1 ATOM 109 C CA . SER A 1 18 ? -4.082 77.357 38.680 1.00 26.46 ? 18 SER A CA 1 ATOM 110 C C . SER A 1 18 ? -3.957 77.969 40.077 1.00 35.64 ? 18 SER A C 1 ATOM 111 O O . SER A 1 18 ? -4.795 78.779 40.466 1.00 32.56 ? 18 SER A O 1 ATOM 112 C CB . SER A 1 18 ? -4.982 76.129 38.744 1.00 32.17 ? 18 SER A CB 1 ATOM 113 O OG . SER A 1 18 ? -4.566 75.244 39.766 1.00 34.72 ? 18 SER A OG 1 ATOM 114 N N . LYS A 1 19 ? -2.921 77.588 40.826 1.00 37.22 ? 19 LYS A N 1 ATOM 115 C CA . LYS A 1 19 ? -2.696 78.123 42.178 1.00 39.53 ? 19 LYS A CA 1 ATOM 116 C C . LYS A 1 19 ? -1.203 78.426 42.387 1.00 33.02 ? 19 LYS A C 1 ATOM 117 O O . LYS A 1 19 ? -0.491 77.703 43.087 1.00 40.11 ? 19 LYS A O 1 ATOM 118 C CB . LYS A 1 19 ? -3.186 77.114 43.225 1.00 40.93 ? 19 LYS A CB 1 ATOM 119 C CG . LYS A 1 19 ? -3.252 77.654 44.643 1.00 57.50 ? 19 LYS A CG 1 ATOM 120 C CD . LYS A 1 19 ? -3.861 76.639 45.602 1.00 58.79 ? 19 LYS A CD 1 ATOM 121 C CE . LYS A 1 19 ? -5.373 76.565 45.471 1.00 68.68 ? 19 LYS A CE 1 ATOM 122 N NZ . LYS A 1 19 ? -5.810 76.216 44.088 1.00 82.05 ? 19 LYS A NZ 1 ATOM 123 N N . HIS A 1 20 ? -0.737 79.509 41.783 1.00 43.02 ? 20 HIS A N 1 ATOM 124 C CA . HIS A 1 20 ? 0.668 79.863 41.868 1.00 41.83 ? 20 HIS A CA 1 ATOM 125 C C . HIS A 1 20 ? 1.119 80.272 43.258 1.00 48.01 ? 20 HIS A C 1 ATOM 126 O O . HIS A 1 20 ? 0.430 81.013 43.953 1.00 41.60 ? 20 HIS A O 1 ATOM 127 C CB . HIS A 1 20 ? 0.983 80.981 40.872 1.00 38.57 ? 20 HIS A CB 1 ATOM 128 C CG . HIS A 1 20 ? 0.525 82.336 41.315 1.00 45.93 ? 20 HIS A CG 1 ATOM 129 N ND1 . HIS A 1 20 ? 1.326 83.191 42.043 1.00 54.10 ? 20 HIS A ND1 1 ATOM 130 C CD2 . HIS A 1 20 ? -0.650 82.984 41.134 1.00 50.72 ? 20 HIS A CD2 1 ATOM 131 C CE1 . HIS A 1 20 ? 0.665 84.308 42.288 1.00 55.95 ? 20 HIS A CE1 1 ATOM 132 N NE2 . HIS A 1 20 ? -0.536 84.209 41.747 1.00 52.93 ? 20 HIS A NE2 1 ATOM 133 N N . VAL A 1 21 ? 2.287 79.763 43.647 1.00 38.67 ? 21 VAL A N 1 ATOM 134 C CA . VAL A 1 21 ? 2.903 80.061 44.931 1.00 40.59 ? 21 VAL A CA 1 ATOM 135 C C . VAL A 1 21 ? 3.620 81.398 44.791 1.00 42.98 ? 21 VAL A C 1 ATOM 136 O O . VAL A 1 21 ? 3.778 81.907 43.686 1.00 36.93 ? 21 VAL A O 1 ATOM 137 C CB . VAL A 1 21 ? 3.936 78.965 45.353 1.00 33.67 ? 21 VAL A CB 1 ATOM 138 C CG1 . VAL A 1 21 ? 3.266 77.609 45.389 1.00 31.72 ? 21 VAL A CG1 1 ATOM 139 C CG2 . VAL A 1 21 ? 5.126 78.940 44.403 1.00 36.94 ? 21 VAL A CG2 1 ATOM 140 N N . GLU A 1 22 ? 4.054 81.958 45.912 1.00 72.90 ? 22 GLU A N 1 ATOM 141 C CA . GLU A 1 22 ? 4.738 83.246 45.927 1.00 74.99 ? 22 GLU A CA 1 ATOM 142 C C . GLU A 1 22 ? 5.992 83.273 45.060 1.00 62.60 ? 22 GLU A C 1 ATOM 143 O O . GLU A 1 22 ? 6.816 82.356 45.119 1.00 72.17 ? 22 GLU A O 1 ATOM 144 C CB . GLU A 1 22 ? 5.126 83.611 47.362 1.00 126.94 ? 22 GLU A CB 1 ATOM 145 C CG . GLU A 1 22 ? 3.986 83.540 48.364 1.00 155.61 ? 22 GLU A CG 1 ATOM 146 C CD . GLU A 1 22 ? 2.937 84.608 48.135 1.00 167.12 ? 22 GLU A CD 1 ATOM 147 O OE1 . GLU A 1 22 ? 3.277 85.806 48.244 1.00 173.46 ? 22 GLU A OE1 1 ATOM 148 O OE2 . GLU A 1 22 ? 1.775 84.249 47.846 1.00 173.89 ? 22 GLU A OE2 1 ATOM 149 N N . ASP A 1 23 ? 6.125 84.330 44.261 1.00 39.91 ? 23 ASP A N 1 ATOM 150 C CA . ASP A 1 23 ? 7.291 84.534 43.398 1.00 44.76 ? 23 ASP A CA 1 ATOM 151 C C . ASP A 1 23 ? 7.355 83.757 42.097 1.00 41.01 ? 23 ASP A C 1 ATOM 152 O O . ASP A 1 23 ? 8.387 83.751 41.426 1.00 42.60 ? 23 ASP A O 1 ATOM 153 C CB . ASP A 1 23 ? 8.587 84.314 44.183 1.00 114.09 ? 23 ASP A CB 1 ATOM 154 C CG . ASP A 1 23 ? 8.806 85.377 45.242 1.00 130.71 ? 23 ASP A CG 1 ATOM 155 O OD1 . ASP A 1 23 ? 8.692 86.577 44.909 1.00 128.40 ? 23 ASP A OD1 1 ATOM 156 O OD2 . ASP A 1 23 ? 9.095 85.015 46.402 1.00 135.09 ? 23 ASP A OD2 1 ATOM 157 N N . VAL A 1 24 ? 6.260 83.093 41.749 1.00 52.52 ? 24 VAL A N 1 ATOM 158 C CA . VAL A 1 24 ? 6.173 82.367 40.490 1.00 43.67 ? 24 VAL A CA 1 ATOM 159 C C . VAL A 1 24 ? 4.911 82.856 39.790 1.00 36.09 ? 24 VAL A C 1 ATOM 160 O O . VAL A 1 24 ? 3.802 82.668 40.290 1.00 39.25 ? 24 VAL A O 1 ATOM 161 C CB . VAL A 1 24 ? 6.073 80.852 40.686 1.00 44.80 ? 24 VAL A CB 1 ATOM 162 C CG1 . VAL A 1 24 ? 5.817 80.187 39.343 1.00 44.33 ? 24 VAL A CG1 1 ATOM 163 C CG2 . VAL A 1 24 ? 7.359 80.316 41.285 1.00 42.35 ? 24 VAL A CG2 1 ATOM 164 N N . PRO A 1 25 ? 5.069 83.534 38.645 1.00 35.19 ? 25 PRO A N 1 ATOM 165 C CA . PRO A 1 25 ? 3.932 84.052 37.882 1.00 36.60 ? 25 PRO A CA 1 ATOM 166 C C . PRO A 1 25 ? 2.935 82.973 37.500 1.00 36.91 ? 25 PRO A C 1 ATOM 167 O O . PRO A 1 25 ? 3.325 81.832 37.253 1.00 39.11 ? 25 PRO A O 1 ATOM 168 C CB . PRO A 1 25 ? 4.595 84.701 36.661 1.00 24.73 ? 25 PRO A CB 1 ATOM 169 C CG . PRO A 1 25 ? 5.974 84.079 36.619 1.00 39.44 ? 25 PRO A CG 1 ATOM 170 C CD . PRO A 1 25 ? 6.334 83.988 38.055 1.00 26.55 ? 25 PRO A CD 1 ATOM 171 N N . ALA A 1 26 ? 1.652 83.329 37.463 1.00 30.73 ? 26 ALA A N 1 ATOM 172 C CA . ALA A 1 26 ? 0.609 82.368 37.103 1.00 34.39 ? 26 ALA A CA 1 ATOM 173 C C . ALA A 1 26 ? 0.674 81.998 35.621 1.00 33.01 ? 26 ALA A C 1 ATOM 174 O O . ALA A 1 26 ? 0.307 80.887 35.242 1.00 34.05 ? 26 ALA A O 1 ATOM 175 C CB . ALA A 1 26 ? -0.767 82.934 37.431 1.00 25.53 ? 26 ALA A CB 1 ATOM 176 N N . PHE A 1 27 ? 1.148 82.935 34.799 1.00 31.44 ? 27 PHE A N 1 ATOM 177 C CA . PHE A 1 27 ? 1.264 82.743 33.356 1.00 30.43 ? 27 PHE A CA 1 ATOM 178 C C . PHE A 1 27 ? 2.645 83.157 32.869 1.00 31.85 ? 27 PHE A C 1 ATOM 179 O O . PHE A 1 27 ? 3.174 84.182 33.282 1.00 35.45 ? 27 PHE A O 1 ATOM 180 C CB . PHE A 1 27 ? 0.208 83.580 32.625 1.00 30.11 ? 27 PHE A CB 1 ATOM 181 C CG . PHE A 1 27 ? 0.186 83.367 31.134 1.00 30.84 ? 27 PHE A CG 1 ATOM 182 C CD1 . PHE A 1 27 ? -0.437 82.254 30.586 1.00 28.55 ? 27 PHE A CD1 1 ATOM 183 C CD2 . PHE A 1 27 ? 0.814 84.266 30.279 1.00 30.18 ? 27 PHE A CD2 1 ATOM 184 C CE1 . PHE A 1 27 ? -0.430 82.042 29.201 1.00 28.63 ? 27 PHE A CE1 1 ATOM 185 C CE2 . PHE A 1 27 ? 0.825 84.059 28.897 1.00 35.81 ? 27 PHE A CE2 1 ATOM 186 C CZ . PHE A 1 27 ? 0.204 82.948 28.360 1.00 32.27 ? 27 PHE A CZ 1 ATOM 187 N N . GLN A 1 28 ? 3.228 82.355 31.989 1.00 20.72 ? 28 GLN A N 1 ATOM 188 C CA . GLN A 1 28 ? 4.545 82.658 31.436 1.00 20.72 ? 28 GLN A CA 1 ATOM 189 C C . GLN A 1 28 ? 4.550 82.250 29.986 1.00 25.17 ? 28 GLN A C 1 ATOM 190 O O . GLN A 1 28 ? 4.023 81.204 29.612 1.00 24.78 ? 28 GLN A O 1 ATOM 191 C CB . GLN A 1 28 ? 5.654 81.921 32.187 1.00 33.16 ? 28 GLN A CB 1 ATOM 192 C CG . GLN A 1 28 ? 6.060 82.627 33.463 1.00 43.43 ? 28 GLN A CG 1 ATOM 193 C CD . GLN A 1 28 ? 6.931 81.781 34.369 1.00 50.01 ? 28 GLN A CD 1 ATOM 194 O OE1 . GLN A 1 28 ? 6.517 80.720 34.836 1.00 55.63 ? 28 GLN A OE1 1 ATOM 195 N NE2 . GLN A 1 28 ? 8.142 82.254 34.634 1.00 47.73 ? 28 GLN A NE2 1 ATOM 196 N N . ALA A 1 29 ? 5.137 83.101 29.162 1.00 26.64 ? 29 ALA A N 1 ATOM 197 C CA . ALA A 1 29 ? 5.209 82.842 27.738 1.00 27.93 ? 29 ALA A CA 1 ATOM 198 C C . ALA A 1 29 ? 6.642 83.032 27.303 1.00 30.48 ? 29 ALA A C 1 ATOM 199 O O . ALA A 1 29 ? 7.378 83.830 27.887 1.00 30.07 ? 29 ALA A O 1 ATOM 200 C CB . ALA A 1 29 ? 4.301 83.813 26.988 1.00 30.42 ? 29 ALA A CB 1 ATOM 201 N N . LEU A 1 30 ? 7.049 82.278 26.298 1.00 25.92 ? 30 LEU A N 1 ATOM 202 C CA . LEU A 1 30 ? 8.393 82.427 25.784 1.00 26.63 ? 30 LEU A CA 1 ATOM 203 C C . LEU A 1 30 ? 8.365 82.019 24.335 1.00 28.80 ? 30 LEU A C 1 ATOM 204 O O . LEU A 1 30 ? 7.433 81.348 23.890 1.00 26.04 ? 30 LEU A O 1 ATOM 205 C CB . LEU A 1 30 ? 9.390 81.580 26.584 1.00 28.38 ? 30 LEU A CB 1 ATOM 206 C CG . LEU A 1 30 ? 9.314 80.059 26.637 1.00 41.00 ? 30 LEU A CG 1 ATOM 207 C CD1 . LEU A 1 30 ? 9.755 79.468 25.319 1.00 41.56 ? 30 LEU A CD1 1 ATOM 208 C CD2 . LEU A 1 30 ? 10.233 79.579 27.718 1.00 40.67 ? 30 LEU A CD2 1 ATOM 209 N N . GLY A 1 31 ? 9.368 82.452 23.591 1.00 41.12 ? 31 GLY A N 1 ATOM 210 C CA . GLY A 1 31 ? 9.423 82.110 22.188 1.00 42.88 ? 31 GLY A CA 1 ATOM 211 C C . GLY A 1 31 ? 10.850 81.912 21.739 1.00 43.22 ? 31 GLY A C 1 ATOM 212 O O . GLY A 1 31 ? 11.768 82.558 22.246 1.00 46.07 ? 31 GLY A O 1 ATOM 213 N N . SER A 1 32 ? 11.049 81.018 20.786 1.00 34.45 ? 32 SER A N 1 ATOM 214 C CA . SER A 1 32 ? 12.391 80.791 20.305 1.00 34.45 ? 32 SER A CA 1 ATOM 215 C C . SER A 1 32 ? 12.477 80.612 18.802 1.00 38.09 ? 32 SER A C 1 ATOM 216 O O . SER A 1 32 ? 11.502 80.255 18.134 1.00 37.04 ? 32 SER A O 1 ATOM 217 C CB . SER A 1 32 ? 12.986 79.584 21.005 1.00 29.66 ? 32 SER A CB 1 ATOM 218 O OG . SER A 1 32 ? 11.964 78.840 21.624 1.00 41.31 ? 32 SER A OG 1 ATOM 219 N N . LEU A 1 33 ? 13.655 80.915 18.278 1.00 31.08 ? 33 LEU A N 1 ATOM 220 C CA . LEU A 1 33 ? 13.951 80.764 16.870 1.00 32.01 ? 33 LEU A CA 1 ATOM 221 C C . LEU A 1 33 ? 15.106 79.780 16.932 1.00 28.41 ? 33 LEU A C 1 ATOM 222 O O . LEU A 1 33 ? 16.161 80.082 17.498 1.00 32.46 ? 33 LEU A O 1 ATOM 223 C CB . LEU A 1 33 ? 14.367 82.105 16.266 1.00 17.05 ? 33 LEU A CB 1 ATOM 224 C CG . LEU A 1 33 ? 13.182 83.064 16.117 1.00 23.37 ? 33 LEU A CG 1 ATOM 225 C CD1 . LEU A 1 33 ? 13.661 84.468 15.821 1.00 21.49 ? 33 LEU A CD1 1 ATOM 226 C CD2 . LEU A 1 33 ? 12.296 82.570 15.003 1.00 21.75 ? 33 LEU A CD2 1 ATOM 227 N N . ASN A 1 34 ? 14.875 78.581 16.398 1.00 36.57 ? 34 ASN A N 1 ATOM 228 C CA . ASN A 1 34 ? 15.876 77.527 16.427 1.00 37.24 ? 34 ASN A CA 1 ATOM 229 C C . ASN A 1 34 ? 16.334 77.288 17.869 1.00 42.02 ? 34 ASN A C 1 ATOM 230 O O . ASN A 1 34 ? 15.523 77.085 18.760 1.00 39.13 ? 34 ASN A O 1 ATOM 231 C CB . ASN A 1 34 ? 17.060 77.910 15.545 1.00 37.46 ? 34 ASN A CB 1 ATOM 232 C CG . ASN A 1 34 ? 16.704 77.916 14.081 1.00 45.36 ? 34 ASN A CG 1 ATOM 233 O OD1 . ASN A 1 34 ? 15.534 77.806 13.721 1.00 40.07 ? 34 ASN A OD1 1 ATOM 234 N ND2 . ASN A 1 34 ? 17.709 78.046 13.224 1.00 38.57 ? 34 ASN A ND2 1 ATOM 235 N N . ASP A 1 35 ? 17.634 77.354 18.100 1.00 30.77 ? 35 ASP A N 1 ATOM 236 C CA . ASP A 1 35 ? 18.192 77.108 19.420 1.00 34.09 ? 35 ASP A CA 1 ATOM 237 C C . ASP A 1 35 ? 18.263 78.316 20.369 1.00 29.35 ? 35 ASP A C 1 ATOM 238 O O . ASP A 1 35 ? 18.828 78.210 21.463 1.00 30.84 ? 35 ASP A O 1 ATOM 239 C CB . ASP A 1 35 ? 19.595 76.533 19.244 1.00 26.22 ? 35 ASP A CB 1 ATOM 240 C CG . ASP A 1 35 ? 20.553 77.528 18.626 1.00 36.21 ? 35 ASP A CG 1 ATOM 241 O OD1 . ASP A 1 35 ? 20.094 78.538 18.052 1.00 27.41 ? 35 ASP A OD1 1 ATOM 242 O OD2 . ASP A 1 35 ? 21.774 77.304 18.706 1.00 30.77 ? 35 ASP A OD2 1 ATOM 243 N N . LEU A 1 36 ? 17.690 79.451 19.974 1.00 30.32 ? 36 LEU A N 1 ATOM 244 C CA . LEU A 1 36 ? 17.768 80.648 20.810 1.00 33.92 ? 36 LEU A CA 1 ATOM 245 C C . LEU A 1 36 ? 16.417 81.176 21.235 1.00 30.92 ? 36 LEU A C 1 ATOM 246 O O . LEU A 1 36 ? 15.452 81.063 20.485 1.00 35.13 ? 36 LEU A O 1 ATOM 247 C CB . LEU A 1 36 ? 18.513 81.754 20.054 1.00 22.48 ? 36 LEU A CB 1 ATOM 248 C CG . LEU A 1 36 ? 19.898 81.374 19.515 1.00 27.87 ? 36 LEU A CG 1 ATOM 249 C CD1 . LEU A 1 36 ? 20.439 82.508 18.667 1.00 28.97 ? 36 LEU A CD1 1 ATOM 250 C CD2 . LEU A 1 36 ? 20.836 81.069 20.675 1.00 28.68 ? 36 LEU A CD2 1 ATOM 251 N N . GLN A 1 37 ? 16.344 81.747 22.437 1.00 33.94 ? 37 GLN A N 1 ATOM 252 C CA . GLN A 1 37 ? 15.089 82.324 22.917 1.00 36.18 ? 37 GLN A CA 1 ATOM 253 C C . GLN A 1 37 ? 15.105 83.806 22.577 1.00 38.64 ? 37 GLN A C 1 ATOM 254 O O . GLN A 1 37 ? 16.046 84.513 22.939 1.00 41.43 ? 37 GLN A O 1 ATOM 255 C CB . GLN A 1 37 ? 14.929 82.150 24.427 1.00 12.68 ? 37 GLN A CB 1 ATOM 256 C CG . GLN A 1 37 ? 13.636 82.773 24.947 1.00 21.16 ? 37 GLN A CG 1 ATOM 257 C CD . GLN A 1 37 ? 13.339 82.460 26.408 1.00 34.21 ? 37 GLN A CD 1 ATOM 258 O OE1 . GLN A 1 37 ? 12.573 83.171 27.055 1.00 27.27 ? 37 GLN A OE1 1 ATOM 259 N NE2 . GLN A 1 37 ? 13.928 81.392 26.927 1.00 26.04 ? 37 GLN A NE2 1 ATOM 260 N N . PHE A 1 38 ? 14.066 84.276 21.890 1.00 32.88 ? 38 PHE A N 1 ATOM 261 C CA . PHE A 1 38 ? 14.009 85.675 21.484 1.00 30.16 ? 38 PHE A CA 1 ATOM 262 C C . PHE A 1 38 ? 13.102 86.590 22.297 1.00 33.72 ? 38 PHE A C 1 ATOM 263 O O . PHE A 1 38 ? 13.205 87.808 22.173 1.00 32.05 ? 38 PHE A O 1 ATOM 264 C CB . PHE A 1 38 ? 13.630 85.781 20.004 1.00 25.90 ? 38 PHE A CB 1 ATOM 265 C CG . PHE A 1 38 ? 12.178 85.486 19.718 1.00 29.67 ? 38 PHE A CG 1 ATOM 266 C CD1 . PHE A 1 38 ? 11.236 86.512 19.709 1.00 27.25 ? 38 PHE A CD1 1 ATOM 267 C CD2 . PHE A 1 38 ? 11.761 84.184 19.414 1.00 23.77 ? 38 PHE A CD2 1 ATOM 268 C CE1 . PHE A 1 38 ? 9.899 86.250 19.393 1.00 28.13 ? 38 PHE A CE1 1 ATOM 269 C CE2 . PHE A 1 38 ? 10.432 83.912 19.101 1.00 28.08 ? 38 PHE A CE2 1 ATOM 270 C CZ . PHE A 1 38 ? 9.496 84.949 19.087 1.00 27.20 ? 38 PHE A CZ 1 ATOM 271 N N . PHE A 1 39 ? 12.211 86.040 23.115 1.00 28.17 ? 39 PHE A N 1 ATOM 272 C CA . PHE A 1 39 ? 11.361 86.913 23.913 1.00 29.06 ? 39 PHE A CA 1 ATOM 273 C C . PHE A 1 39 ? 10.783 86.218 25.126 1.00 29.89 ? 39 PHE A C 1 ATOM 274 O O . PHE A 1 39 ? 10.976 85.028 25.317 1.00 27.10 ? 39 PHE A O 1 ATOM 275 C CB . PHE A 1 39 ? 10.230 87.498 23.056 1.00 36.00 ? 39 PHE A CB 1 ATOM 276 C CG . PHE A 1 39 ? 8.879 86.894 23.327 1.00 34.99 ? 39 PHE A CG 1 ATOM 277 C CD1 . PHE A 1 39 ? 8.574 85.603 22.904 1.00 32.94 ? 39 PHE A CD1 1 ATOM 278 C CD2 . PHE A 1 39 ? 7.920 87.606 24.038 1.00 34.24 ? 39 PHE A CD2 1 ATOM 279 C CE1 . PHE A 1 39 ? 7.338 85.035 23.191 1.00 27.77 ? 39 PHE A CE1 1 ATOM 280 C CE2 . PHE A 1 39 ? 6.681 87.042 24.327 1.00 37.28 ? 39 PHE A CE2 1 ATOM 281 C CZ . PHE A 1 39 ? 6.394 85.758 23.903 1.00 28.01 ? 39 PHE A CZ 1 ATOM 282 N N . ARG A 1 40 ? 10.077 86.977 25.953 1.00 24.52 ? 40 ARG A N 1 ATOM 283 C CA . ARG A 1 40 ? 9.458 86.424 27.144 1.00 26.41 ? 40 ARG A CA 1 ATOM 284 C C . ARG A 1 40 ? 8.374 87.354 27.659 1.00 26.86 ? 40 ARG A C 1 ATOM 285 O O . ARG A 1 40 ? 8.371 88.551 27.373 1.00 29.72 ? 40 ARG A O 1 ATOM 286 C CB . ARG A 1 40 ? 10.498 86.205 28.239 1.00 34.61 ? 40 ARG A CB 1 ATOM 287 C CG . ARG A 1 40 ? 10.994 87.469 28.874 1.00 41.02 ? 40 ARG A CG 1 ATOM 288 C CD . ARG A 1 40 ? 11.900 87.141 30.033 1.00 47.85 ? 40 ARG A CD 1 ATOM 289 N NE . ARG A 1 40 ? 12.541 88.331 30.581 1.00 57.38 ? 40 ARG A NE 1 ATOM 290 C CZ . ARG A 1 40 ? 13.543 88.298 31.452 1.00 69.23 ? 40 ARG A CZ 1 ATOM 291 N NH1 . ARG A 1 40 ? 14.013 87.130 31.874 1.00 68.34 ? 40 ARG A NH1 1 ATOM 292 N NH2 . ARG A 1 40 ? 14.085 89.428 31.888 1.00 72.57 ? 40 ARG A NH2 1 ATOM 293 N N . TYR A 1 41 ? 7.459 86.788 28.430 1.00 29.46 ? 41 TYR A N 1 ATOM 294 C CA . TYR A 1 41 ? 6.357 87.541 29.000 1.00 31.92 ? 41 TYR A CA 1 ATOM 295 C C . TYR A 1 41 ? 5.791 86.755 30.171 1.00 34.49 ? 41 TYR A C 1 ATOM 296 O O . TYR A 1 41 ? 5.702 85.525 30.103 1.00 32.99 ? 41 TYR A O 1 ATOM 297 C CB . TYR A 1 41 ? 5.274 87.748 27.939 1.00 23.86 ? 41 TYR A CB 1 ATOM 298 C CG . TYR A 1 41 ? 3.944 88.247 28.466 1.00 29.61 ? 41 TYR A CG 1 ATOM 299 C CD1 . TYR A 1 41 ? 3.079 87.404 29.167 1.00 22.78 ? 41 TYR A CD1 1 ATOM 300 C CD2 . TYR A 1 41 ? 3.549 89.564 28.263 1.00 25.26 ? 41 TYR A CD2 1 ATOM 301 C CE1 . TYR A 1 41 ? 1.862 87.861 29.651 1.00 25.04 ? 41 TYR A CE1 1 ATOM 302 C CE2 . TYR A 1 41 ? 2.333 90.030 28.743 1.00 27.88 ? 41 TYR A CE2 1 ATOM 303 C CZ . TYR A 1 41 ? 1.498 89.176 29.433 1.00 30.08 ? 41 TYR A CZ 1 ATOM 304 O OH . TYR A 1 41 ? 0.299 89.655 29.894 1.00 30.63 ? 41 TYR A OH 1 ATOM 305 N N . ASN A 1 42 ? 5.427 87.440 31.251 1.00 23.92 ? 42 ASN A N 1 ATOM 306 C CA . ASN A 1 42 ? 4.827 86.741 32.380 1.00 25.75 ? 42 ASN A CA 1 ATOM 307 C C . ASN A 1 42 ? 3.711 87.596 32.938 1.00 27.26 ? 42 ASN A C 1 ATOM 308 O O . ASN A 1 42 ? 3.640 88.787 32.646 1.00 30.70 ? 42 ASN A O 1 ATOM 309 C CB . ASN A 1 42 ? 5.861 86.408 33.459 1.00 19.58 ? 42 ASN A CB 1 ATOM 310 C CG . ASN A 1 42 ? 6.451 87.630 34.100 1.00 26.11 ? 42 ASN A CG 1 ATOM 311 O OD1 . ASN A 1 42 ? 5.743 88.425 34.713 1.00 26.43 ? 42 ASN A OD1 1 ATOM 312 N ND2 . ASN A 1 42 ? 7.755 87.792 33.962 1.00 25.40 ? 42 ASN A ND2 1 ATOM 313 N N . SER A 1 43 ? 2.843 86.981 33.736 1.00 26.29 ? 43 SER A N 1 ATOM 314 C CA . SER A 1 43 ? 1.687 87.658 34.306 1.00 25.03 ? 43 SER A CA 1 ATOM 315 C C . SER A 1 43 ? 1.980 88.700 35.377 1.00 34.35 ? 43 SER A C 1 ATOM 316 O O . SER A 1 43 ? 1.062 89.381 35.842 1.00 32.49 ? 43 SER A O 1 ATOM 317 C CB . SER A 1 43 ? 0.706 86.623 34.855 1.00 32.77 ? 43 SER A CB 1 ATOM 318 O OG . SER A 1 43 ? 1.282 85.890 35.921 1.00 34.95 ? 43 SER A OG 1 ATOM 319 N N . LYS A 1 44 ? 3.245 88.826 35.773 1.00 43.89 ? 44 LYS A N 1 ATOM 320 C CA . LYS A 1 44 ? 3.620 89.807 36.788 1.00 55.60 ? 44 LYS A CA 1 ATOM 321 C C . LYS A 1 44 ? 3.929 91.149 36.130 1.00 54.09 ? 44 LYS A C 1 ATOM 322 O O . LYS A 1 44 ? 3.288 92.152 36.433 1.00 55.84 ? 44 LYS A O 1 ATOM 323 C CB . LYS A 1 44 ? 4.836 89.334 37.578 1.00 61.72 ? 44 LYS A CB 1 ATOM 324 C CG . LYS A 1 44 ? 5.193 90.251 38.732 1.00 76.94 ? 44 LYS A CG 1 ATOM 325 C CD . LYS A 1 44 ? 6.535 89.881 39.349 1.00 85.95 ? 44 LYS A CD 1 ATOM 326 C CE . LYS A 1 44 ? 6.970 90.900 40.403 1.00 94.31 ? 44 LYS A CE 1 ATOM 327 N NZ . LYS A 1 44 ? 8.343 90.610 40.925 1.00 92.27 ? 44 LYS A NZ 1 ATOM 328 N N . ASP A 1 45 ? 4.905 91.168 35.228 1.00 39.24 ? 45 ASP A N 1 ATOM 329 C CA . ASP A 1 45 ? 5.259 92.399 34.527 1.00 40.91 ? 45 ASP A CA 1 ATOM 330 C C . ASP A 1 45 ? 4.281 92.694 33.378 1.00 45.59 ? 45 ASP A C 1 ATOM 331 O O . ASP A 1 45 ? 4.042 93.842 33.035 1.00 38.10 ? 45 ASP A O 1 ATOM 332 C CB . ASP A 1 45 ? 6.679 92.304 33.958 1.00 81.45 ? 45 ASP A CB 1 ATOM 333 C CG . ASP A 1 45 ? 7.697 91.872 34.994 1.00 94.70 ? 45 ASP A CG 1 ATOM 334 O OD1 . ASP A 1 45 ? 7.617 92.356 36.143 1.00 91.52 ? 45 ASP A OD1 1 ATOM 335 O OD2 . ASP A 1 45 ? 8.582 91.058 34.651 1.00 102.99 ? 45 ASP A OD2 1 ATOM 336 N N . ARG A 1 46 ? 3.719 91.649 32.784 1.00 42.49 ? 46 ARG A N 1 ATOM 337 C CA . ARG A 1 46 ? 2.792 91.803 31.675 1.00 38.62 ? 46 ARG A CA 1 ATOM 338 C C . ARG A 1 46 ? 3.402 92.548 30.493 1.00 41.59 ? 46 ARG A C 1 ATOM 339 O O . ARG A 1 46 ? 2.710 93.297 29.809 1.00 39.70 ? 46 ARG A O 1 ATOM 340 C CB . ARG A 1 46 ? 1.527 92.520 32.138 1.00 43.24 ? 46 ARG A CB 1 ATOM 341 C CG . ARG A 1 46 ? 0.740 91.748 33.178 1.00 57.87 ? 46 ARG A CG 1 ATOM 342 C CD . ARG A 1 46 ? -0.563 92.440 33.513 1.00 58.97 ? 46 ARG A CD 1 ATOM 343 N NE . ARG A 1 46 ? -1.730 91.652 33.127 1.00 59.83 ? 46 ARG A NE 1 ATOM 344 C CZ . ARG A 1 46 ? -2.042 90.459 33.634 1.00 68.51 ? 46 ARG A CZ 1 ATOM 345 N NH1 . ARG A 1 46 ? -1.272 89.889 34.554 1.00 45.95 ? 46 ARG A NH1 1 ATOM 346 N NH2 . ARG A 1 46 ? -3.143 89.837 33.228 1.00 75.54 ? 46 ARG A NH2 1 ATOM 347 N N . LYS A 1 47 ? 4.694 92.330 30.250 1.00 36.58 ? 47 LYS A N 1 ATOM 348 C CA . LYS A 1 47 ? 5.393 92.973 29.132 1.00 39.52 ? 47 LYS A CA 1 ATOM 349 C C . LYS A 1 47 ? 6.206 91.988 28.293 1.00 40.92 ? 47 LYS A C 1 ATOM 350 O O . LYS A 1 47 ? 6.981 91.201 28.832 1.00 36.87 ? 47 LYS A O 1 ATOM 351 C CB . LYS A 1 47 ? 6.329 94.080 29.644 1.00 85.73 ? 47 LYS A CB 1 ATOM 352 C CG . LYS A 1 47 ? 5.621 95.226 30.359 1.00 90.61 ? 47 LYS A CG 1 ATOM 353 C CD . LYS A 1 47 ? 4.497 95.805 29.495 1.00 104.19 ? 47 LYS A CD 1 ATOM 354 C CE . LYS A 1 47 ? 3.585 96.752 30.274 1.00 108.80 ? 47 LYS A CE 1 ATOM 355 N NZ . LYS A 1 47 ? 2.403 97.157 29.456 1.00 105.05 ? 47 LYS A NZ 1 ATOM 356 N N . SER A 1 48 ? 6.019 92.021 26.977 1.00 32.61 ? 48 SER A N 1 ATOM 357 C CA . SER A 1 48 ? 6.774 91.140 26.096 1.00 36.27 ? 48 SER A CA 1 ATOM 358 C C . SER A 1 48 ? 8.108 91.812 25.894 1.00 39.12 ? 48 SER A C 1 ATOM 359 O O . SER A 1 48 ? 8.164 92.938 25.406 1.00 39.05 ? 48 SER A O 1 ATOM 360 C CB . SER A 1 48 ? 6.094 90.984 24.743 1.00 35.39 ? 48 SER A CB 1 ATOM 361 O OG . SER A 1 48 ? 4.838 90.370 24.891 1.00 43.85 ? 48 SER A OG 1 ATOM 362 N N . GLN A 1 49 ? 9.183 91.121 26.256 1.00 38.55 ? 49 GLN A N 1 ATOM 363 C CA . GLN A 1 49 ? 10.511 91.692 26.134 1.00 42.18 ? 49 GLN A CA 1 ATOM 364 C C . GLN A 1 49 ? 11.440 90.843 25.302 1.00 42.16 ? 49 GLN A C 1 ATOM 365 O O . GLN A 1 49 ? 11.488 89.629 25.451 1.00 40.24 ? 49 GLN A O 1 ATOM 366 C CB . GLN A 1 49 ? 11.128 91.856 27.516 1.00 63.34 ? 49 GLN A CB 1 ATOM 367 C CG . GLN A 1 49 ? 10.181 92.393 28.551 1.00 74.85 ? 49 GLN A CG 1 ATOM 368 C CD . GLN A 1 49 ? 10.791 92.389 29.930 1.00 82.56 ? 49 GLN A CD 1 ATOM 369 O OE1 . GLN A 1 49 ? 11.128 91.334 30.474 1.00 88.37 ? 49 GLN A OE1 1 ATOM 370 N NE2 . GLN A 1 49 ? 10.944 93.574 30.508 1.00 85.23 ? 49 GLN A NE2 1 ATOM 371 N N . PRO A 1 50 ? 12.202 91.478 24.408 1.00 38.84 ? 50 PRO A N 1 ATOM 372 C CA . PRO A 1 50 ? 13.137 90.723 23.573 1.00 34.34 ? 50 PRO A CA 1 ATOM 373 C C . PRO A 1 50 ? 14.251 90.241 24.475 1.00 34.39 ? 50 PRO A C 1 ATOM 374 O O . PRO A 1 50 ? 14.471 90.815 25.531 1.00 34.89 ? 50 PRO A O 1 ATOM 375 C CB . PRO A 1 50 ? 13.614 91.763 22.565 1.00 30.90 ? 50 PRO A CB 1 ATOM 376 C CG . PRO A 1 50 ? 13.527 93.032 23.332 1.00 35.27 ? 50 PRO A CG 1 ATOM 377 C CD . PRO A 1 50 ? 12.220 92.907 24.062 1.00 32.40 ? 50 PRO A CD 1 ATOM 378 N N . MET A 1 51 ? 14.946 89.189 24.066 1.00 27.77 ? 51 MET A N 1 ATOM 379 C CA . MET A 1 51 ? 16.037 88.634 24.855 1.00 28.94 ? 51 MET A CA 1 ATOM 380 C C . MET A 1 51 ? 17.237 88.346 23.973 1.00 32.07 ? 51 MET A C 1 ATOM 381 O O . MET A 1 51 ? 17.161 88.474 22.745 1.00 30.17 ? 51 MET A O 1 ATOM 382 C CB . MET A 1 51 ? 15.586 87.349 25.547 1.00 35.15 ? 51 MET A CB 1 ATOM 383 C CG . MET A 1 51 ? 14.597 87.586 26.660 1.00 44.28 ? 51 MET A CG 1 ATOM 384 S SD . MET A 1 51 ? 13.987 86.056 27.364 1.00 59.64 ? 51 MET A SD 1 ATOM 385 C CE . MET A 1 51 ? 15.528 85.312 27.963 1.00 58.85 ? 51 MET A CE 1 ATOM 386 N N . GLY A 1 52 ? 18.341 87.954 24.604 1.00 46.04 ? 52 GLY A N 1 ATOM 387 C CA . GLY A 1 52 ? 19.549 87.653 23.861 1.00 42.83 ? 52 GLY A CA 1 ATOM 388 C C . GLY A 1 52 ? 19.881 88.750 22.871 1.00 44.04 ? 52 GLY A C 1 ATOM 389 O O . GLY A 1 52 ? 19.586 89.919 23.106 1.00 49.98 ? 52 GLY A O 1 ATOM 390 N N . LEU A 1 53 ? 20.485 88.368 21.753 1.00 33.39 ? 53 LEU A N 1 ATOM 391 C CA . LEU A 1 53 ? 20.865 89.316 20.715 1.00 37.55 ? 53 LEU A CA 1 ATOM 392 C C . LEU A 1 53 ? 19.704 90.109 20.115 1.00 45.37 ? 53 LEU A C 1 ATOM 393 O O . LEU A 1 53 ? 19.931 91.059 19.368 1.00 42.32 ? 53 LEU A O 1 ATOM 394 C CB . LEU A 1 53 ? 21.590 88.583 19.590 1.00 30.57 ? 53 LEU A CB 1 ATOM 395 C CG . LEU A 1 53 ? 22.866 87.847 20.000 1.00 38.87 ? 53 LEU A CG 1 ATOM 396 C CD1 . LEU A 1 53 ? 23.247 86.885 18.887 1.00 33.77 ? 53 LEU A CD1 1 ATOM 397 C CD2 . LEU A 1 53 ? 23.998 88.836 20.286 1.00 37.75 ? 53 LEU A CD2 1 ATOM 398 N N . TRP A 1 54 ? 18.470 89.726 20.428 1.00 43.91 ? 54 TRP A N 1 ATOM 399 C CA . TRP A 1 54 ? 17.307 90.424 19.882 1.00 41.69 ? 54 TRP A CA 1 ATOM 400 C C . TRP A 1 54 ? 17.016 91.750 20.586 1.00 40.61 ? 54 TRP A C 1 ATOM 401 O O . TRP A 1 54 ? 16.217 92.559 20.104 1.00 43.69 ? 54 TRP A O 1 ATOM 402 C CB . TRP A 1 54 ? 16.078 89.501 19.915 1.00 35.61 ? 54 TRP A CB 1 ATOM 403 C CG . TRP A 1 54 ? 16.042 88.538 18.752 1.00 36.45 ? 54 TRP A CG 1 ATOM 404 C CD1 . TRP A 1 54 ? 15.656 88.821 17.480 1.00 34.78 ? 54 TRP A CD1 1 ATOM 405 C CD2 . TRP A 1 54 ? 16.511 87.174 18.734 1.00 35.60 ? 54 TRP A CD2 1 ATOM 406 N NE1 . TRP A 1 54 ? 15.860 87.732 16.667 1.00 36.80 ? 54 TRP A NE1 1 ATOM 407 C CE2 . TRP A 1 54 ? 16.384 86.708 17.410 1.00 38.37 ? 54 TRP A CE2 1 ATOM 408 C CE3 . TRP A 1 54 ? 