data_1T7Z # _entry.id 1T7Z # _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 1T7Z RCSB RCSB022425 WWPDB D_1000022425 # 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 1t7y . unspecified PDB 1t80 . unspecified # _pdbx_database_status.entry_id 1T7Z _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 1T7Z _cell.length_a 122.084 _cell.length_b 122.084 _cell.length_c 65.415 _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 1T7Z _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 1T7Z _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 1T7Z LYS A 89 ? UNP P25311 ASN 106 ENGINEERED 89 1 1 1T7Z 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 1T7Z _exptl.crystals_number 1 _exptl.method 'X-RAY DIFFRACTION' # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_percent_sol 67.52 _exptl_crystal.density_Matthews 3.79 _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, trehalose, 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 210' _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 1.0781 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'ALS BEAMLINE 8.2.1' _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.0781 _diffrn_source.pdbx_synchrotron_site ALS _diffrn_source.pdbx_synchrotron_beamline 8.2.1 # _reflns.percent_possible_obs 96.900 _reflns.entry_id 1T7Z _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.d_resolution_high 3.0 _reflns.d_resolution_low 20.0 _reflns.number_all ? _reflns.number_obs 9940 _reflns.pdbx_Rmerge_I_obs 0.065 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 16.6 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 3.5 _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 3.0 _reflns_shell.d_res_low 3.11 _reflns_shell.percent_possible_obs 99.900 _reflns_shell.Rmerge_I_obs 0.182 _reflns_shell.percent_possible_all 79.4 _reflns_shell.meanI_over_sigI_obs 5.7 _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 1T7Z _refine.ls_number_reflns_all 10226 _refine.ls_number_reflns_obs 9909 _refine.ls_percent_reflns_obs 96.9 _refine.ls_d_res_high 3.0 _refine.ls_d_res_low 20.0 _refine.B_iso_min 2.35 _refine.B_iso_max 171.92 _refine.B_iso_mean 42.61 _refine.occupancy_min 1.00 _refine.occupancy_max 1.00 _refine.aniso_B[1][1] 2.21 _refine.aniso_B[2][2] 2.21 _refine.aniso_B[3][3] -4.42 _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 16.4763 _refine.solvent_model_param_ksol 0.329988 _refine.solvent_model_details 'CNS bulk solvent model used' _refine.ls_R_factor_R_work 0.217 _refine.ls_R_factor_R_free 0.268 _refine.ls_R_factor_R_free_error 0.012 _refine.ls_number_reflns_R_free 527 _refine.ls_percent_reflns_R_free 5.3 _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 1T7Z _refine_analyze.Luzzati_d_res_low_obs 5.00 _refine_analyze.Luzzati_coordinate_error_obs 0.33 _refine_analyze.Luzzati_sigma_a_obs 0.43 _refine_analyze.Luzzati_coordinate_error_free 0.43 _refine_analyze.Luzzati_sigma_a_free 0.51 _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 3.0 _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 24.2 . ? ? 'X-RAY DIFFRACTION' ? x_torsion_impr_deg 0.78 . ? ? '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 3.01 3.12 1003 796 754 79.4 0.299 0.316 0.049 42 5.3 . . 'X-RAY DIFFRACTION' . 3.12 3.24 993 942 896 94.9 0.283 0.331 0.049 46 4.9 . . 'X-RAY DIFFRACTION' . 3.24 3.39 999 999 952 100.0 0.248 0.331 0.048 47 4.7 . . 'X-RAY DIFFRACTION' . 3.39 3.56 1003 1000 947 99.7 0.223 0.322 0.044 53 5.3 . . 'X-RAY DIFFRACTION' . 3.56 3.79 1008 1007 943 99.9 0.209 0.269 0.034 64 6.4 . . 'X-RAY DIFFRACTION' . 3.79 4.08 1022 1021 960 99.9 0.206 0.241 0.031 61 6.0 . . 'X-RAY DIFFRACTION' . 4.08 4.48 1013 1013 968 100.0 0.161 0.208 0.031 45 4.4 . . 'X-RAY DIFFRACTION' . 4.48 5.12 1035 979 938 94.6 0.184 0.202 0.032 41 4.2 . . 'X-RAY DIFFRACTION' . 5.12 6.42 1043 1043 975 100.0 0.211 0.227 0.028 68 6.5 . . 'X-RAY DIFFRACTION' . 6.42 19.94 1110 1109 1049 99.9 0.238 0.327 0.042 60 5.4 . . 'X-RAY DIFFRACTION' . # _struct.entry_id 1T7Z _struct.title 'Zn-alpha-2-glycoprotein; baculo-ZAG no PEG, 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 1T7Z _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 ? TYR A 88 ? ASP A 62 TYR A 88 1 ? 27 HELX_P HELX_P3 3 ASP A 138 ? GLU A 149 ? ASP A 138 GLU A 149 1 ? 12 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 ? SER A 177 ? GLU A 164 SER A 177 1 ? 14 HELX_P HELX_P6 6 SER A 177 ? ASP A 182 ? SER A 177 ASP A 182 1 ? 6 # _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 ? ? ? ? ? ? ? 1.451 ? covale2 covale ? ? A ASN 239 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 239 A NAG 320 1_555 ? ? ? ? ? ? ? 1.449 ? covale3 covale ? ? C NAG . O4 ? ? ? 1_555 D NAG . C1 ? ? A NAG 320 A NAG 321 1_555 ? ? ? ? ? ? ? 1.385 ? # 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 -0.38 2 TYR 211 A . ? TYR 211 A PRO 212 A ? PRO 212 A 1 -0.20 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 8 ? B ? 4 ? C ? 3 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel A 5 6 ? anti-parallel A 6 7 ? anti-parallel A 7 8 ? anti-parallel 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 # 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 ASP A 216 ? ARG A 221 ? ASP A 216 ARG A 221 C 2 TYR A 258 ? GLN A 263 ? TYR A 258 GLN A 263 C 3 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 LEU A 36 ? O LEU A 36 N LEU A 33 ? N LEU A 33 A 3 4 O GLN A 28 ? O GLN A 28 N THR A 15 ? N THR A 15 A 4 5 N TYR A 12 ? N TYR A 12 O PHE A 101 ? O PHE A 101 A 5 6 N GLU A 104 ? N GLU A 104 O SER A 111 ? O SER A 111 A 6 7 N TYR A 117 ? N TYR A 117 O ILE A 125 ? O ILE A 125 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 LYS A 201 ? N LYS A 201 O VAL A 250 ? O VAL A 250 B 3 4 O TRP A 245 ? O TRP A 245 N GLY A 232 ? N GLY A 232 C 1 2 N HIS A 218 ? N HIS A 218 O HIS A 261 ? O HIS A 261 C 2 3 N CYS A 260 ? N CYS A 260 O VAL A 273 ? O VAL A 273 # 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 ? ? ? ? 6 'BINDING SITE FOR RESIDUE NAG A 320' AC3 Software ? ? ? ? 3 '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 6 ASP A 209 ? ASP A 209 . ? 1_555 ? 3 AC2 6 HIS A 236 ? HIS A 236 . ? 1_555 ? 4 AC2 6 ASN A 239 ? ASN A 239 . ? 1_555 ? 5 AC2 6 THR A 241 ? THR A 241 . ? 1_555 ? 6 AC2 6 GLN A 243 ? GLN A 243 . ? 1_555 ? 7 AC2 6 NAG D . ? NAG A 321 . ? 1_555 ? 8 AC3 3 HIS A 236 ? HIS A 236 . ? 1_555 ? 9 AC3 3 GLN A 243 ? GLN A 243 . ? 1_555 ? 10 AC3 3 NAG C . ? NAG A 320 . ? 1_555 ? # _atom_sites.entry_id 1T7Z _atom_sites.fract_transf_matrix[1][1] 0.008191 _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] 0.008191 _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] 0.015287 _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 ? 19.107 77.379 0.911 1.00 87.65 ? 5 ASP A N 1 ATOM 2 C CA . ASP A 1 5 ? 18.726 77.757 2.302 1.00 85.83 ? 5 ASP A CA 1 ATOM 3 C C . ASP A 1 5 ? 18.687 76.522 3.191 1.00 84.26 ? 5 ASP A C 1 ATOM 4 O O . ASP A 1 5 ? 18.650 75.393 2.698 1.00 90.09 ? 5 ASP A O 1 ATOM 5 C CB . ASP A 1 5 ? 17.351 78.428 2.308 1.00 121.27 ? 5 ASP A CB 1 ATOM 6 C CG . ASP A 1 5 ? 17.345 79.748 1.572 1.00 127.94 ? 5 ASP A CG 1 ATOM 7 O OD1 . ASP A 1 5 ? 18.053 80.675 2.017 1.00 127.79 ? 5 ASP A OD1 1 ATOM 8 O OD2 . ASP A 1 5 ? 16.634 79.857 0.551 1.00 125.71 ? 5 ASP A OD2 1 ATOM 9 N N . GLY A 1 6 ? 18.693 76.739 4.502 1.00 66.04 ? 6 GLY A N 1 ATOM 10 C CA . GLY A 1 6 ? 18.656 75.620 5.422 1.00 52.44 ? 6 GLY A CA 1 ATOM 11 C C . GLY A 1 6 ? 17.349 75.497 6.183 1.00 44.06 ? 6 GLY A C 1 ATOM 12 O O . GLY A 1 6 ? 16.306 75.986 5.739 1.00 36.93 ? 6 GLY A O 1 ATOM 13 N N . ARG A 1 7 ? 17.422 74.831 7.336 1.00 43.19 ? 7 ARG A N 1 ATOM 14 C CA . ARG A 1 7 ? 16.279 74.614 8.212 1.00 40.42 ? 7 ARG A CA 1 ATOM 15 C C . ARG A 1 7 ? 16.211 75.712 9.267 1.00 35.28 ? 7 ARG A C 1 ATOM 16 O O . ARG A 1 7 ? 17.228 76.118 9.821 1.00 30.89 ? 7 ARG A O 1 ATOM 17 C CB . ARG A 1 7 ? 16.408 73.266 8.913 1.00 57.04 ? 7 ARG A CB 1 ATOM 18 C CG . ARG A 1 7 ? 16.478 72.073 7.988 1.00 69.49 ? 7 ARG A CG 1 ATOM 19 C CD . ARG A 1 7 ? 15.247 71.198 8.147 1.00 89.42 ? 7 ARG A CD 1 ATOM 20 N NE . ARG A 1 7 ? 15.092 70.704 9.514 1.00 97.11 ? 7 ARG A NE 1 ATOM 21 C CZ . ARG A 1 7 ? 14.063 69.971 9.931 1.00 102.89 ? 7 ARG A CZ 1 ATOM 22 N NH1 . ARG A 1 7 ? 13.092 69.641 9.087 1.00 98.17 ? 7 ARG A NH1 1 ATOM 23 N NH2 . ARG A 1 7 ? 14.001 69.570 11.194 1.00 101.94 ? 7 ARG A NH2 1 ATOM 24 N N . TYR A 1 8 ? 15.004 76.189 9.539 1.00 24.13 ? 8 TYR A N 1 ATOM 25 C CA . TYR A 1 8 ? 14.776 77.230 10.536 1.00 24.13 ? 8 TYR A CA 1 ATOM 26 C C . TYR A 1 8 ? 13.437 76.958 11.175 1.00 24.13 ? 8 TYR A C 1 ATOM 27 O O . TYR A 1 8 ? 12.495 76.517 10.515 1.00 24.13 ? 8 TYR A O 1 ATOM 28 C CB . TYR A 1 8 ? 14.759 78.601 9.883 1.00 30.56 ? 8 TYR A CB 1 ATOM 29 C CG . TYR A 1 8 ? 16.070 78.953 9.252 1.00 38.57 ? 8 TYR A CG 1 ATOM 30 C CD1 . TYR A 1 8 ? 17.121 79.457 10.014 1.00 34.28 ? 8 TYR A CD1 1 ATOM 31 C CD2 . TYR A 1 8 ? 16.272 78.764 7.893 1.00 32.88 ? 8 TYR A CD2 1 ATOM 32 C CE1 . TYR A 1 8 ? 18.336 79.766 9.433 1.00 33.88 ? 8 TYR A CE1 1 ATOM 33 C CE2 . TYR A 1 8 ? 17.482 79.068 7.304 1.00 40.98 ? 8 TYR A CE2 1 ATOM 34 C CZ . TYR A 1 8 ? 18.505 79.569 8.076 1.00 38.94 ? 8 TYR A CZ 1 ATOM 35 O OH . TYR A 1 8 ? 19.687 79.892 7.474 1.00 35.78 ? 8 TYR A OH 1 ATOM 36 N N . SER A 1 9 ? 13.332 77.225 12.463 1.00 29.99 ? 9 SER A N 1 ATOM 37 C CA . SER A 1 9 ? 12.077 76.949 13.130 1.00 29.99 ? 9 SER A CA 1 ATOM 38 C C . SER A 1 9 ? 11.736 77.958 14.203 1.00 29.99 ? 9 SER A C 1 ATOM 39 O O . SER A 1 9 ? 12.579 78.355 14.998 1.00 30.84 ? 9 SER A O 1 ATOM 40 C CB . SER A 1 9 ? 12.129 75.550 13.722 1.00 10.49 ? 9 SER A CB 1 ATOM 41 O OG . SER A 1 9 ? 13.318 75.398 14.477 1.00 20.16 ? 9 SER A OG 1 ATOM 42 N N . LEU A 1 10 ? 10.478 78.371 14.189 1.00 26.96 ? 10 LEU A N 1 ATOM 43 C CA . LEU A 1 10 ? 9.942 79.316 15.145 1.00 26.96 ? 10 LEU A CA 1 ATOM 44 C C . LEU A 1 10 ? 9.061 78.505 16.083 1.00 26.96 ? 10 LEU A C 1 ATOM 45 O O . LEU A 1 10 ? 8.179 77.760 15.627 1.00 26.96 ? 10 LEU A O 1 ATOM 46 C CB . LEU A 1 10 ? 9.105 80.362 14.412 1.00 20.71 ? 10 LEU A CB 1 ATOM 47 C CG . LEU A 1 10 ? 8.245 81.298 15.261 1.00 20.71 ? 10 LEU A CG 1 ATOM 48 C CD1 . LEU A 1 10 ? 9.125 82.069 16.253 1.00 20.71 ? 10 LEU A CD1 1 ATOM 49 C CD2 . LEU A 1 10 ? 7.502 82.244 14.340 1.00 20.71 ? 10 LEU A CD2 1 ATOM 50 N N . THR A 1 11 ? 9.302 78.626 17.386 1.00 26.83 ? 11 THR A N 1 ATOM 51 C CA . THR A 1 11 ? 8.509 77.881 18.357 1.00 26.83 ? 11 THR A CA 1 ATOM 52 C C . THR A 1 11 ? 8.132 78.710 19.564 1.00 26.83 ? 11 THR A C 1 ATOM 53 O O . THR A 1 11 ? 8.959 79.431 20.126 1.00 26.83 ? 11 THR A O 1 ATOM 54 C CB . THR A 1 11 ? 9.247 76.634 18.862 1.00 22.11 ? 11 THR A CB 1 ATOM 55 O OG1 . THR A 1 11 ? 9.654 75.832 17.748 1.00 22.11 ? 11 THR A OG1 1 ATOM 56 C CG2 . THR A 1 11 ? 8.331 75.808 19.756 1.00 22.11 ? 11 THR A CG2 1 ATOM 57 N N . TYR A 1 12 ? 6.870 78.604 19.955 1.00 21.71 ? 12 TYR A N 1 ATOM 58 C CA . TYR A 1 12 ? 6.376 79.331 21.106 1.00 21.71 ? 12 TYR A CA 1 ATOM 59 C C . TYR A 1 12 ? 5.941 78.364 22.175 1.00 21.71 ? 12 TYR A C 1 ATOM 60 O O . TYR A 1 12 ? 5.367 77.308 21.881 1.00 21.71 ? 12 TYR A O 1 ATOM 61 C CB . TYR A 1 12 ? 5.183 80.189 20.729 1.00 22.32 ? 12 TYR A CB 1 ATOM 62 C CG . TYR A 1 12 ? 5.522 81.277 19.769 1.00 22.32 ? 12 TYR A CG 1 ATOM 63 C CD1 . TYR A 1 12 ? 5.515 81.050 18.391 1.00 22.32 ? 12 TYR A CD1 1 ATOM 64 C CD2 . TYR A 1 12 ? 5.870 82.542 20.235 1.00 22.32 ? 12 TYR A CD2 1 ATOM 65 C CE1 . TYR A 1 12 ? 5.846 82.071 17.499 1.00 22.32 ? 12 TYR A CE1 1 ATOM 66 C CE2 . TYR A 1 12 ? 6.201 83.560 19.363 1.00 22.32 ? 12 TYR A CE2 1 ATOM 67 C CZ . TYR A 1 12 ? 6.187 83.325 17.998 1.00 22.32 ? 12 TYR A CZ 1 ATOM 68 O OH . TYR A 1 12 ? 6.502 84.358 17.150 1.00 22.32 ? 12 TYR A OH 1 ATOM 69 N N . ILE A 1 13 ? 6.216 78.716 23.424 1.00 25.58 ? 13 ILE A N 1 ATOM 70 C CA . ILE A 1 13 ? 5.799 77.870 24.524 1.00 25.58 ? 13 ILE A CA 1 ATOM 71 C C . ILE A 1 13 ? 5.155 78.698 25.610 1.00 25.58 ? 13 ILE A C 1 ATOM 72 O O . ILE A 1 13 ? 5.755 79.657 26.119 1.00 25.58 ? 13 ILE A O 1 ATOM 73 C CB . ILE A 1 13 ? 6.966 77.094 25.129 1.00 10.49 ? 13 ILE A CB 1 ATOM 74 C CG1 . ILE A 1 13 ? 7.675 76.299 24.034 1.00 10.49 ? 13 ILE A CG1 1 ATOM 75 C CG2 . ILE A 1 13 ? 6.444 76.159 26.214 1.00 10.49 ? 13 ILE A CG2 1 ATOM 76 C CD1 . ILE A 1 13 ? 8.667 75.332 24.577 1.00 14.96 ? 13 ILE A CD1 1 ATOM 77 N N . TYR A 1 14 ? 3.918 78.325 25.939 1.00 18.05 ? 14 TYR A N 1 ATOM 78 C CA . TYR A 1 14 ? 3.143 78.991 26.981 1.00 18.05 ? 14 TYR A CA 1 ATOM 79 C C . TYR A 1 14 ? 2.947 78.062 28.166 1.00 18.05 ? 14 TYR A C 1 ATOM 80 O O . TYR A 1 14 ? 2.626 76.887 27.994 1.00 18.05 ? 14 TYR A O 1 ATOM 81 C CB . TYR A 1 14 ? 1.761 79.396 26.472 1.00 19.36 ? 14 TYR A CB 1 ATOM 82 C CG . TYR A 1 14 ? 1.736 80.538 25.494 1.00 19.36 ? 14 TYR A CG 1 ATOM 83 C CD1 . TYR A 1 14 ? 2.850 81.356 25.311 1.00 19.36 ? 14 TYR A CD1 1 ATOM 84 C CD2 . TYR A 1 14 ? 0.568 80.834 24.783 1.00 19.36 ? 14 TYR A CD2 1 ATOM 85 C CE1 . TYR A 1 14 ? 2.800 82.452 24.444 1.00 19.36 ? 14 TYR A CE1 1 ATOM 86 C CE2 . TYR A 1 14 ? 0.502 81.923 23.914 1.00 19.36 ? 14 TYR A CE2 1 ATOM 87 C CZ . TYR A 1 14 ? 1.617 82.731 23.749 1.00 19.36 ? 14 TYR A CZ 1 ATOM 88 O OH . TYR A 1 14 ? 1.549 83.826 22.910 1.00 22.01 ? 14 TYR A OH 1 ATOM 89 N N . THR A 1 15 ? 3.140 78.610 29.365 1.00 14.82 ? 15 THR A N 1 ATOM 90 C CA . THR A 1 15 ? 2.962 77.857 30.597 1.00 14.82 ? 15 THR A CA 1 ATOM 91 C C . THR A 1 15 ? 2.107 78.619 31.597 1.00 14.82 ? 15 THR A C 1 ATOM 92 O O . THR A 1 15 ? 2.388 79.770 31.926 1.00 14.82 ? 15 THR A O 1 ATOM 93 C CB . THR A 1 15 ? 4.284 77.560 31.269 1.00 22.45 ? 15 THR A CB 1 ATOM 94 O OG1 . THR A 1 15 ? 5.216 77.065 30.299 1.00 22.45 ? 15 THR A OG1 1 ATOM 95 C CG2 . THR A 1 15 ? 4.075 76.506 32.352 1.00 22.45 ? 15 THR A CG2 1 ATOM 96 N N . GLY A 1 16 ? 1.063 77.963 32.085 1.00 13.35 ? 16 GLY A N 1 ATOM 97 C CA . GLY A 1 16 ? 0.184 78.591 33.048 1.00 13.35 ? 16 GLY A CA 1 ATOM 98 C C . GLY A 1 16 ? -0.048 77.719 34.265 1.00 13.35 ? 16 GLY A C 1 ATOM 99 O O . GLY A 1 16 ? -0.199 76.501 34.148 1.00 13.35 ? 16 GLY A O 1 ATOM 100 N N . LEU A 1 17 ? -0.077 78.345 35.438 1.00 23.08 ? 17 LEU A N 1 ATOM 101 C CA . LEU A 1 17 ? -0.300 77.633 36.688 1.00 23.08 ? 17 LEU A CA 1 ATOM 102 C C . LEU A 1 17 ? -1.598 78.148 37.295 1.00 23.08 ? 17 LEU A C 1 ATOM 103 O O . LEU A 1 17 ? -1.755 79.347 37.477 1.00 23.08 ? 17 LEU A O 1 ATOM 104 C CB . LEU A 1 17 ? 0.860 77.891 37.646 1.00 11.56 ? 17 LEU A CB 1 ATOM 105 C CG . LEU A 1 17 ? 2.265 77.562 37.136 1.00 11.56 ? 17 LEU A CG 1 ATOM 106 C CD1 . LEU A 1 17 ? 3.285 78.053 38.142 1.00 11.56 ? 17 LEU A CD1 1 ATOM 107 C CD2 . LEU A 1 17 ? 2.412 76.070 36.913 1.00 11.56 ? 17 LEU A CD2 1 ATOM 108 N N . SER A 1 18 ? -2.522 77.249 37.615 1.00 22.49 ? 18 SER A N 1 ATOM 109 C CA . SER A 1 18 ? -3.801 77.658 38.175 1.00 22.49 ? 18 SER A CA 1 ATOM 110 C C . SER A 1 18 ? -3.700 78.228 39.579 1.00 30.27 ? 18 SER A C 1 ATOM 111 O O . SER A 1 18 ? -4.546 79.018 39.978 1.00 27.19 ? 18 SER A O 1 ATOM 112 C CB . SER A 1 18 ? -4.786 76.490 38.176 1.00 31.69 ? 18 SER A CB 1 ATOM 113 O OG . SER A 1 18 ? -4.510 75.588 39.228 1.00 31.69 ? 18 SER A OG 1 ATOM 114 N N . LYS A 1 19 ? -2.681 77.823 40.334 1.00 36.95 ? 19 LYS A N 1 ATOM 115 C CA . LYS A 1 19 ? -2.490 78.324 41.701 1.00 38.68 ? 19 LYS A CA 1 ATOM 116 C C . LYS A 1 19 ? -0.990 78.503 41.990 1.00 36.95 ? 19 LYS A C 1 ATOM 117 O O . LYS A 1 19 ? -0.381 77.749 42.754 1.00 39.26 ? 19 LYS A O 1 ATOM 118 C CB . LYS A 1 19 ? -3.137 77.358 42.699 1.00 26.77 ? 19 LYS A CB 1 ATOM 119 C CG . LYS A 1 19 ? -3.014 77.772 44.152 1.00 42.94 ? 19 LYS A CG 1 ATOM 120 C CD . LYS A 1 19 ? -3.745 76.807 45.085 1.00 44.23 ? 19 LYS A CD 1 ATOM 121 C CE . LYS A 1 19 ? -5.233 77.086 45.127 1.00 54.12 ? 19 LYS A CE 1 ATOM 122 N NZ . LYS A 1 19 ? -5.819 77.099 43.761 1.00 67.49 ? 19 LYS A NZ 1 ATOM 123 N N . HIS A 1 20 ? -0.406 79.518 41.363 1.00 21.83 ? 20 HIS A N 1 ATOM 124 C CA . HIS A 1 20 ? 1.018 79.801 41.493 1.00 20.90 ? 