17.030 86.307 19.709 1.00 33.64 ? 54 TRP A CE3 1 ATOM 409 C CZ2 . TRP A 1 54 ? 16.759 85.411 17.029 1.00 36.21 ? 54 TRP A CZ2 1 ATOM 410 C CZ3 . TRP A 1 54 ? 17.405 85.009 19.331 1.00 30.54 ? 54 TRP A CZ3 1 ATOM 411 C CH2 . TRP A 1 54 ? 17.266 84.579 18.001 1.00 35.28 ? 54 TRP A CH2 1 ATOM 412 N N . ARG A 1 55 ? 17.679 91.973 21.720 1.00 43.98 ? 55 ARG A N 1 ATOM 413 C CA . ARG A 1 55 ? 17.513 93.210 22.482 1.00 48.41 ? 55 ARG A CA 1 ATOM 414 C C . ARG A 1 55 ? 18.110 94.389 21.719 1.00 49.31 ? 55 ARG A C 1 ATOM 415 O O . ARG A 1 55 ? 17.874 95.540 22.060 1.00 52.49 ? 55 ARG A O 1 ATOM 416 C CB . ARG A 1 55 ? 18.196 93.097 23.846 1.00 47.10 ? 55 ARG A CB 1 ATOM 417 C CG . ARG A 1 55 ? 17.468 92.228 24.846 1.00 45.69 ? 55 ARG A CG 1 ATOM 418 C CD . ARG A 1 55 ? 18.315 91.983 26.079 1.00 38.50 ? 55 ARG A CD 1 ATOM 419 N NE . ARG A 1 55 ? 19.512 91.198 25.772 1.00 46.67 ? 55 ARG A NE 1 ATOM 420 C CZ . ARG A 1 55 ? 20.490 90.937 26.639 1.00 54.72 ? 55 ARG A CZ 1 ATOM 421 N NH1 . ARG A 1 55 ? 20.427 91.401 27.882 1.00 53.92 ? 55 ARG A NH1 1 ATOM 422 N NH2 . ARG A 1 55 ? 21.533 90.203 26.267 1.00 54.75 ? 55 ARG A NH2 1 ATOM 423 N N . GLN A 1 56 ? 18.886 94.090 20.683 1.00 65.95 ? 56 GLN A N 1 ATOM 424 C CA . GLN A 1 56 ? 19.507 95.127 19.875 1.00 77.74 ? 56 GLN A CA 1 ATOM 425 C C . GLN A 1 56 ? 18.899 95.227 18.482 1.00 78.53 ? 56 GLN A C 1 ATOM 426 O O . GLN A 1 56 ? 19.205 96.162 17.750 1.00 82.69 ? 56 GLN A O 1 ATOM 427 C CB . GLN A 1 56 ? 21.002 94.875 19.743 1.00 70.12 ? 56 GLN A CB 1 ATOM 428 C CG . GLN A 1 56 ? 21.753 94.911 21.051 1.00 86.29 ? 56 GLN A CG 1 ATOM 429 C CD . GLN A 1 56 ? 23.241 94.684 20.856 1.00 99.15 ? 56 GLN A CD 1 ATOM 430 O OE1 . GLN A 1 56 ? 23.663 93.625 20.384 1.00 95.09 ? 56 GLN A OE1 1 ATOM 431 N NE2 . GLN A 1 56 ? 24.046 95.682 21.211 1.00 105.39 ? 56 GLN A NE2 1 ATOM 432 N N . VAL A 1 57 ? 18.053 94.270 18.105 1.00 46.65 ? 57 VAL A N 1 ATOM 433 C CA . VAL A 1 57 ? 17.427 94.306 16.783 1.00 45.39 ? 57 VAL A CA 1 ATOM 434 C C . VAL A 1 57 ? 16.238 95.259 16.796 1.00 52.79 ? 57 VAL A C 1 ATOM 435 O O . VAL A 1 57 ? 15.332 95.135 17.622 1.00 52.40 ? 57 VAL A O 1 ATOM 436 C CB . VAL A 1 57 ? 16.965 92.906 16.340 1.00 49.23 ? 57 VAL A CB 1 ATOM 437 C CG1 . VAL A 1 57 ? 16.205 92.989 15.022 1.00 39.84 ? 57 VAL A CG1 1 ATOM 438 C CG2 . VAL A 1 57 ? 18.170 92.005 16.181 1.00 42.34 ? 57 VAL A CG2 1 ATOM 439 N N . GLU A 1 58 ? 16.243 96.215 15.875 1.00 61.29 ? 58 GLU A N 1 ATOM 440 C CA . GLU A 1 58 ? 15.168 97.194 15.828 1.00 59.36 ? 58 GLU A CA 1 ATOM 441 C C . GLU A 1 58 ? 14.243 97.065 14.627 1.00 52.37 ? 58 GLU A C 1 ATOM 442 O O . GLU A 1 58 ? 14.694 96.823 13.499 1.00 50.93 ? 58 GLU A O 1 ATOM 443 C CB . GLU A 1 58 ? 15.760 98.601 15.882 1.00 97.24 ? 58 GLU A CB 1 ATOM 444 C CG . GLU A 1 58 ? 16.558 98.855 17.144 1.00 114.80 ? 58 GLU A CG 1 ATOM 445 C CD . GLU A 1 58 ? 17.314 100.163 17.108 1.00 126.30 ? 58 GLU A CD 1 ATOM 446 O OE1 . GLU A 1 58 ? 16.665 101.222 16.986 1.00 135.42 ? 58 GLU A OE1 1 ATOM 447 O OE2 . GLU A 1 58 ? 18.560 100.129 17.202 1.00 126.82 ? 58 GLU A OE2 1 ATOM 448 N N . GLY A 1 59 ? 12.944 97.216 14.892 1.00 44.81 ? 59 GLY A N 1 ATOM 449 C CA . GLY A 1 59 ? 11.943 97.142 13.844 1.00 54.91 ? 59 GLY A CA 1 ATOM 450 C C . GLY A 1 59 ? 11.512 95.756 13.404 1.00 56.57 ? 59 GLY A C 1 ATOM 451 O O . GLY A 1 59 ? 10.977 95.598 12.306 1.00 52.92 ? 59 GLY A O 1 ATOM 452 N N . MET A 1 60 ? 11.745 94.745 14.234 1.00 63.72 ? 60 MET A N 1 ATOM 453 C CA . MET A 1 60 ? 11.337 93.395 13.880 1.00 56.49 ? 60 MET A CA 1 ATOM 454 C C . MET A 1 60 ? 9.981 93.127 14.499 1.00 56.72 ? 60 MET A C 1 ATOM 455 O O . MET A 1 60 ? 9.204 92.324 13.988 1.00 51.84 ? 60 MET A O 1 ATOM 456 C CB . MET A 1 60 ? 12.316 92.367 14.414 1.00 50.85 ? 60 MET A CB 1 ATOM 457 C CG . MET A 1 60 ? 11.797 90.962 14.271 1.00 44.09 ? 60 MET A CG 1 ATOM 458 S SD . MET A 1 60 ? 12.662 89.759 15.279 1.00 40.21 ? 60 MET A SD 1 ATOM 459 C CE . MET A 1 60 ? 13.775 89.084 14.077 1.00 55.29 ? 60 MET A CE 1 ATOM 460 N N . GLU A 1 61 ? 9.697 93.813 15.602 1.00 41.55 ? 61 GLU A N 1 ATOM 461 C CA . GLU A 1 61 ? 8.437 93.630 16.301 1.00 39.22 ? 61 GLU A CA 1 ATOM 462 C C . GLU A 1 61 ? 8.157 94.806 17.223 1.00 43.99 ? 61 GLU A C 1 ATOM 463 O O . GLU A 1 61 ? 9.071 95.373 17.818 1.00 48.99 ? 61 GLU A O 1 ATOM 464 C CB . GLU A 1 61 ? 8.490 92.336 17.126 1.00 40.93 ? 61 GLU A CB 1 ATOM 465 C CG . GLU A 1 61 ? 7.152 91.875 17.655 1.00 41.48 ? 61 GLU A CG 1 ATOM 466 C CD . GLU A 1 61 ? 6.167 91.627 16.540 1.00 44.77 ? 61 GLU A CD 1 ATOM 467 O OE1 . GLU A 1 61 ? 6.319 90.615 15.823 1.00 41.07 ? 61 GLU A OE1 1 ATOM 468 O OE2 . GLU A 1 61 ? 5.249 92.456 16.369 1.00 54.60 ? 61 GLU A OE2 1 ATOM 469 N N . ASP A 1 62 ? 6.890 95.177 17.330 1.00 46.97 ? 62 ASP A N 1 ATOM 470 C CA . ASP A 1 62 ? 6.498 96.267 18.208 1.00 50.29 ? 62 ASP A CA 1 ATOM 471 C C . ASP A 1 62 ? 6.258 95.539 19.521 1.00 49.88 ? 62 ASP A C 1 ATOM 472 O O . ASP A 1 62 ? 5.248 94.858 19.676 1.00 44.16 ? 62 ASP A O 1 ATOM 473 C CB . ASP A 1 62 ? 5.206 96.910 17.685 1.00 54.72 ? 62 ASP A CB 1 ATOM 474 C CG . ASP A 1 62 ? 4.808 98.164 18.451 1.00 58.42 ? 62 ASP A CG 1 ATOM 475 O OD1 . ASP A 1 62 ? 4.629 98.082 19.687 1.00 53.36 ? 62 ASP A OD1 1 ATOM 476 O OD2 . ASP A 1 62 ? 4.665 99.228 17.810 1.00 65.52 ? 62 ASP A OD2 1 ATOM 477 N N . TRP A 1 63 ? 7.186 95.644 20.463 1.00 44.50 ? 63 TRP A N 1 ATOM 478 C CA . TRP A 1 63 ? 7.004 94.924 21.714 1.00 41.67 ? 63 TRP A CA 1 ATOM 479 C C . TRP A 1 63 ? 5.902 95.500 22.571 1.00 43.27 ? 63 TRP A C 1 ATOM 480 O O . TRP A 1 63 ? 5.329 94.793 23.405 1.00 39.35 ? 63 TRP A O 1 ATOM 481 C CB . TRP A 1 63 ? 8.309 94.853 22.510 1.00 41.83 ? 63 TRP A CB 1 ATOM 482 C CG . TRP A 1 63 ? 9.369 94.073 21.796 1.00 35.86 ? 63 TRP A CG 1 ATOM 483 C CD1 . TRP A 1 63 ? 10.553 94.553 21.304 1.00 40.50 ? 63 TRP A CD1 1 ATOM 484 C CD2 . TRP A 1 63 ? 9.307 92.693 21.413 1.00 39.64 ? 63 TRP A CD2 1 ATOM 485 N NE1 . TRP A 1 63 ? 11.225 93.561 20.632 1.00 41.22 ? 63 TRP A NE1 1 ATOM 486 C CE2 . TRP A 1 63 ? 10.484 92.409 20.681 1.00 40.42 ? 63 TRP A CE2 1 ATOM 487 C CE3 . TRP A 1 63 ? 8.372 91.669 21.614 1.00 43.04 ? 63 TRP A CE3 1 ATOM 488 C CZ2 . TRP A 1 63 ? 10.747 91.144 20.150 1.00 44.55 ? 63 TRP A CZ2 1 ATOM 489 C CZ3 . TRP A 1 63 ? 8.638 90.412 21.086 1.00 40.96 ? 63 TRP A CZ3 1 ATOM 490 C CH2 . TRP A 1 63 ? 9.816 90.164 20.363 1.00 43.14 ? 63 TRP A CH2 1 ATOM 491 N N . LYS A 1 64 ? 5.585 96.772 22.373 1.00 54.89 ? 64 LYS A N 1 ATOM 492 C CA . LYS A 1 64 ? 4.534 97.374 23.170 1.00 57.05 ? 64 LYS A CA 1 ATOM 493 C C . LYS A 1 64 ? 3.198 96.795 22.749 1.00 52.53 ? 64 LYS A C 1 ATOM 494 O O . LYS A 1 64 ? 2.305 96.582 23.577 1.00 52.03 ? 64 LYS A O 1 ATOM 495 C CB . LYS A 1 64 ? 4.552 98.897 23.021 1.00 84.52 ? 64 LYS A CB 1 ATOM 496 C CG . LYS A 1 64 ? 5.798 99.517 23.656 1.00 100.28 ? 64 LYS A CG 1 ATOM 497 C CD . LYS A 1 64 ? 5.722 101.032 23.777 1.00 113.28 ? 64 LYS A CD 1 ATOM 498 C CE . LYS A 1 64 ? 6.916 101.575 24.564 1.00 117.43 ? 64 LYS A CE 1 ATOM 499 N NZ . LYS A 1 64 ? 8.226 101.183 23.963 1.00 124.25 ? 64 LYS A NZ 1 ATOM 500 N N . GLN A 1 65 ? 3.063 96.509 21.461 1.00 63.22 ? 65 GLN A N 1 ATOM 501 C CA . GLN A 1 65 ? 1.816 95.947 20.984 1.00 65.81 ? 65 GLN A CA 1 ATOM 502 C C . GLN A 1 65 ? 1.748 94.466 21.348 1.00 61.01 ? 65 GLN A C 1 ATOM 503 O O . GLN A 1 65 ? 0.723 93.986 21.832 1.00 60.58 ? 65 GLN A O 1 ATOM 504 C CB . GLN A 1 65 ? 1.677 96.150 19.473 1.00 78.08 ? 65 GLN A CB 1 ATOM 505 C CG . GLN A 1 65 ? 0.262 95.911 18.958 1.00 86.72 ? 65 GLN A CG 1 ATOM 506 C CD . GLN A 1 65 ? -0.809 96.576 19.830 1.00 98.11 ? 65 GLN A CD 1 ATOM 507 O OE1 . GLN A 1 65 ? -0.715 97.764 20.166 1.00 99.96 ? 65 GLN A OE1 1 ATOM 508 N NE2 . GLN A 1 65 ? -1.837 95.807 20.192 1.00 84.65 ? 65 GLN A NE2 1 ATOM 509 N N . ASP A 1 66 ? 2.847 93.748 21.133 1.00 44.65 ? 66 ASP A N 1 ATOM 510 C CA . ASP A 1 66 ? 2.892 92.328 21.458 1.00 43.28 ? 66 ASP A CA 1 ATOM 511 C C . ASP A 1 66 ? 2.515 92.127 22.919 1.00 44.88 ? 66 ASP A C 1 ATOM 512 O O . ASP A 1 66 ? 2.022 91.069 23.301 1.00 39.03 ? 66 ASP A O 1 ATOM 513 C CB . ASP A 1 66 ? 4.289 91.753 21.211 1.00 53.84 ? 66 ASP A CB 1 ATOM 514 C CG . ASP A 1 66 ? 4.297 90.235 21.206 1.00 62.64 ? 66 ASP A CG 1 ATOM 515 O OD1 . ASP A 1 66 ? 3.634 89.660 20.318 1.00 61.31 ? 66 ASP A OD1 1 ATOM 516 O OD2 . ASP A 1 66 ? 4.953 89.619 22.080 1.00 56.12 ? 66 ASP A OD2 1 ATOM 517 N N . SER A 1 67 ? 2.753 93.144 23.738 1.00 40.19 ? 67 SER A N 1 ATOM 518 C CA . SER A 1 67 ? 2.409 93.052 25.149 1.00 38.54 ? 67 SER A CA 1 ATOM 519 C C . SER A 1 67 ? 0.900 93.011 25.278 1.00 44.97 ? 67 SER A C 1 ATOM 520 O O . SER A 1 67 ? 0.358 92.288 26.103 1.00 40.40 ? 67 SER A O 1 ATOM 521 C CB . SER A 1 67 ? 2.961 94.248 25.924 1.00 49.76 ? 67 SER A CB 1 ATOM 522 O OG . SER A 1 67 ? 4.376 94.268 25.872 1.00 51.58 ? 67 SER A OG 1 ATOM 523 N N . GLN A 1 68 ? 0.216 93.787 24.449 1.00 48.27 ? 68 GLN A N 1 ATOM 524 C CA . GLN A 1 68 ? -1.236 93.812 24.496 1.00 45.47 ? 68 GLN A CA 1 ATOM 525 C C . GLN A 1 68 ? -1.754 92.468 24.028 1.00 39.61 ? 68 GLN A C 1 ATOM 526 O O . GLN A 1 68 ? -2.714 91.929 24.587 1.00 45.59 ? 68 GLN A O 1 ATOM 527 C CB . GLN A 1 68 ? -1.782 94.932 23.606 1.00 48.61 ? 68 GLN A CB 1 ATOM 528 C CG . GLN A 1 68 ? -1.347 96.330 24.027 1.00 49.82 ? 68 GLN A CG 1 ATOM 529 C CD . GLN A 1 68 ? -1.466 96.555 25.528 1.00 48.78 ? 68 GLN A CD 1 ATOM 530 O OE1 . GLN A 1 68 ? -2.549 96.426 26.114 1.00 58.93 ? 68 GLN A OE1 1 ATOM 531 N NE2 . GLN A 1 68 ? -0.342 96.892 26.160 1.00 48.42 ? 68 GLN A NE2 1 ATOM 532 N N . LEU A 1 69 ? -1.097 91.928 23.005 1.00 48.33 ? 69 LEU A N 1 ATOM 533 C CA . LEU A 1 69 ? -1.466 90.642 22.435 1.00 55.45 ? 69 LEU A CA 1 ATOM 534 C C . LEU A 1 69 ? -1.265 89.503 23.436 1.00 53.16 ? 69 LEU A C 1 ATOM 535 O O . LEU A 1 69 ? -2.130 88.625 23.554 1.00 47.13 ? 69 LEU A O 1 ATOM 536 C CB . LEU A 1 69 ? -0.655 90.388 21.166 1.00 17.44 ? 69 LEU A CB 1 ATOM 537 C CG . LEU A 1 69 ? -0.757 89.011 20.500 1.00 23.79 ? 69 LEU A CG 1 ATOM 538 C CD1 . LEU A 1 69 ? -2.202 88.688 20.152 1.00 21.48 ? 69 LEU A CD1 1 ATOM 539 C CD2 . LEU A 1 69 ? 0.121 88.986 19.267 1.00 23.24 ? 69 LEU A CD2 1 ATOM 540 N N . GLN A 1 70 ? -0.136 89.503 24.152 1.00 47.18 ? 70 GLN A N 1 ATOM 541 C CA . GLN A 1 70 ? 0.101 88.457 25.149 1.00 50.41 ? 70 GLN A CA 1 ATOM 542 C C . GLN A 1 70 ? -0.952 88.584 26.228 1.00 48.06 ? 70 GLN A C 1 ATOM 543 O O . GLN A 1 70 ? -1.557 87.595 26.618 1.00 49.78 ? 70 GLN A O 1 ATOM 544 C CB . GLN A 1 70 ? 1.469 88.576 25.809 1.00 27.73 ? 70 GLN A CB 1 ATOM 545 C CG . GLN A 1 70 ? 2.652 88.370 24.891 1.00 30.21 ? 70 GLN A CG 1 ATOM 546 C CD . GLN A 1 70 ? 2.548 87.136 24.026 1.00 30.94 ? 70 GLN A CD 1 ATOM 547 O OE1 . GLN A 1 70 ? 1.944 86.132 24.409 1.00 30.15 ? 70 GLN A OE1 1 ATOM 548 N NE2 . GLN A 1 70 ? 3.164 87.197 22.851 1.00 29.06 ? 70 GLN A NE2 1 ATOM 549 N N . LYS A 1 71 ? -1.172 89.801 26.716 1.00 35.54 ? 71 LYS A N 1 ATOM 550 C CA . LYS A 1 71 ? -2.179 90.012 27.752 1.00 29.82 ? 71 LYS A CA 1 ATOM 551 C C . LYS A 1 71 ? -3.495 89.366 27.324 1.00 32.49 ? 71 LYS A C 1 ATOM 552 O O . LYS A 1 71 ? -4.185 88.747 28.135 1.00 32.11 ? 71 LYS A O 1 ATOM 553 C CB . LYS A 1 71 ? -2.416 91.506 28.007 1.00 54.41 ? 71 LYS A CB 1 ATOM 554 C CG . LYS A 1 71 ? -1.271 92.261 28.664 1.00 63.24 ? 71 LYS A CG 1 ATOM 555 C CD . LYS A 1 71 ? -1.669 93.718 28.886 1.00 69.57 ? 71 LYS A CD 1 ATOM 556 C CE . LYS A 1 71 ? -0.489 94.597 29.278 1.00 73.73 ? 71 LYS A CE 1 ATOM 557 N NZ . LYS A 1 71 ? -0.871 96.042 29.337 1.00 71.29 ? 71 LYS A NZ 1 ATOM 558 N N . ALA A 1 72 ? -3.851 89.501 26.053 1.00 40.41 ? 72 ALA A N 1 ATOM 559 C CA . ALA A 1 72 ? -5.101 88.900 25.601 1.00 43.23 ? 72 ALA A CA 1 ATOM 560 C C . ALA A 1 72 ? -4.984 87.381 25.598 1.00 38.11 ? 72 ALA A C 1 ATOM 561 O O . ALA A 1 72 ? -5.885 86.699 26.063 1.00 35.23 ? 72 ALA A O 1 ATOM 562 C CB . ALA A 1 72 ? -5.474 89.407 24.220 1.00 9.65 ? 72 ALA A CB 1 ATOM 563 N N . ARG A 1 73 ? -3.875 86.862 25.074 1.00 31.66 ? 73 ARG A N 1 ATOM 564 C CA . ARG A 1 73 ? -3.642 85.421 25.038 1.00 36.00 ? 73 ARG A CA 1 ATOM 565 C C . ARG A 1 73 ? -3.697 84.856 26.458 1.00 29.92 ? 73 ARG A C 1 ATOM 566 O O . ARG A 1 73 ? -4.277 83.798 26.700 1.00 30.19 ? 73 ARG A O 1 ATOM 567 C CB . ARG A 1 73 ? -2.265 85.111 24.448 1.00 27.28 ? 73 ARG A CB 1 ATOM 568 C CG . ARG A 1 73 ? -2.082 85.484 22.988 1.00 35.96 ? 73 ARG A CG 1 ATOM 569 C CD . ARG A 1 73 ? -2.533 84.375 22.066 1.00 37.16 ? 73 ARG A CD 1 ATOM 570 N NE . ARG A 1 73 ? -2.265 84.696 20.668 1.00 38.60 ? 73 ARG A NE 1 ATOM 571 C CZ . ARG A 1 73 ? -1.050 84.864 20.149 1.00 36.17 ? 73 ARG A CZ 1 ATOM 572 N NH1 . ARG A 1 73 ? 0.029 84.740 20.912 1.00 34.53 ? 73 ARG A NH1 1 ATOM 573 N NH2 . ARG A 1 73 ? -0.913 85.164 18.863 1.00 29.39 ? 73 ARG A NH2 1 ATOM 574 N N . GLU A 1 74 ? -3.081 85.563 27.395 1.00 43.45 ? 74 GLU A N 1 ATOM 575 C CA . GLU A 1 74 ? -3.054 85.119 28.772 1.00 42.56 ? 74 GLU A CA 1 ATOM 576 C C . GLU A 1 74 ? -4.461 84.923 29.307 1.00 48.31 ? 74 GLU A C 1 ATOM 577 O O . GLU A 1 74 ? -4.773 83.888 29.898 1.00 43.15 ? 74 GLU A O 1 ATOM 578 C CB . GLU A 1 74 ? -2.326 86.137 29.647 1.00 38.22 ? 74 GLU A CB 1 ATOM 579 C CG . GLU A 1 74 ? -2.350 85.780 31.121 1.00 38.41 ? 74 GLU A CG 1 ATOM 580 C CD . GLU A 1 74 ? -1.944 86.937 32.028 1.00 42.89 ? 74 GLU A CD 1 ATOM 581 O OE1 . GLU A 1 74 ? -1.000 87.687 31.672 1.00 43.42 ? 74 GLU A OE1 1 ATOM 582 O OE2 . GLU A 1 74 ? -2.561 87.081 33.114 1.00 44.16 ? 74 GLU A OE2 1 ATOM 583 N N . ASP A 1 75 ? -5.321 85.911 29.100 1.00 40.27 ? 75 ASP A N 1 ATOM 584 C CA . ASP A 1 75 ? -6.673 85.800 29.621 1.00 35.64 ? 75 ASP A CA 1 ATOM 585 C C . ASP A 1 75 ? -7.369 84.563 29.125 1.00 33.55 ? 75 ASP A C 1 ATOM 586 O O . ASP A 1 75 ? -7.984 83.853 29.915 1.00 39.49 ? 75 ASP A O 1 ATOM 587 C CB . ASP A 1 75 ? -7.505 87.044 29.293 1.00 49.12 ? 75 ASP A CB 1 ATOM 588 C CG . ASP A 1 75 ? -7.053 88.269 30.077 1.00 62.78 ? 75 ASP A CG 1 ATOM 589 O OD1 . ASP A 1 75 ? -6.617 88.114 31.242 1.00 61.82 ? 75 ASP A OD1 1 ATOM 590 O OD2 . ASP A 1 75 ? -7.144 89.390 29.534 1.00 62.87 ? 75 ASP A OD2 1 ATOM 591 N N . ILE A 1 76 ? -7.262 84.284 27.830 1.00 33.76 ? 76 ILE A N 1 ATOM 592 C CA . ILE A 1 76 ? -7.911 83.101 27.270 1.00 30.84 ? 76 ILE A CA 1 ATOM 593 C C . ILE A 1 76 ? -7.264 81.816 27.786 1.00 32.75 ? 76 ILE A C 1 ATOM 594 O O . ILE A 1 76 ? -7.957 80.864 28.159 1.00 37.08 ? 76 ILE A O 1 ATOM 595 C CB . ILE A 1 76 ? -7.878 83.111 25.727 1.00 31.67 ? 76 ILE A CB 1 ATOM 596 C CG1 . ILE A 1 76 ? -8.635 84.324 25.196 1.00 41.63 ? 76 ILE A CG1 1 ATOM 597 C CG2 . ILE A 1 76 ? -8.559 81.880 25.186 1.00 36.94 ? 76 ILE A CG2 1 ATOM 598 C CD1 . ILE A 1 76 ? -8.573 84.468 23.688 1.00 54.78 ? 76 ILE A CD1 1 ATOM 599 N N . PHE A 1 77 ? -5.934 81.800 27.823 1.00 33.47 ? 77 PHE A N 1 ATOM 600 C CA . PHE A 1 77 ? -5.206 80.630 28.301 1.00 34.74 ? 77 PHE A CA 1 ATOM 601 C C . PHE A 1 77 ? -5.666 80.286 29.700 1.00 38.71 ? 77 PHE A C 1 ATOM 602 O O . PHE A 1 77 ? -6.130 79.180 29.938 1.00 34.60 ? 77 PHE A O 1 ATOM 603 C CB . PHE A 1 77 ? -3.708 80.898 28.326 1.00 26.34 ? 77 PHE A CB 1 ATOM 604 C CG . PHE A 1 77 ? -2.879 79.672 28.524 1.00 26.34 ? 77 PHE A CG 1 ATOM 605 C CD1 . PHE A 1 77 ? -2.515 78.885 27.438 1.00 26.34 ? 77 PHE A CD1 1 ATOM 606 C CD2 . PHE A 1 77 ? -2.456 79.301 29.796 1.00 27.39 ? 77 PHE A CD2 1 ATOM 607 C CE1 . PHE A 1 77 ? -1.729 77.733 27.613 1.00 26.34 ? 77 PHE A CE1 1 ATOM 608 C CE2 . PHE A 1 77 ? -1.672 78.153 29.988 1.00 29.24 ? 77 PHE A CE2 1 ATOM 609 C CZ . PHE A 1 77 ? -1.306 77.366 28.893 1.00 26.34 ? 77 PHE A CZ 1 ATOM 610 N N . MET A 1 78 ? -5.559 81.241 30.621 1.00 34.93 ? 78 MET A N 1 ATOM 611 C CA . MET A 1 78 ? -5.966 81.003 32.007 1.00 33.68 ? 78 MET A CA 1 ATOM 612 C C . MET A 1 78 ? -7.459 80.705 32.204 1.00 35.75 ? 78 MET A C 1 ATOM 613 O O . MET A 1 78 ? -7.830 80.086 33.194 1.00 34.17 ? 78 MET A O 1 ATOM 614 C CB . MET A 1 78 ? -5.566 82.172 32.919 1.00 34.75 ? 78 MET A CB 1 ATOM 615 C CG . MET A 1 78 ? -4.065 82.474 32.969 1.00 27.99 ? 78 MET A CG 1 ATOM 616 S SD . MET A 1 78 ? -2.999 81.089 33.391 1.00 32.75 ? 78 MET A SD 1 ATOM 617 C CE . MET A 1 78 ? -3.098 81.120 35.137 1.00 33.59 ? 78 MET A CE 1 ATOM 618 N N . GLU A 1 79 ? -8.326 81.143 31.298 1.00 30.65 ? 79 GLU A N 1 ATOM 619 C CA . GLU A 1 79 ? -9.730 80.812 31.484 1.00 30.65 ? 79 GLU A CA 1 ATOM 620 C C . GLU A 1 79 ? -9.872 79.336 31.112 1.00 28.66 ? 79 GLU A C 1 ATOM 621 O O . GLU A 1 79 ? -10.650 78.594 31.725 1.00 31.93 ? 79 GLU A O 1 ATOM 622 C CB . GLU A 1 79 ? -10.641 81.671 30.611 1.00 45.61 ? 79 GLU A CB 1 ATOM 623 C CG . GLU A 1 79 ? -12.091 81.210 30.656 1.00 58.73 ? 79 GLU A CG 1 ATOM 624 C CD . GLU A 1 79 ? -13.037 82.111 29.879 1.00 68.11 ? 79 GLU A CD 1 ATOM 625 O OE1 . GLU A 1 79 ? -12.646 82.611 28.800 1.00 64.60 ? 79 GLU A OE1 1 ATOM 626 O OE2 . GLU A 1 79 ? -14.184 82.303 30.342 1.00 70.35 ? 79 GLU A OE2 1 ATOM 627 N N . THR A 1 80 ? -9.097 78.911 30.114 1.00 33.73 ? 80 THR A N 1 ATOM 628 C CA . THR A 1 80 ? -9.113 77.526 29.682 1.00 30.90 ? 80 THR A CA 1 ATOM 629 C C . THR A 1 80 ? -8.711 76.665 30.870 1.00 27.95 ? 80 THR A C 1 ATOM 630 O O . THR A 1 80 ? -9.431 75.741 31.243 1.00 32.96 ? 80 THR A O 1 ATOM 631 C CB . THR A 1 80 ? -8.126 77.291 28.527 1.00 31.42 ? 80 THR A CB 1 ATOM 632 O OG1 . THR A 1 80 ? -8.516 78.088 27.403 1.00 32.37 ? 80 THR A OG1 1 ATOM 633 C CG2 . THR A 1 80 ? -8.113 75.826 28.119 1.00 28.51 ? 80 THR A CG2 1 ATOM 634 N N . LEU A 1 81 ? -7.563 76.977 31.467 1.00 24.08 ? 81 LEU A N 1 ATOM 635 C CA . LEU A 1 81 ? -7.080 76.229 32.623 1.00 25.02 ? 81 LEU A CA 1 ATOM 636 C C . LEU A 1 81 ? -8.133 76.210 33.711 1.00 27.26 ? 81 LEU A C 1 ATOM 637 O O . LEU A 1 81 ? -8.379 75.169 34.320 1.00 26.74 ? 81 LEU A O 1 ATOM 638 C CB . LEU A 1 81 ? -5.800 76.846 33.186 1.00 13.67 ? 81 LEU A CB 1 ATOM 639 C CG . LEU A 1 81 ? -5.301 76.313 34.535 1.00 15.79 ? 81 LEU A CG 1 ATOM 640 C CD1 . LEU A 1 81 ? -4.943 74.849 34.454 1.00 13.67 ? 81 LEU A CD1 1 ATOM 641 C CD2 . LEU A 1 81 ? -4.087 77.108 34.941 1.00 20.69 ? 81 LEU A CD2 1 ATOM 642 N N . LYS A 1 82 ? -8.766 77.360 33.939 1.00 25.55 ? 82 LYS A N 1 ATOM 643 C CA . LYS A 1 82 ? -9.791 77.472 34.972 1.00 31.40 ? 82 LYS A CA 1 ATOM 644 C C . LYS A 1 82 ? -10.973 76.542 34.695 1.00 27.50 ? 82 LYS A C 1 ATOM 645 O O . LYS A 1 82 ? -11.439 75.840 35.593 1.00 26.76 ? 82 LYS A O 1 ATOM 646 C CB . LYS A 1 82 ? -10.286 78.917 35.094 1.00 59.03 ? 82 LYS A CB 1 ATOM 647 C CG . LYS A 1 82 ? -11.061 79.176 36.385 1.00 71.67 ? 82 LYS A CG 1 ATOM 648 C CD . LYS A 1 82 ? -11.682 80.572 36.448 1.00 81.86 ? 82 LYS A CD 1 ATOM 649 C CE . LYS A 1 82 ? -13.064 80.622 35.794 1.00 88.03 ? 82 LYS A CE 1 ATOM 650 N NZ . LYS A 1 82 ? -13.044 80.349 34.327 1.00 91.98 ? 82 LYS A NZ 1 ATOM 651 N N . ASP A 1 83 ? -11.451 76.535 33.452 1.00 19.46 ? 83 ASP A N 1 ATOM 652 C CA . ASP A 1 83 ? -12.576 75.678 33.087 1.00 20.09 ? 83 ASP A CA 1 ATOM 653 C C . ASP A 1 83 ? -12.262 74.202 33.255 1.00 19.73 ? 83 ASP A C 1 ATOM 654 O O . ASP A 1 83 ? -13.167 73.411 33.478 1.00 21.52 ? 83 ASP A O 1 ATOM 655 C CB . ASP A 1 83 ? -13.013 75.915 31.638 1.00 32.79 ? 83 ASP A CB 1 ATOM 656 C CG . ASP A 1 83 ? -13.456 77.338 31.382 1.00 50.29 ? 83 ASP A CG 1 ATOM 657 O OD1 . ASP A 1 83 ? -13.936 78.001 32.326 1.00 49.20 ? 83 ASP A OD1 1 ATOM 658 O OD2 . ASP A 1 83 ? -13.339 77.789 30.223 1.00 51.78 ? 83 ASP A OD2 1 ATOM 659 N N . ILE A 1 84 ? -10.997 73.813 33.117 1.00 27.03 ? 84 ILE A N 1 ATOM 660 C CA . ILE A 1 84 ? -10.660 72.398 33.278 1.00 22.13 ? 84 ILE A CA 1 ATOM 661 C C . ILE A 1 84 ? -10.776 72.030 34.753 1.00 24.90 ? 84 ILE A C 1 ATOM 662 O O . ILE A 1 84 ? -11.440 71.051 35.110 1.00 25.76 ? 84 ILE A O 1 ATOM 663 C CB . ILE A 1 84 ? -9.224 72.063 32.783 1.00 18.13 ? 84 ILE A CB 1 ATOM 664 C CG1 . ILE A 1 84 ? -9.125 72.322 31.279 1.00 18.13 ? 84 ILE A CG1 1 ATOM 665 C CG2 . ILE A 1 84 ? -8.873 70.608 33.113 1.00 20.07 ? 84 ILE A CG2 1 ATOM 666 C CD1 . ILE A 1 84 ? -7.738 72.075 30.705 1.00 18.13 ? 84 ILE A CD1 1 ATOM 667 N N . VAL A 1 85 ? -10.139 72.826 35.606 1.00 32.35 ? 85 VAL A N 1 ATOM 668 C CA . VAL A 1 85 ? -10.196 72.579 37.039 1.00 36.36 ? 85 VAL A CA 1 ATOM 669 C C . VAL A 1 85 ? -11.658 72.553 37.499 1.00 36.68 ? 85 VAL A C 1 ATOM 670 O O . VAL A 1 85 ? -12.047 71.725 38.322 1.00 38.65 ? 85 VAL A O 1 ATOM 671 C CB . VAL A 1 85 ? -9.431 73.656 37.812 1.00 26.95 ? 85 VAL A CB 1 ATOM 672 C CG1 . VAL A 1 85 ? -9.790 73.574 39.261 1.00 30.22 ? 85 VAL A CG1 1 ATOM 673 C CG2 . VAL A 1 85 ? -7.916 73.460 37.633 1.00 22.36 ? 85 VAL A CG2 1 ATOM 674 N N . GLU A 1 86 ? -12.465 73.456 36.955 1.00 32.92 ? 86 GLU A N 1 ATOM 675 C CA . GLU A 1 86 ? -13.882 73.531 37.279 1.00 39.26 ? 86 GLU A CA 1 ATOM 676 C C . GLU A 1 86 ? -14.493 72.178 36.970 1.00 40.56 ? 86 GLU A C 1 ATOM 677 O O . GLU A 1 86 ? -15.197 71.597 37.789 1.00 37.23 ? 86 GLU A O 1 ATOM 678 C CB . GLU A 1 86 ? -14.579 74.567 36.398 1.00 72.80 ? 86 GLU A CB 1 ATOM 679 C CG . GLU A 1 86 ? -15.529 75.488 37.122 1.00 97.08 ? 86 GLU A CG 1 ATOM 680 C CD . GLU A 1 86 ? -14.806 76.678 37.706 1.00 108.07 ? 86 GLU A CD 1 ATOM 681 O OE1 . GLU A 1 86 ? -13.931 76.472 38.576 1.00 116.74 ? 86 GLU A OE1 1 ATOM 682 O OE2 . GLU A 1 86 ? -15.102 77.817 37.283 1.00 103.07 ? 86 GLU A OE2 1 ATOM 683 N N . TYR A 1 87 ? -14.222 71.686 35.767 1.00 36.91 ? 87 TYR A N 1 ATOM 684 C CA . TYR A 1 87 ? -14.760 70.412 35.326 1.00 34.34 ? 87 TYR A CA 1 ATOM 685 C C . TYR A 1 87 ? -14.416 69.292 36.288 1.00 33.64 ? 87 TYR A C 1 ATOM 686 O O . TYR A 1 87 ? -15.255 68.449 36.580 1.00 33.84 ? 87 TYR A O 1 ATOM 687 C CB . TYR A 1 87 ? -14.239 70.051 33.929 1.00 24.28 ? 87 TYR A CB 1 ATOM 688 C CG . TYR A 1 87 ? -14.692 68.678 33.468 1.00 26.54 ? 87 TYR A CG 1 ATOM 689 C CD1 . TYR A 1 87 ? -15.965 68.486 32.951 1.00 28.09 ? 87 TYR A CD1 1 ATOM 690 C CD2 . TYR A 1 87 ? -13.859 67.566 33.599 1.00 20.17 ? 87 TYR A CD2 1 ATOM 691 C CE1 . TYR A 1 87 ? -16.403 67.220 32.575 1.00 36.89 ? 87 TYR A CE1 1 ATOM 692 C CE2 . TYR A 1 87 ? -14.287 66.295 33.231 1.00 33.84 ? 87 TYR A CE2 1 ATOM 693 C CZ . TYR A 1 87 ? -15.563 66.130 32.718 1.00 31.84 ? 87 TYR A CZ 1 ATOM 694 O OH . TYR A 1 87 ? -16.007 64.876 32.356 1.00 33.82 ? 87 TYR A OH 1 ATOM 695 N N . TYR A 1 88 ? -13.185 69.263 36.778 1.00 39.51 ? 88 TYR A N 1 ATOM 696 C CA . TYR A 1 88 ? -12.816 68.205 37.700 1.00 40.41 ? 88 TYR A CA 1 ATOM 697 C C . TYR A 1 88 ? -13.189 68.496 39.154 1.00 46.12 ? 88 TYR A C 1 ATOM 698 O O . TYR A 1 88 ? -12.918 67.685 40.040 1.00 43.87 ? 88 TYR A O 1 ATOM 699 C CB . TYR A 1 88 ? -11.327 67.884 37.574 1.00 32.93 ? 88 TYR A CB 1 ATOM 700 C CG . TYR A 1 88 ? -10.995 67.162 36.289 1.00 34.04 ? 88 TYR A CG 1 ATOM 701 C CD1 . TYR A 1 88 ? -10.436 67.837 35.211 1.00 32.68 ? 88 TYR A CD1 1 ATOM 702 C CD2 . TYR A 1 88 ? -11.289 65.806 36.135 1.00 32.22 ? 88 TYR A CD2 1 ATOM 703 C CE1 . TYR A 1 88 ? -10.180 67.185 34.016 1.00 31.27 ? 88 TYR A CE1 1 ATOM 704 C CE2 . TYR A 1 88 ? -11.038 65.146 34.948 1.00 40.75 ? 88 TYR A CE2 1 ATOM 705 C CZ . TYR A 1 88 ? -10.484 65.842 33.895 1.00 35.56 ? 