20 HIS A CA 1 ATOM 125 C C . HIS A 1 20 ? 1.458 80.255 42.881 1.00 26.82 ? 20 HIS A C 1 ATOM 126 O O . HIS A 1 20 ? 0.754 80.992 43.567 1.00 20.90 ? 20 HIS A O 1 ATOM 127 C CB . HIS A 1 20 ? 1.426 80.869 40.473 1.00 25.96 ? 20 HIS A CB 1 ATOM 128 C CG . HIS A 1 20 ? 1.081 82.265 40.896 1.00 32.85 ? 20 HIS A CG 1 ATOM 129 N ND1 . HIS A 1 20 ? 1.790 82.944 41.863 1.00 41.02 ? 20 HIS A ND1 1 ATOM 130 C CD2 . HIS A 1 20 ? 0.070 83.086 40.527 1.00 37.64 ? 20 HIS A CD2 1 ATOM 131 C CE1 . HIS A 1 20 ? 1.231 84.122 42.072 1.00 42.87 ? 20 HIS A CE1 1 ATOM 132 N NE2 . HIS A 1 20 ? 0.185 84.233 41.274 1.00 39.85 ? 20 HIS A NE2 1 ATOM 133 N N . VAL A 1 21 ? 2.653 79.822 43.265 1.00 25.95 ? 21 VAL A N 1 ATOM 134 C CA . VAL A 1 21 ? 3.247 80.169 44.549 1.00 27.87 ? 21 VAL A CA 1 ATOM 135 C C . VAL A 1 21 ? 4.027 81.470 44.416 1.00 30.26 ? 21 VAL A C 1 ATOM 136 O O . VAL A 1 21 ? 4.246 81.967 43.306 1.00 24.21 ? 21 VAL A O 1 ATOM 137 C CB . VAL A 1 21 ? 4.231 79.075 45.031 1.00 8.97 ? 21 VAL A CB 1 ATOM 138 C CG1 . VAL A 1 21 ? 3.541 77.728 45.045 1.00 8.97 ? 21 VAL A CG1 1 ATOM 139 C CG2 . VAL A 1 21 ? 5.457 79.032 44.127 1.00 10.91 ? 21 VAL A CG2 1 ATOM 140 N N . GLU A 1 22 ? 4.466 81.998 45.553 1.00 44.47 ? 22 GLU A N 1 ATOM 141 C CA . GLU A 1 22 ? 5.228 83.243 45.599 1.00 46.56 ? 22 GLU A CA 1 ATOM 142 C C . GLU A 1 22 ? 6.435 83.255 44.665 1.00 34.17 ? 22 GLU A C 1 ATOM 143 O O . GLU A 1 22 ? 7.174 82.276 44.568 1.00 43.74 ? 22 GLU A O 1 ATOM 144 C CB . GLU A 1 22 ? 5.713 83.505 47.028 1.00 124.97 ? 22 GLU A CB 1 ATOM 145 C CG . GLU A 1 22 ? 4.611 83.542 48.068 1.00 153.64 ? 22 GLU A CG 1 ATOM 146 C CD . GLU A 1 22 ? 3.611 84.649 47.813 1.00 165.15 ? 22 GLU A CD 1 ATOM 147 O OE1 . GLU A 1 22 ? 4.027 85.826 47.777 1.00 171.49 ? 22 GLU A OE1 1 ATOM 148 O OE2 . GLU A 1 22 ? 2.411 84.343 47.650 1.00 171.92 ? 22 GLU A OE2 1 ATOM 149 N N . ASP A 1 23 ? 6.628 84.380 43.991 1.00 35.82 ? 23 ASP A N 1 ATOM 150 C CA . ASP A 1 23 ? 7.754 84.565 43.084 1.00 40.67 ? 23 ASP A CA 1 ATOM 151 C C . ASP A 1 23 ? 7.704 83.759 41.807 1.00 36.92 ? 23 ASP A C 1 ATOM 152 O O . ASP A 1 23 ? 8.674 83.738 41.049 1.00 38.51 ? 23 ASP A O 1 ATOM 153 C CB . ASP A 1 23 ? 9.069 84.290 43.806 1.00 81.61 ? 23 ASP A CB 1 ATOM 154 C CG . ASP A 1 23 ? 9.378 85.339 44.841 1.00 98.23 ? 23 ASP A CG 1 ATOM 155 O OD1 . ASP A 1 23 ? 9.466 86.524 44.458 1.00 95.92 ? 23 ASP A OD1 1 ATOM 156 O OD2 . ASP A 1 23 ? 9.528 84.985 46.030 1.00 102.61 ? 23 ASP A OD2 1 ATOM 157 N N . VAL A 1 24 ? 6.581 83.093 41.565 1.00 33.97 ? 24 VAL A N 1 ATOM 158 C CA . VAL A 1 24 ? 6.434 82.329 40.338 1.00 26.46 ? 24 VAL A CA 1 ATOM 159 C C . VAL A 1 24 ? 5.233 82.858 39.574 1.00 26.46 ? 24 VAL A C 1 ATOM 160 O O . VAL A 1 24 ? 4.091 82.669 40.008 1.00 26.46 ? 24 VAL A O 1 ATOM 161 C CB . VAL A 1 24 ? 6.202 80.841 40.603 1.00 22.48 ? 24 VAL A CB 1 ATOM 162 C CG1 . VAL A 1 24 ? 6.189 80.084 39.267 1.00 22.48 ? 24 VAL A CG1 1 ATOM 163 C CG2 . VAL A 1 24 ? 7.278 80.300 41.538 1.00 22.48 ? 24 VAL A CG2 1 ATOM 164 N N . PRO A 1 25 ? 5.471 83.538 38.435 1.00 25.55 ? 25 PRO A N 1 ATOM 165 C CA . PRO A 1 25 ? 4.379 84.089 37.623 1.00 25.55 ? 25 PRO A CA 1 ATOM 166 C C . PRO A 1 25 ? 3.372 83.024 37.223 1.00 25.55 ? 25 PRO A C 1 ATOM 167 O O . PRO A 1 25 ? 3.750 81.899 36.919 1.00 25.55 ? 25 PRO A O 1 ATOM 168 C CB . PRO A 1 25 ? 5.109 84.703 36.420 1.00 13.36 ? 25 PRO A CB 1 ATOM 169 C CG . PRO A 1 25 ? 6.407 83.970 36.385 1.00 25.72 ? 25 PRO A CG 1 ATOM 170 C CD . PRO A 1 25 ? 6.770 83.865 37.831 1.00 13.36 ? 25 PRO A CD 1 ATOM 171 N N . ALA A 1 26 ? 2.093 83.381 37.234 1.00 30.61 ? 26 ALA A N 1 ATOM 172 C CA . ALA A 1 26 ? 1.043 82.438 36.875 1.00 30.61 ? 26 ALA A CA 1 ATOM 173 C C . ALA A 1 26 ? 1.098 82.056 35.403 1.00 30.61 ? 26 ALA A C 1 ATOM 174 O O . ALA A 1 26 ? 0.621 80.989 35.016 1.00 30.61 ? 26 ALA A O 1 ATOM 175 C CB . ALA A 1 26 ? -0.312 83.023 37.197 1.00 6.45 ? 26 ALA A CB 1 ATOM 176 N N . PHE A 1 27 ? 1.669 82.936 34.587 1.00 22.14 ? 27 PHE A N 1 ATOM 177 C CA . PHE A 1 27 ? 1.790 82.698 33.159 1.00 22.14 ? 27 PHE A CA 1 ATOM 178 C C . PHE A 1 27 ? 3.155 83.141 32.655 1.00 22.14 ? 27 PHE A C 1 ATOM 179 O O . PHE A 1 27 ? 3.703 84.156 33.098 1.00 22.14 ? 27 PHE A O 1 ATOM 180 C CB . PHE A 1 27 ? 0.710 83.460 32.403 1.00 21.56 ? 27 PHE A CB 1 ATOM 181 C CG . PHE A 1 27 ? 0.765 83.269 30.921 1.00 21.56 ? 27 PHE A CG 1 ATOM 182 C CD1 . PHE A 1 27 ? 0.131 82.184 30.321 1.00 21.56 ? 27 PHE A CD1 1 ATOM 183 C CD2 . PHE A 1 27 ? 1.473 84.161 30.119 1.00 21.56 ? 27 PHE A CD2 1 ATOM 184 C CE1 . PHE A 1 27 ? 0.201 81.985 28.931 1.00 21.56 ? 27 PHE A CE1 1 ATOM 185 C CE2 . PHE A 1 27 ? 1.550 83.972 28.728 1.00 21.56 ? 27 PHE A CE2 1 ATOM 186 C CZ . PHE A 1 27 ? 0.912 82.882 28.135 1.00 21.56 ? 27 PHE A CZ 1 ATOM 187 N N . GLN A 1 28 ? 3.697 82.358 31.730 1.00 11.45 ? 28 GLN A N 1 ATOM 188 C CA . GLN A 1 28 ? 4.990 82.635 31.129 1.00 11.45 ? 28 GLN A CA 1 ATOM 189 C C . GLN A 1 28 ? 4.951 82.213 29.687 1.00 11.45 ? 28 GLN A C 1 ATOM 190 O O . GLN A 1 28 ? 4.313 81.216 29.328 1.00 11.45 ? 28 GLN A O 1 ATOM 191 C CB . GLN A 1 28 ? 6.106 81.886 31.850 1.00 21.78 ? 28 GLN A CB 1 ATOM 192 C CG . GLN A 1 28 ? 6.590 82.622 33.063 1.00 26.84 ? 28 GLN A CG 1 ATOM 193 C CD . GLN A 1 28 ? 7.458 81.783 33.953 1.00 33.42 ? 28 GLN A CD 1 ATOM 194 O OE1 . GLN A 1 28 ? 6.963 81.003 34.766 1.00 39.04 ? 28 GLN A OE1 1 ATOM 195 N NE2 . GLN A 1 28 ? 8.766 81.930 33.806 1.00 31.14 ? 28 GLN A NE2 1 ATOM 196 N N . ALA A 1 29 ? 5.641 82.991 28.864 1.00 15.76 ? 29 ALA A N 1 ATOM 197 C CA . ALA A 1 29 ? 5.711 82.745 27.440 1.00 15.76 ? 29 ALA A CA 1 ATOM 198 C C . ALA A 1 29 ? 7.147 82.927 26.978 1.00 15.76 ? 29 ALA A C 1 ATOM 199 O O . ALA A 1 29 ? 7.877 83.746 27.527 1.00 15.76 ? 29 ALA A O 1 ATOM 200 C CB . ALA A 1 29 ? 4.804 83.715 26.719 1.00 29.18 ? 29 ALA A CB 1 ATOM 201 N N . LEU A 1 30 ? 7.559 82.148 25.986 1.00 10.68 ? 30 LEU A N 1 ATOM 202 C CA . LEU A 1 30 ? 8.907 82.267 25.459 1.00 10.68 ? 30 LEU A CA 1 ATOM 203 C C . LEU A 1 30 ? 8.904 81.776 24.030 1.00 10.68 ? 30 LEU A C 1 ATOM 204 O O . LEU A 1 30 ? 8.039 80.974 23.650 1.00 10.68 ? 30 LEU A O 1 ATOM 205 C CB . LEU A 1 30 ? 9.894 81.455 26.302 1.00 13.26 ? 30 LEU A CB 1 ATOM 206 C CG . LEU A 1 30 ? 9.773 79.937 26.409 1.00 22.03 ? 30 LEU A CG 1 ATOM 207 C CD1 . LEU A 1 30 ? 10.293 79.255 25.148 1.00 22.59 ? 30 LEU A CD1 1 ATOM 208 C CD2 . LEU A 1 30 ? 10.575 79.497 27.602 1.00 21.70 ? 30 LEU A CD2 1 ATOM 209 N N . GLY A 1 31 ? 9.862 82.254 23.238 1.00 23.83 ? 31 GLY A N 1 ATOM 210 C CA . GLY A 1 31 ? 9.924 81.852 21.845 1.00 23.83 ? 31 GLY A CA 1 ATOM 211 C C . GLY A 1 31 ? 11.336 81.600 21.371 1.00 23.83 ? 31 GLY A C 1 ATOM 212 O O . GLY A 1 31 ? 12.252 82.354 21.697 1.00 23.83 ? 31 GLY A O 1 ATOM 213 N N . SER A 1 32 ? 11.511 80.545 20.585 1.00 26.07 ? 32 SER A N 1 ATOM 214 C CA . SER A 1 32 ? 12.831 80.199 20.094 1.00 26.07 ? 32 SER A CA 1 ATOM 215 C C . SER A 1 32 ? 12.959 80.171 18.594 1.00 26.07 ? 32 SER A C 1 ATOM 216 O O . SER A 1 32 ? 12.012 79.855 17.878 1.00 26.07 ? 32 SER A O 1 ATOM 217 C CB . SER A 1 32 ? 13.260 78.837 20.634 1.00 54.88 ? 32 SER A CB 1 ATOM 218 O OG . SER A 1 32 ? 13.470 78.883 22.031 1.00 60.62 ? 32 SER A OG 1 ATOM 219 N N . LEU A 1 33 ? 14.156 80.527 18.143 1.00 23.64 ? 33 LEU A N 1 ATOM 220 C CA . LEU A 1 33 ? 14.534 80.516 16.739 1.00 23.64 ? 33 LEU A CA 1 ATOM 221 C C . LEU A 1 33 ? 15.672 79.509 16.746 1.00 23.64 ? 33 LEU A C 1 ATOM 222 O O . LEU A 1 33 ? 16.743 79.739 17.323 1.00 23.64 ? 33 LEU A O 1 ATOM 223 C CB . LEU A 1 33 ? 15.002 81.896 16.275 1.00 34.98 ? 33 LEU A CB 1 ATOM 224 C CG . LEU A 1 33 ? 13.816 82.826 16.029 1.00 34.98 ? 33 LEU A CG 1 ATOM 225 C CD1 . LEU A 1 33 ? 14.274 84.197 15.591 1.00 34.98 ? 33 LEU A CD1 1 ATOM 226 C CD2 . LEU A 1 33 ? 12.939 82.205 14.969 1.00 34.98 ? 33 LEU A CD2 1 ATOM 227 N N . ASN A 1 34 ? 15.406 78.371 16.121 1.00 22.26 ? 34 ASN A N 1 ATOM 228 C CA . ASN A 1 34 ? 16.354 77.292 16.100 1.00 22.26 ? 34 ASN A CA 1 ATOM 229 C C . ASN A 1 34 ? 16.752 77.041 17.544 1.00 22.26 ? 34 ASN A C 1 ATOM 230 O O . ASN A 1 34 ? 15.886 76.905 18.400 1.00 22.26 ? 34 ASN A O 1 ATOM 231 C CB . ASN A 1 34 ? 17.550 77.646 15.228 1.00 20.79 ? 34 ASN A CB 1 ATOM 232 C CG . ASN A 1 34 ? 17.232 77.530 13.755 1.00 28.69 ? 34 ASN A CG 1 ATOM 233 O OD1 . ASN A 1 34 ? 16.156 77.068 13.379 1.00 23.40 ? 34 ASN A OD1 1 ATOM 234 N ND2 . ASN A 1 34 ? 18.169 77.939 12.910 1.00 21.90 ? 34 ASN A ND2 1 ATOM 235 N N . ASP A 1 35 ? 18.046 77.019 17.832 1.00 18.97 ? 35 ASP A N 1 ATOM 236 C CA . ASP A 1 35 ? 18.511 76.726 19.182 1.00 18.97 ? 35 ASP A CA 1 ATOM 237 C C . ASP A 1 35 ? 18.624 77.913 20.136 1.00 18.97 ? 35 ASP A C 1 ATOM 238 O O . ASP A 1 35 ? 19.190 77.779 21.222 1.00 18.97 ? 35 ASP A O 1 ATOM 239 C CB . ASP A 1 35 ? 19.858 76.022 19.084 1.00 26.44 ? 35 ASP A CB 1 ATOM 240 C CG . ASP A 1 35 ? 20.925 76.914 18.496 1.00 31.49 ? 35 ASP A CG 1 ATOM 241 O OD1 . ASP A 1 35 ? 20.575 77.796 17.679 1.00 26.44 ? 35 ASP A OD1 1 ATOM 242 O OD2 . ASP A 1 35 ? 22.113 76.736 18.842 1.00 26.44 ? 35 ASP A OD2 1 ATOM 243 N N . LEU A 1 36 ? 18.080 79.064 19.760 1.00 10.90 ? 36 LEU A N 1 ATOM 244 C CA . LEU A 1 36 ? 18.192 80.232 20.637 1.00 10.90 ? 36 LEU A CA 1 ATOM 245 C C . LEU A 1 36 ? 16.849 80.827 21.040 1.00 10.90 ? 36 LEU A C 1 ATOM 246 O O . LEU A 1 36 ? 15.920 80.884 20.236 1.00 10.90 ? 36 LEU A O 1 ATOM 247 C CB . LEU A 1 36 ? 19.034 81.314 19.958 1.00 19.62 ? 36 LEU A CB 1 ATOM 248 C CG . LEU A 1 36 ? 20.348 80.796 19.378 1.00 19.62 ? 36 LEU A CG 1 ATOM 249 C CD1 . LEU A 1 36 ? 20.897 81.829 18.445 1.00 19.62 ? 36 LEU A CD1 1 ATOM 250 C CD2 . LEU A 1 36 ? 21.343 80.463 20.471 1.00 19.62 ? 36 LEU A CD2 1 ATOM 251 N N . GLN A 1 37 ? 16.739 81.245 22.296 1.00 19.33 ? 37 GLN A N 1 ATOM 252 C CA . GLN A 1 37 ? 15.507 81.853 22.751 1.00 19.33 ? 37 GLN A CA 1 ATOM 253 C C . GLN A 1 37 ? 15.680 83.320 22.447 1.00 19.33 ? 37 GLN A C 1 ATOM 254 O O . GLN A 1 37 ? 16.673 83.932 22.851 1.00 19.33 ? 37 GLN A O 1 ATOM 255 C CB . GLN A 1 37 ? 15.297 81.635 24.244 1.00 17.04 ? 37 GLN A CB 1 ATOM 256 C CG . GLN A 1 37 ? 14.116 82.404 24.799 1.00 17.04 ? 37 GLN A CG 1 ATOM 257 C CD . GLN A 1 37 ? 13.722 81.973 26.201 1.00 29.22 ? 37 GLN A CD 1 ATOM 258 O OE1 . GLN A 1 37 ? 12.938 82.643 26.878 1.00 22.28 ? 37 GLN A OE1 1 ATOM 259 N NE2 . GLN A 1 37 ? 14.253 80.843 26.640 1.00 21.05 ? 37 GLN A NE2 1 ATOM 260 N N . PHE A 1 38 ? 14.719 83.880 21.723 1.00 32.14 ? 38 PHE A N 1 ATOM 261 C CA . PHE A 1 38 ? 14.784 85.275 21.327 1.00 32.14 ? 38 PHE A CA 1 ATOM 262 C C . PHE A 1 38 ? 13.851 86.187 22.086 1.00 32.14 ? 38 PHE A C 1 ATOM 263 O O . PHE A 1 38 ? 13.879 87.392 21.871 1.00 32.14 ? 38 PHE A O 1 ATOM 264 C CB . PHE A 1 38 ? 14.476 85.407 19.842 1.00 26.99 ? 38 PHE A CB 1 ATOM 265 C CG . PHE A 1 38 ? 13.022 85.219 19.504 1.00 26.99 ? 38 PHE A CG 1 ATOM 266 C CD1 . PHE A 1 38 ? 12.113 86.267 19.666 1.00 26.99 ? 38 PHE A CD1 1 ATOM 267 C CD2 . PHE A 1 38 ? 12.560 83.996 19.016 1.00 26.99 ? 38 PHE A CD2 1 ATOM 268 C CE1 . PHE A 1 38 ? 10.771 86.104 19.346 1.00 26.99 ? 38 PHE A CE1 1 ATOM 269 C CE2 . PHE A 1 38 ? 11.210 83.824 18.691 1.00 26.99 ? 38 PHE A CE2 1 ATOM 270 C CZ . PHE A 1 38 ? 10.314 84.883 18.856 1.00 26.99 ? 38 PHE A CZ 1 ATOM 271 N N . PHE A 1 39 ? 13.009 85.639 22.951 1.00 26.25 ? 39 PHE A N 1 ATOM 272 C CA . PHE A 1 39 ? 12.093 86.495 23.688 1.00 26.25 ? 39 PHE A CA 1 ATOM 273 C C . PHE A 1 39 ? 11.410 85.812 24.863 1.00 26.25 ? 39 PHE A C 1 ATOM 274 O O . PHE A 1 39 ? 11.436 84.595 24.986 1.00 26.25 ? 39 PHE A O 1 ATOM 275 C CB . PHE A 1 39 ? 11.041 87.069 22.728 1.00 24.50 ? 39 PHE A CB 1 ATOM 276 C CG . PHE A 1 39 ? 9.652 86.527 22.941 1.00 24.13 ? 39 PHE A CG 1 ATOM 277 C CD1 . PHE A 1 39 ? 9.284 85.284 22.426 1.00 24.13 ? 39 PHE A CD1 1 ATOM 278 C CD2 . PHE A 1 39 ? 8.714 87.258 23.680 1.00 24.13 ? 39 PHE A CD2 1 ATOM 279 C CE1 . PHE A 1 39 ? 8.001 84.773 22.643 1.00 24.13 ? 39 PHE A CE1 1 ATOM 280 C CE2 . PHE A 1 39 ? 7.433 86.759 23.904 1.00 25.78 ? 39 PHE A CE2 1 ATOM 281 C CZ . PHE A 1 39 ? 7.073 85.511 23.384 1.00 24.13 ? 39 PHE A CZ 1 ATOM 282 N N . ARG A 1 40 ? 10.796 86.611 25.727 1.00 17.63 ? 40 ARG A N 1 ATOM 283 C CA . ARG A 1 40 ? 10.100 86.082 26.886 1.00 17.63 ? 40 ARG A CA 1 ATOM 284 C C . ARG A 1 40 ? 9.076 87.070 27.404 1.00 17.63 ? 40 ARG A C 1 ATOM 285 O O . ARG A 1 40 ? 9.221 88.271 27.231 1.00 17.63 ? 40 ARG A O 1 ATOM 286 C CB . ARG A 1 40 ? 11.096 85.741 27.996 1.00 30.44 ? 40 ARG A CB 1 ATOM 287 C CG . ARG A 1 40 ? 11.949 86.904 28.466 1.00 36.85 ? 40 ARG A CG 1 ATOM 288 C CD . ARG A 1 40 ? 11.546 87.374 29.851 1.00 43.68 ? 40 ARG A CD 1 ATOM 289 N NE . ARG A 1 40 ? 12.488 88.357 30.393 1.00 53.21 ? 40 ARG A NE 1 ATOM 290 C CZ . ARG A 1 40 ? 13.731 88.081 30.783 1.00 65.06 ? 40 ARG A CZ 1 ATOM 291 N NH1 . ARG A 1 40 ? 14.204 86.845 30.697 1.00 64.17 ? 40 ARG A NH1 1 ATOM 292 N NH2 . ARG A 1 40 ? 14.502 89.046 31.264 1.00 68.40 ? 40 ARG A NH2 1 ATOM 293 N N . TYR A 1 41 ? 8.031 86.546 28.026 1.00 8.25 ? 41 TYR A N 1 ATOM 294 C CA . TYR A 1 41 ? 6.969 87.352 28.595 1.00 8.25 ? 41 TYR A CA 1 ATOM 295 C C . TYR A 1 41 ? 6.403 86.651 29.839 1.00 8.25 ? 41 TYR A C 1 ATOM 296 O O . TYR A 1 41 ? 6.419 85.429 29.931 1.00 8.25 ? 41 TYR A O 1 ATOM 297 C CB . TYR A 1 41 ? 5.860 87.559 27.553 1.00 26.35 ? 41 TYR A CB 1 ATOM 298 C CG . TYR A 1 41 ? 4.554 88.083 28.124 1.00 26.35 ? 41 TYR A CG 1 ATOM 299 C CD1 . TYR A 1 41 ? 3.655 87.226 28.776 1.00 26.35 ? 41 TYR A CD1 1 ATOM 300 C CD2 . TYR A 1 41 ? 4.217 89.433 28.027 1.00 26.35 ? 41 TYR A CD2 1 ATOM 301 C CE1 . TYR A 1 41 ? 2.457 87.698 29.315 1.00 26.35 ? 41 TYR A CE1 1 ATOM 302 C CE2 . TYR A 1 41 ? 3.012 89.920 28.565 1.00 26.35 ? 41 TYR A CE2 1 ATOM 303 C CZ . TYR A 1 41 ? 2.139 89.043 29.207 1.00 26.35 ? 41 TYR A CZ 1 ATOM 304 O OH . TYR A 1 41 ? 0.957 89.515 29.733 1.00 26.35 ? 41 TYR A OH 1 ATOM 305 N N . ASN A 1 42 ? 5.923 87.410 30.812 1.00 21.08 ? 42 ASN A N 1 ATOM 306 C CA . ASN A 1 42 ? 5.322 86.770 31.969 1.00 21.08 ? 42 ASN A CA 1 ATOM 307 C C . ASN A 1 42 ? 4.230 87.660 32.547 1.00 21.08 ? 42 ASN A C 1 ATOM 308 O O . ASN A 1 42 ? 4.149 88.844 32.234 1.00 21.08 ? 42 ASN A O 1 ATOM 309 C CB . ASN A 1 42 ? 6.384 86.408 33.014 1.00 26.75 ? 42 ASN A CB 1 ATOM 310 C CG . ASN A 1 42 ? 6.819 87.580 33.845 1.00 31.19 ? 42 ASN A CG 1 ATOM 311 O OD1 . ASN A 1 42 ? 6.024 88.181 34.563 1.00 31.51 ? 42 ASN A OD1 1 ATOM 312 N ND2 . ASN A 1 42 ? 8.096 87.906 33.765 1.00 30.48 ? 42 ASN A ND2 1 ATOM 313 N N . SER A 1 43 ? 3.373 87.078 33.369 1.00 33.74 ? 43 SER A N 1 ATOM 314 C CA . SER A 1 43 ? 2.264 87.812 33.956 1.00 33.74 ? 43 SER A CA 1 ATOM 315 C C . SER A 1 43 ? 2.646 88.790 35.075 1.00 38.82 ? 43 SER A C 1 ATOM 316 O O . SER A 1 43 ? 1.786 89.484 35.617 1.00 36.96 ? 43 SER A O 1 ATOM 317 C CB . SER A 1 43 ? 1.227 86.816 34.466 1.00 32.70 ? 43 SER A CB 1 ATOM 318 O OG . SER A 1 43 ? 1.817 85.937 35.411 1.00 32.70 ? 43 SER A OG 1 ATOM 319 N N . LYS A 1 44 ? 3.922 88.852 35.434 1.00 16.85 ? 44 LYS A N 1 ATOM 320 C CA . LYS A 1 44 ? 4.330 89.775 36.481 1.00 28.56 ? 44 LYS A CA 1 ATOM 321 C C . LYS A 1 44 ? 4.683 91.121 35.854 1.00 27.05 ? 44 LYS A C 1 ATOM 322 O O . LYS A 1 44 ? 3.951 92.096 36.002 1.00 28.80 ? 44 LYS A O 1 ATOM 323 C CB . LYS A 1 44 ? 5.529 89.230 37.252 1.00 34.25 ? 44 LYS A CB 1 ATOM 324 C CG . LYS A 1 44 ? 5.887 90.070 38.464 1.00 49.47 ? 44 LYS A CG 1 ATOM 325 C CD . LYS A 1 44 ? 7.392 90.117 38.665 1.00 58.48 ? 44 LYS A CD 1 ATOM 326 C CE . LYS A 1 44 ? 7.784 91.022 39.826 1.00 66.84 ? 44 LYS A CE 1 ATOM 327 N NZ . LYS A 1 44 ? 9.266 91.180 39.912 1.00 64.80 ? 44 LYS A NZ 1 ATOM 328 N N . ASP A 1 45 ? 5.802 91.162 35.141 1.00 26.54 ? 45 ASP A N 1 ATOM 329 C CA . ASP A 1 45 ? 6.257 92.379 34.489 1.00 28.21 ? 45 ASP A CA 1 ATOM 330 C C . ASP A 1 45 ? 5.361 92.719 33.308 1.00 32.89 ? 45 ASP A C 1 ATOM 331 O O . ASP A 1 45 ? 5.411 93.829 32.782 1.00 25.40 ? 45 ASP A O 1 ATOM 332 C CB . ASP A 1 45 ? 7.695 92.202 34.027 1.00 46.72 ? 45 ASP A CB 1 ATOM 333 C CG . ASP A 1 45 ? 