88 TYR A CZ 1 ATOM 706 O OH . TYR A 1 88 ? -10.233 65.194 32.713 1.00 36.53 ? 88 TYR A OH 1 ATOM 707 N N . LYS A 1 89 ? -13.832 69.638 39.391 1.00 54.07 ? 89 LYS A N 1 ATOM 708 C CA . LYS A 1 89 ? -14.259 70.018 40.736 1.00 63.94 ? 89 LYS A CA 1 ATOM 709 C C . LYS A 1 89 ? -13.118 69.829 41.723 1.00 63.58 ? 89 LYS A C 1 ATOM 710 O O . LYS A 1 89 ? -13.239 69.067 42.679 1.00 63.57 ? 89 LYS A O 1 ATOM 711 C CB . LYS A 1 89 ? -15.445 69.158 41.176 1.00 63.38 ? 89 LYS A CB 1 ATOM 712 C CG . LYS A 1 89 ? -16.680 69.276 40.303 1.00 70.44 ? 89 LYS A CG 1 ATOM 713 C CD . LYS A 1 89 ? -17.735 68.271 40.739 1.00 80.17 ? 89 LYS A CD 1 ATOM 714 C CE . LYS A 1 89 ? -18.947 68.313 39.830 1.00 81.50 ? 89 LYS A CE 1 ATOM 715 N NZ . LYS A 1 89 ? -19.923 67.238 40.163 1.00 90.41 ? 89 LYS A NZ 1 ATOM 716 N N . ASP A 1 90 ? -12.013 70.526 41.496 1.00 66.43 ? 90 ASP A N 1 ATOM 717 C CA . ASP A 1 90 ? -10.863 70.389 42.370 1.00 65.80 ? 90 ASP A CA 1 ATOM 718 C C . ASP A 1 90 ? -9.949 71.612 42.316 1.00 67.45 ? 90 ASP A C 1 ATOM 719 O O . ASP A 1 90 ? -8.774 71.507 41.959 1.00 64.12 ? 90 ASP A O 1 ATOM 720 C CB . ASP A 1 90 ? -10.105 69.114 41.984 1.00 68.83 ? 90 ASP A CB 1 ATOM 721 C CG . ASP A 1 90 ? -8.768 68.993 42.676 1.00 78.96 ? 90 ASP A CG 1 ATOM 722 O OD1 . ASP A 1 90 ? -8.663 69.386 43.857 1.00 86.15 ? 90 ASP A OD1 1 ATOM 723 O OD2 . ASP A 1 90 ? -7.821 68.494 42.036 1.00 76.41 ? 90 ASP A OD2 1 ATOM 724 N N . SER A 1 91 ? -10.492 72.774 42.677 1.00 63.59 ? 91 SER A N 1 ATOM 725 C CA . SER A 1 91 ? -9.719 74.015 42.663 1.00 71.84 ? 91 SER A CA 1 ATOM 726 C C . SER A 1 91 ? -8.886 74.191 43.929 1.00 71.58 ? 91 SER A C 1 ATOM 727 O O . SER A 1 91 ? -8.250 75.222 44.121 1.00 73.76 ? 91 SER A O 1 ATOM 728 C CB . SER A 1 91 ? -10.643 75.222 42.479 1.00 44.99 ? 91 SER A CB 1 ATOM 729 O OG . SER A 1 91 ? -11.600 75.291 43.516 1.00 59.43 ? 91 SER A OG 1 ATOM 730 N N . THR A 1 92 ? -8.891 73.179 44.789 1.00 79.53 ? 92 THR A N 1 ATOM 731 C CA . THR A 1 92 ? -8.117 73.228 46.023 1.00 83.69 ? 92 THR A CA 1 ATOM 732 C C . THR A 1 92 ? -6.676 72.825 45.722 1.00 82.89 ? 92 THR A C 1 ATOM 733 O O . THR A 1 92 ? -5.759 73.128 46.494 1.00 80.50 ? 92 THR A O 1 ATOM 734 C CB . THR A 1 92 ? -8.679 72.258 47.089 1.00 70.94 ? 92 THR A CB 1 ATOM 735 O OG1 . THR A 1 92 ? -8.573 70.907 46.617 1.00 79.26 ? 92 THR A OG1 1 ATOM 736 C CG2 . THR A 1 92 ? -10.138 72.580 47.387 1.00 73.73 ? 92 THR A CG2 1 ATOM 737 N N . GLY A 1 93 ? -6.490 72.143 44.592 1.00 53.48 ? 93 GLY A N 1 ATOM 738 C CA . GLY A 1 93 ? -5.168 71.690 44.189 1.00 51.05 ? 93 GLY A CA 1 ATOM 739 C C . GLY A 1 93 ? -4.472 72.620 43.215 1.00 41.23 ? 93 GLY A C 1 ATOM 740 O O . GLY A 1 93 ? -5.072 73.565 42.691 1.00 39.13 ? 93 GLY A O 1 ATOM 741 N N . SER A 1 94 ? -3.195 72.349 42.974 1.00 65.43 ? 94 SER A N 1 ATOM 742 C CA . SER A 1 94 ? -2.405 73.159 42.059 1.00 62.81 ? 94 SER A CA 1 ATOM 743 C C . SER A 1 94 ? -2.224 72.436 40.720 1.00 52.82 ? 94 SER A C 1 ATOM 744 O O . SER A 1 94 ? -1.540 71.419 40.644 1.00 54.48 ? 94 SER A O 1 ATOM 745 C CB . SER A 1 94 ? -1.041 73.470 42.684 1.00 55.18 ? 94 SER A CB 1 ATOM 746 O OG . SER A 1 94 ? -0.309 74.372 41.877 1.00 62.39 ? 94 SER A OG 1 ATOM 747 N N . HIS A 1 95 ? -2.833 72.971 39.666 1.00 47.09 ? 95 HIS A N 1 ATOM 748 C CA . HIS A 1 95 ? -2.734 72.356 38.352 1.00 44.67 ? 95 HIS A CA 1 ATOM 749 C C . HIS A 1 95 ? -2.054 73.244 37.326 1.00 45.94 ? 95 HIS A C 1 ATOM 750 O O . HIS A 1 95 ? -2.021 74.464 37.466 1.00 42.51 ? 95 HIS A O 1 ATOM 751 C CB . HIS A 1 95 ? -4.123 71.986 37.859 1.00 36.02 ? 95 HIS A CB 1 ATOM 752 C CG . HIS A 1 95 ? -4.899 71.170 38.838 1.00 39.27 ? 95 HIS A CG 1 ATOM 753 N ND1 . HIS A 1 95 ? -4.622 69.843 39.084 1.00 43.60 ? 95 HIS A ND1 1 ATOM 754 C CD2 . HIS A 1 95 ? -5.926 71.500 39.655 1.00 39.42 ? 95 HIS A CD2 1 ATOM 755 C CE1 . HIS A 1 95 ? -5.446 69.390 40.010 1.00 45.24 ? 95 HIS A CE1 1 ATOM 756 N NE2 . HIS A 1 95 ? -6.247 70.375 40.374 1.00 37.77 ? 95 HIS A NE2 1 ATOM 757 N N . VAL A 1 96 ? -1.519 72.619 36.283 1.00 32.34 ? 96 VAL A N 1 ATOM 758 C CA . VAL A 1 96 ? -0.829 73.357 35.242 1.00 32.34 ? 96 VAL A CA 1 ATOM 759 C C . VAL A 1 96 ? -1.313 73.009 33.848 1.00 32.34 ? 96 VAL A C 1 ATOM 760 O O . VAL A 1 96 ? -1.677 71.861 33.560 1.00 34.91 ? 96 VAL A O 1 ATOM 761 C CB . VAL A 1 96 ? 0.670 73.097 35.298 1.00 17.60 ? 96 VAL A CB 1 ATOM 762 C CG1 . VAL A 1 96 ? 0.921 71.612 35.309 1.00 19.92 ? 96 VAL A CG1 1 ATOM 763 C CG2 . VAL A 1 96 ? 1.352 73.724 34.107 1.00 16.13 ? 96 VAL A CG2 1 ATOM 764 N N . LEU A 1 97 ? -1.324 74.034 32.998 1.00 23.77 ? 97 LEU A N 1 ATOM 765 C CA . LEU A 1 97 ? -1.713 73.915 31.601 1.00 23.77 ? 97 LEU A CA 1 ATOM 766 C C . LEU A 1 97 ? -0.544 74.484 30.820 1.00 23.77 ? 97 LEU A C 1 ATOM 767 O O . LEU A 1 97 ? -0.154 75.630 31.027 1.00 23.77 ? 97 LEU A O 1 ATOM 768 C CB . LEU A 1 97 ? -2.975 74.736 31.299 1.00 22.07 ? 97 LEU A CB 1 ATOM 769 C CG . LEU A 1 97 ? -3.422 74.734 29.831 1.00 22.07 ? 97 LEU A CG 1 ATOM 770 C CD1 . LEU A 1 97 ? -3.712 73.304 29.424 1.00 22.07 ? 97 LEU A CD1 1 ATOM 771 C CD2 . LEU A 1 97 ? -4.648 75.580 29.631 1.00 22.07 ? 97 LEU A CD2 1 ATOM 772 N N . GLN A 1 98 ? 0.037 73.670 29.949 1.00 29.20 ? 98 GLN A N 1 ATOM 773 C CA . GLN A 1 98 ? 1.159 74.111 29.126 1.00 29.20 ? 98 GLN A CA 1 ATOM 774 C C . GLN A 1 98 ? 0.728 73.942 27.686 1.00 29.20 ? 98 GLN A C 1 ATOM 775 O O . GLN A 1 98 ? 0.129 72.938 27.333 1.00 29.53 ? 98 GLN A O 1 ATOM 776 C CB . GLN A 1 98 ? 2.408 73.283 29.431 1.00 25.39 ? 98 GLN A CB 1 ATOM 777 C CG . GLN A 1 98 ? 2.711 73.270 30.925 1.00 26.32 ? 98 GLN A CG 1 ATOM 778 C CD . GLN A 1 98 ? 3.831 72.345 31.299 1.00 25.39 ? 98 GLN A CD 1 ATOM 779 O OE1 . GLN A 1 98 ? 5.003 72.721 31.253 1.00 31.00 ? 98 GLN A OE1 1 ATOM 780 N NE2 . GLN A 1 98 ? 3.479 71.119 31.670 1.00 25.39 ? 98 GLN A NE2 1 ATOM 781 N N . GLY A 1 99 ? 1.001 74.949 26.871 1.00 17.93 ? 99 GLY A N 1 ATOM 782 C CA . GLY A 1 99 ? 0.599 74.894 25.488 1.00 17.93 ? 99 GLY A CA 1 ATOM 783 C C . GLY A 1 99 ? 1.800 75.167 24.639 1.00 17.93 ? 99 GLY A C 1 ATOM 784 O O . GLY A 1 99 ? 2.676 75.933 25.016 1.00 17.93 ? 99 GLY A O 1 ATOM 785 N N . ARG A 1 100 ? 1.828 74.560 23.469 1.00 25.79 ? 100 ARG A N 1 ATOM 786 C CA . ARG A 1 100 ? 2.963 74.693 22.589 1.00 25.79 ? 100 ARG A CA 1 ATOM 787 C C . ARG A 1 100 ? 2.458 74.923 21.182 1.00 25.79 ? 100 ARG A C 1 ATOM 788 O O . ARG A 1 100 ? 1.569 74.212 20.731 1.00 25.79 ? 100 ARG A O 1 ATOM 789 C CB . ARG A 1 100 ? 3.752 73.395 22.690 1.00 18.10 ? 100 ARG A CB 1 ATOM 790 C CG . ARG A 1 100 ? 4.895 73.244 21.773 1.00 24.39 ? 100 ARG A CG 1 ATOM 791 C CD . ARG A 1 100 ? 5.769 72.079 22.202 1.00 27.89 ? 100 ARG A CD 1 ATOM 792 N NE . ARG A 1 100 ? 6.936 72.037 21.340 1.00 36.63 ? 100 ARG A NE 1 ATOM 793 C CZ . ARG A 1 100 ? 6.895 71.584 20.098 1.00 34.99 ? 100 ARG A CZ 1 ATOM 794 N NH1 . ARG A 1 100 ? 5.750 71.126 19.607 1.00 27.96 ? 100 ARG A NH1 1 ATOM 795 N NH2 . ARG A 1 100 ? 7.979 71.636 19.332 1.00 30.09 ? 100 ARG A NH2 1 ATOM 796 N N . PHE A 1 101 ? 2.992 75.921 20.488 1.00 34.80 ? 101 PHE A N 1 ATOM 797 C CA . PHE A 1 101 ? 2.556 76.175 19.122 1.00 34.80 ? 101 PHE A CA 1 ATOM 798 C C . PHE A 1 101 ? 3.602 76.939 18.344 1.00 37.00 ? 101 PHE A C 1 ATOM 799 O O . PHE A 1 101 ? 4.311 77.775 18.890 1.00 34.80 ? 101 PHE A O 1 ATOM 800 C CB . PHE A 1 101 ? 1.222 76.927 19.112 1.00 24.00 ? 101 PHE A CB 1 ATOM 801 C CG . PHE A 1 101 ? 1.278 78.265 19.765 1.00 22.65 ? 101 PHE A CG 1 ATOM 802 C CD1 . PHE A 1 101 ? 1.695 79.386 19.050 1.00 28.50 ? 101 PHE A CD1 1 ATOM 803 C CD2 . PHE A 1 101 ? 0.932 78.409 21.113 1.00 23.89 ? 101 PHE A CD2 1 ATOM 804 C CE1 . PHE A 1 101 ? 1.770 80.641 19.671 1.00 29.75 ? 101 PHE A CE1 1 ATOM 805 C CE2 . PHE A 1 101 ? 1.002 79.656 21.748 1.00 29.68 ? 101 PHE A CE2 1 ATOM 806 C CZ . PHE A 1 101 ? 1.424 80.775 21.024 1.00 35.55 ? 101 PHE A CZ 1 ATOM 807 N N . GLY A 1 102 ? 3.699 76.630 17.061 1.00 27.26 ? 102 GLY A N 1 ATOM 808 C CA . GLY A 1 102 ? 4.666 77.283 16.206 1.00 27.26 ? 102 GLY A CA 1 ATOM 809 C C . GLY A 1 102 ? 4.720 76.623 14.837 1.00 29.01 ? 102 GLY A C 1 ATOM 810 O O . GLY A 1 102 ? 3.921 75.729 14.528 1.00 27.26 ? 102 GLY A O 1 ATOM 811 N N . CYS A 1 103 ? 5.655 77.059 14.004 1.00 28.45 ? 103 CYS A N 1 ATOM 812 C CA . CYS A 1 103 ? 5.790 76.478 12.681 1.00 28.45 ? 103 CYS A CA 1 ATOM 813 C C . CYS A 1 103 ? 7.259 76.380 12.283 1.00 35.08 ? 103 CYS A C 1 ATOM 814 O O . CYS A 1 103 ? 8.148 76.768 13.037 1.00 31.59 ? 103 CYS A O 1 ATOM 815 C CB . CYS A 1 103 ? 5.022 77.321 11.670 1.00 34.42 ? 103 CYS A CB 1 ATOM 816 S SG . CYS A 1 103 ? 5.573 79.021 11.583 1.00 39.49 ? 103 CYS A SG 1 ATOM 817 N N . GLU A 1 104 ? 7.518 75.843 11.103 1.00 41.39 ? 104 GLU A N 1 ATOM 818 C CA . GLU A 1 104 ? 8.886 75.713 10.637 1.00 41.97 ? 104 GLU A CA 1 ATOM 819 C C . GLU A 1 104 ? 8.950 75.701 9.123 1.00 48.92 ? 104 GLU A C 1 ATOM 820 O O . GLU A 1 104 ? 8.053 75.185 8.461 1.00 43.80 ? 104 GLU A O 1 ATOM 821 C CB . GLU A 1 104 ? 9.509 74.439 11.182 1.00 20.55 ? 104 GLU A CB 1 ATOM 822 C CG . GLU A 1 104 ? 8.670 73.231 10.957 1.00 47.71 ? 104 GLU A CG 1 ATOM 823 C CD . GLU A 1 104 ? 9.367 71.973 11.398 1.00 62.13 ? 104 GLU A CD 1 ATOM 824 O OE1 . GLU A 1 104 ? 10.301 71.541 10.692 1.00 60.75 ? 104 GLU A OE1 1 ATOM 825 O OE2 . GLU A 1 104 ? 8.986 71.425 12.455 1.00 60.18 ? 104 GLU A OE2 1 ATOM 826 N N . ILE A 1 105 ? 10.009 76.284 8.579 1.00 41.27 ? 105 ILE A N 1 ATOM 827 C CA . ILE A 1 105 ? 10.184 76.330 7.143 1.00 45.48 ? 105 ILE A CA 1 ATOM 828 C C . ILE A 1 105 ? 11.567 75.827 6.796 1.00 48.90 ? 105 ILE A C 1 ATOM 829 O O . ILE A 1 105 ? 12.486 75.883 7.608 1.00 46.32 ? 105 ILE A O 1 ATOM 830 C CB . ILE A 1 105 ? 10.024 77.756 6.607 1.00 42.49 ? 105 ILE A CB 1 ATOM 831 C CG1 . ILE A 1 105 ? 11.139 78.638 7.147 1.00 51.33 ? 105 ILE A CG1 1 ATOM 832 C CG2 . ILE A 1 105 ? 8.689 78.330 7.043 1.00 37.76 ? 105 ILE A CG2 1 ATOM 833 C CD1 . ILE A 1 105 ? 10.939 80.086 6.806 1.00 55.97 ? 105 ILE A CD1 1 ATOM 834 N N . GLU A 1 106 ? 11.700 75.328 5.579 1.00 46.82 ? 106 GLU A N 1 ATOM 835 C CA . GLU A 1 106 ? 12.960 74.803 5.097 1.00 52.69 ? 106 GLU A CA 1 ATOM 836 C C . GLU A 1 106 ? 13.032 75.145 3.618 1.00 56.88 ? 106 GLU A C 1 ATOM 837 O O . GLU A 1 106 ? 12.180 74.728 2.841 1.00 57.74 ? 106 GLU A O 1 ATOM 838 C CB . GLU A 1 106 ? 12.991 73.299 5.329 1.00 38.82 ? 106 GLU A CB 1 ATOM 839 C CG . GLU A 1 106 ? 14.154 72.592 4.709 1.00 55.74 ? 106 GLU A CG 1 ATOM 840 C CD . GLU A 1 106 ? 14.280 71.171 5.216 1.00 66.95 ? 106 GLU A CD 1 ATOM 841 O OE1 . GLU A 1 106 ? 13.237 70.487 5.316 1.00 71.95 ? 106 GLU A OE1 1 ATOM 842 O OE2 . GLU A 1 106 ? 15.418 70.736 5.512 1.00 70.64 ? 106 GLU A OE2 1 ATOM 843 N N . ASN A 1 107 ? 14.040 75.925 3.237 1.00 62.25 ? 107 ASN A N 1 ATOM 844 C CA . ASN A 1 107 ? 14.197 76.354 1.850 1.00 59.36 ? 107 ASN A CA 1 ATOM 845 C C . ASN A 1 107 ? 13.033 77.279 1.528 1.00 56.08 ? 107 ASN A C 1 ATOM 846 O O . ASN A 1 107 ? 12.405 77.160 0.482 1.00 59.86 ? 107 ASN A O 1 ATOM 847 C CB . ASN A 1 107 ? 14.177 75.153 0.904 1.00 79.05 ? 107 ASN A CB 1 ATOM 848 C CG . ASN A 1 107 ? 15.269 74.152 1.213 1.00 90.71 ? 107 ASN A CG 1 ATOM 849 O OD1 . ASN A 1 107 ? 15.343 73.094 0.594 1.00 92.20 ? 107 ASN A OD1 1 ATOM 850 N ND2 . ASN A 1 107 ? 16.126 74.482 2.175 1.00 93.11 ? 107 ASN A ND2 1 ATOM 851 N N . ASN A 1 108 ? 12.759 78.195 2.454 1.00 50.56 ? 108 ASN A N 1 ATOM 852 C CA . ASN A 1 108 ? 11.673 79.161 2.341 1.00 58.37 ? 108 ASN A CA 1 ATOM 853 C C . ASN A 1 108 ? 10.295 78.484 2.183 1.00 60.28 ? 108 ASN A C 1 ATOM 854 O O . ASN A 1 108 ? 9.276 79.155 2.077 1.00 58.64 ? 108 ASN A O 1 ATOM 855 C CB . ASN A 1 108 ? 11.984 80.163 1.208 1.00 58.59 ? 108 ASN A CB 1 ATOM 856 C CG . ASN A 1 108 ? 10.757 80.943 0.745 1.00 75.35 ? 108 ASN A CG 1 ATOM 857 O OD1 . ASN A 1 108 ? 9.848 80.358 0.158 1.00 90.90 ? 108 ASN A OD1 1 ATOM 858 N ND2 . ASN A 1 108 ? 10.717 82.253 0.974 1.00 73.71 ? 108 ASN A ND2 1 ATOM 859 N N . ARG A 1 109 ? 10.261 77.153 2.210 1.00 43.53 ? 109 ARG A N 1 ATOM 860 C CA . ARG A 1 109 ? 8.998 76.409 2.100 1.00 48.43 ? 109 ARG A CA 1 ATOM 861 C C . ARG A 1 109 ? 8.500 75.958 3.483 1.00 41.37 ? 109 ARG A C 1 ATOM 862 O O . ARG A 1 109 ? 9.280 75.439 4.276 1.00 35.83 ? 109 ARG A O 1 ATOM 863 C CB . ARG A 1 109 ? 9.196 75.176 1.216 1.00 107.95 ? 109 ARG A CB 1 ATOM 864 C CG . ARG A 1 109 ? 9.562 75.488 -0.221 1.00 130.44 ? 109 ARG A CG 1 ATOM 865 C CD . ARG A 1 109 ? 8.373 76.044 -0.979 1.00 140.36 ? 109 ARG A CD 1 ATOM 866 N NE . ARG A 1 109 ? 8.715 76.388 -2.355 1.00 149.73 ? 109 ARG A NE 1 ATOM 867 C CZ . ARG A 1 109 ? 7.828 76.762 -3.271 1.00 154.90 ? 109 ARG A CZ 1 ATOM 868 N NH1 . ARG A 1 109 ? 6.541 76.839 -2.959 1.00 157.46 ? 109 ARG A NH1 1 ATOM 869 N NH2 . ARG A 1 109 ? 8.227 77.063 -4.498 1.00 155.06 ? 109 ARG A NH2 1 ATOM 870 N N . SER A 1 110 ? 7.219 76.149 3.787 1.00 42.65 ? 110 SER A N 1 ATOM 871 C CA . SER A 1 110 ? 6.704 75.713 5.091 1.00 42.28 ? 110 SER A CA 1 ATOM 872 C C . SER A 1 110 ? 6.879 74.207 5.207 1.00 44.59 ? 110 SER A C 1 ATOM 873 O O . SER A 1 110 ? 6.350 73.455 4.395 1.00 45.03 ? 110 SER A O 1 ATOM 874 C CB . SER A 1 110 ? 5.225 76.061 5.251 1.00 35.84 ? 110 SER A CB 1 ATOM 875 O OG . SER A 1 110 ? 5.051 77.441 5.511 1.00 37.91 ? 110 SER A OG 1 ATOM 876 N N . SER A 1 111 ? 7.618 73.769 6.219 1.00 29.78 ? 111 SER A N 1 ATOM 877 C CA . SER A 1 111 ? 7.884 72.351 6.415 1.00 25.80 ? 111 SER A CA 1 ATOM 878 C C . SER A 1 111 ? 7.250 71.734 7.661 1.00 27.74 ? 111 SER A C 1 ATOM 879 O O . SER A 1 111 ? 7.686 70.680 8.121 1.00 34.86 ? 111 SER A O 1 ATOM 880 C CB . SER A 1 111 ? 9.400 72.115 6.444 1.00 43.21 ? 111 SER A CB 1 ATOM 881 O OG . SER A 1 111 ? 10.012 72.761 7.546 1.00 51.09 ? 111 SER A OG 1 ATOM 882 N N . GLY A 1 112 ? 6.229 72.378 8.217 1.00 49.75 ? 112 GLY A N 1 ATOM 883 C CA . GLY A 1 112 ? 5.592 71.812 9.393 1.00 49.13 ? 112 GLY A CA 1 ATOM 884 C C . GLY A 1 112 ? 4.975 72.826 10.322 1.00 49.85 ? 112 GLY A C 1 ATOM 885 O O . GLY A 1 112 ? 5.297 74.008 10.269 1.00 42.36 ? 112 GLY A O 1 ATOM 886 N N . ALA A 1 113 ? 4.084 72.357 11.187 1.00 27.30 ? 113 ALA A N 1 ATOM 887 C CA . ALA A 1 113 ? 3.418 73.230 12.143 1.00 30.24 ? 113 ALA A CA 1 ATOM 888 C C . ALA A 1 113 ? 2.763 72.378 13.231 1.00 29.01 ? 113 ALA A C 1 ATOM 889 O O . ALA A 1 113 ? 2.499 71.205 13.011 1.00 26.94 ? 113 ALA A O 1 ATOM 890 C CB . ALA A 1 113 ? 2.382 74.079 11.420 1.00 26.14 ? 113 ALA A CB 1 ATOM 891 N N . PHE A 1 114 ? 2.505 72.964 14.400 1.00 28.81 ? 114 PHE A N 1 ATOM 892 C CA . PHE A 1 114 ? 1.893 72.230 15.514 1.00 28.81 ? 114 PHE A CA 1 ATOM 893 C C . PHE A 1 114 ? 1.143 73.153 16.463 1.00 28.81 ? 114 PHE A C 1 ATOM 894 O O . PHE A 1 114 ? 1.322 74.360 16.444 1.00 28.81 ? 114 PHE A O 1 ATOM 895 C CB . PHE A 1 114 ? 2.969 71.464 16.294 1.00 23.31 ? 114 PHE A CB 1 ATOM 896 C CG . PHE A 1 114 ? 4.124 72.319 16.711 1.00 23.56 ? 114 PHE A CG 1 ATOM 897 C CD1 . PHE A 1 114 ? 4.025 73.162 17.806 1.00 25.64 ? 114 PHE A CD1 1 ATOM 898 C CD2 . PHE A 1 114 ? 5.281 72.363 15.942 1.00 21.07 ? 114 PHE A CD2 1 ATOM 899 C CE1 . PHE A 1 114 ? 5.063 74.042 18.114 1.00 24.32 ? 114 PHE A CE1 1 ATOM 900 C CE2 . PHE A 1 114 ? 6.319 73.241 16.247 1.00 27.95 ? 114 PHE A CE2 1 ATOM 901 C CZ . PHE A 1 114 ? 6.212 74.079 17.326 1.00 26.00 ? 114 PHE A CZ 1 ATOM 902 N N . TRP A 1 115 ? 0.310 72.564 17.305 1.00 26.95 ? 115 TRP A N 1 ATOM 903 C CA . TRP A 1 115 ? -0.484 73.313 18.267 1.00 26.95 ? 115 TRP A CA 1 ATOM 904 C C . TRP A 1 115 ? -1.006 72.275 19.248 1.00 26.95 ? 115 TRP A C 1 ATOM 905 O O . TRP A 1 115 ? -1.951 71.557 18.934 1.00 26.95 ? 115 TRP A O 1 ATOM 906 C CB . TRP A 1 115 ? -1.659 73.977 17.560 1.00 22.56 ? 115 TRP A CB 1 ATOM 907 C CG . TRP A 1 115 ? -2.254 75.140 18.295 1.00 22.56 ? 115 TRP A CG 1 ATOM 908 C CD1 . TRP A 1 115 ? -2.239 75.365 19.648 1.00 22.56 ? 115 TRP A CD1 1 ATOM 909 C CD2 . TRP A 1 115 ? -2.971 76.238 17.717 1.00 22.56 ? 115 TRP A CD2 1 ATOM 910 N NE1 . TRP A 1 115 ? -2.902 76.535 19.944 1.00 22.56 ? 115 TRP A NE1 1 ATOM 911 C CE2 . TRP A 1 115 ? -3.361 77.090 18.778 1.00 22.56 ? 115 TRP A CE2 1 ATOM 912 C CE3 . TRP A 1 115 ? -3.324 76.584 16.404 1.00 26.01 ? 115 TRP A CE3 1 ATOM 913 C CZ2 . TRP A 1 115 ? -4.088 78.266 18.564 1.00 23.72 ? 115 TRP A CZ2 1 ATOM 914 C CZ3 . TRP A 1 115 ? -4.049 77.755 16.195 1.00 25.85 ? 115 TRP A CZ3 1 ATOM 915 C CH2 . TRP A 1 115 ? -4.421 78.579 17.271 1.00 25.54 ? 115 TRP A CH2 1 ATOM 916 N N . LYS A 1 116 ? -0.401 72.185 20.428 1.00 30.75 ? 116 LYS A N 1 ATOM 917 C CA . LYS A 1 116 ? -0.830 71.191 21.404 1.00 30.75 ? 116 LYS A CA 1 ATOM 918 C C . LYS A 1 116 ? -0.859 71.701 22.841 1.00 30.75 ? 116 LYS A C 1 ATOM 919 O O . LYS A 1 116 ? -0.083 72.581 23.210 1.00 30.75 ? 116 LYS A O 1 ATOM 920 C CB . LYS A 1 116 ? 0.091 69.983 21.319 1.00 17.36 ? 116 LYS A CB 1 ATOM 921 C CG . LYS A 1 116 ? -0.502 68.711 21.873 1.00 17.36 ? 116 LYS A CG 1 ATOM 922 C CD . LYS A 1 116 ? 0.540 67.620 21.877 1.00 18.45 ? 116 LYS A CD 1 ATOM 923 C CE . LYS A 1 116 ? -0.028 66.334 22.382 1.00 17.36 ? 116 LYS A CE 1 ATOM 924 N NZ . LYS A 1 116 ? 1.044 65.330 22.480 1.00 17.36 ? 116 LYS A NZ 1 ATOM 925 N N . TYR A 1 117 ? -1.751 71.133 23.652 1.00 22.49 ? 117 TYR A N 1 ATOM 926 C CA . TYR A 1 117 ? -1.882 71.530 25.058 1.00 22.49 ? 117 TYR A CA 1 ATOM 927 C C . TYR A 1 117 ? -1.718 70.344 26.000 1.00 22.49 ? 117 TYR A C 1 ATOM 928 O O . TYR A 1 117 ? -2.147 69.234 25.701 1.00 22.49 ? 117 TYR A O 1 ATOM 929 C CB . TYR A 1 117 ? -3.249 72.187 25.321 1.00 25.84 ? 117 TYR A CB 1 ATOM 930 C CG . TYR A 1 117 ? -3.460 73.523 24.640 1.00 25.98 ? 117 TYR A CG 1 ATOM 931 C CD1 . TYR A 1 117 ? -3.879 73.597 23.321 1.00 25.84 ? 117 TYR A CD1 1 ATOM 932 C CD2 . TYR A 1 117 ? -3.197 74.714 25.308 1.00 25.84 ? 117 TYR A CD2 1 ATOM 933 C CE1 . TYR A 1 117 ? -4.024 74.825 22.686 1.00 25.84 ? 117 TYR A CE1 1 ATOM 934 C CE2 . TYR A 1 117 ? -3.338 75.940 24.682 1.00 29.79 ? 117 TYR A CE2 1 ATOM 935 C CZ . TYR A 1 117 ? -3.749 75.986 23.376 1.00 32.41 ? 117 TYR A CZ 1 ATOM 936 O OH . TYR A 1 117 ? -3.880 77.193 22.750 1.00 29.29 ? 117 TYR A OH 1 ATOM 937 N N . TYR A 1 118 ? -1.096 70.580 27.144 1.00 23.83 ? 118 TYR A N 1 ATOM 938 C CA . TYR A 1 118 ? -0.901 69.520 28.111 1.00 23.83 ? 118 TYR A CA 1 ATOM 939 C C . TYR A 1 118 ? -1.494 69.954 29.434 1.00 23.83 ? 118 TYR A C 1 ATOM 940 O O . TYR A 1 118 ? -1.320 71.098 29.858 1.00 23.83 ? 118 TYR A O 1 ATOM 941 C CB . TYR A 1 118 ? 0.584 69.233 28.300 1.00 19.48 ? 118 TYR A CB 1 ATOM 942 C CG . TYR A 1 118 ? 1.318 68.995 27.017 1.00 18.97 ? 118 TYR A CG 1 ATOM 943 C CD1 . TYR A 1 118 ? 1.624 70.050 26.166 1.00 18.97 ? 118 TYR A CD1 1 ATOM 944 C CD2 . TYR A 1 118 ? 1.647 67.705 26.607 1.00 18.97 ? 118 TYR A CD2 1 ATOM 945 C CE1 . TYR A 1 118 ? 2.233 69.829 24.935 1.00 18.97 ? 118 TYR A CE1 1 ATOM 946 C CE2 . TYR A 1 118 ? 2.256 67.478 25.373 1.00 21.62 ? 118 TYR A CE2 1 ATOM 947 C CZ . TYR A 1 118 ? 2.541 68.547 24.553 1.00 24.50 ? 118 TYR A CZ 1 ATOM 948 O OH . TYR A 1 118 ? 3.144 68.341 23.352 1.00 20.09 ? 118 TYR A OH 1 ATOM 949 N N . TYR A 1 119 ? -2.206 69.046 30.084 1.00 31.64 ? 119 TYR A N 1 ATOM 950 C CA . TYR A 1 119 ? -2.796 69.363 31.367 1.00 31.64 ? 119 TYR A CA 1 ATOM 951 C C . TYR A 1 119 ? -2.200 68.431 32.417 1.00 31.64 ? 119 TYR A C 1 ATOM 952 O O . TYR A 1 119 ? -2.259 67.203 32.280 1.00 31.64 ? 119 TYR A O 1 ATOM 953 C CB . TYR A 1 119 ? -4.303 69.210 31.305 1.00 18.92 ? 119 TYR A CB 1 ATOM 954 C CG . TYR A 1 119 ? -4.959 69.431 32.632 1.00 19.68 ? 119 TYR A CG 1 ATOM 955 C CD1 . TYR A 1 119 ? -4.849 70.653 33.298 1.00 19.69 ? 119 TYR A CD1 1 ATOM 956 C CD2 . TYR A 1 119 ? -5.699 68.418 33.229 1.00 23.87 ? 119 TYR A CD2 1 ATOM 957 C CE1 . TYR A 1 119 ? -5.472 70.855 34.538 1.00 24.52 ? 119 TYR A CE1 1 ATOM 958 C CE2 . TYR A 1 119 ? -6.319 68.604 34.456 1.00 25.32 ? 119 TYR A CE2 1 ATOM 959 C CZ . TYR A 1 119 ? -6.204 69.817 35.110 1.00 31.57 ? 119 TYR A CZ 1 ATOM 960 O OH . TYR A 1 119 ? -6.815 69.957 36.336 1.00 29.97 ? 119 TYR A OH 1 ATOM 961 N N . ASP A 1 120 ? -1.625 69.024 33.462 1.00 33.41 ? 120 ASP A N 1 ATOM 962 C CA . ASP A 1 120 ? -0.975 68.263 34.522 1.00 33.41 ? 120 ASP A CA 1 ATOM 963 C C . ASP A 1 120 ? -0.036 67.224 33.924 1.00 33.41 ? 120 ASP A C 1 ATOM 964 O O . ASP A 1 120 ? 0.096 66.112 34.444 1.00 33.41 ? 120 ASP A O 1 ATOM 965 C CB . ASP A 1 120 ? -1.995 67.580 35.431 1.00 32.52 ? 120 ASP A CB 1 ATOM 966 C CG . ASP A 1 120 ? -2.559 68.519 36.492 1.00 37.85 ? 120 ASP A CG 1 ATOM 967 O OD1 . ASP A 1 120 ? -2.009 69.632 36.685 1.00 36.09 ? 120 ASP A OD1 1 ATOM 968 O OD2 . ASP A 1 120 ? -3.554 68.130 37.144 1.00 38.48 ? 120 ASP A OD2 1 ATOM 969 N N . GLY A 1 121 ? 0.612 67.598 32.822 1.00 21.19 ? 121 GLY A N 1 ATOM 970 C CA . GLY A 1 121 ? 1.551 66.701 32.173 1.00 21.19 ? 121 GLY A CA 1 ATOM 971 C C . GLY A 1 121 ? 1.015 65.799 31.072 1.00 22.91 ? 121 GLY A C 1 ATOM 972 O O . GLY A 1 121 ? 1.793 65.347 30.239 1.00 24.80 ? 121 GLY A O 1 ATOM 973 N N . LYS A 1 122 ? -0.294 65.533 31.064 1.00 34.26 ? 122 LYS A N 1 ATOM 974 C CA . LYS A 1 122 ? -0.909 64.659 30.053 1.00 34.40 ? 122 LYS A CA 1 ATOM 975 C C . LYS A 1 122 ? -1.443 65.417 28.837 1.00 32.54 ? 122 LYS A C 1 ATOM 976 O O . LYS A 1 122 ? -1.810 66.595 28.925 1.00 32.24 ? 122 LYS A O 1 ATOM 977 C CB . LYS A 1 122 ? -2.065 63.830 30.650 1.00 37.12 ? 122 LYS A CB 1 ATOM 978 C CG . LYS A 1 122 ? -1.711 62.902 31.813 1.00 50.36 ? 122 LYS A CG 1 ATOM 979 C CD . LYS A 1 122 ? -1.760 63.654 33.138 1.00 82.32 ? 122 LYS A CD 1 ATOM 980 C CE . LYS A 1 122 ? -1.357 62.779 34.323 1.00 92.73 ? 122 LYS A CE 1 ATOM 981 N NZ . LYS A 1 122 ? -1.352 63.550 35.613 1.00 78.58 ? 122 LYS A NZ 1 ATOM 982 N N . ASP A 1 123 ? -1.488 64.733 27.698 1.00 26.84 ? 123 ASP A N 1 ATOM 983 C CA . ASP A 1 123 ? -1.989 65.350 26.477 1.00 27.84 ? 123 ASP A CA 1 ATOM 984 C C . ASP A 1 123 ? -3.422 65.822 26.708 1.00 26.84 ? 123 ASP A C 1 ATOM 985 O O . ASP A 1 123 ? -4.273 65.049 27.125 1.00 28.24 ? 123 ASP A O 1 ATOM 986 C CB . ASP A 1 123 ? -1.944 64.356 25.308 1.00 37.57 ? 123 ASP A CB 1 ATOM 987 C CG . ASP A 1 123 ? -0.520 64.057 24.838 1.00 42.13 ? 123 ASP A CG 1 ATOM 988 O OD1 . ASP A 1 123 ? 0.444 64.658 25.375 1.00 39.91 ? 123 ASP A OD1 1 ATOM 989 O OD2 . ASP A 1 123 ? -0.360 63.216 23.923 1.00 46.26 ? 123 ASP A OD2 1 ATOM 990 N N . TYR A 1 124 ? -3.686 67.096 26.446 1.00 34.60 ? 124 TYR A N 1 ATOM 991 C CA . TYR A 1 124 ? -5.025 67.612 26.647 1.00 34.60 ? 124 TYR A CA 1 ATOM 992 C C . TYR A 1 124 ? -5.814 67.735 25.359 1.00 34.60 ? 124 TYR A C 1 ATOM 993 O O . TYR A 1 124 ? -6.876 67.127 25.217 1.00 34.60 ? 124 TYR A O 1 ATOM 994 C CB . TYR A 1 124 ? -4.989 68.981 27.337 1.00 26.90 ? 124 TYR A CB 1 ATOM 995 C CG . TYR A 1 124 ? -6.371 69.507 27.681 1.00 31.74 ? 124 TYR A CG 1 ATOM 996 C CD1 . TYR A 1 124 ? -7.192 68.816 28.567 1.00 26.90 ? 124 TYR A CD1 1 ATOM 997 C CD2 . TYR A 1 124 ? -6.871 70.668 27.087 1.00 26.90 ? 124 TYR A CD2 1 ATOM 998 C CE1 . TYR A 1 124 ? -8.473 69.254 28.850 1.00 26.90 ? 