8.560 91.568 35.089 1.00 59.97 ? 45 ASP A CG 1 ATOM 334 O OD1 . ASP A 1 45 ? 8.522 92.042 36.247 1.00 56.79 ? 45 ASP A OD1 1 ATOM 335 O OD2 . ASP A 1 45 ? 9.273 90.595 34.768 1.00 68.26 ? 45 ASP A OD2 1 ATOM 336 N N . ARG A 1 46 ? 4.555 91.744 32.888 1.00 34.94 ? 46 ARG A N 1 ATOM 337 C CA . ARG A 1 46 ? 3.600 91.911 31.794 1.00 31.07 ? 46 ARG A CA 1 ATOM 338 C C . ARG A 1 46 ? 4.182 92.505 30.501 1.00 34.04 ? 46 ARG A C 1 ATOM 339 O O . ARG A 1 46 ? 3.462 93.206 29.779 1.00 32.15 ? 46 ARG A O 1 ATOM 340 C CB . ARG A 1 46 ? 2.470 92.805 32.282 1.00 52.81 ? 46 ARG A CB 1 ATOM 341 C CG . ARG A 1 46 ? 1.095 92.355 31.907 1.00 67.44 ? 46 ARG A CG 1 ATOM 342 C CD . ARG A 1 46 ? 0.547 91.384 32.918 1.00 68.54 ? 46 ARG A CD 1 ATOM 343 N NE . ARG A 1 46 ? -0.871 91.144 32.674 1.00 69.40 ? 46 ARG A NE 1 ATOM 344 C CZ . ARG A 1 46 ? -1.605 90.252 33.330 1.00 78.08 ? 46 ARG A CZ 1 ATOM 345 N NH1 . ARG A 1 46 ? -1.057 89.506 34.281 1.00 55.52 ? 46 ARG A NH1 1 ATOM 346 N NH2 . ARG A 1 46 ? -2.888 90.102 33.024 1.00 85.11 ? 46 ARG A NH2 1 ATOM 347 N N . LYS A 1 47 ? 5.454 92.214 30.196 1.00 30.93 ? 47 LYS A N 1 ATOM 348 C CA . LYS A 1 47 ? 6.103 92.775 28.997 1.00 33.87 ? 47 LYS A CA 1 ATOM 349 C C . LYS A 1 47 ? 6.846 91.811 28.058 1.00 35.27 ? 47 LYS A C 1 ATOM 350 O O . LYS A 1 47 ? 7.592 90.944 28.501 1.00 31.22 ? 47 LYS A O 1 ATOM 351 C CB . LYS A 1 47 ? 7.083 93.890 29.415 1.00 55.67 ? 47 LYS A CB 1 ATOM 352 C CG . LYS A 1 47 ? 6.441 95.042 30.172 1.00 60.55 ? 47 LYS A CG 1 ATOM 353 C CD . LYS A 1 47 ? 5.324 95.668 29.339 1.00 74.13 ? 47 LYS A CD 1 ATOM 354 C CE . LYS A 1 47 ? 4.262 96.355 30.199 1.00 78.74 ? 47 LYS A CE 1 ATOM 355 N NZ . LYS A 1 47 ? 3.036 96.693 29.403 1.00 74.99 ? 47 LYS A NZ 1 ATOM 356 N N . SER A 1 48 ? 6.649 91.983 26.754 1.00 28.96 ? 48 SER A N 1 ATOM 357 C CA . SER A 1 48 ? 7.329 91.154 25.761 1.00 32.56 ? 48 SER A CA 1 ATOM 358 C C . SER A 1 48 ? 8.747 91.675 25.606 1.00 35.41 ? 48 SER A C 1 ATOM 359 O O . SER A 1 48 ? 8.953 92.765 25.065 1.00 35.34 ? 48 SER A O 1 ATOM 360 C CB . SER A 1 48 ? 6.626 91.236 24.410 1.00 26.95 ? 48 SER A CB 1 ATOM 361 O OG . SER A 1 48 ? 5.848 90.082 24.179 1.00 35.41 ? 48 SER A OG 1 ATOM 362 N N . GLN A 1 49 ? 9.726 90.897 26.055 1.00 33.75 ? 49 GLN A N 1 ATOM 363 C CA . GLN A 1 49 ? 11.112 91.340 25.978 1.00 37.38 ? 49 GLN A CA 1 ATOM 364 C C . GLN A 1 49 ? 12.037 90.495 25.120 1.00 37.36 ? 49 GLN A C 1 ATOM 365 O O . GLN A 1 49 ? 12.073 89.267 25.240 1.00 35.44 ? 49 GLN A O 1 ATOM 366 C CB . GLN A 1 49 ? 11.708 91.421 27.381 1.00 51.87 ? 49 GLN A CB 1 ATOM 367 C CG . GLN A 1 49 ? 10.764 91.991 28.407 1.00 63.38 ? 49 GLN A CG 1 ATOM 368 C CD . GLN A 1 49 ? 11.423 92.179 29.750 1.00 71.09 ? 49 GLN A CD 1 ATOM 369 O OE1 . GLN A 1 49 ? 12.005 91.245 30.307 1.00 76.90 ? 49 GLN A OE1 1 ATOM 370 N NE2 . GLN A 1 49 ? 11.335 93.390 30.285 1.00 73.76 ? 49 GLN A NE2 1 ATOM 371 N N . PRO A 1 50 ? 12.798 91.147 24.230 1.00 33.09 ? 50 PRO A N 1 ATOM 372 C CA . PRO A 1 50 ? 13.737 90.421 23.366 1.00 32.97 ? 50 PRO A CA 1 ATOM 373 C C . PRO A 1 50 ? 14.866 89.889 24.239 1.00 32.97 ? 50 PRO A C 1 ATOM 374 O O . PRO A 1 50 ? 15.088 90.394 25.340 1.00 32.97 ? 50 PRO A O 1 ATOM 375 C CB . PRO A 1 50 ? 14.213 91.493 22.385 1.00 18.51 ? 50 PRO A CB 1 ATOM 376 C CG . PRO A 1 50 ? 14.012 92.782 23.154 1.00 22.88 ? 50 PRO A CG 1 ATOM 377 C CD . PRO A 1 50 ? 12.686 92.558 23.823 1.00 20.01 ? 50 PRO A CD 1 ATOM 378 N N . MET A 1 51 ? 15.577 88.879 23.751 1.00 18.14 ? 51 MET A N 1 ATOM 379 C CA . MET A 1 51 ? 16.662 88.278 24.513 1.00 18.14 ? 51 MET A CA 1 ATOM 380 C C . MET A 1 51 ? 17.924 88.000 23.709 1.00 18.41 ? 51 MET A C 1 ATOM 381 O O . MET A 1 51 ? 17.939 88.104 22.481 1.00 18.14 ? 51 MET A O 1 ATOM 382 C CB . MET A 1 51 ? 16.181 86.978 25.148 1.00 41.93 ? 51 MET A CB 1 ATOM 383 C CG . MET A 1 51 ? 15.210 87.176 26.294 1.00 46.88 ? 51 MET A CG 1 ATOM 384 S SD . MET A 1 51 ? 14.643 85.606 26.940 1.00 62.24 ? 51 MET A SD 1 ATOM 385 C CE . MET A 1 51 ? 15.866 85.282 28.178 1.00 61.45 ? 51 MET A CE 1 ATOM 386 N N . GLY A 1 52 ? 18.988 87.635 24.418 1.00 40.12 ? 52 GLY A N 1 ATOM 387 C CA . GLY A 1 52 ? 20.245 87.334 23.764 1.00 40.12 ? 52 GLY A CA 1 ATOM 388 C C . GLY A 1 52 ? 20.633 88.388 22.754 1.00 40.12 ? 52 GLY A C 1 ATOM 389 O O . GLY A 1 52 ? 20.518 89.588 23.009 1.00 42.26 ? 52 GLY A O 1 ATOM 390 N N . LEU A 1 53 ? 21.087 87.929 21.594 1.00 29.62 ? 53 LEU A N 1 ATOM 391 C CA . LEU A 1 53 ? 21.507 88.813 20.512 1.00 29.73 ? 53 LEU A CA 1 ATOM 392 C C . LEU A 1 53 ? 20.380 89.641 19.888 1.00 37.55 ? 53 LEU A C 1 ATOM 393 O O . LEU A 1 53 ? 20.641 90.593 19.159 1.00 34.50 ? 53 LEU A O 1 ATOM 394 C CB . LEU A 1 53 ? 22.199 87.989 19.422 1.00 12.10 ? 53 LEU A CB 1 ATOM 395 C CG . LEU A 1 53 ? 23.504 87.314 19.869 1.00 18.08 ? 53 LEU A CG 1 ATOM 396 C CD1 . LEU A 1 53 ? 24.096 86.442 18.755 1.00 12.98 ? 53 LEU A CD1 1 ATOM 397 C CD2 . LEU A 1 53 ? 24.480 88.382 20.285 1.00 16.96 ? 53 LEU A CD2 1 ATOM 398 N N . TRP A 1 54 ? 19.131 89.286 20.171 1.00 28.93 ? 54 TRP A N 1 ATOM 399 C CA . TRP A 1 54 ? 17.999 90.016 19.614 1.00 26.71 ? 54 TRP A CA 1 ATOM 400 C C . TRP A 1 54 ? 17.728 91.305 20.355 1.00 25.75 ? 54 TRP A C 1 ATOM 401 O O . TRP A 1 54 ? 16.935 92.128 19.910 1.00 28.71 ? 54 TRP A O 1 ATOM 402 C CB . TRP A 1 54 ? 16.754 89.130 19.605 1.00 28.93 ? 54 TRP A CB 1 ATOM 403 C CG . TRP A 1 54 ? 16.761 88.193 18.456 1.00 28.93 ? 54 TRP A CG 1 ATOM 404 C CD1 . TRP A 1 54 ? 16.470 88.492 17.156 1.00 28.93 ? 54 TRP A CD1 1 ATOM 405 C CD2 . TRP A 1 54 ? 17.179 86.824 18.470 1.00 28.93 ? 54 TRP A CD2 1 ATOM 406 N NE1 . TRP A 1 54 ? 16.687 87.394 16.357 1.00 28.93 ? 54 TRP A NE1 1 ATOM 407 C CE2 . TRP A 1 54 ? 17.123 86.356 17.138 1.00 28.93 ? 54 TRP A CE2 1 ATOM 408 C CE3 . TRP A 1 54 ? 17.599 85.946 19.481 1.00 28.93 ? 54 TRP A CE3 1 ATOM 409 C CZ2 . TRP A 1 54 ? 17.472 85.046 16.785 1.00 28.93 ? 54 TRP A CZ2 1 ATOM 410 C CZ3 . TRP A 1 54 ? 17.946 84.634 19.128 1.00 28.93 ? 54 TRP A CZ3 1 ATOM 411 C CH2 . TRP A 1 54 ? 17.879 84.201 17.790 1.00 28.93 ? 54 TRP A CH2 1 ATOM 412 N N . ARG A 1 55 ? 18.394 91.481 21.487 1.00 28.67 ? 55 ARG A N 1 ATOM 413 C CA . ARG A 1 55 ? 18.234 92.694 22.271 1.00 33.10 ? 55 ARG A CA 1 ATOM 414 C C . ARG A 1 55 ? 18.777 93.908 21.521 1.00 34.00 ? 55 ARG A C 1 ATOM 415 O O . ARG A 1 55 ? 18.321 95.029 21.725 1.00 37.18 ? 55 ARG A O 1 ATOM 416 C CB . ARG A 1 55 ? 18.965 92.546 23.597 1.00 41.35 ? 55 ARG A CB 1 ATOM 417 C CG . ARG A 1 55 ? 18.178 91.804 24.646 1.00 39.94 ? 55 ARG A CG 1 ATOM 418 C CD . ARG A 1 55 ? 19.018 91.589 25.870 1.00 32.75 ? 55 ARG A CD 1 ATOM 419 N NE . ARG A 1 55 ? 20.105 90.659 25.588 1.00 40.92 ? 55 ARG A NE 1 ATOM 420 C CZ . ARG A 1 55 ? 21.143 90.468 26.394 1.00 48.97 ? 55 ARG A CZ 1 ATOM 421 N NH1 . ARG A 1 55 ? 21.224 91.157 27.529 1.00 48.17 ? 55 ARG A NH1 1 ATOM 422 N NH2 . ARG A 1 55 ? 22.087 89.584 26.077 1.00 49.00 ? 55 ARG A NH2 1 ATOM 423 N N . GLN A 1 56 ? 19.748 93.657 20.647 1.00 39.49 ? 56 GLN A N 1 ATOM 424 C CA . GLN A 1 56 ? 20.401 94.686 19.844 1.00 51.28 ? 56 GLN A CA 1 ATOM 425 C C . GLN A 1 56 ? 19.844 94.803 18.430 1.00 52.07 ? 56 GLN A C 1 ATOM 426 O O . GLN A 1 56 ? 20.285 95.655 17.663 1.00 56.23 ? 56 GLN A O 1 ATOM 427 C CB . GLN A 1 56 ? 21.895 94.392 19.734 1.00 79.69 ? 56 GLN A CB 1 ATOM 428 C CG . GLN A 1 56 ? 22.625 94.269 21.053 1.00 95.86 ? 56 GLN A CG 1 ATOM 429 C CD . GLN A 1 56 ? 24.081 93.891 20.857 1.00 108.72 ? 56 GLN A CD 1 ATOM 430 O OE1 . GLN A 1 56 ? 24.390 92.834 20.302 1.00 104.66 ? 56 GLN A OE1 1 ATOM 431 N NE2 . GLN A 1 56 ? 24.986 94.757 21.306 1.00 114.96 ? 56 GLN A NE2 1 ATOM 432 N N . VAL A 1 57 ? 18.901 93.940 18.068 1.00 49.91 ? 57 VAL A N 1 ATOM 433 C CA . VAL A 1 57 ? 18.319 93.989 16.730 1.00 48.65 ? 57 VAL A CA 1 ATOM 434 C C . VAL A 1 57 ? 17.157 94.971 16.751 1.00 56.05 ? 57 VAL A C 1 ATOM 435 O O . VAL A 1 57 ? 16.391 95.003 17.716 1.00 55.66 ? 57 VAL A O 1 ATOM 436 C CB . VAL A 1 57 ? 17.818 92.593 16.288 1.00 25.04 ? 57 VAL A CB 1 ATOM 437 C CG1 . VAL A 1 57 ? 17.111 92.680 14.929 1.00 15.65 ? 57 VAL A CG1 1 ATOM 438 C CG2 . VAL A 1 57 ? 18.985 91.628 16.225 1.00 18.15 ? 57 VAL A CG2 1 ATOM 439 N N . GLU A 1 58 ? 17.034 95.776 15.696 1.00 57.28 ? 58 GLU A N 1 ATOM 440 C CA . GLU A 1 58 ? 15.961 96.769 15.617 1.00 55.35 ? 58 GLU A CA 1 ATOM 441 C C . GLU A 1 58 ? 15.085 96.641 14.375 1.00 48.36 ? 58 GLU A C 1 ATOM 442 O O . GLU A 1 58 ? 15.570 96.330 13.283 1.00 46.92 ? 58 GLU A O 1 ATOM 443 C CB . GLU A 1 58 ? 16.548 98.180 15.663 1.00 96.44 ? 58 GLU A CB 1 ATOM 444 C CG . GLU A 1 58 ? 17.276 98.507 16.944 1.00 114.00 ? 58 GLU A CG 1 ATOM 445 C CD . GLU A 1 58 ? 17.804 99.924 16.957 1.00 125.50 ? 58 GLU A CD 1 ATOM 446 O OE1 . GLU A 1 58 ? 16.989 100.866 16.868 1.00 134.62 ? 58 GLU A OE1 1 ATOM 447 O OE2 . GLU A 1 58 ? 19.036 100.095 17.053 1.00 126.02 ? 58 GLU A OE2 1 ATOM 448 N N . GLY A 1 59 ? 13.789 96.884 14.553 1.00 47.39 ? 59 GLY A N 1 ATOM 449 C CA . GLY A 1 59 ? 12.862 96.814 13.437 1.00 57.49 ? 59 GLY A CA 1 ATOM 450 C C . GLY A 1 59 ? 12.249 95.457 13.139 1.00 59.15 ? 59 GLY A C 1 ATOM 451 O O . GLY A 1 59 ? 11.439 95.326 12.218 1.00 55.50 ? 59 GLY A O 1 ATOM 452 N N . MET A 1 60 ? 12.624 94.441 13.906 1.00 60.71 ? 60 MET A N 1 ATOM 453 C CA . MET A 1 60 ? 12.080 93.114 13.676 1.00 53.48 ? 60 MET A CA 1 ATOM 454 C C . MET A 1 60 ? 10.722 92.929 14.329 1.00 53.71 ? 60 MET A C 1 ATOM 455 O O . MET A 1 60 ? 9.825 92.313 13.750 1.00 48.83 ? 60 MET A O 1 ATOM 456 C CB . MET A 1 60 ? 13.025 92.047 14.208 1.00 50.96 ? 60 MET A CB 1 ATOM 457 C CG . MET A 1 60 ? 12.408 90.662 14.189 1.00 44.20 ? 60 MET A CG 1 ATOM 458 S SD . MET A 1 60 ? 13.450 89.462 14.992 1.00 40.32 ? 60 MET A SD 1 ATOM 459 C CE . MET A 1 60 ? 14.444 88.961 13.636 1.00 55.40 ? 60 MET A CE 1 ATOM 460 N N . GLU A 1 61 ? 10.569 93.454 15.538 1.00 39.29 ? 61 GLU A N 1 ATOM 461 C CA . GLU A 1 61 ? 9.309 93.316 16.245 1.00 36.96 ? 61 GLU A CA 1 ATOM 462 C C . GLU A 1 61 ? 9.071 94.482 17.195 1.00 41.73 ? 61 GLU A C 1 ATOM 463 O O . GLU A 1 61 ? 9.936 94.823 17.997 1.00 46.73 ? 61 GLU A O 1 ATOM 464 C CB . GLU A 1 61 ? 9.301 91.991 17.025 1.00 41.06 ? 61 GLU A CB 1 ATOM 465 C CG . GLU A 1 61 ? 7.951 91.600 17.601 1.00 41.61 ? 61 GLU A CG 1 ATOM 466 C CD . GLU A 1 61 ? 6.885 91.456 16.527 1.00 44.90 ? 61 GLU A CD 1 ATOM 467 O OE1 . GLU A 1 61 ? 6.936 90.472 15.754 1.00 41.20 ? 61 GLU A OE1 1 ATOM 468 O OE2 . GLU A 1 61 ? 5.999 92.338 16.447 1.00 54.73 ? 61 GLU A OE2 1 ATOM 469 N N . ASP A 1 62 ? 7.901 95.103 17.083 1.00 27.89 ? 62 ASP A N 1 ATOM 470 C CA . ASP A 1 62 ? 7.524 96.209 17.959 1.00 31.21 ? 62 ASP A CA 1 ATOM 471 C C . ASP A 1 62 ? 7.150 95.559 19.290 1.00 30.80 ? 62 ASP A C 1 ATOM 472 O O . ASP A 1 62 ? 5.991 95.242 19.529 1.00 25.08 ? 62 ASP A O 1 ATOM 473 C CB . ASP A 1 62 ? 6.306 96.946 17.387 1.00 61.88 ? 62 ASP A CB 1 ATOM 474 C CG . ASP A 1 62 ? 5.874 98.126 18.243 1.00 65.58 ? 62 ASP A CG 1 ATOM 475 O OD1 . ASP A 1 62 ? 5.894 98.007 19.486 1.00 60.52 ? 62 ASP A OD1 1 ATOM 476 O OD2 . ASP A 1 62 ? 5.499 99.170 17.671 1.00 72.68 ? 62 ASP A OD2 1 ATOM 477 N N . TRP A 1 63 ? 8.130 95.357 20.156 1.00 34.47 ? 63 TRP A N 1 ATOM 478 C CA . TRP A 1 63 ? 7.888 94.707 21.437 1.00 31.64 ? 63 TRP A CA 1 ATOM 479 C C . TRP A 1 63 ? 6.775 95.318 22.268 1.00 33.24 ? 63 TRP A C 1 ATOM 480 O O . TRP A 1 63 ? 6.105 94.614 23.023 1.00 29.32 ? 63 TRP A O 1 ATOM 481 C CB . TRP A 1 63 ? 9.195 94.649 22.234 1.00 31.39 ? 63 TRP A CB 1 ATOM 482 C CG . TRP A 1 63 ? 10.248 93.859 21.491 1.00 25.97 ? 63 TRP A CG 1 ATOM 483 C CD1 . TRP A 1 63 ? 11.446 94.314 21.020 1.00 30.06 ? 63 TRP A CD1 1 ATOM 484 C CD2 . TRP A 1 63 ? 10.160 92.488 21.098 1.00 29.20 ? 63 TRP A CD2 1 ATOM 485 N NE1 . TRP A 1 63 ? 12.111 93.311 20.357 1.00 30.78 ? 63 TRP A NE1 1 ATOM 486 C CE2 . TRP A 1 63 ? 11.344 92.178 20.392 1.00 29.98 ? 63 TRP A CE2 1 ATOM 487 C CE3 . TRP A 1 63 ? 9.194 91.488 21.275 1.00 32.60 ? 63 TRP A CE3 1 ATOM 488 C CZ2 . TRP A 1 63 ? 11.591 90.908 19.865 1.00 34.11 ? 63 TRP A CZ2 1 ATOM 489 C CZ3 . TRP A 1 63 ? 9.438 90.229 20.753 1.00 30.52 ? 63 TRP A CZ3 1 ATOM 490 C CH2 . TRP A 1 63 ? 10.630 89.948 20.055 1.00 32.70 ? 63 TRP A CH2 1 ATOM 491 N N . LYS A 1 64 ? 6.560 96.621 22.126 1.00 38.08 ? 64 LYS A N 1 ATOM 492 C CA . LYS A 1 64 ? 5.508 97.272 22.893 1.00 40.24 ? 64 LYS A CA 1 ATOM 493 C C . LYS A 1 64 ? 4.163 96.780 22.411 1.00 35.72 ? 64 LYS A C 1 ATOM 494 O O . LYS A 1 64 ? 3.243 96.602 23.204 1.00 35.22 ? 64 LYS A O 1 ATOM 495 C CB . LYS A 1 64 ? 5.601 98.793 22.760 1.00 83.26 ? 64 LYS A CB 1 ATOM 496 C CG . LYS A 1 64 ? 6.819 99.384 23.470 1.00 99.02 ? 64 LYS A CG 1 ATOM 497 C CD . LYS A 1 64 ? 6.902 100.902 23.327 1.00 112.02 ? 64 LYS A CD 1 ATOM 498 C CE . LYS A 1 64 ? 8.054 101.478 24.147 1.00 116.17 ? 64 LYS A CE 1 ATOM 499 N NZ . LYS A 1 64 ? 9.364 100.862 23.794 1.00 122.99 ? 64 LYS A NZ 1 ATOM 500 N N . GLN A 1 65 ? 4.054 96.539 21.110 1.00 32.87 ? 65 GLN A N 1 ATOM 501 C CA . GLN A 1 65 ? 2.800 96.061 20.557 1.00 35.46 ? 65 GLN A CA 1 ATOM 502 C C . GLN A 1 65 ? 2.609 94.577 20.839 1.00 30.66 ? 65 GLN A C 1 ATOM 503 O O . GLN A 1 65 ? 1.493 94.126 21.096 1.00 30.23 ? 65 GLN A O 1 ATOM 504 C CB . GLN A 1 65 ? 2.733 96.324 19.055 1.00 52.94 ? 65 GLN A CB 1 ATOM 505 C CG . GLN A 1 65 ? 1.303 96.381 18.529 1.00 61.58 ? 65 GLN A CG 1 ATOM 506 C CD . GLN A 1 65 ? 0.361 97.173 19.450 1.00 72.97 ? 65 GLN A CD 1 ATOM 507 O OE1 . GLN A 1 65 ? 0.723 98.236 19.964 1.00 74.82 ? 65 GLN A OE1 1 ATOM 508 N NE2 . GLN A 1 65 ? -0.854 96.657 19.650 1.00 59.51 ? 65 GLN A NE2 1 ATOM 509 N N . ASP A 1 66 ? 3.697 93.816 20.803 1.00 37.53 ? 66 ASP A N 1 ATOM 510 C CA . ASP A 1 66 ? 3.603 92.391 21.082 1.00 36.16 ? 66 ASP A CA 1 ATOM 511 C C . ASP A 1 66 ? 3.199 92.211 22.536 1.00 37.76 ? 66 ASP A C 1 ATOM 512 O O . ASP A 1 66 ? 2.463 91.286 22.870 1.00 31.91 ? 66 ASP A O 1 ATOM 513 C CB . ASP A 1 66 ? 4.936 91.687 20.826 1.00 32.88 ? 66 ASP A CB 1 ATOM 514 C CG . ASP A 1 66 ? 4.794 90.171 20.785 1.00 41.68 ? 66 ASP A CG 1 ATOM 515 O OD1 . ASP A 1 66 ? 4.039 89.660 19.930 1.00 40.35 ? 66 ASP A OD1 1 ATOM 516 O OD2 . ASP A 1 66 ? 5.436 89.483 21.606 1.00 35.16 ? 66 ASP A OD2 1 ATOM 517 N N . SER A 1 67 ? 3.680 93.096 23.402 1.00 40.01 ? 67 SER A N 1 ATOM 518 C CA . SER A 1 67 ? 3.335 93.002 24.810 1.00 40.01 ? 67 SER A CA 1 ATOM 519 C C . SER A 1 67 ? 1.826 92.892 24.922 1.00 43.71 ? 67 SER A C 1 ATOM 520 O O . SER A 1 67 ? 1.300 92.056 25.659 1.00 40.01 ? 67 SER A O 1 ATOM 521 C CB . SER A 1 67 ? 3.819 94.235 25.578 1.00 36.53 ? 67 SER A CB 1 ATOM 522 O OG . SER A 1 67 ? 5.208 94.163 25.855 1.00 38.35 ? 67 SER A OG 1 ATOM 523 N N . GLN A 1 68 ? 1.131 93.733 24.171 1.00 34.74 ? 68 GLN A N 1 ATOM 524 C CA . GLN A 1 68 ? -0.322 93.733 24.185 1.00 31.94 ? 68 GLN A CA 1 ATOM 525 C C . GLN A 1 68 ? -0.865 92.403 23.698 1.00 30.15 ? 68 GLN A C 1 ATOM 526 O O . GLN A 1 68 ? -1.818 91.874 24.262 1.00 32.06 ? 68 GLN A O 1 ATOM 527 C CB . GLN A 1 68 ? -0.849 94.871 23.313 1.00 33.72 ? 68 GLN A CB 1 ATOM 528 C CG . GLN A 1 68 ? -0.544 96.239 23.881 1.00 34.93 ? 68 GLN A CG 1 ATOM 529 C CD . GLN A 1 68 ? -0.945 96.345 25.338 1.00 33.89 ? 68 GLN A CD 1 ATOM 530 O OE1 . GLN A 1 68 ? -2.118 96.180 25.687 1.00 44.04 ? 68 GLN A OE1 1 ATOM 531 N NE2 . GLN A 1 68 ? 0.034 96.612 26.202 1.00 33.53 ? 68 GLN A NE2 1 ATOM 532 N N . LEU A 1 69 ? -0.253 91.872 22.642 1.00 26.72 ? 69 LEU A N 1 ATOM 533 C CA . LEU A 1 69 ? -0.662 90.594 22.080 1.00 31.00 ? 69 LEU A CA 1 ATOM 534 C C . LEU A 1 69 ? -0.550 89.517 23.154 1.00 28.71 ? 69 LEU A C 1 ATOM 535 O O . LEU A 1 69 ? -1.496 88.759 23.382 1.00 26.72 ? 69 LEU A O 1 ATOM 536 C CB . LEU A 1 69 ? 0.225 90.220 20.886 1.00 25.74 ? 69 LEU A CB 1 ATOM 537 C CG . LEU A 1 69 ? 0.053 88.787 20.349 1.00 31.27 ? 69 LEU A CG 1 ATOM 538 C CD1 . LEU A 1 69 ? -1.229 88.676 19.519 1.00 28.96 ? 69 LEU A CD1 1 ATOM 539 C CD2 . LEU A 1 69 ? 1.259 88.398 19.511 1.00 30.72 ? 69 LEU A CD2 1 ATOM 540 N N . GLN A 1 70 ? 0.605 89.465 23.817 1.00 28.79 ? 