124 TYR A CE1 1 ATOM 999 C CE2 . TYR A 1 124 ? -8.149 71.121 27.361 1.00 26.90 ? 124 TYR A CE2 1 ATOM 1000 C CZ . TYR A 1 124 ? -8.954 70.405 28.241 1.00 27.71 ? 124 TYR A CZ 1 ATOM 1001 O OH . TYR A 1 124 ? -10.256 70.801 28.482 1.00 30.12 ? 124 TYR A OH 1 ATOM 1002 N N . ILE A 1 125 ? -5.295 68.525 24.424 1.00 35.00 ? 125 ILE A N 1 ATOM 1003 C CA . ILE A 1 125 ? -5.979 68.764 23.157 1.00 35.00 ? 125 ILE A CA 1 ATOM 1004 C C . ILE A 1 125 ? -4.944 69.261 22.148 1.00 35.00 ? 125 ILE A C 1 ATOM 1005 O O . ILE A 1 125 ? -3.943 69.870 22.532 1.00 35.00 ? 125 ILE A O 1 ATOM 1006 C CB . ILE A 1 125 ? -7.082 69.846 23.361 1.00 21.57 ? 125 ILE A CB 1 ATOM 1007 C CG1 . ILE A 1 125 ? -8.114 69.804 22.244 1.00 21.57 ? 125 ILE A CG1 1 ATOM 1008 C CG2 . ILE A 1 125 ? -6.452 71.227 23.390 1.00 21.57 ? 125 ILE A CG2 1 ATOM 1009 C CD1 . ILE A 1 125 ? -9.256 70.809 22.428 1.00 21.57 ? 125 ILE A CD1 1 ATOM 1010 N N . GLU A 1 126 ? -5.159 68.982 20.870 1.00 17.44 ? 126 GLU A N 1 ATOM 1011 C CA . GLU A 1 126 ? -4.242 69.449 19.837 1.00 17.44 ? 126 GLU A CA 1 ATOM 1012 C C . GLU A 1 126 ? -5.045 69.748 18.565 1.00 17.44 ? 126 GLU A C 1 ATOM 1013 O O . GLU A 1 126 ? -6.153 69.218 18.375 1.00 17.44 ? 126 GLU A O 1 ATOM 1014 C CB . GLU A 1 126 ? -3.166 68.402 19.548 1.00 27.27 ? 126 GLU A CB 1 ATOM 1015 C CG . GLU A 1 126 ? -3.610 67.293 18.607 1.00 33.04 ? 126 GLU A CG 1 ATOM 1016 C CD . GLU A 1 126 ? -2.550 66.222 18.381 1.00 42.50 ? 126 GLU A CD 1 ATOM 1017 O OE1 . GLU A 1 126 ? -2.823 65.285 17.600 1.00 36.59 ? 126 GLU A OE1 1 ATOM 1018 O OE2 . GLU A 1 126 ? -1.455 66.307 18.979 1.00 32.93 ? 126 GLU A OE2 1 ATOM 1019 N N . PHE A 1 127 ? -4.499 70.590 17.696 1.00 23.25 ? 127 PHE A N 1 ATOM 1020 C CA . PHE A 1 127 ? -5.188 70.957 16.469 1.00 23.25 ? 127 PHE A CA 1 ATOM 1021 C C . PHE A 1 127 ? -4.653 70.215 15.255 1.00 23.31 ? 127 PHE A C 1 ATOM 1022 O O . PHE A 1 127 ? -3.445 70.139 15.054 1.00 23.25 ? 127 PHE A O 1 ATOM 1023 C CB . PHE A 1 127 ? -5.031 72.451 16.242 1.00 21.72 ? 127 PHE A CB 1 ATOM 1024 C CG . PHE A 1 127 ? -5.806 72.987 15.073 1.00 21.85 ? 127 PHE A CG 1 ATOM 1025 C CD1 . PHE A 1 127 ? -7.185 73.144 15.151 1.00 21.77 ? 127 PHE A CD1 1 ATOM 1026 C CD2 . PHE A 1 127 ? -5.147 73.398 13.927 1.00 21.72 ? 127 PHE A CD2 1 ATOM 1027 C CE1 . PHE A 1 127 ? -7.895 73.711 14.107 1.00 21.72 ? 127 PHE A CE1 1 ATOM 1028 C CE2 . PHE A 1 127 ? -5.843 73.965 12.877 1.00 21.72 ? 127 PHE A CE2 1 ATOM 1029 C CZ . PHE A 1 127 ? -7.226 74.125 12.967 1.00 21.72 ? 127 PHE A CZ 1 ATOM 1030 N N . ASN A 1 128 ? -5.554 69.673 14.442 1.00 30.83 ? 128 ASN A N 1 ATOM 1031 C CA . ASN A 1 128 ? -5.160 68.964 13.225 1.00 31.78 ? 128 ASN A CA 1 ATOM 1032 C C . ASN A 1 128 ? -5.616 69.829 12.048 1.00 30.83 ? 128 ASN A C 1 ATOM 1033 O O . ASN A 1 128 ? -6.781 69.758 11.637 1.00 30.83 ? 128 ASN A O 1 ATOM 1034 C CB . ASN A 1 128 ? -5.845 67.601 13.160 1.00 30.60 ? 128 ASN A CB 1 ATOM 1035 C CG . ASN A 1 128 ? -5.357 66.775 12.001 1.00 34.95 ? 128 ASN A CG 1 ATOM 1036 O OD1 . ASN A 1 128 ? -5.274 67.271 10.882 1.00 36.60 ? 128 ASN A OD1 1 ATOM 1037 N ND2 . ASN A 1 128 ? -5.024 65.512 12.255 1.00 31.18 ? 128 ASN A ND2 1 ATOM 1038 N N . LYS A 1 129 ? -4.709 70.641 11.503 1.00 23.67 ? 129 LYS A N 1 ATOM 1039 C CA . LYS A 1 129 ? -5.078 71.555 10.419 1.00 23.67 ? 129 LYS A CA 1 ATOM 1040 C C . LYS A 1 129 ? -5.578 70.912 9.130 1.00 24.94 ? 129 LYS A C 1 ATOM 1041 O O . LYS A 1 129 ? -6.160 71.581 8.277 1.00 23.67 ? 129 LYS A O 1 ATOM 1042 C CB . LYS A 1 129 ? -3.921 72.502 10.108 1.00 16.67 ? 129 LYS A CB 1 ATOM 1043 C CG . LYS A 1 129 ? -2.754 71.878 9.399 1.00 24.32 ? 129 LYS A CG 1 ATOM 1044 C CD . LYS A 1 129 ? -1.628 72.907 9.278 1.00 25.97 ? 129 LYS A CD 1 ATOM 1045 C CE . LYS A 1 129 ? -0.364 72.309 8.674 1.00 29.91 ? 129 LYS A CE 1 ATOM 1046 N NZ . LYS A 1 129 ? -0.657 71.814 7.309 1.00 36.05 ? 129 LYS A NZ 1 ATOM 1047 N N . GLU A 1 130 ? -5.382 69.609 9.003 1.00 29.85 ? 130 GLU A N 1 ATOM 1048 C CA . GLU A 1 130 ? -5.817 68.916 7.811 1.00 33.20 ? 130 GLU A CA 1 ATOM 1049 C C . GLU A 1 130 ? -7.325 68.730 7.757 1.00 37.06 ? 130 GLU A C 1 ATOM 1050 O O . GLU A 1 130 ? -7.916 68.817 6.684 1.00 33.25 ? 130 GLU A O 1 ATOM 1051 C CB . GLU A 1 130 ? -5.133 67.556 7.709 1.00 28.71 ? 130 GLU A CB 1 ATOM 1052 C CG . GLU A 1 130 ? -5.228 66.951 6.329 1.00 36.68 ? 130 GLU A CG 1 ATOM 1053 C CD . GLU A 1 130 ? -4.510 65.623 6.210 1.00 42.69 ? 130 GLU A CD 1 ATOM 1054 O OE1 . GLU A 1 130 ? -5.037 64.613 6.714 1.00 28.33 ? 130 GLU A OE1 1 ATOM 1055 O OE2 . GLU A 1 130 ? -3.414 65.584 5.612 1.00 33.74 ? 130 GLU A OE2 1 ATOM 1056 N N . ILE A 1 131 ? -7.950 68.496 8.906 1.00 27.40 ? 131 ILE A N 1 ATOM 1057 C CA . ILE A 1 131 ? -9.392 68.257 8.954 1.00 28.37 ? 131 ILE A CA 1 ATOM 1058 C C . ILE A 1 131 ? -10.323 69.390 8.506 1.00 34.27 ? 131 ILE A C 1 ATOM 1059 O O . ILE A 1 131 ? -11.156 69.185 7.625 1.00 33.80 ? 131 ILE A O 1 ATOM 1060 C CB . ILE A 1 131 ? -9.798 67.745 10.351 1.00 17.71 ? 131 ILE A CB 1 ATOM 1061 C CG1 . ILE A 1 131 ? -9.055 66.432 10.605 1.00 20.95 ? 131 ILE A CG1 1 ATOM 1062 C CG2 . ILE A 1 131 ? -11.316 67.576 10.441 1.00 16.56 ? 131 ILE A CG2 1 ATOM 1063 C CD1 . ILE A 1 131 ? -9.326 65.781 11.931 1.00 23.10 ? 131 ILE A CD1 1 ATOM 1064 N N . PRO A 1 132 ? -10.224 70.587 9.108 1.00 23.30 ? 132 PRO A N 1 ATOM 1065 C CA . PRO A 1 132 ? -9.355 71.066 10.181 1.00 21.16 ? 132 PRO A CA 1 ATOM 1066 C C . PRO A 1 132 ? -10.172 71.130 11.463 1.00 24.52 ? 132 PRO A C 1 ATOM 1067 O O . PRO A 1 132 ? -11.292 71.629 11.468 1.00 20.83 ? 132 PRO A O 1 ATOM 1068 C CB . PRO A 1 132 ? -8.966 72.448 9.692 1.00 9.35 ? 132 PRO A CB 1 ATOM 1069 C CG . PRO A 1 132 ? -10.259 72.950 9.150 1.00 13.61 ? 132 PRO A CG 1 ATOM 1070 C CD . PRO A 1 132 ? -10.858 71.731 8.424 1.00 14.50 ? 132 PRO A CD 1 ATOM 1071 N N . ALA A 1 133 ? -9.624 70.625 12.554 1.00 24.25 ? 133 ALA A N 1 ATOM 1072 C CA . ALA A 1 133 ? -10.364 70.652 13.807 1.00 24.25 ? 133 ALA A CA 1 ATOM 1073 C C . ALA A 1 133 ? -9.523 70.282 15.016 1.00 24.25 ? 133 ALA A C 1 ATOM 1074 O O . ALA A 1 133 ? -8.391 69.810 14.890 1.00 24.25 ? 133 ALA A O 1 ATOM 1075 C CB . ALA A 1 133 ? -11.539 69.729 13.711 1.00 8.78 ? 133 ALA A CB 1 ATOM 1076 N N . TRP A 1 134 ? -10.088 70.506 16.194 1.00 27.20 ? 134 TRP A N 1 ATOM 1077 C CA . TRP A 1 134 ? -9.383 70.184 17.413 1.00 27.20 ? 134 TRP A CA 1 ATOM 1078 C C . TRP A 1 134 ? -9.625 68.726 17.729 1.00 27.88 ? 134 TRP A C 1 ATOM 1079 O O . TRP A 1 134 ? -10.687 68.186 17.425 1.00 27.63 ? 134 TRP A O 1 ATOM 1080 C CB . TRP A 1 134 ? -9.843 71.088 18.562 1.00 22.34 ? 134 TRP A CB 1 ATOM 1081 C CG . TRP A 1 134 ? -9.347 72.521 18.405 1.00 22.34 ? 134 TRP A CG 1 ATOM 1082 C CD1 . TRP A 1 134 ? -9.999 73.560 17.794 1.00 22.34 ? 134 TRP A CD1 1 ATOM 1083 C CD2 . TRP A 1 134 ? -8.067 73.034 18.797 1.00 22.34 ? 134 TRP A CD2 1 ATOM 1084 N NE1 . TRP A 1 134 ? -9.208 74.678 17.780 1.00 22.34 ? 134 TRP A NE1 1 ATOM 1085 C CE2 . TRP A 1 134 ? -8.014 74.386 18.385 1.00 22.34 ? 134 TRP A CE2 1 ATOM 1086 C CE3 . TRP A 1 134 ? -6.955 72.480 19.452 1.00 22.34 ? 134 TRP A CE3 1 ATOM 1087 C CZ2 . TRP A 1 134 ? -6.892 75.194 18.604 1.00 22.34 ? 134 TRP A CZ2 1 ATOM 1088 C CZ3 . TRP A 1 134 ? -5.838 73.284 19.669 1.00 22.34 ? 134 TRP A CZ3 1 ATOM 1089 C CH2 . TRP A 1 134 ? -5.816 74.629 19.244 1.00 22.34 ? 134 TRP A CH2 1 ATOM 1090 N N . VAL A 1 135 ? -8.618 68.083 18.310 1.00 32.08 ? 135 VAL A N 1 ATOM 1091 C CA . VAL A 1 135 ? -8.706 66.682 18.676 1.00 32.08 ? 135 VAL A CA 1 ATOM 1092 C C . VAL A 1 135 ? -8.637 66.629 20.186 1.00 32.08 ? 135 VAL A C 1 ATOM 1093 O O . VAL A 1 135 ? -7.672 67.088 20.772 1.00 32.08 ? 135 VAL A O 1 ATOM 1094 C CB . VAL A 1 135 ? -7.537 65.893 18.051 1.00 22.14 ? 135 VAL A CB 1 ATOM 1095 C CG1 . VAL A 1 135 ? -7.589 64.445 18.475 1.00 22.14 ? 135 VAL A CG1 1 ATOM 1096 C CG2 . VAL A 1 135 ? -7.612 65.986 16.530 1.00 22.14 ? 135 VAL A CG2 1 ATOM 1097 N N . PRO A 1 136 ? -9.676 66.096 20.846 1.00 33.13 ? 136 PRO A N 1 ATOM 1098 C CA . PRO A 1 136 ? -9.641 66.035 22.312 1.00 33.13 ? 136 PRO A CA 1 ATOM 1099 C C . PRO A 1 136 ? -9.028 64.732 22.797 1.00 38.19 ? 136 PRO A C 1 ATOM 1100 O O . PRO A 1 136 ? -9.301 63.682 22.226 1.00 34.79 ? 136 PRO A O 1 ATOM 1101 C CB . PRO A 1 136 ? -11.111 66.142 22.683 1.00 26.20 ? 136 PRO A CB 1 ATOM 1102 C CG . PRO A 1 136 ? -11.759 65.303 21.600 1.00 26.67 ? 136 PRO A CG 1 ATOM 1103 C CD . PRO A 1 136 ? -11.015 65.730 20.337 1.00 27.63 ? 136 PRO A CD 1 ATOM 1104 N N . PHE A 1 137 ? -8.206 64.800 23.846 1.00 24.87 ? 137 PHE A N 1 ATOM 1105 C CA . PHE A 1 137 ? -7.568 63.607 24.414 1.00 26.57 ? 137 PHE A CA 1 ATOM 1106 C C . PHE A 1 137 ? -8.072 63.346 25.820 1.00 34.75 ? 137 PHE A C 1 ATOM 1107 O O . PHE A 1 137 ? -8.167 62.207 26.265 1.00 50.25 ? 137 PHE A O 1 ATOM 1108 C CB . PHE A 1 137 ? -6.053 63.770 24.463 1.00 26.00 ? 137 PHE A CB 1 ATOM 1109 C CG . PHE A 1 137 ? -5.410 63.887 23.118 1.00 30.60 ? 137 PHE A CG 1 ATOM 1110 C CD1 . PHE A 1 137 ? -5.606 62.908 22.153 1.00 30.18 ? 137 PHE A CD1 1 ATOM 1111 C CD2 . PHE A 1 137 ? -4.577 64.964 22.823 1.00 26.00 ? 137 PHE A CD2 1 ATOM 1112 C CE1 . PHE A 1 137 ? -4.984 62.988 20.919 1.00 27.71 ? 137 PHE A CE1 1 ATOM 1113 C CE2 . PHE A 1 137 ? -3.946 65.057 21.585 1.00 29.90 ? 137 PHE A CE2 1 ATOM 1114 C CZ . PHE A 1 137 ? -4.153 64.061 20.632 1.00 28.06 ? 137 PHE A CZ 1 ATOM 1115 N N . ASP A 1 138 ? -8.384 64.422 26.518 1.00 34.75 ? 138 ASP A N 1 ATOM 1116 C CA . ASP A 1 138 ? -8.885 64.352 27.884 1.00 34.02 ? 138 ASP A CA 1 ATOM 1117 C C . ASP A 1 138 ? -10.387 64.663 27.830 1.00 27.58 ? 138 ASP A C 1 ATOM 1118 O O . ASP A 1 138 ? -10.822 65.498 27.042 1.00 34.28 ? 138 ASP A O 1 ATOM 1119 C CB . ASP A 1 138 ? -8.119 65.382 28.733 1.00 34.86 ? 138 ASP A CB 1 ATOM 1120 C CG . ASP A 1 138 ? -8.579 65.427 30.168 1.00 39.02 ? 138 ASP A CG 1 ATOM 1121 O OD1 . ASP A 1 138 ? -9.728 65.853 30.410 1.00 37.86 ? 138 ASP A OD1 1 ATOM 1122 O OD2 . ASP A 1 138 ? -7.779 65.043 31.050 1.00 37.03 ? 138 ASP A OD2 1 ATOM 1123 N N . PRO A 1 139 ? -11.201 63.978 28.641 1.00 32.50 ? 139 PRO A N 1 ATOM 1124 C CA . PRO A 1 139 ? -12.635 64.277 28.588 1.00 34.71 ? 139 PRO A CA 1 ATOM 1125 C C . PRO A 1 139 ? -12.994 65.759 28.716 1.00 35.03 ? 139 PRO A C 1 ATOM 1126 O O . PRO A 1 139 ? -13.864 66.245 27.994 1.00 34.28 ? 139 PRO A O 1 ATOM 1127 C CB . PRO A 1 139 ? -13.225 63.403 29.706 1.00 29.27 ? 139 PRO A CB 1 ATOM 1128 C CG . PRO A 1 139 ? -12.036 63.056 30.563 1.00 39.42 ? 139 PRO A CG 1 ATOM 1129 C CD . PRO A 1 139 ? -10.931 62.876 29.571 1.00 32.08 ? 139 PRO A CD 1 ATOM 1130 N N . ALA A 1 140 ? -12.328 66.484 29.607 1.00 27.99 ? 140 ALA A N 1 ATOM 1131 C CA . ALA A 1 140 ? -12.620 67.905 29.751 1.00 27.48 ? 140 ALA A CA 1 ATOM 1132 C C . ALA A 1 140 ? -12.333 68.629 28.437 1.00 26.11 ? 140 ALA A C 1 ATOM 1133 O O . ALA A 1 140 ? -12.869 69.708 28.186 1.00 24.38 ? 140 ALA A O 1 ATOM 1134 C CB . ALA A 1 140 ? -11.791 68.504 30.858 1.00 3.70 ? 140 ALA A CB 1 ATOM 1135 N N . ALA A 1 141 ? -11.483 68.027 27.604 1.00 33.98 ? 141 ALA A N 1 ATOM 1136 C CA . ALA A 1 141 ? -11.125 68.594 26.314 1.00 33.98 ? 141 ALA A CA 1 ATOM 1137 C C . ALA A 1 141 ? -12.309 68.535 25.349 1.00 33.98 ? 141 ALA A C 1 ATOM 1138 O O . ALA A 1 141 ? -12.300 69.183 24.299 1.00 33.98 ? 141 ALA A O 1 ATOM 1139 C CB . ALA A 1 141 ? -9.940 67.857 25.733 1.00 14.15 ? 141 ALA A CB 1 ATOM 1140 N N . GLN A 1 142 ? -13.333 67.760 25.686 1.00 25.92 ? 142 GLN A N 1 ATOM 1141 C CA . GLN A 1 142 ? -14.493 67.705 24.811 1.00 25.92 ? 142 GLN A CA 1 ATOM 1142 C C . GLN A 1 142 ? -15.230 69.025 24.935 1.00 29.23 ? 142 GLN A C 1 ATOM 1143 O O . GLN A 1 142 ? -15.733 69.563 23.950 1.00 27.21 ? 142 GLN A O 1 ATOM 1144 C CB . GLN A 1 142 ? -15.405 66.552 25.195 1.00 26.04 ? 142 GLN A CB 1 ATOM 1145 C CG . GLN A 1 142 ? -14.956 65.249 24.610 1.00 30.21 ? 142 GLN A CG 1 ATOM 1146 C CD . GLN A 1 142 ? -15.591 64.068 25.289 1.00 27.59 ? 142 GLN A CD 1 ATOM 1147 O OE1 . GLN A 1 142 ? -16.795 64.057 25.548 1.00 29.30 ? 142 GLN A OE1 1 ATOM 1148 N NE2 . GLN A 1 142 ? -14.783 63.054 25.579 1.00 31.99 ? 142 GLN A NE2 1 ATOM 1149 N N . ILE A 1 143 ? -15.265 69.554 26.155 1.00 29.89 ? 143 ILE A N 1 ATOM 1150 C CA . ILE A 1 143 ? -15.934 70.816 26.414 1.00 30.88 ? 143 ILE A CA 1 ATOM 1151 C C . ILE A 1 143 ? -15.142 71.926 25.728 1.00 32.58 ? 143 ILE A C 1 ATOM 1152 O O . ILE A 1 143 ? -15.715 72.789 25.057 1.00 31.26 ? 143 ILE A O 1 ATOM 1153 C CB . ILE A 1 143 ? -16.037 71.117 27.959 1.00 11.57 ? 143 ILE A CB 1 ATOM 1154 C CG1 . ILE A 1 143 ? -16.867 70.042 28.673 1.00 19.42 ? 143 ILE A CG1 1 ATOM 1155 C CG2 . ILE A 1 143 ? -16.665 72.477 28.182 1.00 13.79 ? 143 ILE A CG2 1 ATOM 1156 C CD1 . ILE A 1 143 ? -18.167 69.747 28.001 1.00 33.15 ? 143 ILE A CD1 1 ATOM 1157 N N . THR A 1 144 ? -13.823 71.899 25.896 1.00 31.17 ? 144 THR A N 1 ATOM 1158 C CA . THR A 1 144 ? -12.950 72.904 25.293 1.00 30.58 ? 144 THR A CA 1 ATOM 1159 C C . THR A 1 144 ? -13.078 72.963 23.765 1.00 32.85 ? 144 THR A C 1 ATOM 1160 O O . THR A 1 144 ? -13.184 74.046 23.184 1.00 30.67 ? 144 THR A O 1 ATOM 1161 C CB . THR A 1 144 ? -11.475 72.641 25.651 1.00 28.51 ? 144 THR A CB 1 ATOM 1162 O OG1 . THR A 1 144 ? -11.307 72.715 27.074 1.00 27.99 ? 144 THR A OG1 1 ATOM 1163 C CG2 . THR A 1 144 ? -10.565 73.678 24.976 1.00 27.65 ? 144 THR A CG2 1 ATOM 1164 N N . LYS A 1 145 ? -13.046 71.800 23.118 1.00 23.96 ? 145 LYS A N 1 ATOM 1165 C CA . LYS A 1 145 ? -13.185 71.738 21.672 1.00 27.34 ? 145 LYS A CA 1 ATOM 1166 C C . LYS A 1 145 ? -14.519 72.369 21.291 1.00 26.31 ? 145 LYS A C 1 ATOM 1167 O O . LYS A 1 145 ? -14.602 73.137 20.320 1.00 24.78 ? 145 LYS A O 1 ATOM 1168 C CB . LYS A 1 145 ? -13.140 70.282 21.200 1.00 24.29 ? 145 LYS A CB 1 ATOM 1169 C CG . LYS A 1 145 ? -13.508 70.027 19.730 1.00 22.08 ? 145 LYS A CG 1 ATOM 1170 C CD . LYS A 1 145 ? -13.382 68.538 19.439 1.00 22.63 ? 145 LYS A CD 1 ATOM 1171 C CE . LYS A 1 145 ? -14.019 68.122 18.123 1.00 22.08 ? 145 LYS A CE 1 ATOM 1172 N NZ . LYS A 1 145 ? -13.278 68.581 16.924 1.00 27.72 ? 145 LYS A NZ 1 ATOM 1173 N N . GLN A 1 146 ? -15.559 72.054 22.065 1.00 28.98 ? 146 GLN A N 1 ATOM 1174 C CA . GLN A 1 146 ? -16.891 72.588 21.800 1.00 32.36 ? 146 GLN A CA 1 ATOM 1175 C C . GLN A 1 146 ? -16.858 74.107 21.773 1.00 32.66 ? 146 GLN A C 1 ATOM 1176 O O . GLN A 1 146 ? -17.446 74.726 20.892 1.00 29.42 ? 146 GLN A O 1 ATOM 1177 C CB . GLN A 1 146 ? -17.884 72.126 22.864 1.00 48.52 ? 146 GLN A CB 1 ATOM 1178 C CG . GLN A 1 146 ? -19.303 72.035 22.359 1.00 67.39 ? 146 GLN A CG 1 ATOM 1179 C CD . GLN A 1 146 ? -19.516 70.833 21.438 1.00 80.97 ? 146 GLN A CD 1 ATOM 1180 O OE1 . GLN A 1 146 ? -18.617 70.431 20.685 1.00 71.18 ? 146 GLN A OE1 1 ATOM 1181 N NE2 . GLN A 1 146 ? -20.716 70.263 21.487 1.00 75.68 ? 146 GLN A NE2 1 ATOM 1182 N N . LYS A 1 147 ? -16.154 74.701 22.733 1.00 32.80 ? 147 LYS A N 1 ATOM 1183 C CA . LYS A 1 147 ? -16.052 76.150 22.826 1.00 34.01 ? 147 LYS A CA 1 ATOM 1184 C C . LYS A 1 147 ? -15.229 76.759 21.712 1.00 33.38 ? 147 LYS A C 1 ATOM 1185 O O . LYS A 1 147 ? -15.642 77.741 21.101 1.00 31.82 ? 147 LYS A O 1 ATOM 1186 C CB . LYS A 1 147 ? -15.460 76.559 24.175 1.00 47.82 ? 147 LYS A CB 1 ATOM 1187 C CG . LYS A 1 147 ? -16.361 76.217 25.333 1.00 52.36 ? 147 LYS A CG 1 ATOM 1188 C CD . LYS A 1 147 ? -15.974 76.928 26.616 1.00 60.54 ? 147 LYS A CD 1 ATOM 1189 C CE . LYS A 1 147 ? -16.956 76.551 27.724 1.00 59.02 ? 147 LYS A CE 1 ATOM 1190 N NZ . LYS A 1 147 ? -16.520 77.055 29.050 1.00 74.67 ? 147 LYS A NZ 1 ATOM 1191 N N . TRP A 1 148 ? -14.065 76.173 21.450 1.00 31.91 ? 148 TRP A N 1 ATOM 1192 C CA . TRP A 1 148 ? -13.174 76.671 20.414 1.00 31.91 ? 148 TRP A CA 1 ATOM 1193 C C . TRP A 1 148 ? -13.673 76.427 19.004 1.00 33.10 ? 148 TRP A C 1 ATOM 1194 O O . TRP A 1 148 ? -12.989 76.772 18.033 1.00 33.72 ? 148 TRP A O 1 ATOM 1195 C CB . TRP A 1 148 ? -11.798 76.046 20.563 1.00 23.63 ? 148 TRP A CB 1 ATOM 1196 C CG . TRP A 1 148 ? -11.097 76.432 21.824 1.00 28.97 ? 148 TRP A CG 1 ATOM 1197 C CD1 . TRP A 1 148 ? -11.512 77.346 22.756 1.00 26.92 ? 148 TRP A CD1 1 ATOM 1198 C CD2 . TRP A 1 148 ? -9.837 75.926 22.288 1.00 25.59 ? 148 TRP A CD2 1 ATOM 1199 N NE1 . TRP A 1 148 ? -10.583 77.437 23.771 1.00 27.89 ? 148 TRP A NE1 1 ATOM 1200 C CE2 . TRP A 1 148 ? -9.549 76.576 23.509 1.00 25.41 ? 148 TRP A CE2 1 ATOM 1201 C CE3 . TRP A 1 148 ? -8.925 74.987 21.788 1.00 25.39 ? 148 TRP A CE3 1 ATOM 1202 C CZ2 . TRP A 1 148 ? -8.391 76.314 24.240 1.00 23.63 ? 148 TRP A CZ2 1 ATOM 1203 C CZ3 . TRP A 1 148 ? -7.775 74.731 22.514 1.00 23.63 ? 148 TRP A CZ3 1 ATOM 1204 C CH2 . TRP A 1 148 ? -7.519 75.392 23.729 1.00 25.28 ? 148 TRP A CH2 1 ATOM 1205 N N . GLU A 1 149 ? -14.854 75.822 18.894 1.00 28.25 ? 149 GLU A N 1 ATOM 1206 C CA . GLU A 1 149 ? -15.460 75.538 17.591 1.00 30.25 ? 149 GLU A CA 1 ATOM 1207 C C . GLU A 1 149 ? -16.943 75.919 17.556 1.00 36.32 ? 149 GLU A C 1 ATOM 1208 O O . GLU A 1 149 ? -17.698 75.431 16.724 1.00 34.42 ? 149 GLU A O 1 ATOM 1209 C CB . GLU A 1 149 ? -15.317 74.058 17.253 1.00 23.68 ? 149 GLU A CB 1 ATOM 1210 C CG . GLU A 1 149 ? -13.898 73.568 17.127 1.00 21.54 ? 149 GLU A CG 1 ATOM 1211 C CD . GLU A 1 149 ? -13.867 72.076 16.879 1.00 25.35 ? 149 GLU A CD 1 ATOM 1212 O OE1 . GLU A 1 149 ? -14.966 71.483 16.915 1.00 28.50 ? 149 GLU A OE1 1 ATOM 1213 O OE2 . GLU A 1 149 ? -12.777 71.490 16.659 1.00 22.98 ? 149 GLU A OE2 1 ATOM 1214 N N . ALA A 1 150 ? -17.356 76.804 18.453 1.00 32.05 ? 150 ALA A N 1 ATOM 1215 C CA . ALA A 1 150 ? -18.749 77.206 18.506 1.00 37.34 ? 150 ALA A CA 1 ATOM 1216 C C . ALA A 1 150 ? -19.201 77.958 17.258 1.00 35.28 ? 150 ALA A C 1 ATOM 1217 O O . ALA A 1 150 ? -20.396 78.068 17.002 1.00 38.98 ? 150 ALA A O 1 ATOM 1218 C CB . ALA A 1 150 ? -18.995 78.033 19.738 1.00 21.81 ? 150 ALA A CB 1 ATOM 1219 N N . GLU A 1 151 ? -18.248 78.484 16.492 1.00 31.40 ? 151 GLU A N 1 ATOM 1220 C CA . GLU A 1 151 ? -18.537 79.203 15.241 1.00 32.54 ? 151 GLU A CA 1 ATOM 1221 C C . GLU A 1 151 ? -17.648 78.636 14.117 1.00 32.06 ? 151 GLU A C 1 ATOM 1222 O O . GLU A 1 151 ? -16.491 78.263 14.347 1.00 30.74 ? 151 GLU A O 1 ATOM 1223 C CB . GLU A 1 151 ? -18.249 80.710 15.380 1.00 31.26 ? 151 GLU A CB 1 ATOM 1224 C CG . GLU A 1 151 ? -19.094 81.492 16.387 1.00 44.35 ? 151 GLU A CG 1 ATOM 1225 C CD . GLU A 1 151 ? -20.586 81.410 16.124 1.00 58.15 ? 151 GLU A CD 1 ATOM 1226 O OE1 . GLU A 1 151 ? -20.994 81.421 14.945 1.00 50.63 ? 151 GLU A OE1 1 ATOM 1227 O OE2 . GLU A 1 151 ? -21.353 81.352 17.107 1.00 63.35 ? 151 GLU A OE2 1 ATOM 1228 N N . PRO A 1 152 ? -18.174 78.568 12.887 1.00 42.47 ? 152 PRO A N 1 ATOM 1229 C CA . PRO A 1 152 ? -17.408 78.047 11.755 1.00 46.83 ? 152 PRO A CA 1 ATOM 1230 C C . PRO A 1 152 ? -16.046 78.732 11.535 1.00 41.65 ? 152 PRO A C 1 ATOM 1231 O O . PRO A 1 152 ? -15.065 78.061 11.201 1.00 41.68 ? 152 PRO A O 1 ATOM 1232 C CB . PRO A 1 152 ? -18.357 78.260 10.583 1.00 32.85 ? 152 PRO A CB 1 ATOM 1233 C CG . PRO A 1 152 ? -19.682 78.072 11.199 1.00 32.71 ? 152 PRO A CG 1 ATOM 1234 C CD . PRO A 1 152 ? -19.554 78.869 12.477 1.00 33.32 ? 152 PRO A CD 1 ATOM 1235 N N . VAL A 1 153 ? -15.972 80.051 11.718 1.00 32.27 ? 153 VAL A N 1 ATOM 1236 C CA . VAL A 1 153 ? -14.707 80.760 11.509 1.00 36.13 ? 153 VAL A CA 1 ATOM 1237 C C . VAL A 1 153 ? -13.562 80.319 12.409 1.00 31.29 ? 153 VAL A C 1 ATOM 1238 O O . VAL A 1 153 ? -12.400 80.366 12.006 1.00 34.83 ? 153 VAL A O 1 ATOM 1239 C CB . VAL A 1 153 ? -14.850 82.289 11.702 1.00 32.97 ? 153 VAL A CB 1 ATOM 1240 C CG1 . VAL A 1 153 ? -15.877 82.816 10.774 1.00 46.64 ? 153 VAL A CG1 1 ATOM 1241 C CG2 . VAL A 1 153 ? -15.244 82.614 13.136 1.00 33.03 ? 153 VAL A CG2 1 ATOM 1242 N N . TYR A 1 154 ? -13.880 79.897 13.624 1.00 32.61 ? 154 TYR A N 1 ATOM 1243 C CA . TYR A 1 154 ? -12.840 79.507 14.561 1.00 32.08 ? 154 TYR A CA 1 ATOM 1244 C C . TYR A 1 154 ? -11.786 78.524 14.051 1.00 30.60 ? 154 TYR A C 1 ATOM 1245 O O . TYR A 1 154 ? -10.594 78.816 14.156 1.00 31.39 ? 154 TYR A O 1 ATOM 1246 C CB . TYR A 1 154 ? -13.460 78.980 15.855 1.00 25.57 ? 154 TYR A CB 1 ATOM 1247 C CG . TYR A 1 154 ? -14.338 79.982 16.555 1.00 28.90 ? 154 TYR A CG 1 ATOM 1248 C CD1 . TYR A 1 154 ? -14.178 81.347 16.342 1.00 34.39 ? 154 TYR A CD1 1 ATOM 1249 C CD2 . TYR A 1 154 ? -15.324 79.565 17.437 1.00 27.14 ? 154 TYR A CD2 1 ATOM 1250 C CE1 . TYR A 1 154 ? -14.982 82.270 16.988 1.00 29.56 ? 154 TYR A CE1 1 ATOM 1251 C CE2 . TYR A 1 154 ? -16.131 80.479 18.092 1.00 25.37 ? 154 TYR A CE2 1 ATOM 1252 C CZ . TYR A 1 154 ? -15.955 81.830 17.860 1.00 36.44 ? 154 TYR A CZ 1 ATOM 1253 O OH . TYR A 1 154 ? -16.767 82.731 18.498 1.00 39.17 ? 154 TYR A OH 1 ATOM 1254 N N . VAL A 1 155 ? -12.184 77.364 13.522 1.00 28.01 ? 155 VAL A N 1 ATOM 1255 C CA . VAL A 1 155 ? -11.168 76.435 13.031 1.00 28.01 ? 155 VAL A CA 1 ATOM 1256 C C . VAL A 1 155 ? -10.468 77.033 11.818 1.00 29.85 ? 155 VAL A C 1 ATOM 1257 O O . VAL A 1 155 ? -9.269 76.844 11.646 1.00 28.69 ? 155 VAL A O 1 ATOM 1258 C CB . VAL A 1 155 ? -11.746 75.058 12.644 1.00 25.58 ? 155 VAL A CB 1 ATOM 1259 C CG1 . VAL A 1 155 ? -12.440 74.437 13.836 1.00 24.48 ? 155 VAL A CG1 1 ATOM 1260 C CG2 . VAL A 1 155 ? -12.679 75.197 11.472 1.00 31.71 ? 155 VAL A CG2 1 ATOM 1261 N N . GLN A 1 156 ? -11.211 77.763 10.984 1.00 39.00 ? 156 GLN A N 1 ATOM 1262 C CA . GLN A 1 156 ? -10.628 78.396 9.804 1.00 35.62 ? 156 GLN A CA 1 ATOM 1263 C C . GLN A 1 156 ? -9.475 79.306 10.245 1.00 35.62 ? 156 GLN A C 1 ATOM 1264 O O . GLN A 1 156 ? -8.404 79.308 9.629 1.00 38.78 ? 156 GLN A O 1 ATOM 1265 C CB . GLN A 1 156 ? -11.686 79.206 9.042 1.00 32.07 ? 156 GLN A CB 1 ATOM 1266 C CG . GLN A 1 156 ? -12.887 78.384 8.542 1.00 37.70 ? 156 GLN A CG 1 ATOM 1267 C CD . GLN A 1 156 ? -13.897 79.192 7.718 1.00 55.01 ? 156 GLN A CD 1 ATOM 1268 O OE1 . GLN A 1 156 ? -14.317 80.277 8.110 1.00 47.52 ? 156 GLN A OE1 1 ATOM 1269 N NE2 . GLN A 1 156 ? -14.296 78.650 6.580 1.00 40.69 ? 156 GLN A NE2 1 ATOM 1270 N N . ARG A 1 157 ? -9.692 80.073 11.313 1.00 26.07 ? 157 ARG A N 1 ATOM 1271 C CA . ARG A 1 157 ? -8.655 80.954 11.850 1.00 28.52 ? 157 ARG A CA 1 ATOM 1272 C C . ARG A 1 157 ? -7.448 80.161 12.361 1.00 28.21 ? 157 ARG A C 1 ATOM 1273 O O . ARG A 1 157 ? -6.299 80.503 12.065 1.00 27.29 ? 157 ARG A O 1 ATOM 1274 C CB . ARG A 1 157 ? -9.195 81.797 13.010 1.00 30.20 ? 157 ARG A CB 1 ATOM 1275 C CG . ARG A 1 157 ? -10.097 82.942 12.618 1.00 36.25 ? 157 ARG A CG 1 ATOM 1276 C CD . ARG A 1 157 ? -10.684 83.560 13.863 1.00 38.43 ? 157 ARG A CD 1 ATOM 1277 N NE . ARG A 1 157 ? -11.707 84.562 13.586 1.00 35.41 ? 157 ARG A NE 1 ATOM 1278 C CZ . ARG A 1 157 ? -12.515 85.071 14.512 1.00 45.58 ? 157 ARG A CZ 1 ATOM 1279 N NH1 . ARG A 1 157 ? -12.419 84.666 15.770 1.00 34.60 ? 157 ARG A NH1 1 ATOM 1280 N NH2 . ARG A 1 157 ? -13.409 85.993 14.185 1.00 46.80 ? 157 ARG A NH2 1 ATOM 1281 N N . ALA A 1 158 ? -7.710 79.121 13.150 1.00 28.29 ? 158 ALA A N 1 ATOM 1282 C CA . ALA A 1 158 ? -6.643 78.302 13.699 1.00 28.29 ? 158 ALA A CA 1 ATOM 1283 C C . ALA A 1 158 ? -5.855 77.721 12.549 1.00 29.69 ? 158 ALA A C 1 ATOM 1284 O O . ALA A 1 158 ? -4.631 77.653 12.601 1.00 29.78 ? 158 ALA A O 1 ATOM 1285 C CB . ALA A 1 158 ? -7.213 77.192 14.555 1.00 16.59 ? 158 ALA A CB 1 ATOM 1286 N N . LYS A 1 159 ? -6.550 77.297 11.502 1.00 19.16 ? 159 LYS A N 1 ATOM 1287 C CA . LYS A 1 159 ? -5.851 76.745 10.352 1.00 19.16 ? 159 LYS A CA 1 ATOM 1288 C C . LYS A 1 159 ? -5.030 77.859 9.697 1.00 23.88 ? 159 LYS A C 1 ATOM 1289 O O . LYS A 1 159 ? -3.885 77.650 9.291 1.00 20.41 ? 159 LYS A O 1 ATOM 1290 C CB . LYS A 1 159 ? -6.841 76.152 9.353 1.00 19.07 ? 159 LYS A CB 1 ATOM 1291 C CG . LYS A 1 159 ? -6.193 75.480 8.157 1.00 20.47 ? 159 LYS A CG 1 ATOM 1292 C CD . LYS A 1 159 ? -7.279 75.045 7.175 1.00 21.88 ? 159 LYS A CD 1 ATOM 1293 C CE . LYS A 1 159 ? -6.725 74.685 5.797 1.00 24.07 ? 159 LYS A CE 1 ATOM 1294 N NZ . LYS A 1 159 ? -5.840 73.483 5.826 1.00 31.53 ? 159 LYS A NZ 1 ATOM 1295 N N . ALA A 1 160 ? -5.611 79.052 9.629 1.00 42.99 ? 160 ALA A N 1 ATOM 1296 C CA . ALA A 1 160 ? -4.938 80.202 9.029 1.00 44.64 ? 160 ALA A CA 1 ATOM 1297 C C . ALA A 1 160 ? -3.697 80.625 9.820 1.00 43.52 ? 160 ALA A C 1 ATOM 1298 O O . ALA A 1 160 ? -2.707 81.096 9.251 1.00 43.89 ? 160 ALA A O 1 ATOM 1299 C CB . ALA A 1 160 ? -5.918 81.382 8.917 1.00 11.67 ? 160 ALA A CB 1 ATOM 1300 N N . TYR A 1 161 ? -3.748 80.464 11.135 1.00 25.06 ? 161 TYR A N 1 ATOM 1301 C CA . TYR A 1 161 ? -2.614 80.855 11.948 1.00 25.48 ? 161 TYR A CA 1 ATOM 1302 C C . TYR A 1 161 ? -1.391 79.992 11.683 1.00 25.05 ? 161 TYR A C 1 ATOM 1303 O O . TYR A 1 161 ? -0.286 80.513 11.498 1.00 25.78 ? 161 TYR A O 1 ATOM 1304 C CB . TYR A 1 161 ? -2.943 80.774 13.423 1.00 26.29 ? 161 TYR A CB 1 ATOM 1305 C CG . TYR A 1 161 ? -1.727 81.040 14.246 1.00 31.21 ? 161 TYR A CG 1 ATOM 1306 C CD1 . TYR A 1 161 ? -1.245 82.337 14.401 1.00 36.32 ? 161 TYR A CD1 1 ATOM 1307 C CD2 . TYR A 1 161 ? -0.989 79.989 14.789 1.00 29.18 ? 161 TYR A CD2 1 ATOM 1308 C CE1 . TYR A 1 161 ? -0.056 82.584 15.074 1.00 36.47 ? 161 TYR A CE1 1 ATOM 1309 C CE2 . TYR A 1 161 ? 0.202 80.224 15.456 1.00 25.30 ? 161 TYR A CE2 1 ATOM 1310 C CZ . TYR A 1 161 ? 0.660 81.524 15.592 1.00 37.60 ? 161 TYR A CZ 1 ATOM 1311 O OH . TYR A 1 161 ? 1.847 81.762 16.231 1.00 35.53 ? 161 TYR A OH 1 ATOM 1312 N N . LEU A 1 162 ? -1.580 78.675 11.673 1.00 20.21 ? 162 LEU A N 1 ATOM 1313 C CA . LEU A 1 162 ? -0.461 77.774 11.445 1.00 23.37 ? 162 LEU A CA 1 ATOM 1314 C C . LEU A 1 162 ? -0.011 77.777 9.991 1.00 27.52 ? 162 LEU A C 1 ATOM 1315 O O . LEU A 1 162 ? 1.171 77.620 9.713 1.00 22.91 ? 162 LEU A O 1 ATOM 1316 C CB . LEU A 1 162 ? -0.814 76.331 11.862 1.00 11.88 ? 162 LEU A CB 1 ATOM 1317 C CG . LEU A 1 162 ? -1.255 75.996 13.290 1.00 12.64 ? 162 LEU A CG 1 ATOM 1318 C CD1 . LEU A 1 162 ? -1.444 74.511 13.401 1.00 16.25 ? 162 LEU A CD1 1 ATOM 1319 C CD2 . LEU A 1 162 ? -0.215 76.464 14.295 1.00 11.88 ? 162 LEU A CD2 1 ATOM 1320 N N . GLU A 1 163 ? -0.939 77.968 9.062 1.00 27.59 ? 163 GLU A N 1 ATOM 1321 C CA . GLU A 1 163 ? -0.563 77.938 7.657 1.00 33.73 ? 163 GLU A CA 1 ATOM 1322 C C . GLU A 1 163 ? -0.146 79.246 7.026 1.00 29.97 ? 163 GLU A C 1 ATOM 1323 O O . GLU A 1 163 ? 0.575 79.238 6.023 1.00 31.15 ? 163 GLU A O 1 ATOM 1324 C CB . GLU A 1 163 ? -1.680 77.335 6.821 1.00 29.38 ? 163 GLU A CB 1 ATOM 1325 C CG . GLU A 1 163 ? -1.962 75.905 7.188 1.00 37.92 ? 163 GLU A CG 1 ATOM 1326 C CD . GLU A 1 163 ? -2.937 75.254 6.249 1.00 36.78 ? 163 GLU A CD 1 ATOM 1327 O OE1 . GLU A 1 163 ? -3.582 75.996 5.474 1.00 42.17 ? 163 GLU A OE1 1 ATOM 1328 O OE2 . GLU A 1 163 ? -3.059 74.007 6.295 1.00 42.30 ? 163 GLU A OE2 1 ATOM 1329 N N . GLU A 1 164 ? -0.581 80.364 7.601 1.00 29.99 ? 164 GLU A N 1 ATOM 1330 C CA . GLU A 1 164 ? -0.244 81.653 7.028 1.00 34.36 ? 164 GLU A CA 1 ATOM 1331 C C . GLU A 1 164 ? 0.465 82.631 7.976 1.00 30.31 ? 164 GLU A C 1 ATOM 1332 O O . GLU A 1 164 ? 1.638 82.965 7.779 1.00 31.60 ? 164 GLU A O 1 ATOM 1333 C CB . GLU A 1 164 ? -1.515 82.279 6.458 1.00 26.71 ? 164 GLU A CB 1 ATOM 1334 C CG . GLU A 1 164 ? -2.273 81.345 5.538 1.00 45.48 ? 164 GLU A CG 1 ATOM 1335 C CD . GLU A 1 164 ? -3.580 81.942 5.035 1.00 57.38 ? 164 GLU A CD 1 ATOM 1336 O OE1 . GLU A 1 164 ? -4.416 82.368 5.866 1.00 62.86 ? 164 GLU A OE1 1 ATOM 1337 O OE2 . GLU A 1 164 ? -3.776 81.980 3.800 1.00 68.75 ? 164 GLU A OE2 1 ATOM 1338 N N . GLU A 1 165 ? -0.239 83.088 9.003 1.00 30.46 ? 165 GLU A N 1 ATOM 1339 C CA . GLU A 1 165 ? 0.339 84.035 9.944 1.00 33.10 ? 165 GLU A CA 1 ATOM 1340 C C . GLU A 1 165 ? 1.655 83.577 10.548 1.00 36.77 ? 165 GLU A C 1 ATOM 1341 O O . GLU A 1 165 ? 2.670 84.264 10.419 1.00 35.23 ? 165 GLU A O 1 ATOM 1342 C CB . GLU A 1 165 ? -0.651 84.338 11.066 1.00 43.02 ? 165 GLU A CB 1 ATOM 1343 C CG . GLU A 1 165 ? -1.908 85.032 10.586 1.00 61.15 ? 165 GLU A CG 1 ATOM 1344 C CD . GLU A 1 165 ? -3.012 85.005 11.617 1.00 67.01 ? 165 GLU A CD 1 ATOM 1345 O OE1 . GLU A 1 165 ? -2.787 85.500 12.745 1.00 73.65 ? 165 GLU A OE1 1 ATOM 1346 O OE2 . GLU A 1 165 ? -4.102 84.485 11.295 1.00 70.05 ? 165 GLU A OE2 1 ATOM 1347 N N . CYS A 1 166 ? 1.648 82.419 11.200 1.00 39.28 ? 166 CYS A N 1 ATOM 1348 C CA . CYS A 1 166 ? 2.863 81.939 11.838 1.00 37.58 ? 166 CYS A CA 1 ATOM 1349 C C . CYS A 1 166 ? 4.032 81.867 10.858 1.00 36.55 ? 166 CYS A C 1 ATOM 1350 O O . CYS A 1 166 ? 5.071 82.501 11.081 1.00 37.75 ? 166 CYS A O 1 ATOM 1351 C CB . CYS A 1 166 ? 2.625 80.589 12.505 1.00 22.47 ? 166 CYS A CB 1 ATOM 1352 S SG . CYS A 1 166 ? 3.739 80.274 13.889 1.00 30.52 ? 166 CYS A SG 1 ATOM 1353 N N . PRO A 1 167 ? 3.892 81.101 9.763 1.00 36.81 ? 167 PRO A N 1 ATOM 1354 C CA . PRO A 1 167 ? 5.014 81.045 8.821 1.00 39.96 ? 167 PRO A CA 1 ATOM 1355 C C . PRO A 1 167 ? 5.377 82.426 8.262 1.00 43.32 ? 167 PRO A C 1 ATOM 1356 O O . PRO A 1 167 ? 6.490 82.636 7.787 1.00 42.02 ? 167 PRO A O 1 ATOM 1357 C CB . PRO A 1 167 ? 4.535 80.057 7.748 1.00 30.65 ? 167 PRO A CB 1 ATOM 1358 C CG . PRO A 1 167 ? 3.048 80.061 7.891 1.00 34.88 ? 167 PRO A CG 1 ATOM 1359 C CD . PRO A 1 167 ? 2.830 80.161 9.372 1.00 23.68 ? 167 PRO A CD 1 ATOM 1360 N N . ALA A 1 168 ? 4.449 83.375 8.334 1.00 46.65 ? 168 ALA A N 1 ATOM 1361 C CA . ALA A 1 168 ? 4.737 84.726 7.855 1.00 48.33 ? 168 ALA A CA 1 ATOM 1362 C C . ALA A 1 168 ? 5.621 85.419 8.883 1.00 50.81 ? 168 ALA A C 1 ATOM 1363 O O . ALA A 1 168 ? 6.644 86.018 8.539 1.00 47.55 ? 168 ALA A O 1 ATOM 1364 C CB . ALA A 1 168 ? 3.450 85.520 7.675 1.00 6.95 ? 168 ALA A CB 1 ATOM 1365 N N . THR A 1 169 ? 5.203 85.342 10.145 1.00 38.22 ? 169 THR A N 1 ATOM 1366 C CA . THR A 1 169 ? 5.948 85.944 11.228 1.00 34.11 ? 169 THR A CA 1 ATOM 1367 C C . THR A 1 169 ? 7.366 85.405 11.182 1.00 32.99 ? 169 THR A C 1 ATOM 1368 O O . THR A 1 169 ? 8.326 86.170 11.296 1.00 36.62 ? 169 THR A O 1 ATOM 1369 C CB . THR A 1 169 ? 5.338 85.602 12.595 1.00 25.81 ? 169 THR A CB 1 ATOM 1370 O OG1 . THR A 1 169 ? 3.975 86.055 12.643 1.00 27.36 ? 169 THR A OG1 1 ATOM 1371 C CG2 . THR A 1 169 ? 6.142 86.262 13.717 1.00 26.60 ? 169 THR A CG2 1 ATOM 1372 N N . LEU A 1 170 ? 7.509 84.094 11.006 1.00 48.30 ? 170 LEU A N 1 ATOM 1373 C CA . LEU A 1 170 ? 8.841 83.505 10.950 1.00 49.48 ? 170 LEU A CA 1 ATOM 1374 C C . LEU A 1 170 ? 9.683 84.095 9.818 1.00 58.79 ? 170 LEU A C 1 ATOM 1375 O O . LEU A 1 170 ? 10.873 84.341 9.999 1.00 53.12 ? 170 LEU A O 1 ATOM 1376 C CB . LEU A 1 170 ? 8.771 81.985 10.784 1.00 20.85 ? 170 LEU A CB 1 ATOM 1377 C CG . LEU A 1 170 ? 10.146 81.328 10.588 1.00 28.62 ? 170 LEU A CG 1 ATOM 1378 C CD1 . LEU A 1 170 ? 10.990 81.403 11.853 1.00 25.86 ? 170 LEU A CD1 1 ATOM 1379 C CD2 . LEU A 1 170 ? 9.940 79.895 10.197 1.00 27.04 ? 170 LEU A CD2 1 ATOM 1380 N N . ARG A 1 171 ? 9.082 84.315 8.649 1.00 50.33 ? 171 ARG A N 1 ATOM 1381 C CA . ARG A 1 171 ? 9.829 84.888 7.527 1.00 50.72 ? 171 ARG A CA 1 ATOM 1382 C C . ARG A 1 171 ? 10.266 86.303 7.867 1.00 46.90 ? 171 ARG A C 1 ATOM 1383 O O . ARG A 1 171 ? 11.428 86.661 7.680 1.00 56.82 ? 171 ARG A O 1 ATOM 1384 C CB . ARG A 1 171 ? 8.983 84.914 6.254 1.00 30.80 ? 171 ARG A CB 1 ATOM 1385 C CG . ARG A 1 171 ? 8.812 83.559 5.566 1.00 29.81 ? 171 ARG A CG 1 ATOM 1386 C CD . ARG A 1 171 ? 7.825 83.708 4.423 1.00 36.03 ? 171 ARG A CD 1 ATOM 1387 N NE . ARG A 1 171 ? 7.109 82.474 4.101 1.00 50.28 ? 171 ARG A NE 1 ATOM 1388 C CZ . ARG A 1 171 ? 7.670 81.415 3.536 1.00 40.56 ? 171 ARG A CZ 1 ATOM 1389 N NH1 . ARG A 1 171 ? 8.962 81.432 3.230 1.00 57.16 ? 171 ARG A NH1 1 ATOM 1390 N NH2 . ARG A 1 171 ? 6.935 80.346 3.268 1.00 44.12 ? 171 ARG A NH2 1 ATOM 1391 N N . LYS A 1 172 ? 9.331 87.109 8.363 1.00 28.96 ? 172 LYS A N 1 ATOM 1392 C CA . LYS A 1 172 ? 9.642 88.477 8.751 1.00 30.70 ? 172 LYS A CA 1 ATOM 1393 C C . LYS A 1 172 ? 10.843 88.495 9.679 1.00 44.19 ? 172 LYS A C 1 ATOM 1394 O O . LYS A 1 172 ? 11.777 89.255 9.470 1.00 36.79 ? 172 LYS A O 1 ATOM 1395 C CB . LYS A 1 172 ? 8.455 89.112 9.472 1.00 30.84 ? 172 LYS A CB 1 ATOM 1396 C CG . LYS A 1 172 ? 8.777 90.465 10.095 1.00 38.66 ? 172 LYS A CG 1 ATOM 1397 C CD . LYS A 1 172 ? 7.555 91.059 10.758 1.00 50.24 ? 172 LYS A CD 1 ATOM 1398 C CE . LYS A 1 172 ? 7.850 92.424 11.328 1.00 58.52 ? 172 LYS A CE 1 ATOM 1399 N NZ . LYS A 1 172 ? 6.686 92.935 12.088 1.00 62.14 ? 172 LYS A NZ 1 ATOM 1400 N N . TYR A 1 173 ? 10.807 87.647 10.699 1.00 43.85 ? 173 TYR A N 1 ATOM 1401 C CA . TYR A 1 173 ? 11.884 87.572 11.669 1.00 43.14 ? 173 TYR A CA 1 ATOM 1402 C C . TYR A 1 173 ? 13.220 87.168 11.069 1.00 45.34 ? 173 TYR A C 1 ATOM 1403 O O . TYR A 1 173 ? 14.253 87.730 11.416 1.00 48.52 ? 173 TYR A O 1 ATOM 1404 C CB . TYR A 1 173 ? 11.535 86.597 12.798 1.00 32.39 ? 173 TYR A CB 1 ATOM 1405 C CG . TYR A 1 173 ? 10.472 87.074 13.770 1.00 35.87 ? 173 TYR A CG 1 ATOM 1406 C CD1 . TYR A 1 173 ? 9.883 88.328 13.649 1.00 28.55 ? 173 TYR A CD1 1 ATOM 1407 C CD2 . TYR A 1 173 ? 10.044 86.255 14.802 1.00 32.47 ? 173 TYR A CD2 1 ATOM 1408 C CE1 . TYR A 1 173 ? 8.887 88.754 14.534 1.00 30.47 ? 173 TYR A CE1 1 ATOM 1409 C CE2 . TYR A 1 173 ? 9.048 86.667 15.693 1.00 30.47 ? 173 TYR A CE2 1 ATOM 1410 C CZ . TYR A 1 173 ? 8.469 87.917 15.554 1.00 28.95 ? 173 TYR A CZ 1 ATOM 1411 O OH . TYR A 1 173 ? 7.456 88.290 16.419 1.00 31.10 ? 173 TYR A OH 1 ATOM 1412 N N . LEU A 1 174 ? 13.227 86.188 10.182 1.00 38.01 ? 174 LEU A N 1 ATOM 1413 C CA . LEU A 1 174 ? 14.493 85.782 9.595 1.00 45.83 ? 174 LEU A CA 1 ATOM 1414 C C . LEU A 1 174 ? 15.163 86.948 8.868 1.00 50.02 ? 174 LEU A C 1 ATOM 1415 O O . LEU A 1 174 ? 16.391 87.001 8.768 1.00 48.42 ? 174 LEU A O 1 ATOM 1416 C CB . LEU A 1 174 ? 14.290 84.619 8.628 1.00 34.49 ? 174 LEU A CB 1 ATOM 1417 C CG . LEU A 1 174 ? 13.912 83.258 9.218 1.00 43.98 ? 174 LEU A CG 1 ATOM 1418 C CD1 . LEU A 1 174 ? 13.986 82.196 8.127 1.00 43.82 ? 174 LEU A CD1 1 ATOM 1419 C CD2 . LEU A 1 174 ? 14.867 82.895 10.337 1.00 36.64 ? 174 LEU A CD2 1 ATOM 1420 N N . LYS A 1 175 ? 14.363 87.883 8.362 1.00 43.58 ? 175 LYS A N 1 ATOM 1421 C CA . LYS A 1 175 ? 14.910 89.033 7.654 1.00 54.11 ? 175 LYS A CA 1 ATOM 1422 C C . LYS A 1 175 ? 15.766 89.880 8.575 1.00 52.27 ? 175 LYS A C 1 ATOM 1423 O O . LYS A 1 175 ? 16.765 90.449 8.148 1.00 53.79 ? 175 LYS A O 1 ATOM 1424 C CB . LYS A 1 175 ? 13.797 89.905 7.083 1.00 57.71 ? 175 LYS A CB 1 ATOM 1425 C CG . LYS A 1 175 ? 13.268 89.456 5.746 1.00 67.47 ? 175 LYS A CG 1 ATOM 1426 C CD . LYS A 1 175 ? 12.346 90.513 5.166 1.00 77.42 ? 175 LYS A CD 1 ATOM 1427 C CE . LYS A 1 175 ? 11.857 90.113 3.787 1.00 83.17 ? 175 LYS A CE 1 ATOM 1428 N NZ . LYS A 1 175 ? 10.995 91.162 3.177 1.00 86.57 ? 175 LYS A NZ 1 ATOM 1429 N N . TYR A 1 176 ? 15.360 89.966 9.836 1.00 40.42 ? 176 TYR A N 1 ATOM 1430 C CA . TYR A 1 176 ? 16.083 90.747 10.836 1.00 38.38 ? 176 TYR A CA 1 ATOM 1431 C C . TYR A 1 176 ? 17.025 89.886 11.682 1.00 37.45 ? 176 TYR A C 1 ATOM 1432 O O . TYR A 1 176 ? 17.731 90.399 12.547 1.00 38.04 ? 176 TYR A O 1 ATOM 1433 C CB . TYR A 1 176 ? 15.093 91.440 11.776 1.00 37.89 ? 176 TYR A CB 1 ATOM 1434 C CG . TYR A 1 176 ? 14.189 92.453 11.119 1.00 55.06 ? 176 TYR A CG 1 ATOM 1435 C CD1 . TYR A 1 176 ? 13.267 92.072 10.151 1.00 54.85 ? 176 TYR A CD1 1 ATOM 1436 C CD2 . TYR A 1 176 ? 14.240 93.799 11.485 1.00 53.76 ? 176 TYR A CD2 1 ATOM 1437 C CE1 . TYR A 1 176 ? 12.415 93.006 9.567 1.00 58.36 ? 176 TYR A CE1 1 ATOM 1438 C CE2 . TYR A 1 176 ? 13.394 94.737 10.905 1.00 55.05 ? 176 TYR A CE2 1 ATOM 1439 C CZ . TYR A 1 176 ? 12.484 94.333 9.950 1.00 57.26 ? 176 TYR A CZ 1 ATOM 1440 O OH . TYR A 1 176 ? 11.632 95.253 9.389 1.00 57.08 ? 176 TYR A OH 1 ATOM 1441 N N . SER A 1 177 ? 17.035 88.581 11.435 1.00 39.19 ? 177 SER A N 1 ATOM 1442 C CA . SER A 1 177 ? 17.857 87.676 12.222 1.00 38.65 ? 177 SER A CA 1 ATOM 1443 C C . SER A 1 177 ? 19.013 87.038 11.472 1.00 48.76 ? 177 SER A C 1 ATOM 1444 O O . SER A 1 177 ? 19.667 86.139 11.994 1.00 47.83 ? 177 SER A O 1 ATOM 1445 C CB . SER A 1 177 ? 16.978 86.582 12.831 1.00 45.41 ? 177 SER A CB 1 ATOM 1446 O OG . SER A 1 177 ? 15.979 87.143 13.666 1.00 34.94 ? 177 SER A OG 1 ATOM 1447 N N . LYS A 1 178 ? 19.266 87.492 10.252 1.00 51.42 ? 178 LYS A N 1 ATOM 1448 C CA . LYS A 1 178 ? 20.372 86.946 9.484 1.00 54.96 ? 178 LYS A CA 1 ATOM 1449 C C . LYS A 1 178 ? 21.633 87.052 10.333 1.00 49.72 ? 178 LYS A C 1 ATOM 1450 O O . LYS A 1 178 ? 22.372 86.081 10.491 1.00 59.13 ? 178 LYS A O 1 ATOM 1451 C CB . LYS A 1 178 ? 20.562 87.727 8.182 1.00 68.31 ? 178 LYS A CB 1 ATOM 1452 C CG . LYS A 1 178 ? 19.527 87.434 7.106 1.00 73.62 ? 178 LYS A CG 1 ATOM 1453 C CD . LYS A 1 178 ? 19.711 88.368 5.908 1.00 78.13 ? 178 LYS A CD 1 ATOM 1454 C CE . LYS A 1 178 ? 18.781 88.021 4.739 1.00 83.41 ? 178 LYS A CE 1 ATOM 1455 N NZ . LYS A 1 178 ? 19.136 86.730 4.065 1.00 84.51 ? 178 LYS A NZ 1 ATOM 1456 N N . ASN A 1 179 ? 21.864 88.235 10.893 1.00 74.34 ? 179 ASN A N 1 ATOM 1457 C CA . ASN A 1 179 ? 23.041 88.466 11.724 1.00 80.33 ? 179 ASN A CA 1 ATOM 1458 C C . ASN A 1 179 ? 22.965 87.769 13.068 1.00 82.38 ? 179 ASN A C 1 ATOM 1459 O O . ASN A 1 179 ? 23.721 88.100 13.980 1.00 80.86 ? 179 ASN A O 1 ATOM 1460 C CB . ASN A 1 179 ? 23.257 89.962 11.960 1.00 81.59 ? 179 ASN A CB 1 ATOM 1461 C CG . ASN A 1 179 ? 23.680 90.689 10.709 1.00 95.92 ? 179 ASN A CG 1 ATOM 1462 O OD1 . ASN A 1 179 ? 24.561 90.228 9.986 1.00 102.45 ? 179 ASN A OD1 1 ATOM 1463 N ND2 . ASN A 1 179 ? 23.062 91.835 10.446 1.00 94.65 ? 179 ASN A ND2 1 ATOM 1464 N N . ILE A 1 180 ? 22.053 86.812 13.197 1.00 57.07 ? 180 ILE A N 1 ATOM 1465 C CA . ILE A 1 180 ? 21.919 86.087 14.451 1.00 49.67 ? 180 ILE A CA 1 ATOM 1466 C C . ILE A 1 180 ? 21.844 84.584 14.272 1.00 48.28 ? 180 ILE A C 1 ATOM 1467 O O . ILE A 1 180 ? 22.633 83.856 14.862 1.00 48.86 ? 180 ILE A O 1 ATOM 1468 C CB . ILE A 1 180 ? 20.687 86.542 15.233 1.00 29.65 ? 180 ILE A CB 1 ATOM 1469 C CG1 . ILE A 1 180 ? 20.851 88.007 15.644 1.00 25.75 ? 180 ILE A CG1 1 ATOM 1470 C CG2 . ILE A 1 180 ? 20.503 85.659 16.462 1.00 25.54 ? 180 ILE A CG2 1 ATOM 1471 C CD1 . ILE A 1 180 ? 19.719 88.555 16.473 1.00 22.51 ? 180 ILE A CD1 1 ATOM 1472 N N . LEU A 1 181 ? 20.905 84.119 13.456 1.00 44.59 ? 181 LEU A N 1 ATOM 1473 C CA . LEU A 1 181 ? 20.739 82.685 13.227 1.00 40.88 ? 181 LEU A CA 1 ATOM 1474 C C . LEU A 1 181 ? 21.714 82.106 12.211 1.00 47.18 ? 181 LEU A C 1 ATOM 1475 O O . LEU A 1 181 ? 22.074 80.934 12.280 1.00 40.52 ? 181 LEU A O 1 ATOM 1476 C CB . LEU A 1 181 ? 19.312 82.391 12.763 1.00 26.71 ? 181 LEU A CB 1 ATOM 1477 C CG . LEU A 1 181 ? 18.239 82.781 13.768 1.00 29.03 ? 181 LEU A CG 1 ATOM 1478 C CD1 . LEU A 1 181 ? 16.868 82.541 13.191 1.00 31.61 ? 181 LEU A CD1 1 ATOM 1479 C CD2 . LEU A 1 181 ? 18.437 81.969 15.028 1.00 29.07 ? 181 LEU A CD2 1 ATOM 1480 N N . ASP A 1 182 ? 22.147 82.927 11.266 1.00 46.22 ? 182 ASP A N 1 ATOM 1481 C CA . ASP A 1 182 ? 23.049 82.452 10.234 1.00 49.36 ? 182 ASP A CA 1 ATOM 1482 C C . ASP A 1 182 ? 24.516 82.679 10.535 1.00 53.04 ? 182 ASP A C 1 ATOM 1483 O O . ASP A 1 182 ? 25.361 82.457 9.683 1.00 51.75 ? 182 ASP A O 1 ATOM 1484 C CB . ASP A 1 182 ? 22.675 83.093 8.899 1.00 60.39 ? 182 ASP A CB 1 ATOM 1485 C CG . ASP A 1 182 ? 21.263 82.742 8.469 1.00 73.32 ? 182 ASP A CG 1 ATOM 1486 O OD1 . ASP A 1 182 ? 20.945 81.536 8.449 1.00 73.93 ? 182 ASP A OD1 1 ATOM 1487 O OD2 . ASP A 1 182 ? 20.474 83.659 8.152 1.00 77.59 ? 182 ASP A OD2 1 ATOM 1488 N N . ARG A 1 183 ? 24.825 83.115 11.746 1.00 33.88 ? 183 ARG A N 1 ATOM 1489 C CA . ARG A 1 183 ? 26.213 83.339 12.115 1.00 34.57 ? 183 ARG A CA 1 ATOM 1490 C C . ARG A 1 183 ? 27.071 82.085 12.019 1.00 33.85 ? 183 ARG A C 1 ATOM 1491 O O . ARG A 1 183 ? 26.582 80.958 12.051 1.00 31.15 ? 183 ARG A O 1 ATOM 1492 C CB . ARG A 1 183 ? 26.307 83.866 13.543 1.00 40.02 ? 183 ARG A CB 1 ATOM 1493 C CG . ARG A 1 183 ? 25.919 85.305 13.697 1.00 42.75 ? 183 ARG A CG 1 ATOM 1494 C CD . ARG A 1 183 ? 25.167 85.481 14.981 1.00 59.49 ? 183 ARG A CD 1 ATOM 1495 N NE . ARG A 1 183 ? 25.875 84.877 16.098 1.00 59.32 ? 183 ARG A NE 1 ATOM 1496 C CZ . ARG A 1 183 ? 25.277 84.185 17.059 1.00 51.81 ? 183 ARG A CZ 1 ATOM 1497 N NH1 . ARG A 1 183 ? 23.965 84.007 17.035 1.00 39.66 ? 183 ARG A NH1 1 ATOM 1498 N NH2 . ARG A 1 183 ? 25.988 83.677 18.050 1.00 36.55 ? 183 ARG A NH2 1 ATOM 1499 N N . GLN A 1 184 ? 28.371 82.303 11.903 1.00 52.10 ? 184 GLN A N 1 ATOM 1500 C CA . GLN A 1 184 ? 29.335 81.227 11.846 1.00 51.85 ? 184 GLN A CA 1 ATOM 1501 C C . GLN A 1 184 ? 30.552 81.734 12.587 1.00 55.08 ? 184 GLN A C 1 ATOM 1502 O O . GLN A 1 184 ? 31.644 81.787 12.046 1.00 55.41 ? 184 GLN A O 1 ATOM 1503 C CB . GLN A 1 184 ? 29.671 80.898 10.404 1.00 37.11 ? 184 GLN A CB 1 ATOM 1504 C CG . GLN A 1 184 ? 28.674 79.959 9.801 1.00 41.84 ? 184 GLN A CG 1 ATOM 1505 C CD . GLN A 1 184 ? 28.845 78.550 10.325 1.00 42.51 ? 184 GLN A CD 1 ATOM 1506 O OE1 . GLN A 1 184 ? 27.937 77.723 10.237 1.00 45.50 ? 184 GLN A OE1 1 ATOM 1507 N NE2 . GLN A 1 184 ? 30.026 78.261 10.860 1.00 33.80 ? 184 GLN A NE2 1 ATOM 1508 N N . ASP A 1 185 ? 30.336 82.129 13.835 1.00 48.24 ? 185 ASP A N 1 ATOM 1509 C CA . ASP A 1 185 ? 31.392 82.645 14.683 1.00 46.30 ? 185 ASP A CA 1 ATOM 1510 C C . ASP A 1 185 ? 32.402 81.567 15.044 1.00 53.28 ? 185 ASP A C 1 ATOM 1511 O O . ASP A 1 185 ? 32.059 80.566 15.673 1.00 50.03 ? 185 ASP A O 1 ATOM 1512 C CB . ASP A 1 185 ? 30.791 83.229 15.956 1.00 41.39 ? 185 ASP A CB 1 ATOM 1513 C CG . ASP A 1 185 ? 29.814 84.346 15.671 1.00 50.66 ? 185 ASP A CG 1 ATOM 1514 O OD1 . ASP A 1 185 ? 29.805 84.841 14.520 1.00 54.39 ? 185 ASP A OD1 1 ATOM 1515 O OD2 . ASP A 1 185 ? 29.068 84.731 16.600 1.00 51.86 ? 185 ASP A OD2 1 ATOM 1516 N N . PRO A 1 186 ? 33.670 81.761 14.652 1.00 46.90 ? 186 PRO A N 1 ATOM 1517 C CA . PRO A 1 186 ? 34.727 80.793 14.942 1.00 48.06 ? 186 PRO A CA 1 ATOM 1518 C C . PRO A 1 186 ? 34.999 80.777 16.438 1.00 47.08 ? 186 PRO A C 1 ATOM 1519 O O . PRO A 1 186 ? 34.902 81.803 17.115 1.00 49.11 ? 186 PRO A O 1 ATOM 1520 C CB . PRO A 1 186 ? 35.895 81.320 14.126 1.00 59.81 ? 186 PRO A CB 1 ATOM 1521 C CG . PRO A 1 186 ? 35.704 82.795 14.238 1.00 60.61 ? 186 PRO A CG 1 ATOM 1522 C CD . PRO A 1 186 ? 34.224 82.964 14.010 1.00 58.76 ? 186 PRO A CD 1 ATOM 1523 N N . PRO A 1 187 ? 35.364 79.611 16.972 1.00 45.18 ? 187 PRO A N 1 ATOM 1524 C CA . PRO A 1 187 ? 35.639 79.454 18.400 1.00 43.80 ? 187 PRO A CA 1 ATOM 1525 C C . PRO A 1 187 ? 37.003 79.923 18.845 1.00 44.66 ? 187 PRO A C 1 ATOM 1526 O O . PRO A 1 187 ? 37.993 79.658 18.179 1.00 44.53 ? 187 PRO A O 1 ATOM 1527 C CB . PRO A 1 187 ? 35.503 77.955 18.593 1.00 44.55 ? 187 PRO A CB 1 ATOM 1528 C CG . PRO A 1 187 ? 36.184 77.439 17.351 1.00 46.63 ? 187 PRO A CG 1 ATOM 1529 C CD . PRO A 1 187 ? 35.617 78.350 16.250 1.00 38.75 ? 187 PRO A CD 1 ATOM 1530 N N . SER A 1 188 ? 37.056 80.618 19.974 1.00 40.42 ? 188 SER A N 1 ATOM 1531 C CA . SER A 1 188 ? 38.334 81.035 20.534 1.00 45.11 ? 188 SER A CA 1 ATOM 1532 C C . SER A 1 188 ? 38.640 79.868 21.470 1.00 51.56 ? 188 SER A C 1 ATOM 1533 O O . SER A 1 188 ? 37.720 79.291 22.041 1.00 44.15 ? 188 SER A O 1 ATOM 1534 C CB . SER A 1 188 ? 38.182 82.328 21.342 1.00 47.36 ? 188 SER A CB 1 ATOM 1535 O OG . SER A 1 188 ? 37.730 83.395 20.531 1.00 58.96 ? 188 SER A OG 1 ATOM 1536 N N . VAL A 1 189 ? 39.898 79.478 21.615 1.00 43.80 ? 189 VAL A N 1 ATOM 1537 C CA . VAL A 1 189 ? 40.190 78.378 22.524 1.00 50.03 ? 189 VAL A CA 1 ATOM 1538 C C . VAL A 1 189 ? 41.237 78.805 23.528 1.00 54.99 ? 189 VAL A C 1 ATOM 1539 O O . VAL A 1 189 ? 42.059 79.668 23.249 1.00 54.85 ? 189 VAL A O 1 ATOM 1540 C CB . VAL A 1 189 ? 40.692 77.114 21.790 1.00 45.04 ? 189 VAL A CB 1 ATOM 1541 C CG1 . VAL A 1 189 ? 39.914 76.923 20.498 1.00 40.11 ? 189 VAL A CG1 1 ATOM 1542 C CG2 . VAL A 1 189 ? 42.175 77.203 21.544 1.00 60.89 ? 189 VAL A CG2 1 ATOM 1543 N N . VAL A 1 190 ? 41.194 78.200 24.705 1.00 50.58 ? 190 VAL A N 1 ATOM 1544 C CA . VAL A 1 190 ? 42.138 78.519 25.761 1.00 48.50 ? 190 VAL A CA 1 ATOM 1545 C C . VAL A 1 190 ? 42.504 77.251 26.483 1.00 56.36 ? 190 VAL A C 1 ATOM 1546 O O . VAL A 1 190 ? 41.642 76.606 27.063 1.00 49.08 ? 190 VAL A O 1 ATOM 1547 C CB . VAL A 1 190 ? 41.532 79.476 26.796 1.00 48.31 ? 190 VAL A CB 1 ATOM 1548 C CG1 . VAL A 1 190 ? 42.533 79.739 27.903 1.00 43.70 ? 190 VAL A CG1 1 ATOM 1549 C CG2 . VAL A 1 190 ? 41.133 80.773 26.131 1.00 58.64 ? 190 VAL A CG2 1 ATOM 1550 N N . VAL A 1 191 ? 43.776 76.882 26.436 1.00 59.69 ? 191 VAL A N 1 ATOM 1551 C CA . VAL A 1 191 ? 44.223 75.691 27.132 1.00 56.96 ? 191 VAL A CA 1 ATOM 1552 C C . VAL A 1 191 ? 44.786 76.126 28.475 1.00 58.97 ? 191 VAL A C 1 ATOM 1553 O O . VAL A 1 191 ? 45.488 77.131 28.575 1.00 56.58 ? 191 VAL A O 1 ATOM 1554 C CB . VAL A 1 191 ? 45.284 74.930 26.328 1.00 50.90 ? 191 VAL A CB 1 ATOM 1555 C CG1 . VAL A 1 191 ? 46.067 74.014 27.240 1.00 53.01 ? 191 VAL A CG1 1 ATOM 1556 C CG2 . VAL A 1 191 ? 44.604 74.102 25.255 1.00 42.66 ? 191 VAL A CG2 1 ATOM 1557 N N . THR A 1 192 ? 44.456 75.374 29.514 1.00 69.81 ? 192 THR A N 1 ATOM 1558 C CA . THR A 1 192 ? 44.916 75.701 30.851 1.00 65.67 ? 192 THR A CA 1 ATOM 1559 C C . THR A 1 192 ? 45.064 74.409 31.648 1.00 68.01 ? 192 THR A C 1 ATOM 1560 O O . THR A 1 192 ? 44.402 73.414 31.352 1.00 69.46 ? 192 THR A O 1 ATOM 1561 C CB . THR A 1 192 ? 43.909 76.634 31.547 1.00 42.71 ? 192 THR A CB 1 ATOM 1562 O OG1 . THR A 1 192 ? 44.463 77.096 32.782 1.00 59.80 ? 192 THR A OG1 1 ATOM 1563 C CG2 . THR A 1 192 ? 42.603 75.889 31.826 1.00 37.89 ? 192 THR A CG2 1 ATOM 1564 N N . SER A 1 193 ? 45.938 74.418 32.649 1.00 60.99 ? 193 SER A N 1 ATOM 1565 C CA . SER A 1 193 ? 46.155 73.228 33.464 1.00 65.67 ? 193 SER A CA 1 ATOM 1566 C C . SER A 1 193 ? 46.041 73.562 34.936 1.00 64.62 ? 193 SER A C 1 ATOM 1567 O O . SER A 1 193 ? 46.419 74.651 35.357 1.00 60.05 ? 193 SER A O 1 ATOM 1568 C CB . SER A 1 193 ? 47.540 72.643 33.192 1.00 101.63 ? 193 SER A CB 1 ATOM 1569 O OG . SER A 1 193 ? 48.557 73.536 33.610 1.00 104.96 ? 193 SER A OG 1 ATOM 1570 N N . HIS A 1 194 ? 45.508 72.627 35.717 1.00 78.08 ? 194 HIS A N 1 ATOM 1571 C CA . HIS A 1 194 ? 45.370 72.839 37.151 1.00 83.74 ? 194 HIS A CA 1 ATOM 1572 C C . HIS A 1 194 ? 