70 GLN A N 1 ATOM 541 C CA . GLN A 1 70 ? 0.843 88.472 24.860 1.00 32.02 ? 70 GLN A CA 1 ATOM 542 C C . GLN A 1 70 ? -0.157 88.555 26.008 1.00 29.67 ? 70 GLN A C 1 ATOM 543 O O . GLN A 1 70 ? -0.538 87.533 26.587 1.00 31.39 ? 70 GLN A O 1 ATOM 544 C CB . GLN A 1 70 ? 2.265 88.594 25.401 1.00 36.85 ? 70 GLN A CB 1 ATOM 545 C CG . GLN A 1 70 ? 3.348 88.249 24.393 1.00 37.79 ? 70 GLN A CG 1 ATOM 546 C CD . GLN A 1 70 ? 3.056 86.974 23.616 1.00 38.52 ? 70 GLN A CD 1 ATOM 547 O OE1 . GLN A 1 70 ? 2.551 86.001 24.169 1.00 37.73 ? 70 GLN A OE1 1 ATOM 548 N NE2 . GLN A 1 70 ? 3.387 86.973 22.326 1.00 36.85 ? 70 GLN A NE2 1 ATOM 549 N N . LYS A 1 71 ? -0.579 89.768 26.347 1.00 32.23 ? 71 LYS A N 1 ATOM 550 C CA . LYS A 1 71 ? -1.557 89.932 27.414 1.00 27.25 ? 71 LYS A CA 1 ATOM 551 C C . LYS A 1 71 ? -2.851 89.268 26.949 1.00 29.18 ? 71 LYS A C 1 ATOM 552 O O . LYS A 1 71 ? -3.529 88.581 27.706 1.00 28.80 ? 71 LYS A O 1 ATOM 553 C CB . LYS A 1 71 ? -1.814 91.414 27.687 1.00 42.31 ? 71 LYS A CB 1 ATOM 554 C CG . LYS A 1 71 ? -0.586 92.203 28.076 1.00 51.14 ? 71 LYS A CG 1 ATOM 555 C CD . LYS A 1 71 ? -0.962 93.647 28.402 1.00 57.47 ? 71 LYS A CD 1 ATOM 556 C CE . LYS A 1 71 ? 0.258 94.507 28.719 1.00 61.63 ? 71 LYS A CE 1 ATOM 557 N NZ . LYS A 1 71 ? -0.130 95.908 29.041 1.00 59.19 ? 71 LYS A NZ 1 ATOM 558 N N . ALA A 1 72 ? -3.180 89.483 25.684 1.00 28.27 ? 72 ALA A N 1 ATOM 559 C CA . ALA A 1 72 ? -4.381 88.919 25.111 1.00 31.09 ? 72 ALA A CA 1 ATOM 560 C C . ALA A 1 72 ? -4.305 87.408 25.226 1.00 27.08 ? 72 ALA A C 1 ATOM 561 O O . ALA A 1 72 ? -5.160 86.775 25.848 1.00 27.08 ? 72 ALA A O 1 ATOM 562 C CB . ALA A 1 72 ? -4.499 89.332 23.655 1.00 55.69 ? 72 ALA A CB 1 ATOM 563 N N . ARG A 1 73 ? -3.271 86.836 24.622 1.00 35.73 ? 73 ARG A N 1 ATOM 564 C CA . ARG A 1 73 ? -3.077 85.402 24.661 1.00 38.45 ? 73 ARG A CA 1 ATOM 565 C C . ARG A 1 73 ? -3.185 84.904 26.095 1.00 35.73 ? 73 ARG A C 1 ATOM 566 O O . ARG A 1 73 ? -3.894 83.938 26.371 1.00 35.73 ? 73 ARG A O 1 ATOM 567 C CB . ARG A 1 73 ? -1.704 85.051 24.108 1.00 47.59 ? 73 ARG A CB 1 ATOM 568 C CG . ARG A 1 73 ? -1.469 85.507 22.686 1.00 55.12 ? 73 ARG A CG 1 ATOM 569 C CD . ARG A 1 73 ? -2.310 84.727 21.696 1.00 56.32 ? 73 ARG A CD 1 ATOM 570 N NE . ARG A 1 73 ? -1.956 85.076 20.326 1.00 57.76 ? 73 ARG A NE 1 ATOM 571 C CZ . ARG A 1 73 ? -0.766 84.840 19.776 1.00 55.33 ? 73 ARG A CZ 1 ATOM 572 N NH1 . ARG A 1 73 ? 0.189 84.249 20.482 1.00 53.69 ? 73 ARG A NH1 1 ATOM 573 N NH2 . ARG A 1 73 ? -0.528 85.197 18.516 1.00 48.55 ? 73 ARG A NH2 1 ATOM 574 N N . GLU A 1 74 ? -2.483 85.574 27.007 1.00 24.28 ? 74 GLU A N 1 ATOM 575 C CA . GLU A 1 74 ? -2.484 85.194 28.415 1.00 24.28 ? 74 GLU A CA 1 ATOM 576 C C . GLU A 1 74 ? -3.879 84.979 28.971 1.00 25.04 ? 74 GLU A C 1 ATOM 577 O O . GLU A 1 74 ? -4.162 83.940 29.571 1.00 24.28 ? 74 GLU A O 1 ATOM 578 C CB . GLU A 1 74 ? -1.784 86.255 29.256 1.00 27.87 ? 74 GLU A CB 1 ATOM 579 C CG . GLU A 1 74 ? -1.661 85.864 30.711 1.00 28.06 ? 74 GLU A CG 1 ATOM 580 C CD . GLU A 1 74 ? -1.272 87.031 31.606 1.00 32.54 ? 74 GLU A CD 1 ATOM 581 O OE1 . GLU A 1 74 ? -0.340 87.788 31.241 1.00 33.07 ? 74 GLU A OE1 1 ATOM 582 O OE2 . GLU A 1 74 ? -1.894 87.183 32.684 1.00 33.81 ? 74 GLU A OE2 1 ATOM 583 N N . ASP A 1 75 ? -4.749 85.965 28.772 1.00 27.37 ? 75 ASP A N 1 ATOM 584 C CA . ASP A 1 75 ? -6.116 85.890 29.275 1.00 27.15 ? 75 ASP A CA 1 ATOM 585 C C . ASP A 1 75 ? -6.848 84.672 28.771 1.00 27.15 ? 75 ASP A C 1 ATOM 586 O O . ASP A 1 75 ? -7.552 84.009 29.527 1.00 27.15 ? 75 ASP A O 1 ATOM 587 C CB . ASP A 1 75 ? -6.891 87.149 28.911 1.00 48.35 ? 75 ASP A CB 1 ATOM 588 C CG . ASP A 1 75 ? -6.380 88.371 29.643 1.00 62.01 ? 75 ASP A CG 1 ATOM 589 O OD1 . ASP A 1 75 ? -5.813 88.216 30.748 1.00 61.05 ? 75 ASP A OD1 1 ATOM 590 O OD2 . ASP A 1 75 ? -6.557 89.488 29.119 1.00 62.10 ? 75 ASP A OD2 1 ATOM 591 N N . ILE A 1 76 ? -6.672 84.375 27.491 1.00 30.27 ? 76 ILE A N 1 ATOM 592 C CA . ILE A 1 76 ? -7.314 83.214 26.894 1.00 30.27 ? 76 ILE A CA 1 ATOM 593 C C . ILE A 1 76 ? -6.725 81.921 27.452 1.00 30.27 ? 76 ILE A C 1 ATOM 594 O O . ILE A 1 76 ? -7.459 81.011 27.837 1.00 30.27 ? 76 ILE A O 1 ATOM 595 C CB . ILE A 1 76 ? -7.142 83.205 25.360 1.00 18.30 ? 76 ILE A CB 1 ATOM 596 C CG1 . ILE A 1 76 ? -7.800 84.440 24.750 1.00 26.88 ? 76 ILE A CG1 1 ATOM 597 C CG2 . ILE A 1 76 ? -7.774 81.955 24.774 1.00 22.19 ? 76 ILE A CG2 1 ATOM 598 C CD1 . ILE A 1 76 ? -7.659 84.502 23.243 1.00 40.03 ? 76 ILE A CD1 1 ATOM 599 N N . PHE A 1 77 ? -5.399 81.852 27.489 1.00 18.27 ? 77 PHE A N 1 ATOM 600 C CA . PHE A 1 77 ? -4.695 80.676 27.982 1.00 18.27 ? 77 PHE A CA 1 ATOM 601 C C . PHE A 1 77 ? -5.132 80.343 29.393 1.00 18.27 ? 77 PHE A C 1 ATOM 602 O O . PHE A 1 77 ? -5.484 79.198 29.696 1.00 18.27 ? 77 PHE A O 1 ATOM 603 C CB . PHE A 1 77 ? -3.192 80.920 27.978 1.00 16.93 ? 77 PHE A CB 1 ATOM 604 C CG . PHE A 1 77 ? -2.381 79.682 28.196 1.00 16.93 ? 77 PHE A CG 1 ATOM 605 C CD1 . PHE A 1 77 ? -2.032 78.866 27.122 1.00 16.93 ? 77 PHE A CD1 1 ATOM 606 C CD2 . PHE A 1 77 ? -1.977 79.315 29.474 1.00 16.93 ? 77 PHE A CD2 1 ATOM 607 C CE1 . PHE A 1 77 ? -1.292 77.701 27.312 1.00 16.93 ? 77 PHE A CE1 1 ATOM 608 C CE2 . PHE A 1 77 ? -1.232 78.143 29.675 1.00 16.93 ? 77 PHE A CE2 1 ATOM 609 C CZ . PHE A 1 77 ? -0.892 77.336 28.586 1.00 16.93 ? 77 PHE A CZ 1 ATOM 610 N N . MET A 1 78 ? -5.118 81.355 30.256 1.00 18.19 ? 78 MET A N 1 ATOM 611 C CA . MET A 1 78 ? -5.502 81.159 31.644 1.00 18.19 ? 78 MET A CA 1 ATOM 612 C C . MET A 1 78 ? -6.976 80.805 31.804 1.00 18.19 ? 78 MET A C 1 ATOM 613 O O . MET A 1 78 ? -7.343 80.067 32.722 1.00 18.19 ? 78 MET A O 1 ATOM 614 C CB . MET A 1 78 ? -5.167 82.396 32.462 1.00 22.61 ? 78 MET A CB 1 ATOM 615 C CG . MET A 1 78 ? -3.685 82.762 32.474 1.00 22.61 ? 78 MET A CG 1 ATOM 616 S SD . MET A 1 78 ? -2.548 81.428 32.929 1.00 22.61 ? 78 MET A SD 1 ATOM 617 C CE . MET A 1 78 ? -2.973 81.069 34.631 1.00 22.61 ? 78 MET A CE 1 ATOM 618 N N . GLU A 1 79 ? -7.822 81.327 30.917 1.00 17.41 ? 79 GLU A N 1 ATOM 619 C CA . GLU A 1 79 ? -9.245 81.020 30.979 1.00 17.41 ? 79 GLU A CA 1 ATOM 620 C C . GLU A 1 79 ? -9.389 79.543 30.659 1.00 17.41 ? 79 GLU A C 1 ATOM 621 O O . GLU A 1 79 ? -10.189 78.830 31.257 1.00 17.91 ? 79 GLU A O 1 ATOM 622 C CB . GLU A 1 79 ? -10.030 81.826 29.950 1.00 45.58 ? 79 GLU A CB 1 ATOM 623 C CG . GLU A 1 79 ? -11.533 81.749 30.173 1.00 58.70 ? 79 GLU A CG 1 ATOM 624 C CD . GLU A 1 79 ? -12.325 82.396 29.061 1.00 68.08 ? 79 GLU A CD 1 ATOM 625 O OE1 . GLU A 1 79 ? -11.893 83.455 28.560 1.00 64.57 ? 79 GLU A OE1 1 ATOM 626 O OE2 . GLU A 1 79 ? -13.386 81.850 28.695 1.00 70.32 ? 79 GLU A OE2 1 ATOM 627 N N . THR A 1 80 ? -8.586 79.092 29.706 1.00 26.69 ? 80 THR A N 1 ATOM 628 C CA . THR A 1 80 ? -8.601 77.707 29.293 1.00 26.69 ? 80 THR A CA 1 ATOM 629 C C . THR A 1 80 ? -8.298 76.813 30.491 1.00 26.69 ? 80 THR A C 1 ATOM 630 O O . THR A 1 80 ? -9.093 75.928 30.819 1.00 26.69 ? 80 THR A O 1 ATOM 631 C CB . THR A 1 80 ? -7.581 77.488 28.169 1.00 21.43 ? 80 THR A CB 1 ATOM 632 O OG1 . THR A 1 80 ? -7.931 78.324 27.056 1.00 21.43 ? 80 THR A OG1 1 ATOM 633 C CG2 . THR A 1 80 ? -7.566 76.024 27.722 1.00 21.43 ? 80 THR A CG2 1 ATOM 634 N N . LEU A 1 81 ? -7.163 77.052 31.150 1.00 11.09 ? 81 LEU A N 1 ATOM 635 C CA . LEU A 1 81 ? -6.785 76.270 32.325 1.00 11.09 ? 81 LEU A CA 1 ATOM 636 C C . LEU A 1 81 ? -7.903 76.323 33.362 1.00 11.09 ? 81 LEU A C 1 ATOM 637 O O . LEU A 1 81 ? -8.323 75.294 33.905 1.00 11.09 ? 81 LEU A O 1 ATOM 638 C CB . LEU A 1 81 ? -5.496 76.824 32.944 1.00 10.89 ? 81 LEU A CB 1 ATOM 639 C CG . LEU A 1 81 ? -4.938 76.196 34.239 1.00 10.89 ? 81 LEU A CG 1 ATOM 640 C CD1 . LEU A 1 81 ? -4.748 74.681 34.113 1.00 10.89 ? 81 LEU A CD1 1 ATOM 641 C CD2 . LEU A 1 81 ? -3.622 76.867 34.548 1.00 10.89 ? 81 LEU A CD2 1 ATOM 642 N N . LYS A 1 82 ? -8.380 77.534 33.638 1.00 24.01 ? 82 LYS A N 1 ATOM 643 C CA . LYS A 1 82 ? -9.461 77.728 34.593 1.00 24.01 ? 82 LYS A CA 1 ATOM 644 C C . LYS A 1 82 ? -10.608 76.739 34.347 1.00 24.01 ? 82 LYS A C 1 ATOM 645 O O . LYS A 1 82 ? -11.033 76.014 35.251 1.00 24.01 ? 82 LYS A O 1 ATOM 646 C CB . LYS A 1 82 ? -9.978 79.161 34.496 1.00 52.17 ? 82 LYS A CB 1 ATOM 647 C CG . LYS A 1 82 ? -11.184 79.439 35.364 1.00 64.81 ? 82 LYS A CG 1 ATOM 648 C CD . LYS A 1 82 ? -11.572 80.909 35.316 1.00 75.00 ? 82 LYS A CD 1 ATOM 649 C CE . LYS A 1 82 ? -12.956 81.142 35.914 1.00 81.17 ? 82 LYS A CE 1 ATOM 650 N NZ . LYS A 1 82 ? -14.018 80.454 35.116 1.00 85.12 ? 82 LYS A NZ 1 ATOM 651 N N . ASP A 1 83 ? -11.089 76.700 33.108 1.00 20.71 ? 83 ASP A N 1 ATOM 652 C CA . ASP A 1 83 ? -12.189 75.828 32.745 1.00 20.71 ? 83 ASP A CA 1 ATOM 653 C C . ASP A 1 83 ? -11.921 74.353 32.951 1.00 20.71 ? 83 ASP A C 1 ATOM 654 O O . ASP A 1 83 ? -12.826 73.613 33.334 1.00 20.71 ? 83 ASP A O 1 ATOM 655 C CB . ASP A 1 83 ? -12.600 76.076 31.300 1.00 14.08 ? 83 ASP A CB 1 ATOM 656 C CG . ASP A 1 83 ? -13.214 77.444 31.099 1.00 30.72 ? 83 ASP A CG 1 ATOM 657 O OD1 . ASP A 1 83 ? -13.595 78.065 32.110 1.00 29.63 ? 83 ASP A OD1 1 ATOM 658 O OD2 . ASP A 1 83 ? -13.330 77.903 29.942 1.00 32.21 ? 83 ASP A OD2 1 ATOM 659 N N . ILE A 1 84 ? -10.697 73.910 32.699 1.00 14.64 ? 84 ILE A N 1 ATOM 660 C CA . ILE A 1 84 ? -10.387 72.492 32.881 1.00 14.64 ? 84 ILE A CA 1 ATOM 661 C C . ILE A 1 84 ? -10.505 72.159 34.369 1.00 14.64 ? 84 ILE A C 1 ATOM 662 O O . ILE A 1 84 ? -11.115 71.153 34.763 1.00 14.64 ? 84 ILE A O 1 ATOM 663 C CB . ILE A 1 84 ? -8.951 72.148 32.383 1.00 15.72 ? 84 ILE A CB 1 ATOM 664 C CG1 . ILE A 1 84 ? -8.805 72.542 30.905 1.00 15.72 ? 84 ILE A CG1 1 ATOM 665 C CG2 . ILE A 1 84 ? -8.669 70.656 32.574 1.00 15.72 ? 84 ILE A CG2 1 ATOM 666 C CD1 . ILE A 1 84 ? -7.375 72.589 30.410 1.00 15.72 ? 84 ILE A CD1 1 ATOM 667 N N . VAL A 1 85 ? -9.930 73.017 35.198 1.00 26.98 ? 85 VAL A N 1 ATOM 668 C CA . VAL A 1 85 ? -9.995 72.802 36.629 1.00 27.48 ? 85 VAL A CA 1 ATOM 669 C C . VAL A 1 85 ? -11.455 72.820 37.092 1.00 27.80 ? 85 VAL A C 1 ATOM 670 O O . VAL A 1 85 ? -11.846 72.054 37.977 1.00 29.77 ? 85 VAL A O 1 ATOM 671 C CB . VAL A 1 85 ? -9.199 73.873 37.370 1.00 16.19 ? 85 VAL A CB 1 ATOM 672 C CG1 . VAL A 1 85 ? -9.351 73.691 38.851 1.00 19.46 ? 85 VAL A CG1 1 ATOM 673 C CG2 . VAL A 1 85 ? -7.735 73.787 36.981 1.00 13.34 ? 85 VAL A CG2 1 ATOM 674 N N . GLU A 1 86 ? -12.260 73.698 36.498 1.00 17.33 ? 86 GLU A N 1 ATOM 675 C CA . GLU A 1 86 ? -13.671 73.778 36.845 1.00 23.67 ? 86 GLU A CA 1 ATOM 676 C C . GLU A 1 86 ? -14.288 72.445 36.468 1.00 24.97 ? 86 GLU A C 1 ATOM 677 O O . GLU A 1 86 ? -15.098 71.892 37.200 1.00 21.64 ? 86 GLU A O 1 ATOM 678 C CB . GLU A 1 86 ? -14.366 74.891 36.056 1.00 79.83 ? 86 GLU A CB 1 ATOM 679 C CG . GLU A 1 86 ? -15.015 75.960 36.920 1.00 104.11 ? 86 GLU A CG 1 ATOM 680 C CD . GLU A 1 86 ? -14.001 76.936 37.503 1.00 115.10 ? 86 GLU A CD 1 ATOM 681 O OE1 . GLU A 1 86 ? -13.002 76.480 38.106 1.00 123.77 ? 86 GLU A OE1 1 ATOM 682 O OE2 . GLU A 1 86 ? -14.205 78.163 37.358 1.00 110.10 ? 86 GLU A OE2 1 ATOM 683 N N . TYR A 1 87 ? -13.890 71.922 35.317 1.00 22.22 ? 87 TYR A N 1 ATOM 684 C CA . TYR A 1 87 ? -14.438 70.665 34.856 1.00 19.65 ? 87 TYR A CA 1 ATOM 685 C C . TYR A 1 87 ? -14.199 69.533 35.828 1.00 19.50 ? 87 TYR A C 1 ATOM 686 O O . TYR A 1 87 ? -15.103 68.740 36.107 1.00 19.50 ? 87 TYR A O 1 ATOM 687 C CB . TYR A 1 87 ? -13.852 70.262 33.510 1.00 22.94 ? 87 TYR A CB 1 ATOM 688 C CG . TYR A 1 87 ? -14.382 68.922 33.057 1.00 22.94 ? 87 TYR A CG 1 ATOM 689 C CD1 . TYR A 1 87 ? -15.665 68.803 32.521 1.00 22.94 ? 87 TYR A CD1 1 ATOM 690 C CD2 . TYR A 1 87 ? -13.623 67.770 33.215 1.00 22.94 ? 87 TYR A CD2 1 ATOM 691 C CE1 . TYR A 1 87 ? -16.175 67.567 32.156 1.00 30.96 ? 87 TYR A CE1 1 ATOM 692 C CE2 . TYR A 1 87 ? -14.118 66.534 32.855 1.00 27.91 ? 87 TYR A CE2 1 ATOM 693 C CZ . TYR A 1 87 ? -15.394 66.433 32.327 1.00 25.91 ? 87 TYR A CZ 1 ATOM 694 O OH . TYR A 1 87 ? -15.882 65.189 31.986 1.00 27.89 ? 87 TYR A OH 1 ATOM 695 N N . TYR A 1 88 ? -12.974 69.438 36.326 1.00 34.68 ? 88 TYR A N 1 ATOM 696 C CA . TYR A 1 88 ? -12.655 68.377 37.259 1.00 34.68 ? 88 TYR A CA 1 ATOM 697 C C . TYR A 1 88 ? -12.979 68.746 38.687 1.00 39.96 ? 88 TYR A C 1 ATOM 698 O O . TYR A 1 88 ? -12.544 68.074 39.614 1.00 37.71 ? 88 TYR A O 1 ATOM 699 C CB . TYR A 1 88 ? -11.190 67.989 37.128 1.00 33.56 ? 88 TYR A CB 1 ATOM 700 C CG . TYR A 1 88 ? -10.899 67.289 35.823 1.00 33.56 ? 88 TYR A CG 1 ATOM 701 C CD1 . TYR A 1 88 ? -10.093 67.878 34.853 1.00 33.56 ? 88 TYR A CD1 1 ATOM 702 C CD2 . TYR A 1 88 ? -11.464 66.052 35.543 1.00 33.56 ? 88 TYR A CD2 1 ATOM 703 C CE1 . TYR A 1 88 ? -9.862 67.245 33.636 1.00 33.56 ? 88 TYR A CE1 1 ATOM 704 C CE2 . TYR A 1 88 ? -11.242 65.420 34.337 1.00 38.67 ? 88 TYR A CE2 1 ATOM 705 C CZ . TYR A 1 88 ? -10.444 66.019 33.393 1.00 33.56 ? 88 TYR A CZ 1 ATOM 706 O OH . TYR A 1 88 ? -10.244 65.387 32.200 1.00 34.45 ? 88 TYR A OH 1 ATOM 707 N N . LYS A 1 89 ? -13.759 69.811 38.854 1.00 33.16 ? 89 LYS A N 1 ATOM 708 C CA . LYS A 1 89 ? -14.168 70.281 40.176 1.00 43.03 ? 89 LYS A CA 1 ATOM 709 C C . LYS A 1 89 ? -13.042 70.152 41.198 1.00 42.67 ? 89 LYS A C 1 ATOM 710 O O . LYS A 1 89 ? -13.213 69.496 42.226 1.00 42.66 ? 89 LYS A O 1 ATOM 711 C CB . LYS A 1 89 ? -15.369 69.476 40.678 1.00 55.85 ? 89 LYS A CB 1 ATOM 712 C CG . LYS A 1 89 ? -16.569 69.448 39.754 1.00 62.91 ? 89 LYS A CG 1 ATOM 713 C CD . LYS A 1 89 ? -17.636 68.529 40.331 1.00 72.64 ? 89 LYS A CD 1 ATOM 714 C CE . LYS A 1 89 ? -18.857 68.442 39.433 1.00 73.97 ? 89 LYS A CE 1 ATOM 715 N NZ . LYS A 1 89 ? -19.945 67.628 40.050 1.00 82.88 ? 89 LYS A NZ 1 ATOM 716 N N . ASP A 1 90 ? -11.897 70.768 40.920 1.00 66.52 ? 90 ASP A N 1 ATOM 717 C CA . ASP A 1 90 ? -10.767 70.689 41.837 1.00 65.89 ? 90 ASP A CA 1 ATOM 718 C C . ASP A 1 90 ? -9.846 71.895 41.716 1.00 67.54 ? 90 ASP A C 1 ATOM 719 O O . ASP A 1 90 ? -8.772 71.810 41.123 1.00 64.21 ? 90 ASP A O 1 ATOM 720 C CB . ASP A 1 90 ? -9.983 69.399 41.578 1.00 66.05 ? 90 ASP A CB 1 ATOM 721 C CG . ASP A 1 90 ? -8.713 69.307 42.403 1.00 76.18 ? 90 ASP A CG 1 ATOM 722 O OD1 . ASP A 1 90 ? -8.763 69.628 43.612 1.00 83.37 ? 90 ASP A OD1 1 ATOM 723 O OD2 . ASP A 1 90 ? -7.668 68.905 41.842 1.00 73.63 ? 90 ASP A OD2 1 ATOM 724 N N . SER A 1 91 ? -10.265 73.016 42.294 1.00 62.97 ? 91 SER A N 1 ATOM 725 C CA . SER A 1 91 ? -9.473 74.237 42.237 1.00 71.22 ? 91 SER A CA 1 ATOM 726 C C . SER A 1 91 ? -8.580 74.437 43.456 1.00 70.96 ? 91 SER A C 1 ATOM 727 O O . SER A 1 91 ? -7.827 75.403 43.519 1.00 73.14 ? 91 SER A O 1 ATOM 728 C CB . SER A 1 91 ? -10.392 75.449 42.062 1.00 58.58 ? 91 SER A CB 1 ATOM 729 O OG . SER A 1 91 ? -11.356 75.512 43.095 1.00 73.02 ? 91 SER A OG 1 ATOM 730 N N . THR A 1 92 ? -8.662 73.524 44.420 1.00 78.64 ? 92 THR A N 1 ATOM 731 C CA . THR A 1 92 ? -7.841 73.610 45.627 1.00 82.80 ? 92 THR A CA 1 ATOM 732 C C . THR A 1 92 ? -6.428 73.132 45.314 1.00 82.00 ? 92 THR A C 1 ATOM 733 O O . THR A 1 92 ? -5.462 73.555 45.954 1.00 79.61 ? 92 THR A O 1 ATOM 734 C CB . THR A 1 92 ? -8.401 72.740 46.761 1.00 63.28 ? 92 THR A CB 1 ATOM 735 O OG1 . THR A 1 92 ? -8.345 71.360 46.377 1.00 71.60 ? 92 THR A OG1 1 ATOM 736 C CG2 . THR A 1 92 ? -9.839 73.130 47.066 1.00 66.07 ? 92 THR A CG2 1 ATOM 737 N N . GLY A 1 93 ? -6.319 72.236 44.332 1.00 50.26 ? 93 GLY A N 1 ATOM 738 C CA . GLY A 1 93 ? -5.019 71.729 43.927 1.00 47.83 ? 93 GLY A CA 1 ATOM 739 C C . GLY A 1 93 ? -4.369 72.694 42.950 1.00 38.01 ? 93 GLY A C 1 ATOM 740 O O . GLY A 1 93 ? -4.981 73.685 42.534 1.00 35.91 ? 93 GLY A O 1 ATOM 741 N N . SER A 1 94 ? -3.124 72.424 42.583 1.00 62.34 ? 94 SER A N 1 ATOM 742 C CA . SER A 1 94 ? -2.438 73.286 41.635 1.00 59.72 ? 94 SER A CA 1 ATOM 743 C C . SER A 1 94 ? -2.275 72.532 40.328 1.00 49.73 ? 94 SER A C 1 ATOM 744 O O . SER A 1 94 ? -1.832 71.385 40.315 1.00 51.39 ? 94 SER A O 1 ATOM 745 C CB . SER A 1 94 ? -1.073 73.700 42.167 1.00 46.41 ? 94 SER A CB 1 ATOM 746 O OG . SER A 1 94 ? -0.526 74.709 41.338 1.00 53.62 ? 94 SER A OG 1 ATOM 747 N N . HIS A 1 95 ? -2.638 73.176 39.228 1.00 28.53 ? 95 HIS A N 1 ATOM 748 C CA . HIS A 1 95 ? -2.535 72.543 37.920 1.00 28.53 ? 95 HIS A CA 1 ATOM 749 C C . HIS A 1 95 ? -1.818 73.399 36.881 1.00 28.53 ? 95 HIS A C 1 ATOM 750 O O . HIS A 1 95 ? -1.780 74.630 36.963 1.00 28.53 ? 95 HIS A O 1 ATOM 751 C CB . HIS A 1 95 ? -3.930 72.157 37.436 1.00 18.76 ? 95 HIS A CB 1 ATOM 752 C CG . HIS A 1 95 ? -4.654 71.265 38.394 1.00 18.76 ? 95 HIS A CG 1 ATOM 753 N ND1 . HIS A 1 95 ? -4.415 69.910 38.477 1.00 18.91 ? 95 HIS A ND1 1 ATOM 754 C CD2 . HIS A 1 95 ? -5.562 71.546 39.358 1.00 18.76 ? 95 HIS A CD2 1 ATOM 755 C CE1 . HIS A 1 95 ? -5.144 69.396 39.448 1.00 20.55 ? 95 HIS A CE1 1 ATOM 756 N NE2 . HIS A 1 95 ? -5.849 70.367 39.999 1.00 18.76 ? 95 HIS A NE2 1 ATOM 757 N N . VAL A 1 96 ? -1.231 72.732 35.900 1.00 28.90 ? 96 VAL A N 1 ATOM 758 C CA . VAL A 1 96 ? -0.514 73.452 34.875 1.00 28.90 ? 96 VAL A CA 1 ATOM 759 C C . VAL A 1 96 ? -1.025 73.127 33.475 1.00 28.90 ? 96 VAL A C 1 ATOM 760 O O . VAL A 1 96 ? -1.503 72.025 33.194 1.00 28.90 ? 96 VAL A O 1 ATOM 761 C CB . VAL A 1 96 ? 1.008 73.163 34.980 1.00 14.46 ? 96 VAL A CB 1 ATOM 762 C CG1 . VAL A 1 96 ? 1.254 71.664 34.972 1.00 14.46 ? 96 VAL A CG1 1 ATOM 763 C CG2 . VAL A 1 96 ? 1.755 73.838 33.845 1.00 14.46 ? 96 VAL A CG2 1 ATOM 764 N N . LEU A 1 97 ? -0.952 74.128 32.614 1.00 18.86 ? 97 LEU A N 1 ATOM 765 C CA . LEU A 1 97 ? -1.352 73.987 31.232 1.00 18.86 ? 97 LEU A CA 1 ATOM 766 C C . LEU A 1 97 ? -0.141 74.460 30.450 1.00 18.86 ? 97 LEU A C 1 ATOM 767 O O . LEU A 1 97 ? 0.453 75.492 30.769 1.00 18.86 ? 97 LEU A O 1 ATOM 768 C CB . LEU A 1 97 ? -2.550 74.885 30.907 1.00 10.31 ? 97 LEU A CB 1 ATOM 769 C CG . LEU A 1 97 ? -3.059 74.757 29.472 1.00 10.31 ? 97 LEU A CG 1 ATOM 770 C CD1 . LEU A 1 97 ? -3.597 73.350 29.250 1.00 10.31 ? 97 LEU A CD1 1 ATOM 771 C CD2 . LEU A 1 97 ? -4.130 75.774 29.212 1.00 10.31 ? 97 LEU A CD2 1 ATOM 772 N N . GLN A 1 98 ? 0.249 73.689 29.445 1.00 23.31 ? 98 GLN A N 1 ATOM 773 C CA . GLN A 1 98 ? 1.384 74.065 28.631 1.00 23.31 ? 98 GLN A CA 1 ATOM 774 C C . GLN A 1 98 ? 0.975 73.970 27.191 1.00 23.31 ? 98 GLN A C 1 ATOM 775 O O . GLN A 1 98 ? 0.431 72.960 26.761 1.00 23.31 ? 98 GLN A O 1 ATOM 776 C CB . GLN A 1 98 ? 2.580 73.168 28.929 1.00 11.19 ? 98 GLN A CB 1 ATOM 777 C CG . GLN A 1 98 ? 3.157 73.451 30.305 1.00 11.19 ? 98 GLN A CG 1 ATOM 778 C CD . GLN A 1 98 ? 4.007 72.322 30.847 1.00 11.19 ? 98 GLN A CD 1 ATOM 779 O OE1 . GLN A 1 98 ? 5.240 72.415 30.906 1.00 11.19 ? 98 GLN A OE1 1 ATOM 780 N NE2 . GLN A 1 98 ? 3.346 71.236 31.255 1.00 11.19 ? 98 GLN A NE2 1 ATOM 781 N N . GLY A 1 99 ? 1.195 75.064 26.472 1.00 13.38 ? 99 GLY A N 1 ATOM 782 C CA . GLY A 1 99 ? 0.872 75.124 25.066 1.00 13.38 ? 99 GLY A CA 1 ATOM 783 C C . GLY A 1 99 ? 2.169 75.273 24.311 1.00 13.38 ? 99 GLY A C 1 ATOM 784 O O . GLY A 1 99 ? 3.082 75.991 24.733 1.00 13.38 ? 99 GLY A O 1 ATOM 785 N N . ARG A 1 100 ? 2.255 74.577 23.191 1.00 10.12 ? 100 ARG A N 1 ATOM 786 C CA . ARG A 1 100 ? 3.438 74.604 22.343 1.00 10.12 ? 100 ARG A CA 1 ATOM 787 C C . ARG A 1 100 ? 2.924 74.765 20.922 1.00 10.12 ? 100 ARG A C 1 ATOM 788 O O . ARG A 1 100 ? 2.012 74.067 20.513 1.00 10.12 ? 100 ARG A O 1 ATOM 789 C CB . ARG A 1 100 ? 4.190 73.281 22.502 1.00 22.81 ? 100 ARG A CB 1 ATOM 790 C CG . ARG A 1 100 ? 5.196 72.967 21.431 1.00 22.81 ? 100 ARG A CG 1 ATOM 791 C CD . ARG A 1 100 ? 5.972 71.688 21.733 1.00 23.66 ? 100 ARG A CD 1 ATOM 792 N NE . ARG A 1 100 ? 7.152 71.619 20.880 1.00 32.40 ? 100 ARG A NE 1 ATOM 793 C CZ . ARG A 1 100 ? 7.156 71.125 19.649 1.00 30.76 ? 100 ARG A CZ 1 ATOM 794 N NH1 . ARG A 1 100 ? 6.036 70.636 19.129 1.00 23.73 ? 100 ARG A NH1 1 ATOM 795 N NH2 . ARG A 1 100 ? 8.266 71.159 18.920 1.00 25.86 ? 100 ARG A NH2 1 ATOM 796 N N . PHE A 1 101 ? 3.466 75.714 20.181 1.00 17.03 ? 101 PHE A N 1 ATOM 797 C CA . PHE A 1 101 ? 3.032 75.889 18.804 1.00 17.03 ? 101 PHE A CA 1 ATOM 798 C C . PHE A 1 101 ? 4.104 76.587 18.009 1.00 17.03 ? 101 PHE A C 1 ATOM 799 O O . PHE A 1 101 ? 5.005 77.201 18.573 1.00 17.03 ? 101 PHE A O 1 ATOM 800 C CB . PHE A 1 101 ? 1.709 76.659 18.733 1.00 24.68 ? 101 PHE A CB 1 ATOM 801 C CG . PHE A 1 101 ? 1.769 78.036 19.306 1.00 24.68 ? 101 PHE A CG 1 ATOM 802 C CD1 . PHE A 1 101 ? 2.098 79.122 18.501 1.00 24.68 ? 101 PHE A CD1 1 ATOM 803 C CD2 . PHE A 1 101 ? 1.513 78.248 20.658 1.00 24.68 ? 101 PHE A CD2 1 ATOM 804 C CE1 . PHE A 1 101 ? 2.174 80.409 19.038 1.00 24.68 ? 101 PHE A CE1 1 ATOM 805 C CE2 . PHE A 1 101 ? 1.586 79.528 21.211 1.00 24.68 ? 101 PHE A CE2 1 ATOM 806 C CZ . PHE A 1 101 ? 1.918 80.614 20.401 1.00 28.52 ? 101 PHE A CZ 1 ATOM 807 N N . GLY A 1 102 ? 4.030 76.461 16.696 1.00 12.83 ? 102 GLY A N 1 ATOM 808 C CA . GLY A 1 102 ? 5.030 77.093 15.862 1.00 12.83 ? 102 GLY A CA 1 ATOM 809 C C . GLY A 1 102 ? 5.067 76.445 14.501 1.00 12.83 ? 102 GLY A C 1 ATOM 810 O O . GLY A 1 102 ? 4.228 75.590 14.191 1.00 12.83 ? 102 GLY A O 1 ATOM 811 N N . CYS A 1 103 ? 6.044 76.845 13.694 1.00 14.58 ? 103 CYS A N 1 ATOM 812 C CA . CYS A 1 103 ? 6.187 76.308 12.350 1.00 14.58 ? 103 CYS A CA 1 ATOM 813 C C . CYS A 1 103 ? 7.644 76.237 11.969 1.00 14.58 ? 103 CYS A C 1 ATOM 814 O O . CYS A 1 103 ? 8.505 76.745 12.679 1.00 14.58 ? 103 CYS A O 1 ATOM 815 C CB . CYS A 1 103 ? 5.471 77.206 11.350 1.00 24.29 ? 103 CYS A CB 1 ATOM 816 S SG . CYS A 1 103 ? 6.271 78.795 11.120 1.00 24.29 ? 103 CYS A SG 1 ATOM 817 N N . GLU A 1 104 ? 7.917 75.617 10.830 1.00 17.68 ? 104 GLU A N 1 ATOM 818 C CA . GLU A 1 104 ? 9.285 75.498 10.355 1.00 17.68 ? 104 GLU A CA 1 ATOM 819 C C . GLU A 1 104 ? 9.387 75.425 8.835 1.00 17.68 ? 104 GLU A C 1 ATOM 820 O O . GLU A 1 104 ? 8.536 74.835 8.167 1.00 17.68 ? 104 GLU A O 1 ATOM 821 C CB . GLU A 1 104 ? 9.932 74.260 10.949 1.00 16.33 ? 104 GLU A CB 1 ATOM 822 C CG . GLU A 1 104 ? 9.079 73.038 10.787 1.00 42.37 ? 104 GLU A CG 1 ATOM 823 C CD . GLU A 1 104 ? 9.854 71.782 11.010 1.00 56.79 ? 104 GLU A CD 1 ATOM 824 O OE1 . GLU A 1 104 ? 10.708 71.469 10.157 1.00 55.41 ? 104 GLU A OE1 1 ATOM 825 O OE2 . GLU A 1 104 ? 9.618 71.117 12.036 1.00 54.84 ? 104 GLU A OE2 1 ATOM 826 N N . ILE A 1 105 ? 10.436 76.043 8.298 1.00 26.22 ? 105 ILE A N 1 ATOM 827 C CA . ILE A 1 105 ? 10.673 76.018 6.864 1.00 27.16 ? 105 ILE A CA 1 ATOM 828 C C . ILE A 1 105 ? 12.070 75.499 6.592 1.00 30.58 ? 105 ILE A C 1 ATOM 829 O O . ILE A 1 105 ? 12.954 75.541 7.452 1.00 28.00 ? 105 ILE A O 1 ATOM 830 C CB . ILE A 1 105 ? 10.566 77.403 6.208 1.00 32.43 ? 105 ILE A CB 1 ATOM 831 C CG1 . ILE A 1 105 ? 11.734 78.271 6.653 1.00 41.27 ? 105 ILE A CG1 1 ATOM 832 C CG2 . ILE A 1 105 ? 9.227 78.041 6.540 1.00 27.70 ? 105 ILE A CG2 1 ATOM 833 C CD1 . ILE A 1 105 ? 11.699 79.653 6.066 1.00 45.91 ? 105 ILE A CD1 1 ATOM 834 N N . GLU A 1 106 ? 12.240 74.995 5.377 1.00 28.72 ? 106 GLU A N 1 ATOM 835 C CA . GLU A 1 106 ? 13.502 74.461 4.909 1.00 34.59 ? 106 GLU A CA 1 ATOM 836 C C . GLU A 1 106 ? 13.576 74.878 3.449 1.00 38.78 ? 106 GLU A C 1 ATOM 837 O O . GLU A 1 106 ? 12.701 74.530 2.652 1.00 39.64 ? 106 GLU A O 1 ATOM 838 C CB . GLU A 1 106 ? 13.501 72.946 5.046 1.00 35.91 ? 106 GLU A CB 1 ATOM 839 C CG . GLU A 1 106 ? 14.736 72.267 4.506 1.00 52.83 ? 106 GLU A CG 1 ATOM 840 C CD . GLU A 1 106 ? 14.825 70.812 4.933 1.00 64.04 ? 106 GLU A CD 1 ATOM 841 O OE1 . GLU A 1 106 ? 13.790 70.106 4.888 1.00 69.04 ? 106 GLU A OE1 1 ATOM 842 O OE2 . GLU A 1 106 ? 15.934 70.373 5.308 1.00 67.73 ? 106 GLU A OE2 1 ATOM 843 N N . ASN A 1 107 ? 14.600 75.654 3.107 1.00 45.26 ? 107 ASN A N 1 ATOM 844 C CA . ASN A 1 107 ? 14.764 76.122 1.739 1.00 42.37 ? 107 ASN A CA 1 ATOM 845 C C . ASN A 1 107 ? 13.591 77.034 1.427 1.00 39.09 ? 107 ASN A C 1 ATOM 846 O O . ASN A 1 107 ? 12.860 76.810 0.467 1.00 42.87 ? 107 ASN A O 1 ATOM 847 C CB . ASN A 1 107 ? 14.773 74.938 0.767 1.00 69.36 ? 107 ASN A CB 1 ATOM 848 C CG . ASN A 1 107 ? 15.763 73.851 1.172 1.00 81.02 ? 107 ASN A CG 1 ATOM 849 O OD1 . ASN A 1 107 ? 15.810 72.786 0.559 1.00 82.51 ? 107 ASN A OD1 1 ATOM 850 N ND2 . ASN A 1 107 ? 16.557 74.117 2.206 1.00 83.42 ? 107 ASN A ND2 1 ATOM 851 N N . ASN A 1 108 ? 13.404 78.049 2.266 1.00 49.80 ? 108 ASN A N 1 ATOM 852 C CA . ASN A 1 108 ? 12.326 79.017 2.098 1.00 57.61 ? 108 ASN A CA 1 ATOM 853 C C . ASN A 1 108 ? 10.980 78.323 1.842 1.00 59.52 ? 108 ASN A C 1 ATOM 854 O O . ASN A 1 108 ? 10.002 78.946 1.446 1.00 57.88 ? 108 ASN A O 1 ATOM 855 C CB . ASN A 1 108 ? 12.714 79.999 0.978 1.00 43.03 ? 108 ASN A CB 1 ATOM 856 C CG . ASN A 1 108 ? 11.529 80.745 0.395 1.00 59.79 ? 108 ASN A CG 1 ATOM 857 O OD1 . ASN A 1 108 ? 10.708 80.153 -0.302 1.00 75.34 ? 108 ASN A OD1 1 ATOM 858 N ND2 . ASN A 1 108 ? 11.436 82.045 0.641 1.00 58.15 ? 108 ASN A ND2 1 ATOM 859 N N . ARG A 1 109 ? 10.921 77.024 2.105 1.00 41.73 ? 109 ARG A N 1 ATOM 860 C CA . ARG A 1 109 ? 9.682 76.282 1.925 1.00 46.63 ? 109 ARG A CA 1 ATOM 861 C C . ARG A 1 109 ? 9.155 75.782 3.279 1.00 39.57 ? 109 ARG A C 1 ATOM 862 O O . ARG A 1 109 ? 9.871 75.082 4.004 1.00 34.03 ? 109 ARG A O 1 ATOM 863 C CB . ARG A 1 109 ? 9.923 75.100 0.988 1.00 53.41 ? 109 ARG A CB 1 ATOM 864 C CG . ARG A 1 109 ? 10.270 75.500 -0.438 1.00 75.90 ? 109 ARG A CG 1 ATOM 865 C CD . ARG A 1 109 ? 9.026 75.865 -1.236 1.00 85.82 ? 109 ARG A CD 1 ATOM 866 N NE . ARG A 1 109 ? 9.343 76.212 -2.619 1.00 95.19 ? 109 ARG A NE 1 ATOM 867 C CZ . ARG A 1 109 ? 8.452 76.244 -3.605 1.00 100.36 ? 109 ARG A CZ 1 ATOM 868 N NH1 . ARG A 1 109 ? 7.184 75.947 -3.363 1.00 102.92 ? 109 ARG A NH1 1 ATOM 869 N NH2 . ARG A 1 109 ? 8.828 76.574 -4.833 1.00 100.52 ? 109 ARG A NH2 1 ATOM 870 N N . SER A 1 110 ? 7.918 76.162 3.622 1.00 19.44 ? 110 SER A N 1 ATOM 871 C CA . SER A 1 110 ? 7.282 75.737 4.873 1.00 19.07 ? 110 SER A CA 1 ATOM 872 C C . SER A 1 110 ? 7.365 74.232 4.923 1.00 21.38 ? 110 SER A C 1 ATOM 873 O O . SER A 1 110 ? 6.789 73.555 4.077 1.00 21.82 ? 110 SER A O 1 ATOM 874 C CB . SER A 1 110 ? 5.814 76.137 4.905 1.00 36.97 ? 110 SER A CB 1 ATOM 875 O OG . SER A 1 110 ? 5.666 77.526 4.701 1.00 39.04 ? 110 SER A OG 1 ATOM 876 N N . SER A 1 111 ? 8.069 73.714 5.925 1.00 19.27 ? 111 SER A N 1 ATOM 877 C CA . SER A 1 111 ? 8.264 72.282 6.062 1.00 17.70 ? 111 SER A CA 1 ATOM 878 C C . SER A 1 111 ? 7.571 71.618 7.249 1.00 17.70 ? 111 SER A C 1 ATOM 879 O O . SER A 1 111 ? 7.810 70.443 7.516 1.00 24.35 ? 111 SER A O 1 ATOM 880 C CB . SER A 1 111 ? 9.758 72.003 6.140 1.00 25.62 ? 111 SER A CB 1 ATOM 881 O OG . SER A 1 111 ? 10.327 72.665 7.251 1.00 30.72 ? 111 SER A OG 1 ATOM 882 N N . GLY A 1 112 ? 6.726 72.358 7.964 1.00 30.26 ? 112 GLY A N 1 ATOM 883 C CA . GLY A 1 112 ? 6.043 71.783 9.113 1.00 29.64 ? 112 GLY A CA 1 ATOM 884 C C . GLY A 1 112 ? 5.383 72.796 10.032 1.00 30.36 ? 112 GLY A C 1 ATOM 885 O O . GLY A 1 112 ? 5.716 73.979 10.003 1.00 28.88 ? 112 GLY A O 1 ATOM 886 N N . ALA A 1 113 ? 4.445 72.327 10.853 1.00 25.89 ? 113 ALA A N 1 ATOM 887 C CA . ALA A 1 113 ? 3.718 73.185 11.791 1.00 25.89 ? 113 ALA A CA 1 ATOM 888 C C . ALA A 1 113 ? 3.055 72.343 12.870 1.00 25.89 ? 113 ALA A C 1 ATOM 889 O O . ALA A 1 113 ? 2.726 71.186 12.647 1.00 25.89 ? 113 ALA A O 1 ATOM 890 C CB . ALA A 1 113 ? 2.672 73.987 11.059 1.00 3.74 ? 113 ALA A CB 1 ATOM 891 N N . PHE A 1 114 ? 2.837 72.923 14.038 1.00 15.93 ? 114 PHE A N 1 ATOM 892 C CA . PHE A 1 114 ? 2.236 72.169 15.117 1.00 15.93 ? 114 PHE A CA 1 ATOM 893 C C . PHE A 1 114 ? 1.562 73.123 16.078 1.00 15.93 ? 114 PHE A C 1 ATOM 894 O O . PHE A 1 114 ? 1.858 74.316 16.085 1.00 15.93 ? 114 PHE A O 1 ATOM 895 C CB . PHE A 1 114 ? 3.328 71.360 15.832 1.00 4.95 ? 114 PHE A CB 1 ATOM 896 C CG . PHE A 1 114 ? 4.484 72.205 16.330 1.00 4.95 ? 114 PHE A CG 1 ATOM 897 C CD1 . PHE A 1 114 ? 4.407 72.868 17.555 1.00 4.95 ? 114 PHE A CD1 1 ATOM 898 C CD2 . PHE A 1 114 ? 5.610 72.410 15.529 1.00 4.95 ? 114 PHE A CD2 1 ATOM 899 C CE1 . PHE A 1 114 ? 5.431 73.731 17.970 1.00 4.95 ? 114 PHE A CE1 1 ATOM 900 C CE2 . PHE A 1 114 ? 6.624 73.262 15.934 1.00 4.96 ? 114 PHE A CE2 1 ATOM 901 C CZ . PHE A 1 114 ? 6.535 73.929 17.160 1.00 4.95 ? 114 PHE A CZ 1 ATOM 902 N N . TRP A 1 115 ? 0.656 72.595 16.891 1.00 19.60 ? 115 TRP A N 1 ATOM 903 C CA . TRP A 1 115 ? -0.064 73.404 17.865 1.00 19.60 ? 115 TRP A CA 1 ATOM 904 C C . TRP A 1 115 ? -0.741 72.432 18.823 1.00 19.60 ? 115 TRP A C 1 ATOM 905 O O . TRP A 1 115 ? -1.804 71.885 18.529 1.00 19.60 ? 115 TRP A O 1 ATOM 906 C CB . TRP A 1 115 ? -1.107 74.261 17.157 1.00 18.11 ? 115 TRP A CB 1 ATOM 907 C CG . TRP A 1 115 ? -1.654 75.370 17.984 1.00 18.11 ? 115 TRP A CG 1 ATOM 908 C CD1 . TRP A 1 115 ? -1.550 75.527 19.341 1.00 18.11 ? 115 TRP A CD1 1 ATOM 909 C CD2 . TRP A 1 115 ? -2.415 76.486 17.511 1.00 18.11 ? 115 TRP A CD2 1 ATOM 910 N NE1 . TRP A 1 115 ? -2.199 76.674 19.736 1.00 18.11 ? 115 TRP A NE1 1 ATOM 911 C CE2 . TRP A 1 115 ? -2.738 77.280 18.630 1.00 18.11 ? 115 TRP A CE2 1 ATOM 912 C CE3 . TRP A 1 115 ? -2.861 76.892 16.244 1.00 18.11 ? 115 TRP A CE3 1 ATOM 913 C CZ2 . TRP A 1 115 ? -3.485 78.456 18.517 1.00 18.11 ? 115 TRP A CZ2 1 ATOM 914 C CZ3 . TRP A 1 115 ? -3.609 78.063 16.138 1.00 18.11 ? 115 TRP A CZ3 1 ATOM 915 C CH2 . TRP A 1 115 ? -3.909 78.826 17.266 1.00 18.11 ? 115 TRP A CH2 1 ATOM 916 N N . LYS A 1 116 ? -0.131 72.229 19.981 1.00 16.52 ? 116 LYS A N 1 ATOM 917 C CA . LYS A 1 116 ? -0.667 71.281 20.934 1.00 16.52 ? 116 LYS A CA 1 ATOM 918 C C . LYS A 1 116 ? -0.599 71.747 22.379 1.00 16.52 ? 116 LYS A C 1 ATOM 919 O O . LYS A 1 116 ? 0.271 72.543 22.747 1.00 16.52 ? 116 LYS A O 1 ATOM 920 C CB . LYS A 1 116 ? 0.107 69.986 20.779 1.00 11.26 ? 116 LYS A CB 1 ATOM 921 C CG . LYS A 1 116 ? -0.371 68.830 21.615 1.00 11.26 ? 116 LYS A CG 1 ATOM 922 C CD . LYS A 1 116 ? 0.637 67.725 21.486 1.00 11.26 ? 116 LYS A CD 1 ATOM 923 C CE . LYS A 1 116 ? 0.179 66.465 22.129 1.00 11.26 ? 116 LYS A CE 1 ATOM 924 N NZ . LYS A 1 116 ? 1.198 65.426 21.836 1.00 11.26 ? 116 LYS A NZ 1 ATOM 925 N N . TYR A 1 117 ? -1.517 71.235 23.197 1.00 16.65 ? 117 TYR A N 1 ATOM 926 C CA . TYR A 1 117 ? -1.555 71.568 24.618 1.00 16.65 ? 117 TYR A CA 1 ATOM 927 C C . TYR A 1 117 ? -1.416 70.333 25.507 1.00 16.65 ? 117 TYR A C 1 ATOM 928 O O . TYR A 1 117 ? -1.747 69.213 25.112 1.00 16.65 ? 117 TYR A O 1 ATOM 929 C CB . TYR A 1 117 ? -2.856 72.286 24.976 1.00 25.64 ? 117 TYR A CB 1 ATOM 930 C CG . TYR A 1 117 ? -3.037 73.620 24.296 1.00 25.64 ? 117 TYR A CG 1 ATOM 931 C CD1 . TYR A 1 117 ? -3.256 73.700 22.925 1.00 25.64 ? 117 TYR A CD1 1 ATOM 932 C CD2 . TYR A 1 117 ? -3.004 74.802 25.023 1.00 25.64 ? 117 TYR A CD2 1 ATOM 933 C CE1 . TYR A 1 117 ? -3.442 74.924 22.299 1.00 25.64 ? 117 TYR A CE1 1 ATOM 934 C CE2 . TYR A 1 117 ? -3.183 76.025 24.407 1.00 25.64 ? 117 TYR A CE2 1 ATOM 935 C CZ . TYR A 1 117 ? -3.403 76.081 23.048 1.00 25.64 ? 117 TYR A CZ 1 ATOM 936 O OH . TYR A 1 117 ? -3.579 77.293 22.424 1.00 25.64 ? 117 TYR A OH 1 ATOM 937 N N . TYR A 1 118 ? -0.911 70.552 26.715 1.00 17.57 ? 118 TYR A N 1 ATOM 938 C CA . TYR A 1 118 ? -0.745 69.474 27.673 1.00 17.57 ? 118 TYR A CA 1 ATOM 939 C C . TYR A 1 118 ? -1.268 69.957 29.017 1.00 17.57 ? 118 TYR A C 1 ATOM 940 O O . TYR A 1 118 ? -0.931 71.054 29.478 1.00 17.57 ? 118 TYR A O 1 ATOM 941 C CB . TYR A 1 118 ? 0.725 69.076 27.819 1.00 11.58 ? 118 TYR A CB 1 ATOM 942 C CG . TYR A 1 118 ? 1.439 68.851 26.521 1.00 11.58 ? 118 TYR A CG 1 ATOM 943 C CD1 . TYR A 1 118 ? 1.783 69.929 25.695 1.00 11.58 ? 118 TYR A CD1 1 ATOM 944 C CD2 . TYR A 1 118 ? 1.792 67.565 26.112 1.00 11.58 ? 118 TYR A CD2 1 ATOM 945 C CE1 . TYR A 1 118 ? 2.464 69.737 24.501 1.00 11.58 ? 118 TYR A CE1 1 ATOM 946 C CE2 . TYR A 1 118 ? 2.477 67.354 24.912 1.00 11.58 ? 118 TYR A CE2 1 ATOM 947 C CZ . TYR A 1 118 ? 2.807 68.446 24.118 1.00 11.58 ? 118 TYR A CZ 1 ATOM 948 O OH . TYR A 1 118 ? 3.464 68.251 22.937 1.00 11.58 ? 118 TYR A OH 1 ATOM 949 N N . TYR A 1 119 ? -2.106 69.136 29.635 1.00 20.14 ? 119 TYR A N 1 ATOM 950 C CA . TYR A 1 119 ? -2.658 69.478 30.924 1.00 20.14 ? 