45.837 71.612 37.925 1.00 82.12 ? 194 HIS A C 1 ATOM 1573 O O . HIS A 1 194 ? 45.543 70.471 37.553 1.00 70.52 ? 194 HIS A O 1 ATOM 1574 C CB . HIS A 1 194 ? 43.924 73.169 37.521 1.00 94.17 ? 194 HIS A CB 1 ATOM 1575 C CG . HIS A 1 194 ? 43.799 73.916 38.810 1.00 105.48 ? 194 HIS A CG 1 ATOM 1576 N ND1 . HIS A 1 194 ? 44.281 73.424 40.004 1.00 109.24 ? 194 HIS A ND1 1 ATOM 1577 C CD2 . HIS A 1 194 ? 43.286 75.138 39.087 1.00 109.18 ? 194 HIS A CD2 1 ATOM 1578 C CE1 . HIS A 1 194 ? 44.073 74.311 40.960 1.00 114.37 ? 194 HIS A CE1 1 ATOM 1579 N NE2 . HIS A 1 194 ? 43.471 75.360 40.430 1.00 113.33 ? 194 HIS A NE2 1 ATOM 1580 N N . GLN A 1 195 ? 46.574 71.865 39.003 1.00 103.22 ? 195 GLN A N 1 ATOM 1581 C CA . GLN A 1 195 ? 47.119 70.805 39.840 1.00 113.23 ? 195 GLN A CA 1 ATOM 1582 C C . GLN A 1 195 ? 46.476 70.785 41.218 1.00 115.84 ? 195 GLN A C 1 ATOM 1583 O O . GLN A 1 195 ? 46.699 71.682 42.033 1.00 112.61 ? 195 GLN A O 1 ATOM 1584 C CB . GLN A 1 195 ? 48.631 70.991 39.994 1.00 113.03 ? 195 GLN A CB 1 ATOM 1585 C CG . GLN A 1 195 ? 49.321 69.914 40.816 1.00 113.54 ? 195 GLN A CG 1 ATOM 1586 C CD . GLN A 1 195 ? 49.353 68.579 40.107 1.00 115.89 ? 195 GLN A CD 1 ATOM 1587 O OE1 . GLN A 1 195 ? 48.314 68.038 39.736 1.00 119.29 ? 195 GLN A OE1 1 ATOM 1588 N NE2 . GLN A 1 195 ? 50.550 68.040 39.914 1.00 112.67 ? 195 GLN A NE2 1 ATOM 1589 N N . ALA A 1 196 ? 45.674 69.758 41.474 1.00 193.29 ? 196 ALA A N 1 ATOM 1590 C CA . ALA A 1 196 ? 45.018 69.613 42.764 1.00 197.78 ? 196 ALA A CA 1 ATOM 1591 C C . ALA A 1 196 ? 46.015 68.962 43.715 1.00 199.18 ? 196 ALA A C 1 ATOM 1592 O O . ALA A 1 196 ? 46.575 67.909 43.413 1.00 199.52 ? 196 ALA A O 1 ATOM 1593 C CB . ALA A 1 196 ? 43.773 68.743 42.629 1.00 99.15 ? 196 ALA A CB 1 ATOM 1594 N N . PRO A 1 197 ? 46.254 69.586 44.877 1.00 117.37 ? 197 PRO A N 1 ATOM 1595 C CA . PRO A 1 197 ? 47.201 69.020 45.841 1.00 117.37 ? 197 PRO A CA 1 ATOM 1596 C C . PRO A 1 197 ? 46.895 67.562 46.158 1.00 117.00 ? 197 PRO A C 1 ATOM 1597 O O . PRO A 1 197 ? 45.954 67.260 46.891 1.00 119.00 ? 197 PRO A O 1 ATOM 1598 C CB . PRO A 1 197 ? 47.040 69.931 47.057 1.00 112.18 ? 197 PRO A CB 1 ATOM 1599 C CG . PRO A 1 197 ? 45.620 70.406 46.942 1.00 114.09 ? 197 PRO A CG 1 ATOM 1600 C CD . PRO A 1 197 ? 45.513 70.711 45.471 1.00 115.86 ? 197 PRO A CD 1 ATOM 1601 N N . GLY A 1 198 ? 47.691 66.662 45.590 1.00 95.32 ? 198 GLY A N 1 ATOM 1602 C CA . GLY A 1 198 ? 47.490 65.245 45.824 1.00 92.29 ? 198 GLY A CA 1 ATOM 1603 C C . GLY A 1 198 ? 46.982 64.502 44.603 1.00 93.35 ? 198 GLY A C 1 ATOM 1604 O O . GLY A 1 198 ? 47.095 63.279 44.520 1.00 94.31 ? 198 GLY A O 1 ATOM 1605 N N . GLU A 1 199 ? 46.417 65.236 43.651 1.00 128.07 ? 199 GLU A N 1 ATOM 1606 C CA . GLU A 1 199 ? 45.897 64.627 42.432 1.00 125.20 ? 199 GLU A CA 1 ATOM 1607 C C . GLU A 1 199 ? 46.819 64.903 41.248 1.00 121.70 ? 199 GLU A C 1 ATOM 1608 O O . GLU A 1 199 ? 47.695 65.766 41.319 1.00 117.01 ? 199 GLU A O 1 ATOM 1609 C CB . GLU A 1 199 ? 44.501 65.171 42.129 1.00 103.71 ? 199 GLU A CB 1 ATOM 1610 C CG . GLU A 1 199 ? 43.487 64.923 43.228 1.00 106.12 ? 199 GLU A CG 1 ATOM 1611 C CD . GLU A 1 199 ? 42.130 65.511 42.902 1.00 107.59 ? 199 GLU A CD 1 ATOM 1612 O OE1 . GLU A 1 199 ? 41.593 65.197 41.818 1.00 108.79 ? 199 GLU A OE1 1 ATOM 1613 O OE2 . GLU A 1 199 ? 41.602 66.283 43.730 1.00 106.90 ? 199 GLU A OE2 1 ATOM 1614 N N . LYS A 1 200 ? 46.619 64.166 40.160 1.00 91.02 ? 200 LYS A N 1 ATOM 1615 C CA . LYS A 1 200 ? 47.427 64.344 38.963 1.00 88.23 ? 200 LYS A CA 1 ATOM 1616 C C . LYS A 1 200 ? 47.240 65.767 38.437 1.00 89.56 ? 200 LYS A C 1 ATOM 1617 O O . LYS A 1 200 ? 46.386 66.513 38.924 1.00 89.09 ? 200 LYS A O 1 ATOM 1618 C CB . LYS A 1 200 ? 46.983 63.362 37.878 1.00 82.22 ? 200 LYS A CB 1 ATOM 1619 C CG . LYS A 1 200 ? 46.869 61.917 38.315 1.00 81.14 ? 200 LYS A CG 1 ATOM 1620 C CD . LYS A 1 200 ? 46.295 61.067 37.184 1.00 77.53 ? 200 LYS A CD 1 ATOM 1621 C CE . LYS A 1 200 ? 46.226 59.592 37.556 1.00 88.20 ? 200 LYS A CE 1 ATOM 1622 N NZ . LYS A 1 200 ? 47.579 59.030 37.833 1.00 88.82 ? 200 LYS A NZ 1 ATOM 1623 N N . LYS A 1 201 ? 48.041 66.146 37.445 1.00 129.76 ? 201 LYS A N 1 ATOM 1624 C CA . LYS A 1 201 ? 47.919 67.467 36.838 1.00 126.09 ? 201 LYS A CA 1 ATOM 1625 C C . LYS A 1 201 ? 46.773 67.365 35.842 1.00 122.61 ? 201 LYS A C 1 ATOM 1626 O O . LYS A 1 201 ? 46.653 66.360 35.142 1.00 118.83 ? 201 LYS A O 1 ATOM 1627 C CB . LYS A 1 201 ? 49.205 67.849 36.108 1.00 90.48 ? 201 LYS A CB 1 ATOM 1628 C CG . LYS A 1 201 ? 49.045 69.041 35.174 1.00 92.04 ? 201 LYS A CG 1 ATOM 1629 C CD . LYS A 1 201 ? 50.361 69.457 34.546 1.00 92.28 ? 201 LYS A CD 1 ATOM 1630 C CE . LYS A 1 201 ? 51.301 70.034 35.584 1.00 94.49 ? 201 LYS A CE 1 ATOM 1631 N NZ . LYS A 1 201 ? 52.569 70.487 34.963 1.00 96.25 ? 201 LYS A NZ 1 ATOM 1632 N N . LYS A 1 202 ? 45.932 68.393 35.773 1.00 87.86 ? 202 LYS A N 1 ATOM 1633 C CA . LYS A 1 202 ? 44.797 68.362 34.856 1.00 86.32 ? 202 LYS A CA 1 ATOM 1634 C C . LYS A 1 202 ? 44.762 69.512 33.843 1.00 81.07 ? 202 LYS A C 1 ATOM 1635 O O . LYS A 1 202 ? 44.806 70.686 34.215 1.00 72.35 ? 202 LYS A O 1 ATOM 1636 C CB . LYS A 1 202 ? 43.498 68.305 35.667 1.00 72.74 ? 202 LYS A CB 1 ATOM 1637 C CG . LYS A 1 202 ? 43.399 67.049 36.534 1.00 78.32 ? 202 LYS A CG 1 ATOM 1638 C CD . LYS A 1 202 ? 42.111 66.993 37.339 1.00 86.24 ? 202 LYS A CD 1 ATOM 1639 C CE . LYS A 1 202 ? 42.019 65.699 38.130 1.00 86.25 ? 202 LYS A CE 1 ATOM 1640 N NZ . LYS A 1 202 ? 40.767 65.624 38.922 1.00 92.10 ? 202 LYS A NZ 1 ATOM 1641 N N . LEU A 1 203 ? 44.684 69.146 32.561 1.00 69.43 ? 203 LEU A N 1 ATOM 1642 C CA . LEU A 1 203 ? 44.657 70.095 31.446 1.00 71.88 ? 203 LEU A CA 1 ATOM 1643 C C . LEU A 1 203 ? 43.237 70.291 30.929 1.00 68.88 ? 203 LEU A C 1 ATOM 1644 O O . LEU A 1 203 ? 42.558 69.317 30.607 1.00 64.45 ? 203 LEU A O 1 ATOM 1645 C CB . LEU A 1 203 ? 45.510 69.574 30.288 1.00 45.99 ? 203 LEU A CB 1 ATOM 1646 C CG . LEU A 1 203 ? 46.912 69.016 30.537 1.00 49.45 ? 203 LEU A CG 1 ATOM 1647 C CD1 . LEU A 1 203 ? 47.517 68.628 29.188 1.00 46.05 ? 203 LEU A CD1 1 ATOM 1648 C CD2 . LEU A 1 203 ? 47.777 70.037 31.259 1.00 43.12 ? 203 LEU A CD2 1 ATOM 1649 N N . LYS A 1 204 ? 42.808 71.547 30.817 1.00 66.00 ? 204 LYS A N 1 ATOM 1650 C CA . LYS A 1 204 ? 41.458 71.871 30.345 1.00 62.49 ? 204 LYS A CA 1 ATOM 1651 C C . LYS A 1 204 ? 41.412 72.738 29.097 1.00 65.25 ? 204 LYS A C 1 ATOM 1652 O O . LYS A 1 204 ? 41.816 73.901 29.128 1.00 66.29 ? 204 LYS A O 1 ATOM 1653 C CB . LYS A 1 204 ? 40.671 72.574 31.450 1.00 47.17 ? 204 LYS A CB 1 ATOM 1654 C CG . LYS A 1 204 ? 39.351 73.197 31.012 1.00 55.01 ? 204 LYS A CG 1 ATOM 1655 C CD . LYS A 1 204 ? 38.772 73.976 32.177 1.00 58.98 ? 204 LYS A CD 1 ATOM 1656 C CE . LYS A 1 204 ? 37.626 74.880 31.784 1.00 73.89 ? 204 LYS A CE 1 ATOM 1657 N NZ . LYS A 1 204 ? 37.258 75.742 32.952 1.00 71.67 ? 204 LYS A NZ 1 ATOM 1658 N N . CYS A 1 205 ? 40.890 72.169 28.014 1.00 56.75 ? 205 CYS A N 1 ATOM 1659 C CA . CYS A 1 205 ? 40.760 72.879 26.744 1.00 56.62 ? 205 CYS A CA 1 ATOM 1660 C C . CYS A 1 205 ? 39.375 73.501 26.612 1.00 56.73 ? 205 CYS A C 1 ATOM 1661 O O . CYS A 1 205 ? 38.374 72.788 26.595 1.00 55.81 ? 205 CYS A O 1 ATOM 1662 C CB . CYS A 1 205 ? 40.961 71.931 25.576 1.00 49.60 ? 205 CYS A CB 1 ATOM 1663 S SG . CYS A 1 205 ? 40.981 72.837 24.006 1.00 69.53 ? 205 CYS A SG 1 ATOM 1664 N N . LEU A 1 206 ? 39.313 74.819 26.482 1.00 47.34 ? 206 LEU A N 1 ATOM 1665 C CA . LEU A 1 206 ? 38.031 75.495 26.382 1.00 36.88 ? 206 LEU A CA 1 ATOM 1666 C C . LEU A 1 206 ? 37.776 76.195 25.062 1.00 50.67 ? 206 LEU A C 1 ATOM 1667 O O . LEU A 1 206 ? 38.546 77.056 24.654 1.00 44.31 ? 206 LEU A O 1 ATOM 1668 C CB . LEU A 1 206 ? 37.903 76.520 27.505 1.00 21.06 ? 206 LEU A CB 1 ATOM 1669 C CG . LEU A 1 206 ? 36.630 77.368 27.484 1.00 28.29 ? 206 LEU A CG 1 ATOM 1670 C CD1 . LEU A 1 206 ? 35.425 76.473 27.703 1.00 37.46 ? 206 LEU A CD1 1 ATOM 1671 C CD2 . LEU A 1 206 ? 36.702 78.436 28.556 1.00 28.61 ? 206 LEU A CD2 1 ATOM 1672 N N . ALA A 1 207 ? 36.685 75.834 24.399 1.00 43.33 ? 207 ALA A N 1 ATOM 1673 C CA . ALA A 1 207 ? 36.319 76.480 23.141 1.00 39.47 ? 207 ALA A CA 1 ATOM 1674 C C . ALA A 1 207 ? 35.230 77.488 23.515 1.00 47.87 ? 207 ALA A C 1 ATOM 1675 O O . ALA A 1 207 ? 34.324 77.150 24.271 1.00 48.38 ? 207 ALA A O 1 ATOM 1676 C CB . ALA A 1 207 ? 35.777 75.447 22.153 1.00 34.23 ? 207 ALA A CB 1 ATOM 1677 N N . TYR A 1 208 ? 35.311 78.723 23.029 1.00 39.46 ? 208 TYR A N 1 ATOM 1678 C CA . TYR A 1 208 ? 34.274 79.683 23.387 1.00 35.65 ? 208 TYR A CA 1 ATOM 1679 C C . TYR A 1 208 ? 33.888 80.725 22.352 1.00 38.79 ? 208 TYR A C 1 ATOM 1680 O O . TYR A 1 208 ? 34.520 80.855 21.304 1.00 42.02 ? 208 TYR A O 1 ATOM 1681 C CB . TYR A 1 208 ? 34.611 80.383 24.704 1.00 40.98 ? 208 TYR A CB 1 ATOM 1682 C CG . TYR A 1 208 ? 35.848 81.249 24.686 1.00 46.65 ? 208 TYR A CG 1 ATOM 1683 C CD1 . TYR A 1 208 ? 37.116 80.691 24.565 1.00 52.45 ? 208 TYR A CD1 1 ATOM 1684 C CD2 . TYR A 1 208 ? 35.751 82.628 24.852 1.00 49.79 ? 208 TYR A CD2 1 ATOM 1685 C CE1 . TYR A 1 208 ? 38.257 81.487 24.618 1.00 54.04 ? 208 TYR A CE1 1 ATOM 1686 C CE2 . TYR A 1 208 ? 36.886 83.427 24.907 1.00 48.11 ? 208 TYR A CE2 1 ATOM 1687 C CZ . TYR A 1 208 ? 38.132 82.851 24.792 1.00 62.20 ? 208 TYR A CZ 1 ATOM 1688 O OH . TYR A 1 208 ? 39.251 83.641 24.873 1.00 70.32 ? 208 TYR A OH 1 ATOM 1689 N N . ASP A 1 209 ? 32.815 81.444 22.669 1.00 31.93 ? 209 ASP A N 1 ATOM 1690 C CA . ASP A 1 209 ? 32.263 82.480 21.813 1.00 38.50 ? 209 ASP A CA 1 ATOM 1691 C C . ASP A 1 209 ? 31.943 81.978 20.417 1.00 42.75 ? 209 ASP A C 1 ATOM 1692 O O . ASP A 1 209 ? 31.949 82.756 19.472 1.00 38.99 ? 209 ASP A O 1 ATOM 1693 C CB . ASP A 1 209 ? 33.222 83.674 21.703 1.00 47.26 ? 209 ASP A CB 1 ATOM 1694 C CG . ASP A 1 209 ? 33.433 84.392 23.029 1.00 49.29 ? 209 ASP A CG 1 ATOM 1695 O OD1 . ASP A 1 209 ? 32.507 84.414 23.869 1.00 47.84 ? 209 ASP A OD1 1 ATOM 1696 O OD2 . ASP A 1 209 ? 34.529 84.958 23.218 1.00 56.10 ? 209 ASP A OD2 1 ATOM 1697 N N . PHE A 1 210 ? 31.654 80.691 20.275 1.00 39.22 ? 210 PHE A N 1 ATOM 1698 C CA . PHE A 1 210 ? 31.344 80.148 18.949 1.00 32.62 ? 210 PHE A CA 1 ATOM 1699 C C . PHE A 1 210 ? 29.857 79.885 18.713 1.00 40.20 ? 210 PHE A C 1 ATOM 1700 O O . PHE A 1 210 ? 29.073 79.808 19.662 1.00 38.22 ? 210 PHE A O 1 ATOM 1701 C CB . PHE A 1 210 ? 32.132 78.855 18.713 1.00 38.45 ? 210 PHE A CB 1 ATOM 1702 C CG . PHE A 1 210 ? 31.721 77.707 19.599 1.00 48.98 ? 210 PHE A CG 1 ATOM 1703 C CD1 . PHE A 1 210 ? 30.624 76.915 19.276 1.00 36.33 ? 210 PHE A CD1 1 ATOM 1704 C CD2 . PHE A 1 210 ? 32.461 77.389 20.733 1.00 38.69 ? 210 PHE A CD2 1 ATOM 1705 C CE1 . PHE A 1 210 ? 30.284 75.826 20.064 1.00 38.08 ? 210 PHE A CE1 1 ATOM 1706 C CE2 . PHE A 1 210 ? 32.126 76.305 21.523 1.00 46.01 ? 210 PHE A CE2 1 ATOM 1707 C CZ . PHE A 1 210 ? 31.042 75.524 21.189 1.00 33.33 ? 210 PHE A CZ 1 ATOM 1708 N N . TYR A 1 211 ? 29.479 79.754 17.442 1.00 37.53 ? 211 TYR A N 1 ATOM 1709 C CA . TYR A 1 211 ? 28.095 79.480 17.047 1.00 36.59 ? 211 TYR A CA 1 ATOM 1710 C C . TYR A 1 211 ? 28.128 79.030 15.594 1.00 38.05 ? 211 TYR A C 1 ATOM 1711 O O . TYR A 1 211 ? 28.880 79.587 14.805 1.00 44.12 ? 211 TYR A O 1 ATOM 1712 C CB . TYR A 1 211 ? 27.239 80.742 17.167 1.00 29.07 ? 211 TYR A CB 1 ATOM 1713 C CG . TYR A 1 211 ? 25.764 80.507 16.918 1.00 34.44 ? 211 TYR A CG 1 ATOM 1714 C CD1 . TYR A 1 211 ? 24.932 80.014 17.927 1.00 35.37 ? 211 TYR A CD1 1 ATOM 1715 C CD2 . TYR A 1 211 ? 25.198 80.752 15.663 1.00 32.69 ? 211 TYR A CD2 1 ATOM 1716 C CE1 . TYR A 1 211 ? 23.563 79.768 17.692 1.00 30.20 ? 211 TYR A CE1 1 ATOM 1717 C CE2 . TYR A 1 211 ? 23.837 80.511 15.417 1.00 39.57 ? 211 TYR A CE2 1 ATOM 1718 C CZ . TYR A 1 211 ? 23.029 80.020 16.437 1.00 37.22 ? 211 TYR A CZ 1 ATOM 1719 O OH . TYR A 1 211 ? 21.695 79.786 16.199 1.00 33.58 ? 211 TYR A OH 1 ATOM 1720 N N . PRO A 1 212 ? 27.333 78.011 15.211 1.00 46.17 ? 212 PRO A N 1 ATOM 1721 C CA . PRO A 1 212 ? 26.368 77.159 15.913 1.00 41.73 ? 212 PRO A CA 1 ATOM 1722 C C . PRO A 1 212 ? 26.997 76.280 16.983 1.00 48.13 ? 212 PRO A C 1 ATOM 1723 O O . PRO A 1 212 ? 28.214 76.252 17.131 1.00 45.52 ? 212 PRO A O 1 ATOM 1724 C CB . PRO A 1 212 ? 25.769 76.326 14.787 1.00 39.91 ? 212 PRO A CB 1 ATOM 1725 C CG . PRO A 1 212 ? 25.885 77.214 13.608 1.00 54.66 ? 212 PRO A CG 1 ATOM 1726 C CD . PRO A 1 212 ? 27.277 77.734 13.765 1.00 36.68 ? 212 PRO A CD 1 ATOM 1727 N N . GLY A 1 213 ? 26.151 75.542 17.700 1.00 31.75 ? 213 GLY A N 1 ATOM 1728 C CA . GLY A 1 213 ? 26.602 74.679 18.785 1.00 25.27 ? 213 GLY A CA 1 ATOM 1729 C C . GLY A 1 213 ? 27.443 73.469 18.431 1.00 28.72 ? 213 GLY A C 1 ATOM 1730 O O . GLY A 1 213 ? 28.334 73.106 19.188 1.00 33.20 ? 213 GLY A O 1 ATOM 1731 N N . LYS A 1 214 ? 27.158 72.835 17.301 1.00 42.35 ? 214 LYS A N 1 ATOM 1732 C CA . LYS A 1 214 ? 27.905 71.659 16.855 1.00 43.35 ? 214 LYS A CA 1 ATOM 1733 C C . LYS A 1 214 ? 29.421 71.934 16.830 1.00 46.34 ? 214 LYS A C 1 ATOM 1734 O O . LYS A 1 214 ? 29.888 72.817 16.104 1.00 42.24 ? 214 LYS A O 1 ATOM 1735 C CB . LYS A 1 214 ? 27.419 71.267 15.458 1.00 88.89 ? 214 LYS A CB 1 ATOM 1736 C CG . LYS A 1 214 ? 28.157 70.116 14.813 1.00 104.03 ? 214 LYS A CG 1 ATOM 1737 C CD . LYS A 1 214 ? 27.960 68.830 15.582 1.00 116.36 ? 214 LYS A CD 1 ATOM 1738 C CE . LYS A 1 214 ? 28.460 67.651 14.773 1.00 121.19 ? 214 LYS A CE 1 ATOM 1739 N NZ . LYS A 1 214 ? 27.731 67.563 13.477 1.00 128.53 ? 214 LYS A NZ 1 ATOM 1740 N N . ILE A 1 215 ? 30.188 71.176 17.613 1.00 53.68 ? 215 ILE A N 1 ATOM 1741 C CA . ILE A 1 215 ? 31.640 71.367 17.675 1.00 56.67 ? 215 ILE A CA 1 ATOM 1742 C C . ILE A 1 215 ? 32.345 70.091 18.127 1.00 64.19 ? 215 ILE A C 1 ATOM 1743 O O . ILE A 1 215 ? 31.767 69.264 18.829 1.00 55.60 ? 215 ILE A O 1 ATOM 1744 C CB . ILE A 1 215 ? 32.016 72.510 18.676 1.00 42.34 ? 215 ILE A CB 1 ATOM 1745 C CG1 . ILE A 1 215 ? 33.464 72.973 18.455 1.00 46.72 ? 215 ILE A CG1 1 ATOM 1746 C CG2 . ILE A 1 215 ? 31.886 72.016 20.117 1.00 43.67 ? 215 ILE A CG2 1 ATOM 1747 C CD1 . ILE A 1 215 ? 33.928 74.086 19.427 1.00 34.49 ? 215 ILE A CD1 1 ATOM 1748 N N . ASP A 1 216 ? 33.598 69.939 17.716 1.00 58.18 ? 216 ASP A N 1 ATOM 1749 C CA . ASP A 1 216 ? 34.406 68.788 18.100 1.00 52.48 ? 216 ASP A CA 1 ATOM 1750 C C . ASP A 1 216 ? 35.620 69.325 18.857 1.00 59.17 ? 216 ASP A C 1 ATOM 1751 O O . ASP A 1 216 ? 36.394 70.122 18.322 1.00 59.06 ? 216 ASP A O 1 ATOM 1752 C CB . ASP A 1 216 ? 34.878 68.019 16.867 1.00 62.61 ? 216 ASP A CB 1 ATOM 1753 C CG . ASP A 1 216 ? 35.590 66.724 17.227 1.00 79.74 ? 216 ASP A CG 1 ATOM 1754 O OD1 . ASP A 1 216 ? 36.370 66.714 18.209 1.00 82.02 ? 216 ASP A OD1 1 ATOM 1755 O OD2 . ASP A 1 216 ? 35.375 65.719 16.516 1.00 84.75 ? 216 ASP A OD2 1 ATOM 1756 N N . VAL A 1 217 ? 35.783 68.885 20.099 1.00 35.24 ? 217 VAL A N 1 ATOM 1757 C CA . VAL A 1 217 ? 36.890 69.339 20.935 1.00 43.85 ? 217 VAL A CA 1 ATOM 1758 C C . VAL A 1 217 ? 37.539 68.155 21.637 1.00 52.75 ? 217 VAL A C 1 ATOM 1759 O O . VAL A 1 217 ? 36.919 67.536 22.488 1.00 51.98 ? 217 VAL A O 1 ATOM 1760 C CB . VAL A 1 217 ? 36.386 70.352 22.008 1.00 41.57 ? 217 VAL A CB 1 ATOM 1761 C CG1 . VAL A 1 217 ? 37.514 70.727 22.958 1.00 42.67 ? 217 VAL A CG1 1 ATOM 1762 C CG2 . VAL A 1 217 ? 35.821 71.601 21.330 1.00 42.69 ? 217 VAL A CG2 1 ATOM 1763 N N . HIS A 1 218 ? 38.781 67.834 21.289 1.00 65.25 ? 218 HIS A N 1 ATOM 1764 C CA . HIS A 1 218 ? 39.454 66.712 21.941 1.00 68.92 ? 218 HIS A CA 1 ATOM 1765 C C . HIS A 1 218 ? 40.954 66.899 22.138 1.00 71.35 ? 218 HIS A C 1 ATOM 1766 O O . HIS A 1 218 ? 41.621 67.529 21.318 1.00 71.10 ? 218 HIS A O 1 ATOM 1767 C CB . HIS A 1 218 ? 39.215 65.415 21.160 1.00 63.05 ? 218 HIS A CB 1 ATOM 1768 C CG . HIS A 1 218 ? 39.885 65.378 19.822 1.00 69.49 ? 218 HIS A CG 1 ATOM 1769 N ND1 . HIS A 1 218 ? 39.445 66.121 18.748 1.00 71.26 ? 218 HIS A ND1 1 ATOM 1770 C CD2 . HIS A 1 218 ? 40.962 64.683 19.385 1.00 72.95 ? 218 HIS A CD2 1 ATOM 1771 C CE1 . HIS A 1 218 ? 40.221 65.883 17.705 1.00 67.18 ? 218 HIS A CE1 1 ATOM 1772 N NE2 . HIS A 1 218 ? 41.149 65.015 18.066 1.00 73.84 ? 218 HIS A NE2 1 ATOM 1773 N N . TRP A 1 219 ? 41.470 66.352 23.239 1.00 63.83 ? 219 TRP A N 1 ATOM 1774 C CA . TRP A 1 219 ? 42.894 66.418 23.551 1.00 62.78 ? 219 TRP A CA 1 ATOM 1775 C C . TRP A 1 219 ? 43.609 65.299 22.808 1.00 65.59 ? 219 TRP A C 1 ATOM 1776 O O . TRP A 1 219 ? 42.979 64.331 22.378 1.00 66.42 ? 219 TRP A O 1 ATOM 1777 C CB . TRP A 1 219 ? 43.146 66.222 25.046 1.00 56.37 ? 219 TRP A CB 1 ATOM 1778 C CG . TRP A 1 219 ? 43.024 67.456 25.881 1.00 59.36 ? 219 TRP A CG 1 ATOM 1779 C CD1 . TRP A 1 219 ? 41.978 67.803 26.690 1.00 51.45 ? 219 TRP A CD1 1 ATOM 1780 C CD2 . TRP A 1 219 ? 44.009 68.487 26.040 1.00 58.66 ? 219 TRP A CD2 1 ATOM 1781 N NE1 . TRP A 1 219 ? 42.253 68.982 27.349 1.00 55.99 ? 219 TRP A NE1 1 ATOM 1782 C CE2 . TRP A 1 219 ? 43.492 69.423 26.968 1.00 56.63 ? 219 TRP A CE2 1 ATOM 1783 C CE3 . TRP A 1 219 ? 45.277 68.710 25.492 1.00 62.95 ? 219 TRP A CE3 1 ATOM 1784 C CZ2 . TRP A 1 219 ? 44.199 70.560 27.358 1.00 61.19 ? 219 TRP A CZ2 1 ATOM 1785 C CZ3 . TRP A 1 219 ? 45.979 69.840 25.882 1.00 53.07 ? 219 TRP A CZ3 1 ATOM 1786 C CH2 . TRP A 1 219 ? 45.438 70.750 26.808 1.00 57.73 ? 219 TRP A CH2 1 ATOM 1787 N N . THR A 1 220 ? 44.924 65.440 22.651 1.00 99.39 ? 220 THR A N 1 ATOM 1788 C CA . THR A 1 220 ? 45.743 64.422 21.993 1.00 101.30 ? 220 THR A CA 1 ATOM 1789 C C . THR A 1 220 ? 47.059 64.272 22.746 1.00 103.23 ? 220 THR A C 1 ATOM 1790 O O . THR A 1 220 ? 47.721 65.261 23.073 1.00 100.72 ? 220 THR A O 1 ATOM 1791 C CB . THR A 1 220 ? 46.060 64.765 20.512 1.00 80.34 ? 220 THR A CB 1 ATOM 1792 O OG1 . THR A 1 220 ? 46.755 66.016 20.439 1.00 81.36 ? 220 THR A OG1 1 ATOM 1793 C CG2 . THR A 1 220 ? 44.783 64.833 19.696 1.00 85.28 ? 220 THR A CG2 1 ATOM 1794 N N . ARG A 1 221 ? 47.417 63.026 23.035 1.00 74.57 ? 221 ARG A N 1 ATOM 1795 C CA . ARG A 1 221 ? 48.652 62.719 23.739 1.00 77.37 ? 221 ARG A CA 1 ATOM 1796 C C . ARG A 1 221 ? 49.606 62.142 22.703 1.00 77.92 ? 221 ARG A C 1 ATOM 1797 O O . ARG A 1 221 ? 49.455 60.996 22.268 1.00 77.74 ? 221 ARG A O 1 ATOM 1798 C CB . ARG A 1 221 ? 48.387 61.699 24.850 1.00 100.15 ? 221 ARG A CB 1 ATOM 1799 C CG . ARG A 1 221 ? 49.492 61.593 25.884 1.00 103.26 ? 221 ARG A CG 1 ATOM 1800 C CD . ARG A 1 221 ? 50.219 60.266 25.822 1.00 105.81 ? 221 ARG A CD 1 ATOM 1801 N NE . ARG A 1 221 ? 51.244 60.185 26.860 1.00 102.86 ? 221 ARG A NE 1 ATOM 1802 C CZ . ARG A 1 221 ? 52.061 59.151 27.030 1.00 102.55 ? 221 ARG A CZ 1 ATOM 1803 N NH1 . ARG A 1 221 ? 51.979 58.096 26.228 1.00 102.55 ? 221 ARG A NH1 1 ATOM 1804 N NH2 . ARG A 1 221 ? 52.961 59.172 28.004 1.00 104.15 ? 221 ARG A NH2 1 ATOM 1805 N N . ALA A 1 222 ? 50.577 62.952 22.296 1.00 106.39 ? 222 ALA A N 1 ATOM 1806 C CA . ALA A 1 222 ? 51.551 62.535 21.299 1.00 106.74 ? 222 ALA A CA 1 ATOM 1807 C C . ALA A 1 222 ? 50.840 62.054 20.039 1.00 105.54 ? 222 ALA A C 1 ATOM 1808 O O . ALA A 1 222 ? 51.211 61.035 19.458 1.00 106.01 ? 222 ALA A O 1 ATOM 1809 C CB . ALA A 1 222 ? 52.430 61.433 21.859 1.00 85.76 ? 222 ALA A CB 1 ATOM 1810 N N . GLY A 1 223 ? 49.809 62.787 19.629 1.00 84.80 ? 223 GLY A N 1 ATOM 1811 C CA . GLY A 1 223 ? 49.068 62.430 18.430 1.00 83.64 ? 223 GLY A CA 1 ATOM 1812 C C . GLY A 1 223 ? 47.882 61.506 18.644 1.00 88.19 ? 223 GLY A C 1 ATOM 1813 O O . GLY A 1 223 ? 46.942 61.505 17.848 1.00 88.93 ? 223 GLY A O 1 ATOM 1814 N N . GLU A 1 224 ? 47.921 60.718 19.714 1.00 96.22 ? 224 GLU A N 1 ATOM 1815 C CA . GLU A 1 224 ? 46.841 59.784 20.014 1.00 99.51 ? 224 GLU A CA 1 ATOM 1816 C C . GLU A 1 224 ? 45.692 60.447 20.769 1.00 95.25 ? 224 GLU A C 1 ATOM 1817 O O . GLU A 1 224 ? 45.853 60.883 21.909 1.00 91.46 ? 224 GLU A O 1 ATOM 1818 C CB . GLU A 1 224 ? 47.381 58.610 20.833 1.00 104.91 ? 224 GLU A CB 1 ATOM 1819 C CG . GLU A 1 224 ? 48.342 57.713 20.073 1.00 111.97 ? 224 GLU A CG 1 ATOM 1820 C CD . GLU A 1 224 ? 47.657 56.927 18.973 1.00 114.37 ? 224 GLU A CD 1 ATOM 1821 O OE1 . GLU A 1 224 ? 46.774 56.105 19.294 1.00 115.06 ? 224 GLU A OE1 1 ATOM 1822 O OE2 . GLU A 1 224 ? 47.999 57.129 17.789 1.00 112.41 ? 224 GLU A OE2 1 ATOM 1823 N N . VAL A 1 225 ? 44.528 60.519 20.131 1.00 89.70 ? 225 VAL A N 1 ATOM 1824 C CA . VAL A 1 225 ? 43.366 61.125 20.764 1.00 90.80 ? 225 VAL A CA 1 ATOM 1825 C C . VAL A 1 225 ? 43.062 60.445 22.090 1.00 86.80 ? 225 VAL A C 1 ATOM 1826 O O . VAL A 1 225 ? 42.844 59.238 22.147 1.00 85.07 ? 225 VAL A O 1 ATOM 1827 C CB . VAL A 1 225 ? 42.123 61.030 19.869 1.00 70.56 ? 225 VAL A CB 1 ATOM 1828 C CG1 . VAL A 1 225 ? 41.951 59.611 19.367 1.00 74.92 ? 225 VAL A CG1 1 ATOM 1829 C CG2 . VAL A 1 225 ? 40.899 61.463 20.650 1.00 66.74 ? 225 VAL A CG2 1 ATOM 1830 N N . GLN A 1 226 ? 43.045 61.238 23.154 1.00 80.31 ? 226 GLN A N 1 ATOM 1831 C CA . GLN A 1 226 ? 42.774 60.739 24.494 1.00 82.61 ? 226 GLN A CA 1 ATOM 1832 C C . GLN A 1 226 ? 41.287 60.688 24.823 1.00 87.06 ? 226 GLN A C 1 ATOM 1833 O O . GLN A 1 226 ? 40.459 61.317 24.156 1.00 89.61 ? 226 GLN A O 1 ATOM 1834 C CB . GLN A 1 226 ? 43.485 61.618 25.525 1.00 88.11 ? 226 GLN A CB 1 ATOM 1835 C CG . GLN A 1 226 ? 44.983 61.609 25.367 1.00 91.94 ? 226 GLN A CG 1 ATOM 1836 C CD . GLN A 1 226 ? 45.559 60.220 25.540 1.00 86.02 ? 226 GLN A CD 1 ATOM 1837 O OE1 . GLN A 1 226 ? 45.788 59.765 26.661 1.00 86.00 ? 226 GLN A OE1 1 ATOM 1838 N NE2 . GLN A 1 226 ? 45.779 59.529 24.428 1.00 80.60 ? 226 GLN A NE2 1 ATOM 1839 N N . GLU A 1 227 ? 40.957 59.920 25.855 1.00 76.61 ? 227 GLU A N 1 ATOM 1840 C CA . GLU A 1 227 ? 39.582 59.797 26.314 1.00 71.51 ? 227 GLU A CA 1 ATOM 1841 C C . GLU A 1 227 ? 39.432 60.846 27.410 1.00 62.65 ? 227 GLU A C 1 ATOM 1842 O O . GLU A 1 227 ? 40.041 60.743 28.470 1.00 62.58 ? 227 GLU A O 1 ATOM 1843 C CB . GLU A 1 227 ? 39.328 58.396 26.875 1.00 100.57 ? 227 GLU A CB 1 ATOM 1844 C CG . GLU A 1 227 ? 37.923 58.188 27.407 1.00 112.21 ? 227 GLU A CG 1 ATOM 1845 C CD . GLU A 1 227 ? 36.860 58.537 26.387 1.00 117.37 ? 227 GLU A CD 1 ATOM 1846 O OE1 . GLU A 1 227 ? 36.902 57.978 25.270 1.00 118.46 ? 227 GLU A OE1 1 ATOM 1847 O OE2 . GLU A 1 227 ? 35.982 59.368 26.703 1.00 121.23 ? 227 GLU A OE2 1 ATOM 1848 N N . PRO A 1 228 ? 38.625 61.882 27.159 1.00 61.09 ? 228 PRO A N 1 ATOM 1849 C CA . PRO A 1 228 ? 38.452 62.919 28.173 1.00 59.90 ? 228 PRO A CA 1 ATOM 1850 C C . PRO A 1 228 ? 38.034 62.398 29.535 1.00 60.52 ? 228 PRO A C 1 ATOM 1851 O O . PRO A 1 228 ? 37.255 61.451 29.644 1.00 60.60 ? 228 PRO A O 1 ATOM 1852 C CB . PRO A 1 228 ? 37.405 63.842 27.549 1.00 54.04 ? 228 PRO A CB 1 ATOM 1853 C CG . PRO A 1 228 ? 36.630 62.934 26.665 1.00 49.48 ? 228 PRO A CG 1 ATOM 1854 C CD . PRO A 1 228 ? 37.703 62.092 26.031 1.00 53.25 ? 228 PRO A CD 1 ATOM 1855 N N . GLU A 1 229 ? 38.584 63.018 30.570 1.00 58.87 ? 229 GLU A N 1 ATOM 1856 C CA . GLU A 1 229 ? 38.262 62.670 31.940 1.00 58.15 ? 229 GLU A CA 1 ATOM 1857 C C . GLU A 1 229 ? 36.908 63.309 32.230 1.00 66.40 ? 