119 TYR A CA 1 ATOM 951 C C . TYR A 1 119 ? -2.064 68.512 31.923 1.00 20.14 ? 119 TYR A C 1 ATOM 952 O O . TYR A 1 119 ? -2.135 67.305 31.740 1.00 20.14 ? 119 TYR A O 1 ATOM 953 C CB . TYR A 1 119 ? -4.174 69.360 30.902 1.00 16.11 ? 119 TYR A CB 1 ATOM 954 C CG . TYR A 1 119 ? -4.799 69.611 32.241 1.00 16.11 ? 119 TYR A CG 1 ATOM 955 C CD1 . TYR A 1 119 ? -4.589 70.803 32.912 1.00 16.11 ? 119 TYR A CD1 1 ATOM 956 C CD2 . TYR A 1 119 ? -5.593 68.656 32.841 1.00 16.11 ? 119 TYR A CD2 1 ATOM 957 C CE1 . TYR A 1 119 ? -5.162 71.038 34.161 1.00 16.11 ? 119 TYR A CE1 1 ATOM 958 C CE2 . TYR A 1 119 ? -6.168 68.877 34.079 1.00 16.11 ? 119 TYR A CE2 1 ATOM 959 C CZ . TYR A 1 119 ? -5.950 70.070 34.738 1.00 18.73 ? 119 TYR A CZ 1 ATOM 960 O OH . TYR A 1 119 ? -6.524 70.284 35.973 1.00 17.13 ? 119 TYR A OH 1 ATOM 961 N N . ASP A 1 120 ? -1.473 69.055 32.980 1.00 18.04 ? 120 ASP A N 1 ATOM 962 C CA . ASP A 1 120 ? -0.827 68.248 34.005 1.00 18.04 ? 120 ASP A CA 1 ATOM 963 C C . ASP A 1 120 ? 0.086 67.197 33.374 1.00 18.04 ? 120 ASP A C 1 ATOM 964 O O . ASP A 1 120 ? 0.183 66.053 33.841 1.00 18.04 ? 120 ASP A O 1 ATOM 965 C CB . ASP A 1 120 ? -1.865 67.600 34.924 1.00 23.48 ? 120 ASP A CB 1 ATOM 966 C CG . ASP A 1 120 ? -2.499 68.600 35.893 1.00 23.48 ? 120 ASP A CG 1 ATOM 967 O OD1 . ASP A 1 120 ? -1.955 69.726 36.048 1.00 23.48 ? 120 ASP A OD1 1 ATOM 968 O OD2 . ASP A 1 120 ? -3.535 68.248 36.506 1.00 23.48 ? 120 ASP A OD2 1 ATOM 969 N N . GLY A 1 121 ? 0.743 67.609 32.292 1.00 9.99 ? 121 GLY A N 1 ATOM 970 C CA . GLY A 1 121 ? 1.688 66.745 31.613 1.00 9.99 ? 121 GLY A CA 1 ATOM 971 C C . GLY A 1 121 ? 1.175 65.831 30.530 1.00 9.99 ? 121 GLY A C 1 ATOM 972 O O . GLY A 1 121 ? 1.952 65.402 29.691 1.00 9.99 ? 121 GLY A O 1 ATOM 973 N N . LYS A 1 122 ? -0.116 65.522 30.539 1.00 16.44 ? 122 LYS A N 1 ATOM 974 C CA . LYS A 1 122 ? -0.672 64.617 29.549 1.00 16.44 ? 122 LYS A CA 1 ATOM 975 C C . LYS A 1 122 ? -1.234 65.413 28.391 1.00 16.44 ? 122 LYS A C 1 ATOM 976 O O . LYS A 1 122 ? -1.602 66.584 28.549 1.00 16.44 ? 122 LYS A O 1 ATOM 977 C CB . LYS A 1 122 ? -1.793 63.755 30.145 1.00 18.95 ? 122 LYS A CB 1 ATOM 978 C CG . LYS A 1 122 ? -1.582 63.260 31.555 1.00 22.16 ? 122 LYS A CG 1 ATOM 979 C CD . LYS A 1 122 ? -2.299 64.196 32.539 1.00 54.12 ? 122 LYS A CD 1 ATOM 980 C CE . LYS A 1 122 ? -2.227 63.723 34.000 1.00 64.53 ? 122 LYS A CE 1 ATOM 981 N NZ . LYS A 1 122 ? -0.882 63.888 34.640 1.00 50.38 ? 122 LYS A NZ 1 ATOM 982 N N . ASP A 1 123 ? -1.304 64.764 27.230 1.00 22.51 ? 123 ASP A N 1 ATOM 983 C CA . ASP A 1 123 ? -1.838 65.398 26.038 1.00 22.51 ? 123 ASP A CA 1 ATOM 984 C C . ASP A 1 123 ? -3.244 65.886 26.305 1.00 22.51 ? 123 ASP A C 1 ATOM 985 O O . ASP A 1 123 ? -4.097 65.118 26.717 1.00 22.51 ? 123 ASP A O 1 ATOM 986 C CB . ASP A 1 123 ? -1.866 64.417 24.873 1.00 30.87 ? 123 ASP A CB 1 ATOM 987 C CG . ASP A 1 123 ? -0.483 64.083 24.358 1.00 30.87 ? 123 ASP A CG 1 ATOM 988 O OD1 . ASP A 1 123 ? 0.506 64.681 24.844 1.00 30.87 ? 123 ASP A OD1 1 ATOM 989 O OD2 . ASP A 1 123 ? -0.388 63.225 23.457 1.00 30.87 ? 123 ASP A OD2 1 ATOM 990 N N . TYR A 1 124 ? -3.487 67.168 26.076 1.00 17.87 ? 124 TYR A N 1 ATOM 991 C CA . TYR A 1 124 ? -4.813 67.709 26.299 1.00 17.87 ? 124 TYR A CA 1 ATOM 992 C C . TYR A 1 124 ? -5.579 67.849 24.986 1.00 17.87 ? 124 TYR A C 1 ATOM 993 O O . TYR A 1 124 ? -6.673 67.315 24.842 1.00 17.87 ? 124 TYR A O 1 ATOM 994 C CB . TYR A 1 124 ? -4.733 69.078 27.007 1.00 11.45 ? 124 TYR A CB 1 ATOM 995 C CG . TYR A 1 124 ? -6.102 69.605 27.414 1.00 11.45 ? 124 TYR A CG 1 ATOM 996 C CD1 . TYR A 1 124 ? -6.893 68.906 28.333 1.00 11.45 ? 124 TYR A CD1 1 ATOM 997 C CD2 . TYR A 1 124 ? -6.643 70.741 26.808 1.00 11.45 ? 124 TYR A CD2 1 ATOM 998 C CE1 . TYR A 1 124 ? -8.183 69.317 28.625 1.00 11.45 ? 124 TYR A CE1 1 ATOM 999 C CE2 . TYR A 1 124 ? -7.930 71.160 27.095 1.00 11.45 ? 124 TYR A CE2 1 ATOM 1000 C CZ . TYR A 1 124 ? -8.694 70.442 28.000 1.00 11.45 ? 124 TYR A CZ 1 ATOM 1001 O OH . TYR A 1 124 ? -9.976 70.844 28.271 1.00 11.45 ? 124 TYR A OH 1 ATOM 1002 N N . ILE A 1 125 ? -4.993 68.568 24.033 1.00 18.34 ? 125 ILE A N 1 ATOM 1003 C CA . ILE A 1 125 ? -5.637 68.804 22.750 1.00 18.34 ? 125 ILE A CA 1 ATOM 1004 C C . ILE A 1 125 ? -4.636 69.346 21.721 1.00 18.34 ? 125 ILE A C 1 ATOM 1005 O O . ILE A 1 125 ? -3.661 70.012 22.079 1.00 18.34 ? 125 ILE A O 1 ATOM 1006 C CB . ILE A 1 125 ? -6.792 69.812 22.937 1.00 24.69 ? 125 ILE A CB 1 ATOM 1007 C CG1 . ILE A 1 125 ? -7.636 69.903 21.671 1.00 24.69 ? 125 ILE A CG1 1 ATOM 1008 C CG2 . ILE A 1 125 ? -6.231 71.182 23.311 1.00 24.69 ? 125 ILE A CG2 1 ATOM 1009 C CD1 . ILE A 1 125 ? -8.902 70.723 21.861 1.00 24.69 ? 125 ILE A CD1 1 ATOM 1010 N N . GLU A 1 126 ? -4.873 69.055 20.446 1.00 14.73 ? 126 GLU A N 1 ATOM 1011 C CA . GLU A 1 126 ? -3.992 69.529 19.384 1.00 14.73 ? 126 GLU A CA 1 ATOM 1012 C C . GLU A 1 126 ? -4.818 69.887 18.155 1.00 14.73 ? 126 GLU A C 1 ATOM 1013 O O . GLU A 1 126 ? -5.982 69.511 18.039 1.00 14.73 ? 126 GLU A O 1 ATOM 1014 C CB . GLU A 1 126 ? -2.964 68.462 19.018 1.00 34.84 ? 126 GLU A CB 1 ATOM 1015 C CG . GLU A 1 126 ? -3.549 67.282 18.279 1.00 34.84 ? 126 GLU A CG 1 ATOM 1016 C CD . GLU A 1 126 ? -2.530 66.188 17.999 1.00 40.04 ? 126 GLU A CD 1 ATOM 1017 O OE1 . GLU A 1 126 ? -2.938 65.121 17.483 1.00 34.84 ? 126 GLU A OE1 1 ATOM 1018 O OE2 . GLU A 1 126 ? -1.326 66.390 18.289 1.00 34.84 ? 126 GLU A OE2 1 ATOM 1019 N N . PHE A 1 127 ? -4.201 70.618 17.235 1.00 20.94 ? 127 PHE A N 1 ATOM 1020 C CA . PHE A 1 127 ? -4.868 71.057 16.022 1.00 20.94 ? 127 PHE A CA 1 ATOM 1021 C C . PHE A 1 127 ? -4.348 70.300 14.819 1.00 20.94 ? 127 PHE A C 1 ATOM 1022 O O . PHE A 1 127 ? -3.140 70.100 14.674 1.00 20.94 ? 127 PHE A O 1 ATOM 1023 C CB . PHE A 1 127 ? -4.623 72.553 15.797 1.00 11.11 ? 127 PHE A CB 1 ATOM 1024 C CG . PHE A 1 127 ? -5.455 73.152 14.684 1.00 11.11 ? 127 PHE A CG 1 ATOM 1025 C CD1 . PHE A 1 127 ? -6.839 73.312 14.835 1.00 11.11 ? 127 PHE A CD1 1 ATOM 1026 C CD2 . PHE A 1 127 ? -4.854 73.567 13.486 1.00 11.11 ? 127 PHE A CD2 1 ATOM 1027 C CE1 . PHE A 1 127 ? -7.604 73.872 13.817 1.00 11.11 ? 127 PHE A CE1 1 ATOM 1028 C CE2 . PHE A 1 127 ? -5.611 74.129 12.458 1.00 11.11 ? 127 PHE A CE2 1 ATOM 1029 C CZ . PHE A 1 127 ? -6.991 74.283 12.622 1.00 11.11 ? 127 PHE A CZ 1 ATOM 1030 N N . ASN A 1 128 ? -5.271 69.872 13.963 1.00 15.88 ? 128 ASN A N 1 ATOM 1031 C CA . ASN A 1 128 ? -4.924 69.178 12.734 1.00 15.88 ? 128 ASN A CA 1 ATOM 1032 C C . ASN A 1 128 ? -5.435 70.112 11.653 1.00 15.88 ? 128 ASN A C 1 ATOM 1033 O O . ASN A 1 128 ? -6.637 70.161 11.375 1.00 15.88 ? 128 ASN A O 1 ATOM 1034 C CB . ASN A 1 128 ? -5.641 67.836 12.645 1.00 20.12 ? 128 ASN A CB 1 ATOM 1035 C CG . ASN A 1 128 ? -5.159 66.994 11.478 1.00 20.12 ? 128 ASN A CG 1 ATOM 1036 O OD1 . ASN A 1 128 ? -5.062 67.471 10.354 1.00 20.12 ? 128 ASN A OD1 1 ATOM 1037 N ND2 . ASN A 1 128 ? -4.867 65.731 11.741 1.00 20.12 ? 128 ASN A ND2 1 ATOM 1038 N N . LYS A 1 129 ? -4.520 70.875 11.062 1.00 27.56 ? 129 LYS A N 1 ATOM 1039 C CA . LYS A 1 129 ? -4.893 71.822 10.019 1.00 27.56 ? 129 LYS A CA 1 ATOM 1040 C C . LYS A 1 129 ? -5.368 71.166 8.717 1.00 27.56 ? 129 LYS A C 1 ATOM 1041 O O . LYS A 1 129 ? -5.760 71.853 7.779 1.00 27.56 ? 129 LYS A O 1 ATOM 1042 C CB . LYS A 1 129 ? -3.728 72.761 9.734 1.00 24.46 ? 129 LYS A CB 1 ATOM 1043 C CG . LYS A 1 129 ? -2.524 72.061 9.173 1.00 24.46 ? 129 LYS A CG 1 ATOM 1044 C CD . LYS A 1 129 ? -1.369 73.031 8.990 1.00 24.46 ? 129 LYS A CD 1 ATOM 1045 C CE . LYS A 1 129 ? -0.207 72.352 8.301 1.00 27.67 ? 129 LYS A CE 1 ATOM 1046 N NZ . LYS A 1 129 ? -0.634 71.833 6.969 1.00 33.81 ? 129 LYS A NZ 1 ATOM 1047 N N . GLU A 1 130 ? -5.351 69.841 8.659 1.00 26.08 ? 130 GLU A N 1 ATOM 1048 C CA . GLU A 1 130 ? -5.797 69.169 7.457 1.00 26.08 ? 130 GLU A CA 1 ATOM 1049 C C . GLU A 1 130 ? -7.307 68.954 7.400 1.00 26.08 ? 130 GLU A C 1 ATOM 1050 O O . GLU A 1 130 ? -7.864 68.837 6.306 1.00 26.08 ? 130 GLU A O 1 ATOM 1051 C CB . GLU A 1 130 ? -5.093 67.828 7.289 1.00 26.11 ? 130 GLU A CB 1 ATOM 1052 C CG . GLU A 1 130 ? -5.471 67.123 5.998 1.00 28.53 ? 130 GLU A CG 1 ATOM 1053 C CD . GLU A 1 130 ? -4.618 65.901 5.718 1.00 34.54 ? 130 GLU A CD 1 ATOM 1054 O OE1 . GLU A 1 130 ? -5.094 64.760 5.896 1.00 26.11 ? 130 GLU A OE1 1 ATOM 1055 O OE2 . GLU A 1 130 ? -3.452 66.083 5.321 1.00 26.11 ? 130 GLU A OE2 1 ATOM 1056 N N . ILE A 1 131 ? -7.973 68.897 8.556 1.00 27.49 ? 131 ILE A N 1 ATOM 1057 C CA . ILE A 1 131 ? -9.419 68.690 8.565 1.00 27.49 ? 131 ILE A CA 1 ATOM 1058 C C . ILE A 1 131 ? -10.162 69.923 8.059 1.00 27.49 ? 131 ILE A C 1 ATOM 1059 O O . ILE A 1 131 ? -10.979 69.821 7.147 1.00 27.49 ? 131 ILE A O 1 ATOM 1060 C CB . ILE A 1 131 ? -9.961 68.320 9.977 1.00 12.44 ? 131 ILE A CB 1 ATOM 1061 C CG1 . ILE A 1 131 ? -9.602 66.873 10.331 1.00 12.44 ? 131 ILE A CG1 1 ATOM 1062 C CG2 . ILE A 1 131 ? -11.491 68.491 10.015 1.00 12.44 ? 131 ILE A CG2 1 ATOM 1063 C CD1 . ILE A 1 131 ? -8.146 66.631 10.499 1.00 12.44 ? 131 ILE A CD1 1 ATOM 1064 N N . PRO A 1 132 ? -9.921 71.101 8.658 1.00 30.07 ? 132 PRO A N 1 ATOM 1065 C CA . PRO A 1 132 ? -9.041 71.460 9.770 1.00 30.07 ? 132 PRO A CA 1 ATOM 1066 C C . PRO A 1 132 ? -9.899 71.429 11.017 1.00 30.07 ? 132 PRO A C 1 ATOM 1067 O O . PRO A 1 132 ? -11.075 71.783 10.963 1.00 30.07 ? 132 PRO A O 1 ATOM 1068 C CB . PRO A 1 132 ? -8.617 72.875 9.412 1.00 10.43 ? 132 PRO A CB 1 ATOM 1069 C CG . PRO A 1 132 ? -9.875 73.448 8.885 1.00 10.43 ? 132 PRO A CG 1 ATOM 1070 C CD . PRO A 1 132 ? -10.432 72.319 8.007 1.00 10.43 ? 132 PRO A CD 1 ATOM 1071 N N . ALA A 1 133 ? -9.320 71.020 12.138 1.00 27.73 ? 133 ALA A N 1 ATOM 1072 C CA . ALA A 1 133 ? -10.084 70.934 13.380 1.00 27.73 ? 133 ALA A CA 1 ATOM 1073 C C . ALA A 1 133 ? -9.221 70.606 14.590 1.00 27.73 ? 133 ALA A C 1 ATOM 1074 O O . ALA A 1 133 ? -8.045 70.256 14.453 1.00 27.73 ? 133 ALA A O 1 ATOM 1075 C CB . ALA A 1 133 ? -11.146 69.880 13.232 1.00 2.35 ? 133 ALA A CB 1 ATOM 1076 N N . TRP A 1 134 ? -9.816 70.712 15.776 1.00 21.48 ? 134 TRP A N 1 ATOM 1077 C CA . TRP A 1 134 ? -9.101 70.389 17.007 1.00 21.48 ? 134 TRP A CA 1 ATOM 1078 C C . TRP A 1 134 ? -9.320 68.922 17.354 1.00 21.48 ? 134 TRP A C 1 ATOM 1079 O O . TRP A 1 134 ? -10.399 68.384 17.152 1.00 21.48 ? 134 TRP A O 1 ATOM 1080 C CB . TRP A 1 134 ? -9.567 71.281 18.171 1.00 12.70 ? 134 TRP A CB 1 ATOM 1081 C CG . TRP A 1 134 ? -9.065 72.713 18.068 1.00 12.70 ? 134 TRP A CG 1 ATOM 1082 C CD1 . TRP A 1 134 ? -9.737 73.782 17.545 1.00 12.70 ? 134 TRP A CD1 1 ATOM 1083 C CD2 . TRP A 1 134 ? -7.751 73.191 18.391 1.00 12.70 ? 134 TRP A CD2 1 ATOM 1084 N NE1 . TRP A 1 134 ? -8.926 74.892 17.510 1.00 12.70 ? 134 TRP A NE1 1 ATOM 1085 C CE2 . TRP A 1 134 ? -7.698 74.561 18.019 1.00 12.70 ? 134 TRP A CE2 1 ATOM 1086 C CE3 . TRP A 1 134 ? -6.613 72.597 18.949 1.00 12.70 ? 134 TRP A CE3 1 ATOM 1087 C CZ2 . TRP A 1 134 ? -6.543 75.353 18.184 1.00 12.70 ? 134 TRP A CZ2 1 ATOM 1088 C CZ3 . TRP A 1 134 ? -5.459 73.389 19.115 1.00 12.70 ? 134 TRP A CZ3 1 ATOM 1089 C CH2 . TRP A 1 134 ? -5.439 74.757 18.727 1.00 12.70 ? 134 TRP A CH2 1 ATOM 1090 N N . VAL A 1 135 ? -8.277 68.269 17.846 1.00 9.41 ? 135 VAL A N 1 ATOM 1091 C CA . VAL A 1 135 ? -8.366 66.868 18.243 1.00 9.41 ? 135 VAL A CA 1 ATOM 1092 C C . VAL A 1 135 ? -8.186 66.805 19.761 1.00 9.41 ? 135 VAL A C 1 ATOM 1093 O O . VAL A 1 135 ? -7.124 67.137 20.290 1.00 9.41 ? 135 VAL A O 1 ATOM 1094 C CB . VAL A 1 135 ? -7.277 66.009 17.542 1.00 10.63 ? 135 VAL A CB 1 ATOM 1095 C CG1 . VAL A 1 135 ? -7.339 64.561 18.044 1.00 10.63 ? 135 VAL A CG1 1 ATOM 1096 C CG2 . VAL A 1 135 ? -7.467 66.065 16.029 1.00 10.63 ? 135 VAL A CG2 1 ATOM 1097 N N . PRO A 1 136 ? -9.239 66.394 20.481 1.00 26.39 ? 136 PRO A N 1 ATOM 1098 C CA . PRO A 1 136 ? -9.199 66.297 21.943 1.00 26.39 ? 136 PRO A CA 1 ATOM 1099 C C . PRO A 1 136 ? -8.645 64.965 22.415 1.00 26.39 ? 136 PRO A C 1 ATOM 1100 O O . PRO A 1 136 ? -8.849 63.941 21.773 1.00 26.39 ? 136 PRO A O 1 ATOM 1101 C CB . PRO A 1 136 ? -10.659 66.472 22.330 1.00 3.72 ? 136 PRO A CB 1 ATOM 1102 C CG . PRO A 1 136 ? -11.361 65.709 21.236 1.00 3.72 ? 136 PRO A CG 1 ATOM 1103 C CD . PRO A 1 136 ? -10.577 66.048 19.962 1.00 3.72 ? 136 PRO A CD 1 ATOM 1104 N N . PHE A 1 137 ? -7.946 64.983 23.542 1.00 7.61 ? 137 PHE A N 1 ATOM 1105 C CA . PHE A 1 137 ? -7.379 63.770 24.109 1.00 7.61 ? 137 PHE A CA 1 ATOM 1106 C C . PHE A 1 137 ? -7.940 63.554 25.520 1.00 7.61 ? 137 PHE A C 1 ATOM 1107 O O . PHE A 1 137 ? -8.122 62.428 25.979 1.00 22.96 ? 137 PHE A O 1 ATOM 1108 C CB . PHE A 1 137 ? -5.850 63.865 24.115 1.00 16.30 ? 137 PHE A CB 1 ATOM 1109 C CG . PHE A 1 137 ? -5.261 64.028 22.749 1.00 16.30 ? 137 PHE A CG 1 ATOM 1110 C CD1 . PHE A 1 137 ? -5.465 63.055 21.769 1.00 16.30 ? 137 PHE A CD1 1 ATOM 1111 C CD2 . PHE A 1 137 ? -4.548 65.174 22.412 1.00 16.30 ? 137 PHE A CD2 1 ATOM 1112 C CE1 . PHE A 1 137 ? -4.973 63.223 20.464 1.00 16.30 ? 137 PHE A CE1 1 ATOM 1113 C CE2 . PHE A 1 137 ? -4.049 65.356 21.106 1.00 16.30 ? 137 PHE A CE2 1 ATOM 1114 C CZ . PHE A 1 137 ? -4.265 64.378 20.133 1.00 16.30 ? 137 PHE A CZ 1 ATOM 1115 N N . ASP A 1 138 ? -8.233 64.644 26.199 1.00 19.04 ? 138 ASP A N 1 ATOM 1116 C CA . ASP A 1 138 ? -8.793 64.558 27.530 1.00 19.04 ? 138 ASP A CA 1 ATOM 1117 C C . ASP A 1 138 ? -10.276 64.918 27.427 1.00 19.04 ? 138 ASP A C 1 ATOM 1118 O O . ASP A 1 138 ? -10.664 65.785 26.629 1.00 19.04 ? 138 ASP A O 1 ATOM 1119 C CB . ASP A 1 138 ? -8.053 65.523 28.443 1.00 21.80 ? 138 ASP A CB 1 ATOM 1120 C CG . ASP A 1 138 ? -8.730 65.697 29.764 1.00 22.45 ? 138 ASP A CG 1 ATOM 1121 O OD1 . ASP A 1 138 ? -9.817 66.305 29.784 1.00 21.80 ? 138 ASP A OD1 1 ATOM 1122 O OD2 . ASP A 1 138 ? -8.175 65.231 30.784 1.00 21.80 ? 138 ASP A OD2 1 ATOM 1123 N N . PRO A 1 139 ? -11.135 64.243 28.207 1.00 24.00 ? 139 PRO A N 1 ATOM 1124 C CA . PRO A 1 139 ? -12.576 64.525 28.176 1.00 24.00 ? 139 PRO A CA 1 ATOM 1125 C C . PRO A 1 139 ? -12.922 66.015 28.288 1.00 24.00 ? 139 PRO A C 1 ATOM 1126 O O . PRO A 1 139 ? -13.798 66.513 27.590 1.00 24.00 ? 139 PRO A O 1 ATOM 1127 C CB . PRO A 1 139 ? -13.119 63.685 29.338 1.00 2.35 ? 139 PRO A CB 1 ATOM 1128 C CG . PRO A 1 139 ? -11.928 63.427 30.195 1.00 9.66 ? 139 PRO A CG 1 ATOM 1129 C CD . PRO A 1 139 ? -10.837 63.199 29.194 1.00 2.35 ? 139 PRO A CD 1 ATOM 1130 N N . ALA A 1 140 ? -12.225 66.724 29.167 1.00 25.00 ? 140 ALA A N 1 ATOM 1131 C CA . ALA A 1 140 ? -12.452 68.150 29.327 1.00 25.00 ? 140 ALA A CA 1 ATOM 1132 C C . ALA A 1 140 ? -12.159 68.861 28.006 1.00 25.00 ? 140 ALA A C 1 ATOM 1133 O O . ALA A 1 140 ? -12.739 69.903 27.707 1.00 25.00 ? 140 ALA A O 1 ATOM 1134 C CB . ALA A 1 140 ? -11.550 68.699 30.422 1.00 10.65 ? 140 ALA A CB 1 ATOM 1135 N N . ALA A 1 141 ? -11.255 68.287 27.219 1.00 25.34 ? 141 ALA A N 1 ATOM 1136 C CA . ALA A 1 141 ? -10.864 68.873 25.946 1.00 25.34 ? 141 ALA A CA 1 ATOM 1137 C C . ALA A 1 141 ? -12.027 68.947 24.952 1.00 25.34 ? 141 ALA A C 1 ATOM 1138 O O . ALA A 1 141 ? -11.993 69.734 23.995 1.00 25.34 ? 141 ALA A O 1 ATOM 1139 C CB . ALA A 1 141 ? -9.696 68.097 25.363 1.00 2.35 ? 141 ALA A CB 1 ATOM 1140 N N . GLN A 1 142 ? -13.055 68.130 25.182 1.00 17.14 ? 142 GLN A N 1 ATOM 1141 C CA . GLN A 1 142 ? -14.239 68.134 24.325 1.00 17.14 ? 142 GLN A CA 1 ATOM 1142 C C . GLN A 1 142 ? -14.964 69.472 24.487 1.00 17.14 ? 142 GLN A C 1 ATOM 1143 O O . GLN A 1 142 ? -15.391 70.089 23.513 1.00 17.14 ? 142 GLN A O 1 ATOM 1144 C CB . GLN A 1 142 ? -15.164 66.995 24.706 1.00 16.74 ? 142 GLN A CB 1 ATOM 1145 C CG . GLN A 1 142 ? -14.633 65.641 24.359 1.00 16.74 ? 142 GLN A CG 1 ATOM 1146 C CD . GLN A 1 142 ? -15.481 64.546 24.966 1.00 16.74 ? 142 GLN A CD 1 ATOM 1147 O OE1 . GLN A 1 142 ? -16.709 64.647 24.991 1.00 16.74 ? 142 GLN A OE1 1 ATOM 1148 N NE2 . GLN A 1 142 ? -14.836 63.489 25.459 1.00 16.74 ? 142 GLN A NE2 1 ATOM 1149 N N . ILE A 1 143 ? -15.103 69.905 25.732 1.00 16.78 ? 143 ILE A N 1 ATOM 1150 C CA . ILE A 1 143 ? -15.719 71.183 26.045 1.00 16.78 ? 