229 GLU A C 1 ATOM 1858 O O . GLU A 1 229 ? 35.973 62.639 32.661 1.00 68.32 ? 229 GLU A O 1 ATOM 1859 C CB . GLU A 1 229 ? 39.331 63.222 32.885 1.00 54.54 ? 229 GLU A CB 1 ATOM 1860 C CG . GLU A 1 229 ? 38.935 63.219 34.348 1.00 61.59 ? 229 GLU A CG 1 ATOM 1861 C CD . GLU A 1 229 ? 40.129 63.303 35.283 1.00 67.37 ? 229 GLU A CD 1 ATOM 1862 O OE1 . GLU A 1 229 ? 40.942 62.350 35.286 1.00 67.41 ? 229 GLU A OE1 1 ATOM 1863 O OE2 . GLU A 1 229 ? 40.253 64.314 36.012 1.00 65.42 ? 229 GLU A OE2 1 ATOM 1864 N N . LEU A 1 230 ? 36.807 64.610 31.977 1.00 93.45 ? 230 LEU A N 1 ATOM 1865 C CA . LEU A 1 230 ? 35.561 65.340 32.193 1.00 91.88 ? 230 LEU A CA 1 ATOM 1866 C C . LEU A 1 230 ? 35.156 65.994 30.878 1.00 96.78 ? 230 LEU A C 1 ATOM 1867 O O . LEU A 1 230 ? 35.895 65.933 29.899 1.00 97.15 ? 230 LEU A O 1 ATOM 1868 C CB . LEU A 1 230 ? 35.749 66.409 33.269 1.00 49.11 ? 230 LEU A CB 1 ATOM 1869 C CG . LEU A 1 230 ? 34.473 67.000 33.866 1.00 57.46 ? 230 LEU A CG 1 ATOM 1870 C CD1 . LEU A 1 230 ? 33.665 65.884 34.510 1.00 63.39 ? 230 LEU A CD1 1 ATOM 1871 C CD2 . LEU A 1 230 ? 34.823 68.072 34.894 1.00 52.90 ? 230 LEU A CD2 1 ATOM 1872 N N . ARG A 1 231 ? 33.988 66.620 30.849 1.00 65.22 ? 231 ARG A N 1 ATOM 1873 C CA . ARG A 1 231 ? 33.528 67.262 29.628 1.00 60.27 ? 231 ARG A CA 1 ATOM 1874 C C . ARG A 1 231 ? 32.218 67.975 29.877 1.00 64.78 ? 231 ARG A C 1 ATOM 1875 O O . ARG A 1 231 ? 31.375 67.480 30.616 1.00 57.89 ? 231 ARG A O 1 ATOM 1876 C CB . ARG A 1 231 ? 33.319 66.228 28.521 1.00 70.86 ? 231 ARG A CB 1 ATOM 1877 C CG . ARG A 1 231 ? 32.823 66.834 27.221 1.00 84.07 ? 231 ARG A CG 1 ATOM 1878 C CD . ARG A 1 231 ? 32.326 65.780 26.256 1.00 91.73 ? 231 ARG A CD 1 ATOM 1879 N NE . ARG A 1 231 ? 33.328 64.751 25.999 1.00 99.90 ? 231 ARG A NE 1 ATOM 1880 C CZ . ARG A 1 231 ? 33.153 63.736 25.158 1.00 101.93 ? 231 ARG A CZ 1 ATOM 1881 N NH1 . ARG A 1 231 ? 32.013 63.619 24.491 1.00 99.11 ? 231 ARG A NH1 1 ATOM 1882 N NH2 . ARG A 1 231 ? 34.111 62.835 24.986 1.00 107.90 ? 231 ARG A NH2 1 ATOM 1883 N N . GLY A 1 232 ? 32.043 69.135 29.257 1.00 49.40 ? 232 GLY A N 1 ATOM 1884 C CA . GLY A 1 232 ? 30.807 69.867 29.430 1.00 49.36 ? 232 GLY A CA 1 ATOM 1885 C C . GLY A 1 232 ? 30.681 70.964 28.400 1.00 57.35 ? 232 GLY A C 1 ATOM 1886 O O . GLY A 1 232 ? 31.610 71.216 27.629 1.00 50.85 ? 232 GLY A O 1 ATOM 1887 N N . ASP A 1 233 ? 29.524 71.611 28.369 1.00 46.89 ? 233 ASP A N 1 ATOM 1888 C CA . ASP A 1 233 ? 29.317 72.703 27.437 1.00 39.13 ? 233 ASP A CA 1 ATOM 1889 C C . ASP A 1 233 ? 28.130 73.556 27.852 1.00 45.16 ? 233 ASP A C 1 ATOM 1890 O O . ASP A 1 233 ? 27.479 73.276 28.854 1.00 41.37 ? 233 ASP A O 1 ATOM 1891 C CB . ASP A 1 233 ? 29.124 72.177 26.008 1.00 28.74 ? 233 ASP A CB 1 ATOM 1892 C CG . ASP A 1 233 ? 27.871 71.352 25.845 1.00 36.95 ? 233 ASP A CG 1 ATOM 1893 O OD1 . ASP A 1 233 ? 26.805 71.765 26.343 1.00 42.37 ? 233 ASP A OD1 1 ATOM 1894 O OD2 . ASP A 1 233 ? 27.951 70.292 25.194 1.00 40.04 ? 233 ASP A OD2 1 ATOM 1895 N N . VAL A 1 234 ? 27.853 74.608 27.092 1.00 35.18 ? 234 VAL A N 1 ATOM 1896 C CA . VAL A 1 234 ? 26.728 75.460 27.426 1.00 30.40 ? 234 VAL A CA 1 ATOM 1897 C C . VAL A 1 234 ? 26.434 76.492 26.359 1.00 39.37 ? 234 VAL A C 1 ATOM 1898 O O . VAL A 1 234 ? 27.242 76.730 25.460 1.00 38.89 ? 234 VAL A O 1 ATOM 1899 C CB . VAL A 1 234 ? 26.959 76.205 28.764 1.00 20.37 ? 234 VAL A CB 1 ATOM 1900 C CG1 . VAL A 1 234 ? 28.145 77.158 28.642 1.00 21.12 ? 234 VAL A CG1 1 ATOM 1901 C CG2 . VAL A 1 234 ? 25.695 76.956 29.165 1.00 24.27 ? 234 VAL A CG2 1 ATOM 1902 N N . LEU A 1 235 ? 25.253 77.089 26.473 1.00 32.47 ? 235 LEU A N 1 ATOM 1903 C CA . LEU A 1 235 ? 24.811 78.125 25.562 1.00 32.57 ? 235 LEU A CA 1 ATOM 1904 C C . LEU A 1 235 ? 24.384 79.326 26.371 1.00 31.80 ? 235 LEU A C 1 ATOM 1905 O O . LEU A 1 235 ? 23.477 79.245 27.186 1.00 31.21 ? 235 LEU A O 1 ATOM 1906 C CB . LEU A 1 235 ? 23.617 77.668 24.711 1.00 33.49 ? 235 LEU A CB 1 ATOM 1907 C CG . LEU A 1 235 ? 22.821 78.844 24.120 1.00 34.99 ? 235 LEU A CG 1 ATOM 1908 C CD1 . LEU A 1 235 ? 23.450 79.229 22.792 1.00 32.05 ? 235 LEU A CD1 1 ATOM 1909 C CD2 . LEU A 1 235 ? 21.355 78.485 23.944 1.00 36.87 ? 235 LEU A CD2 1 ATOM 1910 N N . HIS A 1 236 ? 25.050 80.441 26.146 1.00 36.25 ? 236 HIS A N 1 ATOM 1911 C CA . HIS A 1 236 ? 24.692 81.662 26.828 1.00 36.71 ? 236 HIS A CA 1 ATOM 1912 C C . HIS A 1 236 ? 23.724 82.304 25.849 1.00 36.36 ? 236 HIS A C 1 ATOM 1913 O O . HIS A 1 236 ? 24.103 82.685 24.746 1.00 39.66 ? 236 HIS A O 1 ATOM 1914 C CB . HIS A 1 236 ? 25.943 82.510 27.046 1.00 47.13 ? 236 HIS A CB 1 ATOM 1915 C CG . HIS A 1 236 ? 26.962 81.842 27.917 1.00 48.53 ? 236 HIS A CG 1 ATOM 1916 N ND1 . HIS A 1 236 ? 26.769 81.643 29.267 1.00 44.88 ? 236 HIS A ND1 1 ATOM 1917 C CD2 . HIS A 1 236 ? 28.148 81.262 27.618 1.00 46.58 ? 236 HIS A CD2 1 ATOM 1918 C CE1 . HIS A 1 236 ? 27.789 80.966 29.761 1.00 52.04 ? 236 HIS A CE1 1 ATOM 1919 N NE2 . HIS A 1 236 ? 28.640 80.721 28.782 1.00 52.58 ? 236 HIS A NE2 1 ATOM 1920 N N . ASN A 1 237 ? 22.463 82.390 26.238 1.00 49.23 ? 237 ASN A N 1 ATOM 1921 C CA . ASN A 1 237 ? 21.462 82.949 25.354 1.00 56.03 ? 237 ASN A CA 1 ATOM 1922 C C . ASN A 1 237 ? 21.538 84.460 25.187 1.00 54.54 ? 237 ASN A C 1 ATOM 1923 O O . ASN A 1 237 ? 21.228 84.971 24.107 1.00 53.85 ? 237 ASN A O 1 ATOM 1924 C CB . ASN A 1 237 ? 20.066 82.569 25.837 1.00 44.88 ? 237 ASN A CB 1 ATOM 1925 C CG . ASN A 1 237 ? 18.996 82.936 24.841 1.00 40.34 ? 237 ASN A CG 1 ATOM 1926 O OD1 . ASN A 1 237 ? 18.855 82.285 23.805 1.00 42.47 ? 237 ASN A OD1 1 ATOM 1927 N ND2 . ASN A 1 237 ? 18.236 83.996 25.139 1.00 37.65 ? 237 ASN A ND2 1 ATOM 1928 N N . GLY A 1 238 ? 21.944 85.170 26.244 1.00 28.69 ? 238 GLY A N 1 ATOM 1929 C CA . GLY A 1 238 ? 22.012 86.628 26.186 1.00 27.17 ? 238 GLY A CA 1 ATOM 1930 C C . GLY A 1 238 ? 22.994 87.080 25.134 1.00 27.97 ? 238 GLY A C 1 ATOM 1931 O O . GLY A 1 238 ? 22.875 88.144 24.526 1.00 32.51 ? 238 GLY A O 1 ATOM 1932 N N . ASN A 1 239 ? 23.957 86.201 24.914 1.00 47.26 ? 239 ASN A N 1 ATOM 1933 C CA . ASN A 1 239 ? 25.058 86.377 23.987 1.00 60.21 ? 239 ASN A CA 1 ATOM 1934 C C . ASN A 1 239 ? 24.770 85.676 22.656 1.00 55.12 ? 239 ASN A C 1 ATOM 1935 O O . ASN A 1 239 ? 25.074 86.197 21.579 1.00 49.20 ? 239 ASN A O 1 ATOM 1936 C CB . ASN A 1 239 ? 26.289 85.745 24.624 1.00 44.00 ? 239 ASN A CB 1 ATOM 1937 C CG . ASN A 1 239 ? 27.524 86.501 24.349 1.00 55.42 ? 239 ASN A CG 1 ATOM 1938 O OD1 . ASN A 1 239 ? 27.851 86.743 23.194 1.00 79.57 ? 239 ASN A OD1 1 ATOM 1939 N ND2 . ASN A 1 239 ? 28.225 86.886 25.410 1.00 41.64 ? 239 ASN A ND2 1 ATOM 1940 N N . GLY A 1 240 ? 24.195 84.478 22.754 1.00 39.79 ? 240 GLY A N 1 ATOM 1941 C CA . GLY A 1 240 ? 23.905 83.681 21.580 1.00 32.05 ? 240 GLY A CA 1 ATOM 1942 C C . GLY A 1 240 ? 25.132 82.861 21.214 1.00 35.98 ? 240 GLY A C 1 ATOM 1943 O O . GLY A 1 240 ? 25.273 82.422 20.076 1.00 36.51 ? 240 GLY A O 1 ATOM 1944 N N . THR A 1 241 ? 26.012 82.640 22.189 1.00 30.55 ? 241 THR A N 1 ATOM 1945 C CA . THR A 1 241 ? 27.247 81.884 21.966 1.00 33.81 ? 241 THR A CA 1 ATOM 1946 C C . THR A 1 241 ? 27.353 80.608 22.803 1.00 33.06 ? 241 THR A C 1 ATOM 1947 O O . THR A 1 241 ? 26.770 80.507 23.878 1.00 34.72 ? 241 THR A O 1 ATOM 1948 C CB . THR A 1 241 ? 28.482 82.757 22.281 1.00 49.77 ? 241 THR A CB 1 ATOM 1949 O OG1 . THR A 1 241 ? 28.494 83.088 23.676 1.00 48.05 ? 241 THR A OG1 1 ATOM 1950 C CG2 . THR A 1 241 ? 28.437 84.047 21.480 1.00 49.65 ? 241 THR A CG2 1 ATOM 1951 N N . TYR A 1 242 ? 28.106 79.635 22.304 1.00 38.02 ? 242 TYR A N 1 ATOM 1952 C CA . TYR A 1 242 ? 28.303 78.376 23.019 1.00 39.07 ? 242 TYR A CA 1 ATOM 1953 C C . TYR A 1 242 ? 29.709 78.286 23.546 1.00 46.84 ? 242 TYR A C 1 ATOM 1954 O O . TYR A 1 242 ? 30.617 78.945 23.059 1.00 41.14 ? 242 TYR A O 1 ATOM 1955 C CB . TYR A 1 242 ? 28.131 77.162 22.110 1.00 32.94 ? 242 TYR A CB 1 ATOM 1956 C CG . TYR A 1 242 ? 26.732 76.861 21.684 1.00 42.65 ? 242 TYR A CG 1 ATOM 1957 C CD1 . TYR A 1 242 ? 26.139 77.547 20.629 1.00 41.28 ? 242 TYR A CD1 1 ATOM 1958 C CD2 . TYR A 1 242 ? 25.987 75.893 22.346 1.00 35.27 ? 242 TYR A CD2 1 ATOM 1959 C CE1 . TYR A 1 242 ? 24.833 77.278 20.247 1.00 35.37 ? 242 TYR A CE1 1 ATOM 1960 C CE2 . TYR A 1 242 ? 24.680 75.616 21.972 1.00 35.60 ? 242 TYR A CE2 1 ATOM 1961 C CZ . TYR A 1 242 ? 24.111 76.313 20.928 1.00 38.64 ? 242 TYR A CZ 1 ATOM 1962 O OH . TYR A 1 242 ? 22.810 76.074 20.602 1.00 34.93 ? 242 TYR A OH 1 ATOM 1963 N N . GLN A 1 243 ? 29.882 77.434 24.537 1.00 36.45 ? 243 GLN A N 1 ATOM 1964 C CA . GLN A 1 243 ? 31.189 77.179 25.104 1.00 35.11 ? 243 GLN A CA 1 ATOM 1965 C C . GLN A 1 243 ? 31.235 75.683 25.295 1.00 41.13 ? 243 GLN A C 1 ATOM 1966 O O . GLN A 1 243 ? 30.230 75.077 25.631 1.00 39.54 ? 243 GLN A O 1 ATOM 1967 C CB . GLN A 1 243 ? 31.361 77.893 26.432 1.00 22.85 ? 243 GLN A CB 1 ATOM 1968 C CG . GLN A 1 243 ? 31.681 79.356 26.279 1.00 31.10 ? 243 GLN A CG 1 ATOM 1969 C CD . GLN A 1 243 ? 32.157 79.953 27.574 1.00 31.04 ? 243 GLN A CD 1 ATOM 1970 O OE1 . GLN A 1 243 ? 32.962 79.350 28.278 1.00 36.21 ? 243 GLN A OE1 1 ATOM 1971 N NE2 . GLN A 1 243 ? 31.677 81.144 27.895 1.00 32.96 ? 243 GLN A NE2 1 ATOM 1972 N N . SER A 1 244 ? 32.389 75.088 25.044 1.00 42.40 ? 244 SER A N 1 ATOM 1973 C CA . SER A 1 244 ? 32.550 73.652 25.185 1.00 41.59 ? 244 SER A CA 1 ATOM 1974 C C . SER A 1 244 ? 33.958 73.364 25.671 1.00 53.02 ? 244 SER A C 1 ATOM 1975 O O . SER A 1 244 ? 34.917 73.989 25.216 1.00 49.16 ? 244 SER A O 1 ATOM 1976 C CB . SER A 1 244 ? 32.315 72.963 23.844 1.00 33.12 ? 244 SER A CB 1 ATOM 1977 O OG . SER A 1 244 ? 32.470 71.564 23.970 1.00 37.01 ? 244 SER A OG 1 ATOM 1978 N N . TRP A 1 245 ? 34.082 72.421 26.599 1.00 44.14 ? 245 TRP A N 1 ATOM 1979 C CA . TRP A 1 245 ? 35.387 72.076 27.142 1.00 37.57 ? 245 TRP A CA 1 ATOM 1980 C C . TRP A 1 245 ? 35.574 70.584 27.356 1.00 52.84 ? 245 TRP A C 1 ATOM 1981 O O . TRP A 1 245 ? 34.621 69.803 27.324 1.00 45.75 ? 245 TRP A O 1 ATOM 1982 C CB . TRP A 1 245 ? 35.628 72.823 28.459 1.00 53.26 ? 245 TRP A CB 1 ATOM 1983 C CG . TRP A 1 245 ? 34.687 72.452 29.540 1.00 62.91 ? 245 TRP A CG 1 ATOM 1984 C CD1 . TRP A 1 245 ? 34.852 71.468 30.469 1.00 65.12 ? 245 TRP A CD1 1 ATOM 1985 C CD2 . TRP A 1 245 ? 33.399 73.019 29.777 1.00 69.70 ? 245 TRP A CD2 1 ATOM 1986 N NE1 . TRP A 1 245 ? 33.744 71.385 31.273 1.00 65.90 ? 245 TRP A NE1 1 ATOM 1987 C CE2 . TRP A 1 245 ? 32.834 72.328 30.867 1.00 70.00 ? 245 TRP A CE2 1 ATOM 1988 C CE3 . TRP A 1 245 ? 32.663 74.046 29.172 1.00 71.56 ? 245 TRP A CE3 1 ATOM 1989 C CZ2 . TRP A 1 245 ? 31.557 72.631 31.368 1.00 75.68 ? 245 TRP A CZ2 1 ATOM 1990 C CZ3 . TRP A 1 245 ? 31.392 74.348 29.671 1.00 79.13 ? 245 TRP A CZ3 1 ATOM 1991 C CH2 . TRP A 1 245 ? 30.855 73.642 30.757 1.00 77.05 ? 245 TRP A CH2 1 ATOM 1992 N N . VAL A 1 246 ? 36.834 70.214 27.555 1.00 56.23 ? 246 VAL A N 1 ATOM 1993 C CA . VAL A 1 246 ? 37.252 68.842 27.785 1.00 63.12 ? 246 VAL A CA 1 ATOM 1994 C C . VAL A 1 246 ? 38.391 68.892 28.790 1.00 66.76 ? 246 VAL A C 1 ATOM 1995 O O . VAL A 1 246 ? 39.101 69.888 28.881 1.00 62.05 ? 246 VAL A O 1 ATOM 1996 C CB . VAL A 1 246 ? 37.763 68.199 26.492 1.00 56.47 ? 246 VAL A CB 1 ATOM 1997 C CG1 . VAL A 1 246 ? 38.337 66.838 26.792 1.00 65.28 ? 246 VAL A CG1 1 ATOM 1998 C CG2 . VAL A 1 246 ? 36.632 68.085 25.485 1.00 58.83 ? 246 VAL A CG2 1 ATOM 1999 N N . VAL A 1 247 ? 38.561 67.823 29.552 1.00 52.42 ? 247 VAL A N 1 ATOM 2000 C CA . VAL A 1 247 ? 39.619 67.772 30.548 1.00 56.87 ? 247 VAL A CA 1 ATOM 2001 C C . VAL A 1 247 ? 40.292 66.416 30.505 1.00 58.49 ? 247 VAL A C 1 ATOM 2002 O O . VAL A 1 247 ? 39.677 65.421 30.135 1.00 57.82 ? 247 VAL A O 1 ATOM 2003 C CB . VAL A 1 247 ? 39.065 68.004 31.977 1.00 43.17 ? 247 VAL A CB 1 ATOM 2004 C CG1 . VAL A 1 247 ? 40.192 67.932 32.999 1.00 44.91 ? 247 VAL A CG1 1 ATOM 2005 C CG2 . VAL A 1 247 ? 38.381 69.363 32.058 1.00 41.25 ? 247 VAL A CG2 1 ATOM 2006 N N . VAL A 1 248 ? 41.567 66.386 30.867 1.00 73.24 ? 248 VAL A N 1 ATOM 2007 C CA . VAL A 1 248 ? 42.332 65.147 30.902 1.00 71.93 ? 248 VAL A CA 1 ATOM 2008 C C . VAL A 1 248 ? 43.326 65.212 32.046 1.00 73.94 ? 248 VAL A C 1 ATOM 2009 O O . VAL A 1 248 ? 43.921 66.260 32.300 1.00 68.88 ? 248 VAL A O 1 ATOM 2010 C CB . VAL A 1 248 ? 43.120 64.912 29.602 1.00 56.67 ? 248 VAL A CB 1 ATOM 2011 C CG1 . VAL A 1 248 ? 42.201 64.367 28.522 1.00 50.46 ? 248 VAL A CG1 1 ATOM 2012 C CG2 . VAL A 1 248 ? 43.777 66.213 29.163 1.00 52.68 ? 248 VAL A CG2 1 ATOM 2013 N N . ALA A 1 249 ? 43.482 64.096 32.748 1.00 78.64 ? 249 ALA A N 1 ATOM 2014 C CA . ALA A 1 249 ? 44.426 64.023 33.848 1.00 80.77 ? 249 ALA A CA 1 ATOM 2015 C C . ALA A 1 249 ? 45.706 63.456 33.249 1.00 78.39 ? 249 ALA A C 1 ATOM 2016 O O . ALA A 1 249 ? 45.659 62.547 32.416 1.00 69.44 ? 249 ALA A O 1 ATOM 2017 C CB . ALA A 1 249 ? 43.895 63.111 34.945 1.00 79.53 ? 249 ALA A CB 1 ATOM 2018 N N . VAL A 1 250 ? 46.846 63.999 33.660 1.00 94.39 ? 250 VAL A N 1 ATOM 2019 C CA . VAL A 1 250 ? 48.129 63.544 33.141 1.00 103.78 ? 250 VAL A CA 1 ATOM 2020 C C . VAL A 1 250 ? 49.022 62.915 34.216 1.00 102.41 ? 250 VAL A C 1 ATOM 2021 O O . VAL A 1 250 ? 49.210 63.484 35.295 1.00 99.95 ? 250 VAL A O 1 ATOM 2022 C CB . VAL A 1 250 ? 48.884 64.717 32.468 1.00 75.04 ? 250 VAL A CB 1 ATOM 2023 C CG1 . VAL A 1 250 ? 48.939 65.909 33.410 1.00 71.05 ? 250 VAL A CG1 1 ATOM 2024 C CG2 . VAL A 1 250 ? 50.286 64.280 32.081 1.00 74.92 ? 250 VAL A CG2 1 ATOM 2025 N N . PRO A 1 251 ? 49.573 61.720 33.933 1.00 92.99 ? 251 PRO A N 1 ATOM 2026 C CA . PRO A 1 251 ? 50.448 61.030 34.885 1.00 98.70 ? 251 PRO A CA 1 ATOM 2027 C C . PRO A 1 251 ? 51.545 61.973 35.390 1.00 103.63 ? 251 PRO A C 1 ATOM 2028 O O . PRO A 1 251 ? 52.119 62.742 34.614 1.00 102.84 ? 251 PRO A O 1 ATOM 2029 C CB . PRO A 1 251 ? 50.997 59.871 34.060 1.00 81.20 ? 251 PRO A CB 1 ATOM 2030 C CG . PRO A 1 251 ? 49.832 59.531 33.170 1.00 79.77 ? 251 PRO A CG 1 ATOM 2031 C CD . PRO A 1 251 ? 49.363 60.901 32.724 1.00 77.85 ? 251 PRO A CD 1 ATOM 2032 N N . PRO A 1 252 ? 51.854 61.919 36.699 1.00 129.99 ? 252 PRO A N 1 ATOM 2033 C CA . PRO A 1 252 ? 52.879 62.770 37.318 1.00 131.12 ? 252 PRO A CA 1 ATOM 2034 C C . PRO A 1 252 ? 54.282 62.624 36.736 1.00 132.06 ? 252 PRO A C 1 ATOM 2035 O O . PRO A 1 252 ? 55.212 63.308 37.166 1.00 132.39 ? 252 PRO A O 1 ATOM 2036 C CB . PRO A 1 252 ? 52.816 62.365 38.788 1.00 97.15 ? 252 PRO A CB 1 ATOM 2037 C CG . PRO A 1 252 ? 52.453 60.917 38.708 1.00 98.03 ? 252 PRO A CG 1 ATOM 2038 C CD . PRO A 1 252 ? 51.362 60.917 37.662 1.00 96.50 ? 252 PRO A CD 1 ATOM 2039 N N . GLN A 1 253 ? 54.430 61.738 35.756 1.00 116.99 ? 253 GLN A N 1 ATOM 2040 C CA . GLN A 1 253 ? 55.725 61.512 35.127 1.00 119.93 ? 253 GLN A CA 1 ATOM 2041 C C . GLN A 1 253 ? 55.575 61.375 33.613 1.00 119.69 ? 253 GLN A C 1 ATOM 2042 O O . GLN A 1 253 ? 56.318 60.638 32.967 1.00 118.24 ? 253 GLN A O 1 ATOM 2043 C CB . GLN A 1 253 ? 56.369 60.250 35.714 1.00 168.63 ? 253 GLN A CB 1 ATOM 2044 C CG . GLN A 1 253 ? 57.833 60.050 35.347 1.00 171.39 ? 253 GLN A CG 1 ATOM 2045 C CD . GLN A 1 253 ? 58.443 58.833 36.023 1.00 177.07 ? 253 GLN A CD 1 ATOM 2046 O OE1 . GLN A 1 253 ? 58.458 58.735 37.250 1.00 178.68 ? 253 GLN A OE1 1 ATOM 2047 N NE2 . GLN A 1 253 ? 58.949 57.900 35.224 1.00 175.10 ? 253 GLN A NE2 1 ATOM 2048 N N . ASP A 1 254 ? 54.607 62.090 33.050 1.00 139.22 ? 254 ASP A N 1 ATOM 2049 C CA . ASP A 1 254 ? 54.369 62.042 31.612 1.00 137.89 ? 254 ASP A CA 1 ATOM 2050 C C . ASP A 1 254 ? 55.005 63.263 30.962 1.00 133.86 ? 254 ASP A C 1 ATOM 2051 O O . ASP A 1 254 ? 54.756 64.397 31.374 1.00 129.52 ? 254 ASP A O 1 ATOM 2052 C CB . ASP A 1 254 ? 52.864 62.025 31.320 1.00 101.34 ? 254 ASP A CB 1 ATOM 2053 C CG . ASP A 1 254 ? 52.548 61.646 29.879 1.00 102.99 ? 254 ASP A CG 1 ATOM 2054 O OD1 . ASP A 1 254 ? 53.097 62.282 28.957 1.00 105.63 ? 254 ASP A OD1 1 ATOM 2055 O OD2 . ASP A 1 254 ? 51.743 60.715 29.668 1.00 107.03 ? 254 ASP A OD2 1 ATOM 2056 N N . THR A 1 255 ? 55.830 63.022 29.947 1.00 144.48 ? 255 THR A N 1 ATOM 2057 C CA . THR A 1 255 ? 56.506 64.100 29.235 1.00 145.46 ? 255 THR A CA 1 ATOM 2058 C C . THR A 1 255 ? 55.888 64.309 27.862 1.00 141.38 ? 255 THR A C 1 ATOM 2059 O O . THR A 1 255 ? 56.052 65.367 27.257 1.00 141.32 ? 255 THR A O 1 ATOM 2060 C CB . THR A 1 255 ? 58.004 63.793 29.047 1.00 134.66 ? 255 THR A CB 1 ATOM 2061 O OG1 . THR A 1 255 ? 58.604 63.542 30.322 1.00 132.48 ? 255 THR A OG1 1 ATOM 2062 C CG2 . THR A 1 255 ? 58.714 64.970 28.392 1.00 135.21 ? 255 THR A CG2 1 ATOM 2063 N N . ALA A 1 256 ? 55.177 63.294 27.377 1.00 125.80 ? 256 ALA A N 1 ATOM 2064 C CA . ALA A 1 256 ? 54.531 63.350 26.068 1.00 124.18 ? 256 ALA A CA 1 ATOM 2065 C C . ALA A 1 256 ? 53.907 64.718 25.788 1.00 122.31 ? 256 ALA A C 1 ATOM 2066 O O . ALA A 1 256 ? 53.557 65.459 26.710 1.00 110.95 ? 256 ALA A O 1 ATOM 2067 C CB . ALA A 1 256 ? 53.472 62.257 25.958 1.00 91.12 ? 256 ALA A CB 1 ATOM 2068 N N . PRO A 1 257 ? 53.761 65.067 24.501 1.00 115.29 ? 257 PRO A N 1 ATOM 2069 C CA . PRO A 1 257 ? 53.183 66.349 24.089 1.00 114.00 ? 257 PRO A CA 1 ATOM 2070 C C . PRO A 1 257 ? 51.657 66.356 24.131 1.00 112.05 ? 257 PRO A C 1 ATOM 2071 O O . PRO A 1 257 ? 51.012 65.420 23.655 1.00 109.31 ? 257 PRO A O 1 ATOM 2072 C CB . PRO A 1 257 ? 53.722 66.514 22.676 1.00 93.67 ? 257 PRO A CB 1 ATOM 2073 C CG . PRO A 1 257 ? 53.671 65.098 22.160 1.00 96.32 ? 257 PRO A CG 1 ATOM 2074 C CD . PRO A 1 257 ? 54.199 64.281 23.330 1.00 96.11 ? 257 PRO A CD 1 ATOM 2075 N N . TYR A 1 258 ? 51.087 67.414 24.703 1.00 79.18 ? 258 TYR A N 1 ATOM 2076 C CA . TYR A 1 258 ? 49.634 67.548 24.803 1.00 79.30 ? 258 TYR A CA 1 ATOM 2077 C C . TYR A 1 258 ? 49.127 68.725 23.987 1.00 75.56 ? 258 TYR A C 1 ATOM 2078 O O . TYR A 1 258 ? 49.452 69.875 24.271 1.00 74.87 ? 258 TYR A O 1 ATOM 2079 C CB . TYR A 1 258 ? 49.210 67.719 26.264 1.00 71.55 ? 258 TYR A CB 1 ATOM 2080 C CG . TYR A 1 258 ? 49.133 66.418 27.028 1.00 78.97 ? 258 TYR A CG 1 ATOM 2081 C CD1 . TYR A 1 258 ? 49.766 66.272 28.259 1.00 75.58 ? 258 TYR A CD1 1 ATOM 2082 C CD2 . TYR A 1 258 ? 48.427 65.333 26.518 1.00 77.79 ? 258 TYR A CD2 1 ATOM 2083 C CE1 . TYR A 1 258 ? 49.700 65.076 28.961 1.00 79.99 ? 258 TYR A CE1 1 ATOM 2084 C CE2 . TYR A 1 258 ? 48.355 64.135 27.215 1.00 81.21 ? 258 TYR A CE2 1 ATOM 2085 C CZ . TYR A 1 258 ? 48.994 64.012 28.434 1.00 81.14 ? 258 TYR A CZ 1 ATOM 2086 O OH . TYR A 1 258 ? 48.933 62.823 29.123 1.00 79.84 ? 258 TYR A OH 1 ATOM 2087 N N . SER A 1 259 ? 48.319 68.434 22.976 1.00 92.32 ? 259 SER A N 1 ATOM 2088 C CA . SER A 1 259 ? 47.786 69.483 22.122 1.00 94.47 ? 259 SER A CA 1 ATOM 2089 C C . SER A 1 259 ? 46.273 69.359 21.975 1.00 92.16 ? 259 SER A C 1 ATOM 2090 O O . SER A 1 259 ? 45.759 68.267 21.735 1.00 82.63 ? 259 SER A O 1 ATOM 2091 C CB . SER A 1 259 ? 48.452 69.405 20.747 1.00 82.73 ? 259 SER A CB 1 ATOM 2092 O OG . SER A 1 259 ? 49.865 69.409 20.869 1.00 99.77 ? 259 SER A OG 1 ATOM 2093 N N . CYS A 1 260 ? 45.559 70.475 22.122 1.00 78.04 ? 260 CYS A N 1 ATOM 2094 C CA . CYS A 1 260 ? 44.103 70.456 21.981 1.00 74.52 ? 260 CYS A CA 1 ATOM 2095 C C . CYS A 1 260 ? 43.663 70.648 20.545 1.00 71.69 ? 260 CYS A C 1 ATOM 2096 O O . CYS A 1 260 ? 44.253 71.433 19.807 1.00 72.04 ? 260 CYS A O 1 ATOM 2097 C CB . CYS A 1 260 ? 43.437 71.552 22.806 1.00 61.65 ? 260 CYS A CB 1 ATOM 2098 S SG . CYS A 1 260 ? 41.618 71.445 22.682 1.00 65.66 ? 260 CYS A SG 1 ATOM 2099 N N . HIS A 1 261 ? 42.614 69.940 20.150 1.00 57.83 ? 261 HIS A N 1 ATOM 2100 C CA . HIS A 1 261 ? 42.110 70.069 18.794 1.00 54.82 ? 261 HIS A CA 1 ATOM 2101 C C . HIS A 1 261 ? 40.664 70.541 18.785 1.00 63.76 ? 261 HIS A C 1 ATOM 2102 O O . HIS A 1 261 ? 39.876 70.195 19.672 1.00 55.18 ? 261 HIS A O 1 ATOM 2103 C CB . HIS A 1 261 ? 42.237 68.742 18.052 1.00 74.87 ? 261 HIS A CB 1 ATOM 2104 C CG . HIS A 1 261 ? 43.642 68.237 17.970 1.00 87.57 ? 261 HIS A CG 1 ATOM 2105 N ND1 . HIS A 1 261 ? 44.020 67.224 17.117 1.00 89.13 ? 261 HIS A ND1 1 ATOM 2106 C CD2 . HIS A 1 261 ? 44.759 68.596 18.646 1.00 91.74 ? 261 HIS A CD2 1 ATOM 2107 C CE1 . HIS A 1 261 ? 45.309 66.981 17.272 1.00 94.08 ? 261 HIS A CE1 1 ATOM 2108 N NE2 . HIS A 1 261 ? 45.781 67.800 18.194 1.00 94.49 ? 261 HIS A NE2 1 ATOM 2109 N N . VAL A 1 262 ? 40.322 71.342 17.782 1.00 50.98 ? 262 VAL A N 1 ATOM 2110 C CA . VAL A 1 262 ? 38.976 71.869 17.662 1.00 42.11 ? 262 VAL A CA 1 ATOM 2111 C C . VAL A 1 262 ? 38.539 71.928 16.211 1.00 49.44 ? 262 VAL A C 1 ATOM 2112 O O . VAL A 1 262 ? 39.258 72.455 15.373 1.00 50.57 ? 262 VAL A O 1 ATOM 2113 C CB . VAL A 1 262 ? 38.890 73.297 18.244 1.00 45.31 ? 262 VAL A CB 1 ATOM 2114 C CG1 . VAL A 1 262 ? 37.474 73.835 18.103 1.00 46.40 ? 262 VAL A CG1 1 ATOM 2115 C CG2 . VAL A 1 262 ? 39.314 73.293 19.702 1.00 43.87 ? 262 VAL A CG2 1 ATOM 2116 N N . GLN A 1 263 ? 37.370 71.370 15.913 1.00 50.43 ? 263 GLN A N 1 ATOM 2117 C CA . GLN A 1 263 ? 36.823 71.418 14.558 1.00 47.65 ? 263 GLN A CA 1 ATOM 2118 C C . GLN A 1 263 ? 35.453 72.072 14.668 1.00 55.30 ? 263 GLN A C 1 ATOM 2119 O O . GLN A 1 263 ? 34.719 71.821 15.617 1.00 54.09 ? 263 GLN A O 1 ATOM 2120 C CB . GLN A 1 263 ? 36.686 70.017 13.947 1.00 62.45 ? 263 GLN A CB 1 ATOM 2121 C CG . GLN A 1 263 ? 35.932 69.988 12.607 1.00 72.59 ? 263 GLN A CG 1 ATOM 2122 C CD . GLN A 1 263 ? 36.595 70.822 11.507 1.00 90.27 ? 263 GLN A CD 1 ATOM 2123 O OE1 . GLN A 1 263 ? 36.821 72.023 11.666 1.00 91.32 ? 263 GLN A OE1 1 ATOM 2124 N NE2 . GLN A 1 263 ? 36.897 70.182 10.381 1.00 96.35 ? 263 GLN A NE2 1 ATOM 2125 N N . HIS A 1 264 ? 35.112 72.915 13.702 1.00 46.88 ? 264 HIS A N 1 ATOM 2126 C CA . HIS A 1 264 ? 33.833 73.611 13.721 1.00 47.52 ? 264 HIS A CA 1 ATOM 2127 C C . HIS A 1 264 ? 33.499 74.063 12.302 1.00 51.66 ? 264 HIS A C 1 ATOM 2128 O O . HIS A 1 264 ? 34.388 74.326 11.501 1.00 52.83 ? 264 HIS A O 1 ATOM 2129 C CB . HIS A 1 264 ? 33.930 74.808 14.681 1.00 41.37 ? 264 HIS A CB 1 ATOM 2130 C CG . HIS A 1 264 ? 32.657 75.583 14.837 1.00 51.45 ? 264 HIS A CG 1 ATOM 2131 N ND1 . HIS A 1 264 ? 32.162 76.411 13.855 1.00 43.46 ? 264 HIS A ND1 1 ATOM 2132 C CD2 . HIS A 1 264 ? 31.805 75.692 15.882 1.00 43.51 ? 264 HIS A CD2 1 ATOM 2133 C CE1 . HIS A 1 264 ? 31.063 77.001 14.289 1.00 52.49 ? 264 HIS A CE1 1 ATOM 2134 N NE2 . HIS A 1 264 ? 30.825 76.583 15.517 1.00 45.52 ? 264 HIS A NE2 1 ATOM 2135 N N . SER A 1 265 ? 32.213 74.138 11.992 1.00 41.24 ? 265 SER A N 1 ATOM 2136 C CA . SER A 1 265 ? 31.768 74.541 10.667 1.00 43.14 ? 265 SER A CA 1 ATOM 2137 C C . SER A 1 265 ? 32.350 75.867 10.169 1.00 43.23 ? 265 SER A C 1 ATOM 2138 O O . SER A 1 265 ? 32.550 76.042 8.970 1.00 48.06 ? 265 SER A O 1 ATOM 2139 C CB . SER A 1 265 ? 30.245 74.615 10.657 1.00 48.02 ? 265 SER A CB 1 ATOM 2140 O OG . SER A 1 265 ? 29.775 75.338 11.784 1.00 48.46 ? 265 SER A OG 1 ATOM 2141 N N . SER A 1 266 ? 32.625 76.792 11.087 1.00 51.48 ? 266 SER A N 1 ATOM 2142 C CA . SER A 1 266 ? 33.154 78.115 10.736 1.00 49.73 ? 266 SER A CA 1 ATOM 2143 C C . SER A 1 266 ? 34.648 78.130 10.467 1.00 55.31 ? 