143 ILE A CA 1 ATOM 1151 C C . ILE A 1 143 ? -14.906 72.307 25.384 1.00 16.78 ? 143 ILE A C 1 ATOM 1152 O O . ILE A 1 143 ? -15.461 73.247 24.808 1.00 16.78 ? 143 ILE A O 1 ATOM 1153 C CB . ILE A 1 143 ? -15.706 71.436 27.557 1.00 24.29 ? 143 ILE A CB 1 ATOM 1154 C CG1 . ILE A 1 143 ? -16.607 70.430 28.282 1.00 25.93 ? 143 ILE A CG1 1 ATOM 1155 C CG2 . ILE A 1 143 ? -16.095 72.872 27.830 1.00 24.29 ? 143 ILE A CG2 1 ATOM 1156 C CD1 . ILE A 1 143 ? -18.056 70.579 27.952 1.00 39.66 ? 143 ILE A CD1 1 ATOM 1157 N N . THR A 1 144 ? -13.583 72.215 25.487 1.00 23.12 ? 144 THR A N 1 ATOM 1158 C CA . THR A 1 144 ? -12.702 73.220 24.897 1.00 23.12 ? 144 THR A CA 1 ATOM 1159 C C . THR A 1 144 ? -12.872 73.240 23.390 1.00 23.12 ? 144 THR A C 1 ATOM 1160 O O . THR A 1 144 ? -12.933 74.305 22.781 1.00 23.12 ? 144 THR A O 1 ATOM 1161 C CB . THR A 1 144 ? -11.214 72.929 25.178 1.00 12.92 ? 144 THR A CB 1 ATOM 1162 O OG1 . THR A 1 144 ? -11.006 72.776 26.586 1.00 12.92 ? 144 THR A OG1 1 ATOM 1163 C CG2 . THR A 1 144 ? -10.343 74.067 24.656 1.00 12.92 ? 144 THR A CG2 1 ATOM 1164 N N . LYS A 1 145 ? -12.937 72.053 22.795 1.00 16.41 ? 145 LYS A N 1 ATOM 1165 C CA . LYS A 1 145 ? -13.081 71.945 21.349 1.00 16.41 ? 145 LYS A CA 1 ATOM 1166 C C . LYS A 1 145 ? -14.349 72.662 20.909 1.00 16.41 ? 145 LYS A C 1 ATOM 1167 O O . LYS A 1 145 ? -14.352 73.447 19.946 1.00 16.41 ? 145 LYS A O 1 ATOM 1168 C CB . LYS A 1 145 ? -13.123 70.465 20.931 1.00 9.33 ? 145 LYS A CB 1 ATOM 1169 C CG . LYS A 1 145 ? -13.200 70.205 19.414 1.00 9.33 ? 145 LYS A CG 1 ATOM 1170 C CD . LYS A 1 145 ? -13.011 68.717 19.106 1.00 9.33 ? 145 LYS A CD 1 ATOM 1171 C CE . LYS A 1 145 ? -13.678 68.304 17.801 1.00 9.33 ? 145 LYS A CE 1 ATOM 1172 N NZ . LYS A 1 145 ? -13.271 69.154 16.665 1.00 9.33 ? 145 LYS A NZ 1 ATOM 1173 N N . GLN A 1 146 ? -15.423 72.397 21.643 1.00 24.63 ? 146 GLN A N 1 ATOM 1174 C CA . GLN A 1 146 ? -16.708 72.996 21.346 1.00 24.63 ? 146 GLN A CA 1 ATOM 1175 C C . GLN A 1 146 ? -16.561 74.510 21.362 1.00 24.63 ? 146 GLN A C 1 ATOM 1176 O O . GLN A 1 146 ? -17.017 75.190 20.444 1.00 24.63 ? 146 GLN A O 1 ATOM 1177 C CB . GLN A 1 146 ? -17.754 72.531 22.368 1.00 20.99 ? 146 GLN A CB 1 ATOM 1178 C CG . GLN A 1 146 ? -19.118 72.240 21.758 1.00 39.86 ? 146 GLN A CG 1 ATOM 1179 C CD . GLN A 1 146 ? -19.105 71.085 20.735 1.00 53.44 ? 146 GLN A CD 1 ATOM 1180 O OE1 . GLN A 1 146 ? -18.099 70.841 20.043 1.00 43.65 ? 146 GLN A OE1 1 ATOM 1181 N NE2 . GLN A 1 146 ? -20.238 70.387 20.623 1.00 48.15 ? 146 GLN A NE2 1 ATOM 1182 N N . LYS A 1 147 ? -15.894 75.032 22.388 1.00 22.89 ? 147 LYS A N 1 ATOM 1183 C CA . LYS A 1 147 ? -15.712 76.476 22.499 1.00 22.89 ? 147 LYS A CA 1 ATOM 1184 C C . LYS A 1 147 ? -14.880 77.055 21.387 1.00 22.89 ? 147 LYS A C 1 ATOM 1185 O O . LYS A 1 147 ? -15.246 78.061 20.778 1.00 22.89 ? 147 LYS A O 1 ATOM 1186 C CB . LYS A 1 147 ? -15.074 76.855 23.834 1.00 50.11 ? 147 LYS A CB 1 ATOM 1187 C CG . LYS A 1 147 ? -16.020 76.693 24.994 1.00 54.65 ? 147 LYS A CG 1 ATOM 1188 C CD . LYS A 1 147 ? -15.512 77.378 26.239 1.00 62.83 ? 147 LYS A CD 1 ATOM 1189 C CE . LYS A 1 147 ? -16.423 77.079 27.420 1.00 61.31 ? 147 LYS A CE 1 ATOM 1190 N NZ . LYS A 1 147 ? -15.859 77.662 28.664 1.00 76.96 ? 147 LYS A NZ 1 ATOM 1191 N N . TRP A 1 148 ? -13.755 76.410 21.125 1.00 20.23 ? 148 TRP A N 1 ATOM 1192 C CA . TRP A 1 148 ? -12.844 76.867 20.103 1.00 20.23 ? 148 TRP A CA 1 ATOM 1193 C C . TRP A 1 148 ? -13.339 76.716 18.687 1.00 20.23 ? 148 TRP A C 1 ATOM 1194 O O . TRP A 1 148 ? -12.733 77.264 17.769 1.00 20.23 ? 148 TRP A O 1 ATOM 1195 C CB . TRP A 1 148 ? -11.514 76.155 20.259 1.00 16.51 ? 148 TRP A CB 1 ATOM 1196 C CG . TRP A 1 148 ? -10.777 76.579 21.490 1.00 16.51 ? 148 TRP A CG 1 ATOM 1197 C CD1 . TRP A 1 148 ? -11.196 77.476 22.449 1.00 16.51 ? 148 TRP A CD1 1 ATOM 1198 C CD2 . TRP A 1 148 ? -9.501 76.097 21.919 1.00 16.51 ? 148 TRP A CD2 1 ATOM 1199 N NE1 . TRP A 1 148 ? -10.253 77.573 23.444 1.00 16.51 ? 148 TRP A NE1 1 ATOM 1200 C CE2 . TRP A 1 148 ? -9.204 76.739 23.148 1.00 16.51 ? 148 TRP A CE2 1 ATOM 1201 C CE3 . TRP A 1 148 ? -8.581 75.182 21.391 1.00 16.51 ? 148 TRP A CE3 1 ATOM 1202 C CZ2 . TRP A 1 148 ? -8.021 76.489 23.853 1.00 16.51 ? 148 TRP A CZ2 1 ATOM 1203 C CZ3 . TRP A 1 148 ? -7.402 74.936 22.097 1.00 16.51 ? 148 TRP A CZ3 1 ATOM 1204 C CH2 . TRP A 1 148 ? -7.136 75.586 23.310 1.00 16.51 ? 148 TRP A CH2 1 ATOM 1205 N N . GLU A 1 149 ? -14.429 75.974 18.504 1.00 9.27 ? 149 GLU A N 1 ATOM 1206 C CA . GLU A 1 149 ? -14.989 75.778 17.172 1.00 9.27 ? 149 GLU A CA 1 ATOM 1207 C C . GLU A 1 149 ? -16.455 76.198 17.088 1.00 9.27 ? 149 GLU A C 1 ATOM 1208 O O . GLU A 1 149 ? -17.198 75.706 16.246 1.00 9.27 ? 149 GLU A O 1 ATOM 1209 C CB . GLU A 1 149 ? -14.835 74.316 16.749 1.00 30.32 ? 149 GLU A CB 1 ATOM 1210 C CG . GLU A 1 149 ? -13.403 73.824 16.768 1.00 30.32 ? 149 GLU A CG 1 ATOM 1211 C CD . GLU A 1 149 ? -13.282 72.347 16.421 1.00 30.32 ? 149 GLU A CD 1 ATOM 1212 O OE1 . GLU A 1 149 ? -14.283 71.615 16.587 1.00 30.32 ? 149 GLU A OE1 1 ATOM 1213 O OE2 . GLU A 1 149 ? -12.184 71.909 16.000 1.00 30.32 ? 149 GLU A OE2 1 ATOM 1214 N N . ALA A 1 150 ? -16.865 77.130 17.946 1.00 24.35 ? 150 ALA A N 1 ATOM 1215 C CA . ALA A 1 150 ? -18.254 77.589 17.962 1.00 24.35 ? 150 ALA A CA 1 ATOM 1216 C C . ALA A 1 150 ? -18.625 78.351 16.708 1.00 24.35 ? 150 ALA A C 1 ATOM 1217 O O . ALA A 1 150 ? -19.795 78.413 16.338 1.00 25.14 ? 150 ALA A O 1 ATOM 1218 C CB . ALA A 1 150 ? -18.495 78.433 19.150 1.00 2.35 ? 150 ALA A CB 1 ATOM 1219 N N . GLU A 1 151 ? -17.621 78.934 16.061 1.00 31.11 ? 151 GLU A N 1 ATOM 1220 C CA . GLU A 1 151 ? -17.817 79.677 14.823 1.00 31.11 ? 151 GLU A CA 1 ATOM 1221 C C . GLU A 1 151 ? -16.917 79.108 13.718 1.00 31.11 ? 151 GLU A C 1 ATOM 1222 O O . GLU A 1 151 ? -15.727 78.827 13.939 1.00 31.11 ? 151 GLU A O 1 ATOM 1223 C CB . GLU A 1 151 ? -17.498 81.159 15.026 1.00 32.55 ? 151 GLU A CB 1 ATOM 1224 C CG . GLU A 1 151 ? -18.387 81.873 16.026 1.00 45.64 ? 151 GLU A CG 1 ATOM 1225 C CD . GLU A 1 151 ? -19.859 81.522 15.870 1.00 59.44 ? 151 GLU A CD 1 ATOM 1226 O OE1 . GLU A 1 151 ? -20.332 81.366 14.726 1.00 51.92 ? 151 GLU A OE1 1 ATOM 1227 O OE2 . GLU A 1 151 ? -20.553 81.411 16.901 1.00 64.64 ? 151 GLU A OE2 1 ATOM 1228 N N . PRO A 1 152 ? -17.477 78.930 12.509 1.00 27.95 ? 152 PRO A N 1 ATOM 1229 C CA . PRO A 1 152 ? -16.772 78.399 11.339 1.00 32.31 ? 152 PRO A CA 1 ATOM 1230 C C . PRO A 1 152 ? -15.422 79.066 11.056 1.00 27.78 ? 152 PRO A C 1 ATOM 1231 O O . PRO A 1 152 ? -14.505 78.418 10.553 1.00 27.78 ? 152 PRO A O 1 ATOM 1232 C CB . PRO A 1 152 ? -17.764 78.635 10.215 1.00 15.07 ? 152 PRO A CB 1 ATOM 1233 C CG . PRO A 1 152 ? -19.056 78.471 10.889 1.00 14.93 ? 152 PRO A CG 1 ATOM 1234 C CD . PRO A 1 152 ? -18.874 79.232 12.168 1.00 15.54 ? 152 PRO A CD 1 ATOM 1235 N N . VAL A 1 153 ? -15.309 80.354 11.371 1.00 36.19 ? 153 VAL A N 1 ATOM 1236 C CA . VAL A 1 153 ? -14.075 81.110 11.141 1.00 36.19 ? 153 VAL A CA 1 ATOM 1237 C C . VAL A 1 153 ? -12.927 80.585 11.963 1.00 36.19 ? 153 VAL A C 1 ATOM 1238 O O . VAL A 1 153 ? -11.780 80.598 11.525 1.00 36.19 ? 153 VAL A O 1 ATOM 1239 C CB . VAL A 1 153 ? -14.196 82.574 11.577 1.00 45.69 ? 153 VAL A CB 1 ATOM 1240 C CG1 . VAL A 1 153 ? -13.470 83.471 10.594 1.00 59.36 ? 153 VAL A CG1 1 ATOM 1241 C CG2 . VAL A 1 153 ? -15.647 82.945 11.747 1.00 45.75 ? 153 VAL A CG2 1 ATOM 1242 N N . TYR A 1 154 ? -13.246 80.149 13.174 1.00 16.86 ? 154 TYR A N 1 ATOM 1243 C CA . TYR A 1 154 ? -12.239 79.683 14.110 1.00 16.86 ? 154 TYR A CA 1 ATOM 1244 C C . TYR A 1 154 ? -11.195 78.719 13.562 1.00 16.86 ? 154 TYR A C 1 ATOM 1245 O O . TYR A 1 154 ? -10.002 78.995 13.648 1.00 16.86 ? 154 TYR A O 1 ATOM 1246 C CB . TYR A 1 154 ? -12.922 79.096 15.347 1.00 16.10 ? 154 TYR A CB 1 ATOM 1247 C CG . TYR A 1 154 ? -13.739 80.098 16.130 1.00 16.10 ? 154 TYR A CG 1 ATOM 1248 C CD1 . TYR A 1 154 ? -13.742 81.452 15.786 1.00 19.30 ? 154 TYR A CD1 1 ATOM 1249 C CD2 . TYR A 1 154 ? -14.533 79.689 17.202 1.00 16.10 ? 154 TYR A CD2 1 ATOM 1250 C CE1 . TYR A 1 154 ? -14.524 82.379 16.487 1.00 16.10 ? 154 TYR A CE1 1 ATOM 1251 C CE2 . TYR A 1 154 ? -15.319 80.603 17.910 1.00 16.10 ? 154 TYR A CE2 1 ATOM 1252 C CZ . TYR A 1 154 ? -15.313 81.948 17.545 1.00 21.35 ? 154 TYR A CZ 1 ATOM 1253 O OH . TYR A 1 154 ? -16.121 82.844 18.210 1.00 24.08 ? 154 TYR A OH 1 ATOM 1254 N N . VAL A 1 155 ? -11.626 77.593 13.009 1.00 25.30 ? 155 VAL A N 1 ATOM 1255 C CA . VAL A 1 155 ? -10.668 76.642 12.468 1.00 25.30 ? 155 VAL A CA 1 ATOM 1256 C C . VAL A 1 155 ? -9.959 77.244 11.273 1.00 25.30 ? 155 VAL A C 1 ATOM 1257 O O . VAL A 1 155 ? -8.783 76.972 11.062 1.00 25.30 ? 155 VAL A O 1 ATOM 1258 C CB . VAL A 1 155 ? -11.336 75.331 12.040 1.00 23.37 ? 155 VAL A CB 1 ATOM 1259 C CG1 . VAL A 1 155 ? -12.072 74.722 13.229 1.00 23.37 ? 155 VAL A CG1 1 ATOM 1260 C CG2 . VAL A 1 155 ? -12.266 75.581 10.865 1.00 24.04 ? 155 VAL A CG2 1 ATOM 1261 N N . GLN A 1 156 ? -10.675 78.058 10.496 1.00 22.75 ? 156 GLN A N 1 ATOM 1262 C CA . GLN A 1 156 ? -10.095 78.723 9.331 1.00 22.75 ? 156 GLN A CA 1 ATOM 1263 C C . GLN A 1 156 ? -8.937 79.583 9.822 1.00 22.75 ? 156 GLN A C 1 ATOM 1264 O O . GLN A 1 156 ? -7.853 79.588 9.233 1.00 22.75 ? 156 GLN A O 1 ATOM 1265 C CB . GLN A 1 156 ? -11.132 79.601 8.627 1.00 28.21 ? 156 GLN A CB 1 ATOM 1266 C CG . GLN A 1 156 ? -12.310 78.839 8.026 1.00 28.21 ? 156 GLN A CG 1 ATOM 1267 C CD . GLN A 1 156 ? -13.355 79.754 7.368 1.00 43.28 ? 156 GLN A CD 1 ATOM 1268 O OE1 . GLN A 1 156 ? -13.659 80.834 7.880 1.00 35.79 ? 156 GLN A OE1 1 ATOM 1269 N NE2 . GLN A 1 156 ? -13.918 79.313 6.245 1.00 28.96 ? 156 GLN A NE2 1 ATOM 1270 N N . ARG A 1 157 ? -9.171 80.297 10.916 1.00 23.98 ? 157 ARG A N 1 ATOM 1271 C CA . ARG A 1 157 ? -8.151 81.143 11.517 1.00 23.98 ? 157 ARG A CA 1 ATOM 1272 C C . ARG A 1 157 ? -6.968 80.328 12.014 1.00 23.98 ? 157 ARG A C 1 ATOM 1273 O O . ARG A 1 157 ? -5.818 80.601 11.662 1.00 23.98 ? 157 ARG A O 1 ATOM 1274 C CB . ARG A 1 157 ? -8.727 81.921 12.689 1.00 19.86 ? 157 ARG A CB 1 ATOM 1275 C CG . ARG A 1 157 ? -9.569 83.110 12.301 1.00 20.29 ? 157 ARG A CG 1 ATOM 1276 C CD . ARG A 1 157 ? -10.017 83.825 13.542 1.00 22.47 ? 157 ARG A CD 1 ATOM 1277 N NE . ARG A 1 157 ? -10.782 85.028 13.256 1.00 19.86 ? 157 ARG A NE 1 ATOM 1278 C CZ . ARG A 1 157 ? -11.638 85.579 14.114 1.00 29.62 ? 157 ARG A CZ 1 ATOM 1279 N NH1 . ARG A 1 157 ? -11.827 85.022 15.307 1.00 19.86 ? 157 ARG A NH1 1 ATOM 1280 N NH2 . ARG A 1 157 ? -12.317 86.676 13.779 1.00 30.84 ? 157 ARG A NH2 1 ATOM 1281 N N . ALA A 1 158 ? -7.254 79.332 12.843 1.00 19.71 ? 158 ALA A N 1 ATOM 1282 C CA . ALA A 1 158 ? -6.203 78.486 13.382 1.00 19.71 ? 158 ALA A CA 1 ATOM 1283 C C . ALA A 1 158 ? -5.381 77.945 12.233 1.00 19.71 ? 158 ALA A C 1 ATOM 1284 O O . ALA A 1 158 ? -4.151 77.876 12.311 1.00 19.71 ? 158 ALA A O 1 ATOM 1285 C CB . ALA A 1 158 ? -6.796 77.343 14.184 1.00 5.66 ? 158 ALA A CB 1 ATOM 1286 N N . LYS A 1 159 ? -6.060 77.569 11.156 1.00 31.28 ? 159 LYS A N 1 ATOM 1287 C CA . LYS A 1 159 ? -5.371 77.036 9.998 1.00 31.28 ? 159 LYS A CA 1 ATOM 1288 C C . LYS A 1 159 ? -4.512 78.109 9.357 1.00 31.28 ? 159 LYS A C 1 ATOM 1289 O O . LYS A 1 159 ? -3.342 77.869 9.050 1.00 31.28 ? 159 LYS A O 1 ATOM 1290 C CB . LYS A 1 159 ? -6.370 76.497 8.985 1.00 12.08 ? 159 LYS A CB 1 ATOM 1291 C CG . LYS A 1 159 ? -5.713 75.856 7.787 1.00 12.08 ? 159 LYS A CG 1 ATOM 1292 C CD . LYS A 1 159 ? -6.750 75.248 6.879 1.00 12.08 ? 159 LYS A CD 1 ATOM 1293 C CE . LYS A 1 159 ? -6.155 74.838 5.552 1.00 12.08 ? 159 LYS A CE 1 ATOM 1294 N NZ . LYS A 1 159 ? -5.113 73.806 5.740 1.00 17.05 ? 159 LYS A NZ 1 ATOM 1295 N N . ALA A 1 160 ? -5.091 79.293 9.170 1.00 24.55 ? 160 ALA A N 1 ATOM 1296 C CA . ALA A 1 160 ? -4.383 80.418 8.555 1.00 24.55 ? 160 ALA A CA 1 ATOM 1297 C C . ALA A 1 160 ? -3.119 80.806 9.309 1.00 24.55 ? 160 ALA A C 1 ATOM 1298 O O . ALA A 1 160 ? -2.103 81.184 8.708 1.00 24.55 ? 160 ALA A O 1 ATOM 1299 C CB . ALA A 1 160 ? -5.292 81.599 8.473 1.00 16.50 ? 160 ALA A CB 1 ATOM 1300 N N . TYR A 1 161 ? -3.198 80.735 10.634 1.00 20.14 ? 161 TYR A N 1 ATOM 1301 C CA . TYR A 1 161 ? -2.056 81.052 11.478 1.00 20.14 ? 161 TYR A CA 1 ATOM 1302 C C . TYR A 1 161 ? -0.908 80.074 11.209 1.00 20.14 ? 161 TYR A C 1 ATOM 1303 O O . TYR A 1 161 ? 0.238 80.477 11.025 1.00 20.14 ? 161 TYR A O 1 ATOM 1304 C CB . TYR A 1 161 ? -2.440 80.964 12.957 1.00 28.36 ? 161 TYR A CB 1 ATOM 1305 C CG . TYR A 1 161 ? -1.242 81.152 13.847 1.00 28.36 ? 161 TYR A CG 1 ATOM 1306 C CD1 . TYR A 1 161 ? -0.613 82.391 13.940 1.00 33.22 ? 161 TYR A CD1 1 ATOM 1307 C CD2 . TYR A 1 161 ? -0.663 80.070 14.501 1.00 28.36 ? 161 TYR A CD2 1 ATOM 1308 C CE1 . TYR A 1 161 ? 0.560 82.548 14.645 1.00 33.37 ? 161 TYR A CE1 1 ATOM 1309 C CE2 . TYR A 1 161 ? 0.524 80.220 15.212 1.00 28.36 ? 161 TYR A CE2 1 ATOM 1310 C CZ . TYR A 1 161 ? 1.129 81.463 15.273 1.00 34.50 ? 161 TYR A CZ 1 ATOM 1311 O OH . TYR A 1 161 ? 2.328 81.606 15.927 1.00 32.43 ? 161 TYR A OH 1 ATOM 1312 N N . LEU A 1 162 ? -1.234 78.786 11.191 1.00 20.20 ? 162 LEU A N 1 ATOM 1313 C CA . LEU A 1 162 ? -0.237 77.759 10.971 1.00 20.20 ? 162 LEU A CA 1 ATOM 1314 C C . LEU A 1 162 ? 0.366 77.707 9.577 1.00 20.20 ? 162 LEU A C 1 ATOM 1315 O O . LEU A 1 162 ? 1.540 77.358 9.417 1.00 20.20 ? 162 LEU A O 1 ATOM 1316 C CB . LEU A 1 162 ? -0.810 76.377 11.307 1.00 23.96 ? 162 LEU A CB 1 ATOM 1317 C CG . LEU A 1 162 ? -0.915 76.014 12.794 1.00 23.96 ? 162 LEU A CG 1 ATOM 1318 C CD1 . LEU A 1 162 ? -1.184 74.530 12.925 1.00 23.96 ? 162 LEU A CD1 1 ATOM 1319 C CD2 . LEU A 1 162 ? 0.382 76.381 13.526 1.00 23.96 ? 162 LEU A CD2 1 ATOM 1320 N N . GLU A 1 163 ? -0.424 78.052 8.567 1.00 23.42 ? 163 GLU A N 1 ATOM 1321 C CA . GLU A 1 163 ? 0.068 77.985 7.204 1.00 24.25 ? 163 GLU A CA 1 ATOM 1322 C C . GLU A 1 163 ? 0.427 79.316 6.593 1.00 23.42 ? 163 GLU A C 1 ATOM 1323 O O . GLU A 1 163 ? 1.057 79.360 5.538 1.00 23.42 ? 163 GLU A O 1 ATOM 1324 C CB . GLU A 1 163 ? -0.960 77.314 6.322 1.00 27.29 ? 163 GLU A CB 1 ATOM 1325 C CG . GLU A 1 163 ? -1.554 76.106 6.943 1.00 30.58 ? 163 GLU A CG 1 ATOM 1326 C CD . GLU A 1 163 ? -2.527 75.422 6.025 1.00 29.44 ? 163 GLU A CD 1 ATOM 1327 O OE1 . GLU A 1 163 ? -3.332 76.130 5.374 1.00 34.83 ? 163 GLU A OE1 1 ATOM 1328 O OE2 . GLU A 1 163 ? -2.492 74.176 5.962 1.00 34.96 ? 163 GLU A OE2 1 ATOM 1329 N N . GLU A 1 164 ? 0.034 80.406 7.233 1.00 28.22 ? 164 GLU A N 1 ATOM 1330 C CA . GLU A 1 164 ? 0.341 81.698 6.659 1.00 30.05 ? 164 GLU A CA 1 ATOM 1331 C C . GLU A 1 164 ? 1.062 82.649 7.604 1.00 28.22 ? 164 GLU A C 1 ATOM 1332 O O . GLU A 1 164 ? 2.225 82.989 7.382 1.00 28.22 ? 164 GLU A O 1 ATOM 1333 C CB . GLU A 1 164 ? -0.944 82.331 6.124 1.00 15.25 ? 164 GLU A CB 1 ATOM 1334 C CG . GLU A 1 164 ? -1.685 81.427 5.155 1.00 33.72 ? 164 GLU A CG 1 ATOM 1335 C CD . GLU A 1 164 ? -2.888 82.093 4.505 1.00 45.62 ? 164 GLU A CD 1 ATOM 1336 O OE1 . GLU A 1 164 ? -3.746 82.654 5.226 1.00 51.10 ? 164 GLU A OE1 1 ATOM 1337 O OE2 . GLU A 1 164 ? -2.981 82.043 3.259 1.00 56.99 ? 164 GLU A OE2 1 ATOM 1338 N N . GLU A 1 165 ? 0.376 83.067 8.659 1.00 22.03 ? 165 GLU A N 1 ATOM 1339 C CA . GLU A 1 165 ? 0.957 83.994 9.609 1.00 22.03 ? 165 GLU A CA 1 ATOM 1340 C C . GLU A 1 165 ? 2.293 83.547 10.186 1.00 23.59 ? 165 GLU A C 1 ATOM 1341 O O . GLU A 1 165 ? 3.323 84.184 9.963 1.00 22.05 ? 165 GLU A O 1 ATOM 1342 C CB . GLU A 1 165 ? -0.034 84.258 10.733 1.00 66.24 ? 165 GLU A CB 1 ATOM 1343 C CG . GLU A 1 165 ? -1.337 84.825 10.225 1.00 84.37 ? 165 GLU A CG 1 ATOM 1344 C CD . GLU A 1 165 ? -2.337 85.053 11.329 1.00 90.23 ? 165 GLU A CD 1 ATOM 1345 O OE1 . GLU A 1 165 ? -1.959 85.696 12.334 1.00 96.87 ? 165 GLU A OE1 1 ATOM 1346 O OE2 . GLU A 1 165 ? -3.495 84.593 11.189 1.00 93.27 ? 165 GLU A OE2 1 ATOM 1347 N N . CYS A 1 166 ? 2.285 82.448 10.923 1.00 29.32 ? 166 CYS A N 1 ATOM 1348 C CA . CYS A 1 166 ? 3.505 81.972 11.544 1.00 29.32 ? 