266 SER A C 1 ATOM 2144 O O . SER A 1 266 ? 35.212 79.171 10.131 1.00 55.34 ? 266 SER A O 1 ATOM 2145 C CB . SER A 1 266 ? 32.880 79.109 11.859 1.00 44.76 ? 266 SER A CB 1 ATOM 2146 O OG . SER A 1 266 ? 33.793 78.911 12.929 1.00 44.85 ? 266 SER A OG 1 ATOM 2147 N N . LEU A 1 267 ? 35.289 76.981 10.631 1.00 37.64 ? 267 LEU A N 1 ATOM 2148 C CA . LEU A 1 267 ? 36.722 76.884 10.421 1.00 38.84 ? 267 LEU A CA 1 ATOM 2149 C C . LEU A 1 267 ? 37.073 76.278 9.072 1.00 48.00 ? 267 LEU A C 1 ATOM 2150 O O . LEU A 1 267 ? 36.567 75.220 8.704 1.00 47.20 ? 267 LEU A O 1 ATOM 2151 C CB . LEU A 1 267 ? 37.362 76.053 11.539 1.00 48.92 ? 267 LEU A CB 1 ATOM 2152 C CG . LEU A 1 267 ? 37.219 76.605 12.959 1.00 52.50 ? 267 LEU A CG 1 ATOM 2153 C CD1 . LEU A 1 267 ? 37.887 75.658 13.928 1.00 50.20 ? 267 LEU A CD1 1 ATOM 2154 C CD2 . LEU A 1 267 ? 37.841 77.990 13.054 1.00 47.19 ? 267 LEU A CD2 1 ATOM 2155 N N . ALA A 1 268 ? 37.946 76.960 8.338 1.00 59.90 ? 268 ALA A N 1 ATOM 2156 C CA . ALA A 1 268 ? 38.384 76.483 7.037 1.00 64.45 ? 268 ALA A CA 1 ATOM 2157 C C . ALA A 1 268 ? 39.058 75.133 7.238 1.00 63.45 ? 268 ALA A C 1 ATOM 2158 O O . ALA A 1 268 ? 39.043 74.284 6.356 1.00 60.82 ? 268 ALA A O 1 ATOM 2159 C CB . ALA A 1 268 ? 39.355 77.473 6.419 1.00 87.00 ? 268 ALA A CB 1 ATOM 2160 N N . GLN A 1 269 ? 39.657 74.956 8.410 1.00 64.78 ? 269 GLN A N 1 ATOM 2161 C CA . GLN A 1 269 ? 40.337 73.714 8.783 1.00 62.69 ? 269 GLN A CA 1 ATOM 2162 C C . GLN A 1 269 ? 40.405 73.686 10.303 1.00 59.62 ? 269 GLN A C 1 ATOM 2163 O O . GLN A 1 269 ? 40.227 74.714 10.955 1.00 56.63 ? 269 GLN A O 1 ATOM 2164 C CB . GLN A 1 269 ? 41.759 73.650 8.200 1.00 84.06 ? 269 GLN A CB 1 ATOM 2165 C CG . GLN A 1 269 ? 42.181 74.854 7.358 1.00 101.69 ? 269 GLN A CG 1 ATOM 2166 C CD . GLN A 1 269 ? 42.655 76.028 8.193 1.00 96.24 ? 269 GLN A CD 1 ATOM 2167 O OE1 . GLN A 1 269 ? 41.943 76.516 9.070 1.00 93.64 ? 269 GLN A OE1 1 ATOM 2168 N NE2 . GLN A 1 269 ? 43.866 76.489 7.918 1.00 105.54 ? 269 GLN A NE2 1 ATOM 2169 N N . PRO A 1 270 ? 40.665 72.514 10.893 1.00 64.95 ? 270 PRO A N 1 ATOM 2170 C CA . PRO A 1 270 ? 40.732 72.455 12.355 1.00 68.07 ? 270 PRO A CA 1 ATOM 2171 C C . PRO A 1 270 ? 41.872 73.265 12.952 1.00 69.72 ? 270 PRO A C 1 ATOM 2172 O O . PRO A 1 270 ? 42.844 73.588 12.271 1.00 71.27 ? 270 PRO A O 1 ATOM 2173 C CB . PRO A 1 270 ? 40.864 70.962 12.633 1.00 49.30 ? 270 PRO A CB 1 ATOM 2174 C CG . PRO A 1 270 ? 41.609 70.472 11.457 1.00 49.09 ? 270 PRO A CG 1 ATOM 2175 C CD . PRO A 1 270 ? 40.940 71.195 10.304 1.00 51.83 ? 270 PRO A CD 1 ATOM 2176 N N . LEU A 1 271 ? 41.720 73.610 14.226 1.00 58.91 ? 271 LEU A N 1 ATOM 2177 C CA . LEU A 1 271 ? 42.728 74.366 14.950 1.00 55.99 ? 271 LEU A CA 1 ATOM 2178 C C . LEU A 1 271 ? 43.464 73.406 15.855 1.00 59.87 ? 271 LEU A C 1 ATOM 2179 O O . LEU A 1 271 ? 43.011 72.293 16.089 1.00 62.14 ? 271 LEU A O 1 ATOM 2180 C CB . LEU A 1 271 ? 42.088 75.470 15.803 1.00 47.10 ? 271 LEU A CB 1 ATOM 2181 C CG . LEU A 1 271 ? 41.944 76.858 15.176 1.00 61.47 ? 271 LEU A CG 1 ATOM 2182 C CD1 . LEU A 1 271 ? 41.159 76.758 13.890 1.00 73.79 ? 271 LEU A CD1 1 ATOM 2183 C CD2 . LEU A 1 271 ? 41.258 77.789 16.149 1.00 58.33 ? 271 LEU A CD2 1 ATOM 2184 N N . VAL A 1 272 ? 44.610 73.839 16.354 1.00 55.08 ? 272 VAL A N 1 ATOM 2185 C CA . VAL A 1 272 ? 45.405 73.026 17.260 1.00 53.92 ? 272 VAL A CA 1 ATOM 2186 C C . VAL A 1 272 ? 46.047 73.970 18.265 1.00 55.72 ? 272 VAL A C 1 ATOM 2187 O O . VAL A 1 272 ? 46.512 75.058 17.910 1.00 59.01 ? 272 VAL A O 1 ATOM 2188 C CB . VAL A 1 272 ? 46.505 72.243 16.512 1.00 43.01 ? 272 VAL A CB 1 ATOM 2189 C CG1 . VAL A 1 272 ? 47.373 71.494 17.518 1.00 42.81 ? 272 VAL A CG1 1 ATOM 2190 C CG2 . VAL A 1 272 ? 45.871 71.276 15.505 1.00 37.38 ? 272 VAL A CG2 1 ATOM 2191 N N . VAL A 1 273 ? 46.056 73.568 19.527 1.00 59.19 ? 273 VAL A N 1 ATOM 2192 C CA . VAL A 1 273 ? 46.638 74.413 20.553 1.00 65.84 ? 273 VAL A CA 1 ATOM 2193 C C . VAL A 1 273 ? 47.383 73.578 21.576 1.00 75.32 ? 273 VAL A C 1 ATOM 2194 O O . VAL A 1 273 ? 46.799 73.093 22.546 1.00 79.18 ? 273 VAL A O 1 ATOM 2195 C CB . VAL A 1 273 ? 45.551 75.264 21.248 1.00 49.91 ? 273 VAL A CB 1 ATOM 2196 C CG1 . VAL A 1 273 ? 46.162 76.071 22.386 1.00 50.03 ? 273 VAL A CG1 1 ATOM 2197 C CG2 . VAL A 1 273 ? 44.908 76.197 20.229 1.00 49.08 ? 273 VAL A CG2 1 ATOM 2198 N N . PRO A 1 274 ? 48.695 73.398 21.367 1.00 75.53 ? 274 PRO A N 1 ATOM 2199 C CA . PRO A 1 274 ? 49.524 72.610 22.280 1.00 76.56 ? 274 PRO A CA 1 ATOM 2200 C C . PRO A 1 274 ? 49.605 73.231 23.664 1.00 76.62 ? 274 PRO A C 1 ATOM 2201 O O . PRO A 1 274 ? 49.367 74.426 23.836 1.00 73.74 ? 274 PRO A O 1 ATOM 2202 C CB . PRO A 1 274 ? 50.874 72.589 21.577 1.00 68.43 ? 274 PRO A CB 1 ATOM 2203 C CG . PRO A 1 274 ? 50.901 73.925 20.894 1.00 67.04 ? 274 PRO A CG 1 ATOM 2204 C CD . PRO A 1 274 ? 49.519 74.000 20.303 1.00 64.19 ? 274 PRO A CD 1 ATOM 2205 N N . TRP A 1 275 ? 49.932 72.404 24.649 1.00 89.29 ? 275 TRP A N 1 ATOM 2206 C CA . TRP A 1 275 ? 50.072 72.876 26.014 1.00 96.43 ? 275 TRP A CA 1 ATOM 2207 C C . TRP A 1 275 ? 51.550 72.897 26.406 1.00 103.07 ? 275 TRP A C 1 ATOM 2208 O O . TRP A 1 275 ? 52.219 71.859 26.417 1.00 100.89 ? 275 TRP A O 1 ATOM 2209 C CB . TRP A 1 275 ? 49.293 71.985 26.980 1.00 82.65 ? 275 TRP A CB 1 ATOM 2210 C CG . TRP A 1 275 ? 49.511 72.391 28.392 1.00 74.91 ? 275 TRP A CG 1 ATOM 2211 C CD1 . TRP A 1 275 ? 49.146 73.574 28.976 1.00 75.82 ? 275 TRP A CD1 1 ATOM 2212 C CD2 . TRP A 1 275 ? 50.232 71.659 29.384 1.00 72.88 ? 275 TRP A CD2 1 ATOM 2213 N NE1 . TRP A 1 275 ? 49.603 73.626 30.271 1.00 79.92 ? 275 TRP A NE1 1 ATOM 2214 C CE2 . TRP A 1 275 ? 50.273 72.463 30.549 1.00 76.19 ? 275 TRP A CE2 1 ATOM 2215 C CE3 . TRP A 1 275 ? 50.853 70.400 29.403 1.00 75.27 ? 275 TRP A CE3 1 ATOM 2216 C CZ2 . TRP A 1 275 ? 50.915 72.047 31.728 1.00 78.25 ? 275 TRP A CZ2 1 ATOM 2217 C CZ3 . TRP A 1 275 ? 51.494 69.984 30.579 1.00 83.98 ? 275 TRP A CZ3 1 ATOM 2218 C CH2 . TRP A 1 275 ? 51.518 70.810 31.724 1.00 84.36 ? 275 TRP A CH2 1 ATOM 2219 N N . GLU A 1 276 ? 52.048 74.091 26.721 1.00 111.30 ? 276 GLU A N 1 ATOM 2220 C CA . GLU A 1 276 ? 53.442 74.285 27.109 1.00 119.24 ? 276 GLU A CA 1 ATOM 2221 C C . GLU A 1 276 ? 53.645 74.115 28.612 1.00 122.84 ? 276 GLU A C 1 ATOM 2222 O O . GLU A 1 276 ? 53.360 75.025 29.394 1.00 122.21 ? 276 GLU A O 1 ATOM 2223 C CB . GLU A 1 276 ? 53.912 75.678 26.680 1.00 114.49 ? 276 GLU A CB 1 ATOM 2224 C CG . GLU A 1 276 ? 53.929 75.886 25.175 1.00 122.22 ? 276 GLU A CG 1 ATOM 2225 C CD . GLU A 1 276 ? 54.841 74.903 24.467 1.00 126.79 ? 276 GLU A CD 1 ATOM 2226 O OE1 . GLU A 1 276 ? 56.055 74.907 24.754 1.00 130.22 ? 276 GLU A OE1 1 ATOM 2227 O OE2 . GLU A 1 276 ? 54.345 74.122 23.626 1.00 126.97 ? 276 GLU A OE2 1 ATOM 2228 N N . ALA A 1 277 ? 54.151 72.947 29.004 1.00 144.81 ? 277 ALA A N 1 ATOM 2229 C CA . ALA A 1 277 ? 54.394 72.634 30.409 1.00 147.77 ? 277 ALA A CA 1 ATOM 2230 C C . ALA A 1 277 ? 55.261 73.691 31.083 1.00 150.90 ? 277 ALA A C 1 ATOM 2231 O O . ALA A 1 277 ? 55.736 74.605 30.378 1.00 151.30 ? 277 ALA A O 1 ATOM 2232 C CB . ALA A 1 277 ? 55.054 71.261 30.531 1.00 80.43 ? 277 ALA A CB 1 HETATM 2233 C C1 . NAG B 2 . ? 10.533 83.158 -0.149 1.00 76.80 ? 310 NAG A C1 1 HETATM 2234 C C2 . NAG B 2 . ? 9.376 84.163 0.111 1.00 77.41 ? 310 NAG A C2 1 HETATM 2235 C C3 . NAG B 2 . ? 9.315 85.256 -0.986 1.00 81.14 ? 310 NAG A C3 1 HETATM 2236 C C4 . NAG B 2 . ? 10.701 85.870 -1.203 1.00 84.48 ? 310 NAG A C4 1 HETATM 2237 C C5 . NAG B 2 . ? 11.670 84.732 -1.541 1.00 86.42 ? 310 NAG A C5 1 HETATM 2238 C C6 . NAG B 2 . ? 13.088 85.151 -1.887 1.00 89.07 ? 310 NAG A C6 1 HETATM 2239 C C7 . NAG B 2 . ? 7.242 83.432 -0.824 1.00 88.26 ? 310 NAG A C7 1 HETATM 2240 C C8 . NAG B 2 . ? 7.341 82.286 -1.818 1.00 82.81 ? 310 NAG A C8 1 HETATM 2241 N N2 . NAG B 2 . ? 8.107 83.450 0.192 1.00 77.16 ? 310 NAG A N2 1 HETATM 2242 O O3 . NAG B 2 . ? 8.389 86.275 -0.626 1.00 77.23 ? 310 NAG A O3 1 HETATM 2243 O O4 . NAG B 2 . ? 10.652 86.821 -2.257 1.00 89.02 ? 310 NAG A O4 1 HETATM 2244 O O5 . NAG B 2 . ? 11.763 83.839 -0.418 1.00 83.21 ? 310 NAG A O5 1 HETATM 2245 O O6 . NAG B 2 . ? 13.946 84.015 -1.965 1.00 85.52 ? 310 NAG A O6 1 HETATM 2246 O O7 . NAG B 2 . ? 6.366 84.285 -0.969 1.00 93.14 ? 310 NAG A O7 1 HETATM 2247 C C1 . NAG C 2 . ? 29.089 85.947 26.105 1.00 33.13 ? 320 NAG A C1 1 HETATM 2248 C C2 . NAG C 2 . ? 30.539 86.477 26.097 1.00 41.51 ? 320 NAG A C2 1 HETATM 2249 C C3 . NAG C 2 . ? 31.457 85.602 26.964 1.00 44.55 ? 320 NAG A C3 1 HETATM 2250 C C4 . NAG C 2 . ? 30.844 85.393 28.357 1.00 43.27 ? 320 NAG A C4 1 HETATM 2251 C C5 . NAG C 2 . ? 29.441 84.814 28.195 1.00 41.34 ? 320 NAG A C5 1 HETATM 2252 C C6 . NAG C 2 . ? 28.755 84.582 29.515 1.00 44.87 ? 320 NAG A C6 1 HETATM 2253 C C7 . NAG C 2 . ? 30.997 87.625 24.018 1.00 40.63 ? 320 NAG A C7 1 HETATM 2254 C C8 . NAG C 2 . ? 31.819 87.678 22.737 1.00 38.49 ? 320 NAG A C8 1 HETATM 2255 N N2 . NAG C 2 . ? 31.050 86.504 24.737 1.00 37.24 ? 320 NAG A N2 1 HETATM 2256 O O3 . NAG C 2 . ? 32.727 86.229 27.081 1.00 45.78 ? 320 NAG A O3 1 HETATM 2257 O O4 . NAG C 2 . ? 31.666 84.515 29.157 1.00 49.00 ? 320 NAG A O4 1 HETATM 2258 O O5 . NAG C 2 . ? 28.623 85.740 27.453 1.00 38.51 ? 320 NAG A O5 1 HETATM 2259 O O6 . NAG C 2 . ? 28.306 85.806 30.068 1.00 41.69 ? 320 NAG A O6 1 HETATM 2260 O O7 . NAG C 2 . ? 30.320 88.604 24.348 1.00 37.19 ? 320 NAG A O7 1 HETATM 2261 C C1 . NAG D 2 . ? 32.238 85.111 30.270 1.00 121.02 ? 321 NAG A C1 1 HETATM 2262 C C2 . NAG D 2 . ? 32.486 84.071 31.358 1.00 127.19 ? 321 NAG A C2 1 HETATM 2263 C C3 . NAG D 2 . ? 33.191 84.730 32.551 1.00 137.33 ? 321 NAG A C3 1 HETATM 2264 C C4 . NAG D 2 . ? 34.457 85.458 32.090 1.00 141.22 ? 321 NAG A C4 1 HETATM 2265 C C5 . NAG D 2 . ? 34.114 86.428 30.953 1.00 142.65 ? 321 NAG A C5 1 HETATM 2266 C C6 . NAG D 2 . ? 35.336 87.117 30.375 1.00 141.58 ? 321 NAG A C6 1 HETATM 2267 C C7 . NAG D 2 . ? 31.188 82.252 32.236 1.00 133.97 ? 321 NAG A C7 1 HETATM 2268 C C8 . NAG D 2 . ? 31.110 82.063 33.742 1.00 140.08 ? 321 NAG A C8 1 HETATM 2269 N N2 . NAG D 2 . ? 31.226 83.499 31.782 1.00 125.30 ? 321 NAG A N2 1 HETATM 2270 O O3 . NAG D 2 . ? 33.537 83.744 33.512 1.00 133.02 ? 321 NAG A O3 1 HETATM 2271 O O4 . NAG D 2 . ? 35.023 86.173 33.181 1.00 149.79 ? 321 NAG A O4 1 HETATM 2272 O O5 . NAG D 2 . ? 33.477 85.712 29.871 1.00 134.38 ? 321 NAG A O5 1 HETATM 2273 O O6 . NAG D 2 . ? 34.966 88.175 29.503 1.00 141.63 ? 321 NAG A O6 1 HETATM 2274 O O7 . NAG D 2 . ? 31.221 81.271 31.494 1.00 137.90 ? 321 NAG A O7 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 GLN 1 1 ? ? ? A . n A 1 2 GLU 2 2 ? ? ? A . n A 1 3 ASN 3 3 ? ? ? A . n A 1 4 GLN 4 4 ? ? ? A . n A 1 5 ASP 5 5 5 ASP ASP A . n A 1 6 GLY 6 6 6 GLY GLY A . n A 1 7 ARG 7 7 7 ARG ARG A . n A 1 8 TYR 8 8 8 TYR TYR A . n A 1 9 SER 9 9 9 SER SER A . n A 1 10 LEU 10 10 10 LEU LEU A . n A 1 11 THR 11 11 11 THR THR A . n A 1 12 TYR 12 12 12 TYR TYR A . n A 1 13 ILE 13 13 13 ILE ILE A . n A 1 14 TYR 14 14 14 TYR TYR A . n A 1 15 THR 15 15 15 THR THR A . n A 1 16 GLY 16 16 16 GLY GLY A . n A 1 17 LEU 17 17 17 LEU LEU A . n A 1 18 SER 18 18 18 SER SER A . n A 1 19 LYS 19 19 19 LYS LYS A . n A 1 20 HIS 20 20 20 HIS HIS A . n A 1 21 VAL 21 21 21 VAL VAL A . n A 1 22 GLU 22 22 22 GLU GLU A . n A 1 23 ASP 23 23 23 ASP ASP A . n A 1 24 VAL 24 24 24 VAL VAL A . n A 1 25 PRO 25 25 25 PRO PRO A . n A 1 26 ALA 26 26 26 ALA ALA A . n A 1 27 PHE 27 27 27 PHE PHE A . n A 1 28 GLN 28 28 28 GLN GLN A . n A 1 29 ALA 29 29 29 ALA ALA A . n A 1 30 LEU 30 30 30 LEU LEU A . n A 1 31 GLY 31 31 31 GLY GLY A . n A 1 32 SER 32 32 32 SER SER A . n A 1 33 LEU 33 33 33 LEU LEU A . n A 1 34 ASN 34 34 34 ASN ASN A . n A 1 35 ASP 35 35 35 ASP ASP A . n A 1 36 LEU 36 36 36 LEU LEU A . n A 1 37 GLN 37 37 37 GLN GLN A . n A 1 38 PHE 38 38 38 PHE PHE A . n A 1 39 PHE 39 39 39 PHE PHE A . n A 1 40 ARG 40 40 40 ARG ARG A . n A 1 41 TYR 41 41 41 TYR TYR A . n A 1 42 ASN 42 42 42 ASN ASN A . n A 1 43 SER 43 43 43 SER SER A . n A 1 44 LYS 44 44 44 LYS LYS A . n A 1 45 ASP 45 45 45 ASP ASP A . n A 1 46 ARG 46 46 46 ARG ARG A . n A 1 47 LYS 47 47 47 LYS LYS A . n A 1 48 SER 48 48 48 SER SER A . n A 1 49 GLN 49 49 49 GLN GLN A . n A 1 50 PRO 50 50 50 PRO PRO A . n A 1 51 MET 51 51 51 MET MET A . n A 1 52 GLY 52 52 52 GLY GLY A . n A 1 53 LEU 53 53 53 LEU LEU A . n A 1 54 TRP 54 54 54 TRP TRP A . n A 1 55 ARG 55 55 55 ARG ARG A . n A 1 56 GLN 56 56 56 GLN GLN A . n A 1 57 VAL 57 57 57 VAL VAL A . n A 1 58 GLU 58 58 58 GLU GLU A . n A 1 59 GLY 59 59 59 GLY GLY A . n A 1 60 MET 60 60 60 MET MET A . n A 1 61 GLU 61 61 61 GLU GLU A . n A 1 62 ASP 62 62 62 ASP ASP A . n A 1 63 TRP 63 63 63 TRP TRP A . n A 1 64 LYS 64 64 64 LYS LYS A . n A 1 65 GLN 65 65 65 GLN GLN A . n A 1 66 ASP 66 66 66 ASP ASP A . n A 1 67 SER 67 67 67 SER SER A . n A 1 68 GLN 68 68 68 GLN GLN A . n A 1 69 LEU 69 69 69 LEU LEU A . n A 1 70 GLN 70 70 70 GLN GLN A . n A 1 71 LYS 71 71 71 LYS LYS A . n A 1 72 ALA 72 72 72 ALA ALA A . n A 1 73 ARG 73 73 73 ARG ARG A . n A 1 74 GLU 74 74 74 GLU GLU A . n A 1 75 ASP 75 75 75 ASP ASP A . n A 1 76 ILE 76 76 76 ILE ILE A . n A 1 77 PHE 77 77 77 PHE PHE A . n A 1 78 MET 78 78 78 MET MET A . n A 1 79 GLU 79 79 79 GLU GLU A . n A 1 80 THR 80 80 80 THR THR A . n A 1 81 LEU 81 81 81 LEU LEU A . n A 1 82 LYS 82 82 82 LYS LYS A . n A 1 83 ASP 83 83 83 ASP ASP A . n A 1 84 ILE 84 84 84 ILE ILE A . n A 1 85 VAL 85 85 85 VAL VAL A . n A 1 86 GLU 86 86 86 GLU GLU A . n A 1 87 TYR 87 87 87 TYR TYR A . n A 1 88 TYR 88 88 88 TYR TYR A . n A 1 89 LYS 89 89 89 LYS LYS A . n A 1 90 ASP 90 90 90 ASP ASP A . n A 1 91 SER 91 91 91 SER SER A . n A 1 92 THR 92 92 92 THR THR A . n A 1 93 GLY 93 93 93 GLY GLY A . n A 1 94 SER 94 94 94 SER SER A . n A 1 95 HIS 95 95 95 HIS HIS A . n A 1 96 VAL 96 96 96 VAL VAL A . n A 1 97 LEU 97 97 97 LEU LEU A . n A 1 98 GLN 98 98 98 GLN GLN A . n A 1 99 GLY 99 99 99 GLY GLY A . n A 1 100 ARG 100 100 100 ARG ARG A . n A 1 101 PHE 101 101 101 PHE PHE A . n A 1 102 GLY 102 102 102 GLY GLY A . n A 1 103 CYS 103 103 103 CYS CYS A . n A 1 104 GLU 104 104 104 GLU GLU A . n A 1 105 ILE 105 105 105 ILE ILE A . n A 1 106 GLU 106 106 106 GLU GLU A . n A 1 107 ASN 107 107 107 ASN ASN A . n A 1 108 ASN 108 108 108 ASN ASN A . n A 1 109 ARG 109 109 109 ARG ARG A . n A 1 110 SER 110 110 110 SER SER A . n A 1 111 SER 111 111 111 SER SER A . n A 1 112 GLY 112 112 112 GLY GLY A . n A 1 113 ALA 113 113 113 ALA ALA A . n A 1 114 PHE 114 114 114 PHE PHE A . n A 1 115 TRP 115 115 115 TRP TRP A . n A 1 116 LYS 116 116 116 LYS LYS A . n A 1 117 TYR 117 117 117 TYR TYR A . n A 1 118 TYR 118 118 118 TYR TYR A . n A 1 119 TYR 119 119 119 TYR TYR A . n A 1 120 ASP 120 120 120 ASP ASP A . n A 1 121 GLY 121 121 121 GLY GLY A . n A 1 122 LYS 122 122 122 LYS LYS A . n A 1 123 ASP 123 123 123 ASP ASP A . n A 1 124 TYR 124 124 124 TYR TYR A . n A 1 125 ILE 125 125 125 ILE ILE A . n A 1 126 GLU 126 126 126 GLU GLU A . n A 1 127 PHE 127 127 127 PHE PHE A . n A 1 128 ASN 128 128 128 ASN ASN A . n A 1 129 LYS 129 129 129 LYS LYS A . n A 1 130 GLU 130 130 130 GLU GLU A . n A 1 131 ILE 131 131 131 ILE ILE A . n A 1 132 PRO 132 132 132 PRO PRO A . n A 1 133 ALA 133 133 133 ALA ALA A . n A 1 134 TRP 134 134 134 TRP TRP A . n A 1 135 VAL 135 135 135 VAL VAL A . n A 1 136 PRO 136 136 136 PRO PRO A . n A 1 137 PHE 137 137 137 PHE PHE A . n A 1 138 ASP 138 138 138 ASP ASP A . n A 1 139 PRO 139 139 139 PRO PRO A . n A 1 140 ALA 140 140 140 ALA ALA A . n A 1 141 ALA 141 141 141 ALA ALA A . n A 1 142 GLN 142 142 142 GLN GLN A . n A 1 143 ILE 143 143 143 ILE ILE A . n A 1 144 THR 144 144 144 THR THR A . n A 1 145 LYS 145 145 145 LYS LYS A . n A 1 146 GLN 146 146 146 GLN GLN A . n A 1 147 LYS 147 147 147 LYS LYS A . n A 1 148 TRP 148 148 148 TRP TRP A . n A 1 149 GLU 149 149 149 GLU GLU A . n A 1 150 ALA 150 150 150 ALA ALA A . n A 1 151 GLU 151 151 151 GLU GLU A . n A 1 152 PRO 152 152 152 PRO PRO A . n A 1 153 VAL 153 153 153 VAL VAL A . n A 1 154 TYR 154 154 154 TYR TYR A . n A 1 155 VAL 155 155 155 VAL VAL A . n A 1 156 GLN 156 156 156 GLN GLN A . n A 1 157 ARG 157 157 157 ARG ARG A . n A 1 158 ALA 158 158 158 ALA ALA A . n A 1 159 LYS 159 159 159 LYS LYS A . n A 1 160 ALA 160 160 160 ALA ALA A . n A 1 161 TYR 161 161 161 TYR TYR A . n A 1 162 LEU 162 162 162 LEU LEU A . n A 1 163 GLU 163 163 163 GLU GLU A . n A 1 164 GLU 164 164 164 GLU GLU A . n A 1 165 GLU 165 165 165 GLU GLU A . n A 1 166 CYS 166 166 166 CYS CYS A . n A 1 167 PRO 167 167 167 PRO PRO A . n A 1 168 ALA 168 168 168 ALA ALA A . n A 1 169 THR 169 169 169 THR THR A . n A 1 170 LEU 170 170 170 LEU LEU A . n A 1 171 ARG 171 171 171 ARG ARG A . n A 1 172 LYS 172 172 172 LYS LYS A . n A 1 173 TYR 173 173 173 TYR TYR A . n A 1 174 LEU 174 174 174 LEU LEU A . n A 1 175 LYS 175 175 175 LYS LYS A . n A 1 176 TYR 176 176 176 TYR TYR A . n A 1 177 SER 177 177 177 SER SER A . n A 1 178 LYS 178 178 178 LYS LYS A . n A 1 179 ASN 179 179 179 ASN ASN A . n A 1 180 ILE 180 180 180 ILE ILE A . n A 1 181 LEU 181 181 181 LEU LEU A . n A 1 182 ASP 182 182 182 ASP ASP A . n A 1 183 ARG 183 183 183 ARG ARG A . n A 1 184 GLN 184 184 184 GLN GLN A . n A 1 185 ASP 185 185 185 ASP ASP A . n A 1 186 PRO 186 186 186 PRO PRO A . n A 1 187 PRO 187 187 187 PRO PRO A . n A 1 188 SER 188 188 188 SER SER A . n A 1 189 VAL 189 189 189 VAL VAL A . n A 1 190 VAL 190 190 190 VAL VAL A . n A 1 191 VAL 191 191 191 VAL VAL A . n A 1 192 THR 192 192 192 THR THR A . n A 1 193 SER 193 193 193 SER SER A . n A 1 194 HIS 194 194 194 HIS HIS A . n A 1 195 GLN 195 195 195 GLN GLN A . n A 1 196 ALA 196 196 196 ALA ALA A . n A 1 197 PRO 197 197 197 PRO PRO A . n A 1 198 GLY 198 198 198 GLY GLY A . n A 1 199 GLU 199 199 199 GLU GLU A . n A 1 200 LYS 200 200 200 LYS LYS A . n A 1 201 LYS 201 201 201 LYS LYS A . n A 1 202 LYS 202 202 202 LYS LYS A . n A 1 203 LEU 203 203 203 LEU LEU A . n A 1 204 LYS 204 204 204 LYS LYS A . n A 1 205 CYS 205 205 205 CYS CYS A . n A 1 206 LEU 206 206 206 LEU LEU A . n A 1 207 ALA 207 207 207 ALA ALA A . n A 1 208 TYR 208 208 208 TYR TYR A . n A 1 209 ASP 209 209 209 ASP ASP A . n A 1 210 PHE 210 210 210 PHE PHE A . n A 1 211 TYR 211 211 211 TYR TYR A . n A 1 212 PRO 212 212 212 PRO PRO A . n A 1 213 GLY 213 213 213 GLY GLY A . n A 1 214 LYS 214 214 214 LYS LYS A . n A 1 215 ILE 215 215 215 ILE ILE A . n A 1 216 ASP 216 216 216 ASP ASP A . n A 1 217 VAL 217 217 217 VAL VAL A . n A 1 218 HIS 218 218 218 HIS HIS A . n A 1 219 TRP 219 219 219 TRP TRP A . n A 1 220 THR 220 220 220 THR THR A . n A 1 221 ARG 221 221 221 ARG ARG A . n A 1 222 ALA 222 222 222 ALA ALA A . n A 1 223 GLY 223 223 223 GLY GLY A . n A 1 224 GLU 224 224 224 GLU GLU A . n A 1 225 VAL 225 225 225 VAL VAL A . n A 1 226 GLN 226 226 226 GLN GLN A . n A 1 227 GLU 227 227 227 GLU GLU A . n A 1 228 PRO 228 228 228 PRO PRO A . n A 1 229 GLU 229 229 229 GLU GLU A . n A 1 230 LEU 230 230 230 LEU LEU A . n A 1 231 ARG 231 231 231 ARG ARG A . n A 1 232 GLY 232 232 232 GLY GLY A . n A 1 233 ASP 233 233 233 ASP ASP A . n A 1 234 VAL 234 234 234 VAL VAL A . n A 1 235 LEU 235 235 235 LEU LEU A . n A 1 236 HIS 236 236 236 HIS HIS A . n A 1 237 ASN 237 237 237 ASN ASN A . n A 1 238 GLY 238 238 238 GLY GLY A . n A 1 239 ASN 239 239 239 ASN ASN A . n A 1 240 GLY 240 240 240 GLY GLY A . n A 1 241 THR 241 241 241 THR THR A . n A 1 242 TYR 242 242 242 TYR TYR A . n A 1 243 GLN 243 243 243 GLN GLN A . n A 1 244 SER 244 244 244 SER SER A . n A 1 245 TRP 245 245 245 TRP TRP A . n A 1 246 VAL 246 246 246 VAL VAL A . n A 1 247 VAL 247 247 247 VAL VAL A . n A 1 248 VAL 248 248 248 VAL VAL A . n A 1 249 ALA 249 249 249 ALA ALA A . n A 1 250 VAL 250 250 250 VAL VAL A . n A 1 251 PRO 251 251 251 PRO PRO A . n A 1 252 PRO 252 252 252 PRO PRO A . n A 1 253 GLN 253 253 253 GLN GLN A . n A 1 254 ASP 254 254 254 ASP ASP A . n A 1 255 THR 255 255 255 THR THR A . n A 1 256 ALA 256 256 256 ALA ALA A . n A 1 257 PRO 257 257 257 PRO PRO A . n A 1 258 TYR 258 258 258 TYR TYR A . n A 1 259 SER 259 259 259 SER SER A . n A 1 260 CYS 260 260 260 CYS CYS A . n A 1 261 HIS 261 261 261 HIS HIS A . n A 1 262 VAL 262 262 262 VAL VAL A . n A 1 263 GLN 263 263 263 GLN GLN A . n A 1 264 HIS 264 264 264 HIS HIS A . n A 1 265 SER 265 265 265 SER SER A . n A 1 266 SER 266 266 266 SER SER A . n A 1 267 LEU 267 267 267 LEU LEU A . n A 1 268 ALA 268 268 268 ALA ALA A . n A 1 269 GLN 269 269 269 GLN GLN A . n A 1 270 PRO 270 270 270 PRO PRO A . n A 1 271 LEU 271 271 271 LEU LEU A . n A 1 272 VAL 272 272 272 VAL VAL A . n A 1 273 VAL 273 273 273 VAL VAL A . n A 1 274 PRO 274 274 274 PRO PRO A . n A 1 275 TRP 275 275 275 TRP TRP A . n A 1 276 GLU 276 276 276 GLU GLU A . n A 1 277 ALA 277 277 277 ALA ALA A . n A 1 278 SER 278 278 ? ? ? A . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code B 2 NAG 1 310 310 NAG NAG A . C 2 NAG 1 320 320 NAG NAG A . D 2 NAG 2 321 321 NAG NAG A . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 A ASN 108 A ASN 108 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 239 A ASN 239 ? ASN 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D # _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 2004-12-21 2 'Structure model' 1 1 2008-04-30 3 'Structure model' 1 2 2011-07-13 4 'Structure model' 1 3 2017-10-11 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Version format compliance' 2 3 'Structure model' 'Non-polymer description' 3 3 'Structure model' 'Version format compliance' 4 4 'Structure model' 'Refinement description' # _pdbx_audit_revision_category.ordinal 1 _pdbx_audit_revision_category.revision_ordinal 4 _pdbx_audit_revision_category.data_content_type 'Structure model' _pdbx_audit_revision_category.category software # _phasing.method MR # loop_ _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id _software.pdbx_ordinal CNS 1.1 1998 package 'Axel T. Brunger' axel.brunger@yale.edu refinement http://cns.csb.yale.edu/v1.1/ Fortran_77 ? 1 DENZO . ? package 'Zbyszek Otwinowski' zbyszek@mix.swmed.edu 'data reduction' http://www.lnls.br/infra/linhasluz/denzo-hkl.htm ? ? 2 SCALEPACK . ? package 'Zbyszek Otwinowski' zbyszek@mix.swmed.edu 'data scaling' http://www.lnls.br/infra/linhasluz/denzo-hkl.htm ? ? 3 AMoRE . ? ? ? ? phasing ? ? ? 4 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 ASN A 34 ? ? 54.44 -125.85 2 1 ASP A 90 ? ? -156.89 60.38 3 1 ASN A 108 ? ? 58.48 1.97 4 1 TRP A 115 ? ? -165.84 102.30 5 1 GLU A 164 ? ? -123.91 -66.80 6 1 ILE A 180 ? ? -132.63 -54.85 7 1 GLN A 184 ? ? -144.15 56.34 8 1 PRO A 197 ? ? -52.03 104.05 9 1 ARG A 231 ? ? -176.47 142.50 10 1 PRO A 252 ? ? -59.15 -0.98 11 1 ALA A 256 ? ? -40.00 154.75 # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A GLN 1 ? A GLN 1 2 1 Y 1 A GLU 2 ? A GLU 2 3 1 Y 1 A ASN 3 ? A ASN 3 4 1 Y 1 A GLN 4 ? A GLN 4 5 1 Y 1 A SER 278 ? A SER 278 # _pdbx_entity_nonpoly.entity_id 2 _pdbx_entity_nonpoly.name N-ACETYL-D-GLUCOSAMINE _pdbx_entity_nonpoly.comp_id NAG #