166 CYS A CA 1 ATOM 1349 C C . CYS A 1 166 ? 4.692 81.925 10.579 1.00 29.32 ? 166 CYS A C 1 ATOM 1350 O O . CYS A 1 166 ? 5.734 82.516 10.847 1.00 29.32 ? 166 CYS A O 1 ATOM 1351 C CB . CYS A 1 166 ? 3.258 80.603 12.177 1.00 25.44 ? 166 CYS A CB 1 ATOM 1352 S SG . CYS A 1 166 ? 4.436 80.137 13.455 1.00 28.13 ? 166 CYS A SG 1 ATOM 1353 N N . PRO A 1 167 ? 4.556 81.231 9.440 1.00 15.12 ? 167 PRO A N 1 ATOM 1354 C CA . PRO A 1 167 ? 5.702 81.191 8.521 1.00 15.12 ? 167 PRO A CA 1 ATOM 1355 C C . PRO A 1 167 ? 6.122 82.567 7.994 1.00 17.08 ? 167 PRO A C 1 ATOM 1356 O O . PRO A 1 167 ? 7.304 82.829 7.759 1.00 15.78 ? 167 PRO A O 1 ATOM 1357 C CB . PRO A 1 167 ? 5.243 80.219 7.425 1.00 2.35 ? 167 PRO A CB 1 ATOM 1358 C CG . PRO A 1 167 ? 3.767 80.233 7.523 1.00 5.20 ? 167 PRO A CG 1 ATOM 1359 C CD . PRO A 1 167 ? 3.484 80.331 8.989 1.00 2.35 ? 167 PRO A CD 1 ATOM 1360 N N . ALA A 1 168 ? 5.142 83.447 7.824 1.00 26.46 ? 168 ALA A N 1 ATOM 1361 C CA . ALA A 1 168 ? 5.390 84.803 7.371 1.00 28.14 ? 168 ALA A CA 1 ATOM 1362 C C . ALA A 1 168 ? 6.258 85.477 8.428 1.00 30.62 ? 168 ALA A C 1 ATOM 1363 O O . ALA A 1 168 ? 7.252 86.137 8.116 1.00 27.36 ? 168 ALA A O 1 ATOM 1364 C CB . ALA A 1 168 ? 4.089 85.527 7.239 1.00 2.35 ? 168 ALA A CB 1 ATOM 1365 N N . THR A 1 169 ? 5.867 85.314 9.687 1.00 25.42 ? 169 THR A N 1 ATOM 1366 C CA . THR A 1 169 ? 6.624 85.873 10.792 1.00 24.36 ? 169 THR A CA 1 ATOM 1367 C C . THR A 1 169 ? 8.022 85.277 10.771 1.00 24.36 ? 169 THR A C 1 ATOM 1368 O O . THR A 1 169 ? 8.999 85.989 10.946 1.00 24.36 ? 169 THR A O 1 ATOM 1369 C CB . THR A 1 169 ? 5.996 85.525 12.137 1.00 22.78 ? 169 THR A CB 1 ATOM 1370 O OG1 . THR A 1 169 ? 4.629 85.936 12.143 1.00 22.78 ? 169 THR A OG1 1 ATOM 1371 C CG2 . THR A 1 169 ? 6.736 86.218 13.264 1.00 22.78 ? 169 THR A CG2 1 ATOM 1372 N N . LEU A 1 170 ? 8.122 83.968 10.556 1.00 28.11 ? 170 LEU A N 1 ATOM 1373 C CA . LEU A 1 170 ? 9.434 83.329 10.524 1.00 28.11 ? 170 LEU A CA 1 ATOM 1374 C C . LEU A 1 170 ? 10.327 83.879 9.415 1.00 32.80 ? 170 LEU A C 1 ATOM 1375 O O . LEU A 1 170 ? 11.533 84.058 9.615 1.00 28.11 ? 170 LEU A O 1 ATOM 1376 C CB . LEU A 1 170 ? 9.320 81.801 10.358 1.00 16.47 ? 170 LEU A CB 1 ATOM 1377 C CG . LEU A 1 170 ? 10.685 81.079 10.248 1.00 16.47 ? 170 LEU A CG 1 ATOM 1378 C CD1 . LEU A 1 170 ? 11.551 81.412 11.464 1.00 16.47 ? 170 LEU A CD1 1 ATOM 1379 C CD2 . LEU A 1 170 ? 10.484 79.579 10.125 1.00 16.47 ? 170 LEU A CD2 1 ATOM 1380 N N . ARG A 1 171 ? 9.757 84.133 8.242 1.00 30.65 ? 171 ARG A N 1 ATOM 1381 C CA . ARG A 1 171 ? 10.567 84.656 7.154 1.00 31.04 ? 171 ARG A CA 1 ATOM 1382 C C . ARG A 1 171 ? 11.085 86.042 7.501 1.00 28.82 ? 171 ARG A C 1 ATOM 1383 O O . ARG A 1 171 ? 12.257 86.359 7.274 1.00 37.14 ? 171 ARG A O 1 ATOM 1384 C CB . ARG A 1 171 ? 9.761 84.709 5.867 1.00 20.50 ? 171 ARG A CB 1 ATOM 1385 C CG . ARG A 1 171 ? 9.634 83.359 5.173 1.00 19.66 ? 171 ARG A CG 1 ATOM 1386 C CD . ARG A 1 171 ? 8.746 83.496 3.949 1.00 25.73 ? 171 ARG A CD 1 ATOM 1387 N NE . ARG A 1 171 ? 8.069 82.252 3.602 1.00 39.98 ? 171 ARG A NE 1 ATOM 1388 C CZ . ARG A 1 171 ? 8.684 81.201 3.083 1.00 30.26 ? 171 ARG A CZ 1 ATOM 1389 N NH1 . ARG A 1 171 ? 9.995 81.251 2.851 1.00 46.86 ? 171 ARG A NH1 1 ATOM 1390 N NH2 . ARG A 1 171 ? 7.988 80.105 2.803 1.00 33.82 ? 171 ARG A NH2 1 ATOM 1391 N N . LYS A 1 172 ? 10.203 86.863 8.059 1.00 26.09 ? 172 LYS A N 1 ATOM 1392 C CA . LYS A 1 172 ? 10.570 88.209 8.448 1.00 26.09 ? 172 LYS A CA 1 ATOM 1393 C C . LYS A 1 172 ? 11.729 88.147 9.432 1.00 37.54 ? 172 LYS A C 1 ATOM 1394 O O . LYS A 1 172 ? 12.760 88.788 9.229 1.00 30.14 ? 172 LYS A O 1 ATOM 1395 C CB . LYS A 1 172 ? 9.377 88.904 9.089 1.00 17.84 ? 172 LYS A CB 1 ATOM 1396 C CG . LYS A 1 172 ? 9.653 90.313 9.555 1.00 25.66 ? 172 LYS A CG 1 ATOM 1397 C CD . LYS A 1 172 ? 8.433 90.872 10.276 1.00 37.24 ? 172 LYS A CD 1 ATOM 1398 C CE . LYS A 1 172 ? 8.669 92.292 10.766 1.00 45.52 ? 172 LYS A CE 1 ATOM 1399 N NZ . LYS A 1 172 ? 7.559 92.778 11.631 1.00 49.14 ? 172 LYS A NZ 1 ATOM 1400 N N . TYR A 1 173 ? 11.559 87.364 10.493 1.00 33.39 ? 173 TYR A N 1 ATOM 1401 C CA . TYR A 1 173 ? 12.591 87.222 11.512 1.00 32.68 ? 173 TYR A CA 1 ATOM 1402 C C . TYR A 1 173 ? 13.929 86.775 10.936 1.00 34.88 ? 173 TYR A C 1 ATOM 1403 O O . TYR A 1 173 ? 14.991 87.195 11.395 1.00 38.06 ? 173 TYR A O 1 ATOM 1404 C CB . TYR A 1 173 ? 12.141 86.228 12.583 1.00 26.65 ? 173 TYR A CB 1 ATOM 1405 C CG . TYR A 1 173 ? 11.087 86.763 13.523 1.00 28.66 ? 173 TYR A CG 1 ATOM 1406 C CD1 . TYR A 1 173 ? 10.561 88.044 13.359 1.00 26.65 ? 173 TYR A CD1 1 ATOM 1407 C CD2 . TYR A 1 173 ? 10.617 85.987 14.579 1.00 26.65 ? 173 TYR A CD2 1 ATOM 1408 C CE1 . TYR A 1 173 ? 9.591 88.538 14.228 1.00 26.65 ? 173 TYR A CE1 1 ATOM 1409 C CE2 . TYR A 1 173 ? 9.649 86.466 15.450 1.00 26.65 ? 173 TYR A CE2 1 ATOM 1410 C CZ . TYR A 1 173 ? 9.139 87.741 15.271 1.00 26.65 ? 173 TYR A CZ 1 ATOM 1411 O OH . TYR A 1 173 ? 8.167 88.219 16.127 1.00 26.65 ? 173 TYR A OH 1 ATOM 1412 N N . LEU A 1 174 ? 13.882 85.917 9.932 1.00 24.21 ? 174 LEU A N 1 ATOM 1413 C CA . LEU A 1 174 ? 15.114 85.454 9.339 1.00 31.55 ? 174 LEU A CA 1 ATOM 1414 C C . LEU A 1 174 ? 15.846 86.600 8.666 1.00 35.74 ? 174 LEU A C 1 ATOM 1415 O O . LEU A 1 174 ? 17.073 86.647 8.681 1.00 34.14 ? 174 LEU A O 1 ATOM 1416 C CB . LEU A 1 174 ? 14.844 84.334 8.342 1.00 16.87 ? 174 LEU A CB 1 ATOM 1417 C CG . LEU A 1 174 ? 14.352 83.031 8.963 1.00 26.36 ? 174 LEU A CG 1 ATOM 1418 C CD1 . LEU A 1 174 ? 14.572 81.890 7.965 1.00 26.20 ? 174 LEU A CD1 1 ATOM 1419 C CD2 . LEU A 1 174 ? 15.121 82.752 10.260 1.00 19.02 ? 174 LEU A CD2 1 ATOM 1420 N N . LYS A 1 175 ? 15.104 87.529 8.074 1.00 34.92 ? 175 LYS A N 1 ATOM 1421 C CA . LYS A 1 175 ? 15.748 88.661 7.434 1.00 45.45 ? 175 LYS A CA 1 ATOM 1422 C C . LYS A 1 175 ? 16.589 89.401 8.469 1.00 43.61 ? 175 LYS A C 1 ATOM 1423 O O . LYS A 1 175 ? 17.785 89.610 8.274 1.00 45.13 ? 175 LYS A O 1 ATOM 1424 C CB . LYS A 1 175 ? 14.708 89.595 6.827 1.00 42.38 ? 175 LYS A CB 1 ATOM 1425 C CG . LYS A 1 175 ? 14.022 89.000 5.624 1.00 52.14 ? 175 LYS A CG 1 ATOM 1426 C CD . LYS A 1 175 ? 13.267 90.047 4.832 1.00 62.09 ? 175 LYS A CD 1 ATOM 1427 C CE . LYS A 1 175 ? 12.747 89.459 3.527 1.00 67.84 ? 175 LYS A CE 1 ATOM 1428 N NZ . LYS A 1 175 ? 12.032 90.464 2.690 1.00 71.24 ? 175 LYS A NZ 1 ATOM 1429 N N . TYR A 1 176 ? 15.970 89.769 9.586 1.00 36.57 ? 176 TYR A N 1 ATOM 1430 C CA . TYR A 1 176 ? 16.675 90.484 10.642 1.00 34.53 ? 176 TYR A CA 1 ATOM 1431 C C . TYR A 1 176 ? 17.611 89.626 11.494 1.00 33.60 ? 176 TYR A C 1 ATOM 1432 O O . TYR A 1 176 ? 18.337 90.159 12.326 1.00 34.19 ? 176 TYR A O 1 ATOM 1433 C CB . TYR A 1 176 ? 15.677 91.151 11.583 1.00 35.63 ? 176 TYR A CB 1 ATOM 1434 C CG . TYR A 1 176 ? 14.803 92.191 10.938 1.00 52.80 ? 176 TYR A CG 1 ATOM 1435 C CD1 . TYR A 1 176 ? 13.871 91.840 9.967 1.00 52.59 ? 176 TYR A CD1 1 ATOM 1436 C CD2 . TYR A 1 176 ? 14.903 93.535 11.304 1.00 51.50 ? 176 TYR A CD2 1 ATOM 1437 C CE1 . TYR A 1 176 ? 13.060 92.804 9.376 1.00 56.10 ? 176 TYR A CE1 1 ATOM 1438 C CE2 . TYR A 1 176 ? 14.102 94.501 10.719 1.00 52.79 ? 176 TYR A CE2 1 ATOM 1439 C CZ . TYR A 1 176 ? 13.184 94.130 9.759 1.00 55.00 ? 176 TYR A CZ 1 ATOM 1440 O OH . TYR A 1 176 ? 12.381 95.079 9.185 1.00 54.82 ? 176 TYR A OH 1 ATOM 1441 N N . SER A 1 177 ? 17.608 88.312 11.300 1.00 25.28 ? 177 SER A N 1 ATOM 1442 C CA . SER A 1 177 ? 18.442 87.453 12.130 1.00 24.74 ? 177 SER A CA 1 ATOM 1443 C C . SER A 1 177 ? 19.574 86.724 11.438 1.00 34.85 ? 177 SER A C 1 ATOM 1444 O O . SER A 1 177 ? 20.139 85.792 12.014 1.00 33.92 ? 177 SER A O 1 ATOM 1445 C CB . SER A 1 177 ? 17.566 86.425 12.847 1.00 28.54 ? 177 SER A CB 1 ATOM 1446 O OG . SER A 1 177 ? 16.511 87.052 13.547 1.00 18.32 ? 177 SER A OG 1 ATOM 1447 N N . LYS A 1 178 ? 19.909 87.134 10.219 1.00 43.32 ? 178 LYS A N 1 ATOM 1448 C CA . LYS A 1 178 ? 20.997 86.499 9.473 1.00 46.86 ? 178 LYS A CA 1 ATOM 1449 C C . LYS A 1 178 ? 22.313 86.521 10.262 1.00 41.62 ? 178 LYS A C 1 ATOM 1450 O O . LYS A 1 178 ? 22.984 85.495 10.409 1.00 51.03 ? 178 LYS A O 1 ATOM 1451 C CB . LYS A 1 178 ? 21.194 87.212 8.135 1.00 74.81 ? 178 LYS A CB 1 ATOM 1452 C CG . LYS A 1 178 ? 20.111 86.948 7.104 1.00 80.12 ? 178 LYS A CG 1 ATOM 1453 C CD . LYS A 1 178 ? 20.219 87.943 5.955 1.00 84.63 ? 178 LYS A CD 1 ATOM 1454 C CE . LYS A 1 178 ? 19.416 87.513 4.739 1.00 89.91 ? 178 LYS A CE 1 ATOM 1455 N NZ . LYS A 1 178 ? 20.018 86.322 4.073 1.00 91.01 ? 178 LYS A NZ 1 ATOM 1456 N N . ASN A 1 179 ? 22.672 87.700 10.766 1.00 68.83 ? 179 ASN A N 1 ATOM 1457 C CA . ASN A 1 179 ? 23.897 87.872 11.540 1.00 74.82 ? 179 ASN A CA 1 ATOM 1458 C C . ASN A 1 179 ? 23.824 87.135 12.864 1.00 76.87 ? 179 ASN A C 1 ATOM 1459 O O . ASN A 1 179 ? 24.635 87.384 13.759 1.00 75.35 ? 179 ASN A O 1 ATOM 1460 C CB . ASN A 1 179 ? 24.151 89.353 11.827 1.00 91.04 ? 179 ASN A CB 1 ATOM 1461 C CG . ASN A 1 179 ? 24.413 90.152 10.576 1.00 105.37 ? 179 ASN A CG 1 ATOM 1462 O OD1 . ASN A 1 179 ? 25.316 89.836 9.806 1.00 111.90 ? 179 ASN A OD1 1 ATOM 1463 N ND2 . ASN A 1 179 ? 23.626 91.200 10.367 1.00 104.10 ? 179 ASN A ND2 1 ATOM 1464 N N . ILE A 1 180 ? 22.848 86.241 12.995 1.00 34.80 ? 180 ILE A N 1 ATOM 1465 C CA . ILE A 1 180 ? 22.679 85.482 14.228 1.00 27.40 ? 180 ILE A CA 1 ATOM 1466 C C . ILE A 1 180 ? 22.555 83.987 13.984 1.00 26.01 ? 180 ILE A C 1 ATOM 1467 O O . ILE A 1 180 ? 23.344 83.194 14.498 1.00 26.59 ? 180 ILE A O 1 ATOM 1468 C CB . ILE A 1 180 ? 21.436 85.946 15.025 1.00 22.07 ? 180 ILE A CB 1 ATOM 1469 C CG1 . ILE A 1 180 ? 21.529 87.444 15.323 1.00 18.17 ? 180 ILE A CG1 1 ATOM 1470 C CG2 . ILE A 1 180 ? 21.362 85.187 16.345 1.00 17.96 ? 180 ILE A CG2 1 ATOM 1471 C CD1 . ILE A 1 180 ? 20.444 87.983 16.243 1.00 16.97 ? 180 ILE A CD1 1 ATOM 1472 N N . LEU A 1 181 ? 21.565 83.600 13.192 1.00 32.34 ? 181 LEU A N 1 ATOM 1473 C CA . LEU A 1 181 ? 21.355 82.193 12.918 1.00 31.76 ? 181 LEU A CA 1 ATOM 1474 C C . LEU A 1 181 ? 22.263 81.605 11.861 1.00 34.93 ? 181 LEU A C 1 ATOM 1475 O O . LEU A 1 181 ? 22.389 80.389 11.764 1.00 31.76 ? 181 LEU A O 1 ATOM 1476 C CB . LEU A 1 181 ? 19.910 81.963 12.517 1.00 20.67 ? 181 LEU A CB 1 ATOM 1477 C CG . LEU A 1 181 ? 18.941 82.389 13.608 1.00 20.94 ? 181 LEU A CG 1 ATOM 1478 C CD1 . LEU A 1 181 ? 17.517 82.101 13.169 1.00 23.52 ? 181 LEU A CD1 1 ATOM 1479 C CD2 . LEU A 1 181 ? 19.274 81.641 14.880 1.00 20.98 ? 181 LEU A CD2 1 ATOM 1480 N N . ASP A 1 182 ? 22.907 82.456 11.072 1.00 28.68 ? 182 ASP A N 1 ATOM 1481 C CA . ASP A 1 182 ? 23.778 81.963 10.010 1.00 31.82 ? 182 ASP A CA 1 ATOM 1482 C C . ASP A 1 182 ? 25.254 82.164 10.272 1.00 35.50 ? 182 ASP A C 1 ATOM 1483 O O . ASP A 1 182 ? 26.067 82.019 9.375 1.00 34.21 ? 182 ASP A O 1 ATOM 1484 C CB . ASP A 1 182 ? 23.383 82.612 8.686 1.00 54.00 ? 182 ASP A CB 1 ATOM 1485 C CG . ASP A 1 182 ? 21.949 82.311 8.304 1.00 66.93 ? 182 ASP A CG 1 ATOM 1486 O OD1 . ASP A 1 182 ? 21.601 81.113 8.253 1.00 67.54 ? 182 ASP A OD1 1 ATOM 1487 O OD2 . ASP A 1 182 ? 21.174 83.262 8.063 1.00 71.20 ? 182 ASP A OD2 1 ATOM 1488 N N . ARG A 1 183 ? 25.592 82.476 11.515 1.00 25.87 ? 183 ARG A N 1 ATOM 1489 C CA . ARG A 1 183 ? 26.976 82.695 11.914 1.00 26.56 ? 183 ARG A CA 1 ATOM 1490 C C . ARG A 1 183 ? 27.849 81.449 11.883 1.00 25.84 ? 183 ARG A C 1 ATOM 1491 O O . ARG A 1 183 ? 27.367 80.319 11.966 1.00 23.14 ? 183 ARG A O 1 ATOM 1492 C CB . ARG A 1 183 ? 27.026 83.269 13.325 1.00 19.95 ? 183 ARG A CB 1 ATOM 1493 C CG . ARG A 1 183 ? 26.516 84.671 13.441 1.00 22.68 ? 183 ARG A CG 1 ATOM 1494 C CD . ARG A 1 183 ? 25.763 84.819 14.722 1.00 39.42 ? 183 ARG A CD 1 ATOM 1495 N NE . ARG A 1 183 ? 26.510 84.254 15.825 1.00 39.25 ? 183 ARG A NE 1 ATOM 1496 C CZ . ARG A 1 183 ? 25.952 83.623 16.848 1.00 31.74 ? 183 ARG A CZ 1 ATOM 1497 N NH1 . ARG A 1 183 ? 24.637 83.474 16.906 1.00 19.59 ? 183 ARG A NH1 1 ATOM 1498 N NH2 . ARG A 1 183 ? 26.716 83.139 17.814 1.00 18.10 ? 183 ARG A NH2 1 ATOM 1499 N N . GLN A 1 184 ? 29.150 81.684 11.776 1.00 40.96 ? 184 GLN A N 1 ATOM 1500 C CA . GLN A 1 184 ? 30.135 80.623 11.766 1.00 40.71 ? 184 GLN A CA 1 ATOM 1501 C C . GLN A 1 184 ? 31.312 81.089 12.598 1.00 43.94 ? 184 GLN A C 1 ATOM 1502 O O . GLN A 1 184 ? 32.463 80.985 12.185 1.00 44.27 ? 184 GLN A O 1 ATOM 1503 C CB . GLN A 1 184 ? 30.572 80.310 10.341 1.00 38.97 ? 184 GLN A CB 1 ATOM 1504 C CG . GLN A 1 184 ? 29.535 79.520 9.573 1.00 43.70 ? 184 GLN A CG 1 ATOM 1505 C CD . GLN A 1 184 ? 29.372 78.115 10.108 1.00 44.37 ? 184 GLN A CD 1 ATOM 1506 O OE1 . GLN A 1 184 ? 28.365 77.459 9.861 1.00 47.36 ? 184 GLN A OE1 1 ATOM 1507 N NE2 . GLN A 1 184 ? 30.374 77.639 10.838 1.00 35.66 ? 184 GLN A NE2 1 ATOM 1508 N N . ASP A 1 185 ? 30.998 81.613 13.778 1.00 36.41 ? 185 ASP A N 1 ATOM 1509 C CA . ASP A 1 185 ? 31.997 82.106 14.714 1.00 34.83 ? 185 ASP A CA 1 ATOM 1510 C C . ASP A 1 185 ? 32.954 80.996 15.111 1.00 41.45 ? 185 ASP A C 1 ATOM 1511 O O . ASP A 1 185 ? 32.586 80.085 15.848 1.00 38.20 ? 185 ASP A O 1 ATOM 1512 C CB . ASP A 1 185 ? 31.319 82.638 15.970 1.00 34.52 ? 185 ASP A CB 1 ATOM 1513 C CG . ASP A 1 185 ? 30.262 83.673 15.665 1.00 43.79 ? 185 ASP A CG 1 ATOM 1514 O OD1 . ASP A 1 185 ? 30.053 83.978 14.468 1.00 47.52 ? 185 ASP A OD1 1 ATOM 1515 O OD2 . ASP A 1 185 ? 29.640 84.181 16.628 1.00 44.99 ? 185 ASP A OD2 1 ATOM 1516 N N . PRO A 1 186 ? 34.202 81.057 14.629 1.00 42.72 ? 186 PRO A N 1 ATOM 1517 C CA . PRO A 1 186 ? 35.168 80.013 14.983 1.00 43.57 ? 186 PRO A CA 1 ATOM 1518 C C . PRO A 1 186 ? 35.495 80.008 16.475 1.00 42.72 ? 186 PRO A C 1 ATOM 1519 O O . PRO A 1 186 ? 35.456 81.042 17.153 1.00 44.62 ? 186 PRO A O 1 ATOM 1520 C CB . PRO A 1 186 ? 36.374 80.342 14.107 1.00 25.06 ? 186 PRO A CB 1 ATOM 1521 C CG . PRO A 1 186 ? 36.298 81.824 13.986 1.00 25.86 ? 186 PRO A CG 1 ATOM 1522 C CD . PRO A 1 186 ? 34.817 82.078 13.761 1.00 24.01 ? 186 PRO A CD 1 ATOM 1523 N N . PRO A 1 187 ? 35.828 78.830 17.004 1.00 48.09 ? 187 PRO A N 1 ATOM 1524 C CA . PRO A 1 187 ? 36.162 78.637 18.412 1.00 46.71 ? 187 PRO A CA 1 ATOM 1525 C C . PRO A 1 187 ? 37.522 79.161 18.821 1.00 47.57 ? 187 PRO A C 1 ATOM 1526 O O . PRO A 1 187 ? 38.485 79.080 18.064 1.00 47.44 ? 187 PRO A O 1 ATOM 1527 C CB . PRO A 1 187 ? 36.095 77.131 18.565 1.00 35.89 ? 187 PRO A CB 1 ATOM 1528 C CG . PRO A 1 187 ? 36.671 76.675 17.253 1.00 37.97 ? 187 PRO A CG 1 ATOM 1529 C CD . PRO A 1 187 ? 35.949 77.563 16.260 1.00 33.32 ? 187 PRO A CD 1 ATOM 1530 N N . SER A 1 188 ? 37.584 79.699 20.030 1.00 44.15 ? 188 SER A N 1 ATOM 1531 C CA . SER A 1 188 ? 38.831 80.182 20.597 1.00 48.70 ? 188 SER A CA 1 ATOM 1532 C C . SER A 1 188 ? 39.138 79.063 21.578 1.00 55.15 ? 188 SER A C 1 ATOM 1533 O O . SER A 1 188 ? 38.380 78.854 22.510 1.00 47.74 ? 188 SER A O 1 ATOM 1534 C CB . SER A 1 188 ? 38.616 81.490 21.376 1.00 31.39 ? 188 SER A CB 1 ATOM 1535 O OG . SER A 1 188 ? 38.126 82.538 20.553 1.00 42.99 ? 188 SER A OG 1 ATOM 1536 N N . VAL A 1 189 ? 40.204 78.305 21.366 1.00 28.40 ? 189 VAL A N 1 ATOM 1537 C CA . VAL A 1 189 ? 40.511 77.246 22.318 1.00 34.63 ? 189 VAL A CA 1 ATOM 1538 C C . VAL A 1 189 ? 41.515 77.766 23.340 1.00 39.59 ? 189 VAL A C 1 ATOM 1539 O O . VAL A 1 189 ? 42.179 78.776 23.120 1.00 39.45 ? 189 VAL A O 1 ATOM 1540 C CB . VAL A 1 189 ? 41.102 75.993 21.645 1.00 43.03 ? 189 VAL A CB 1 ATOM 1541 C CG1 . VAL A 1 189 ? 40.425 75.746 20.301 1.00 38.10 ? 189 VAL A CG1 1 ATOM 1542 C CG2 . VAL A 1 189 ? 42.590 76.145 21.504 1.00 58.88 ? 189 VAL A CG2 1 ATOM 1543 N N . VAL A 1 190 ? 41.621 77.063 24.458 1.00 43.23 ? 190 VAL A N 1 ATOM 1544 C CA . VAL A 1 190 ? 42.521 77.444 25.531 1.00 41.15 ? 190 VAL A CA 1 ATOM 1545 C C . VAL A 1 190 ? 42.854 76.218 26.356 1.00 49.01 ? 190 VAL A C 1 ATOM 1546 O O . VAL A 1 190 ? 41.983 75.650 27.005 1.00 41.73 ? 190 VAL A O 1 ATOM 1547 C CB . VAL A 1 190 ? 41.877 78.489 26.463 1.00 34.70 ? 190 VAL A CB 1 ATOM 1548 C CG1 . VAL A 1 190 ? 42.737 78.693 27.700 1.00 30.09 ? 190 VAL A CG1 1 ATOM 1549 C CG2 . VAL A 1 190 ? 41.717 79.794 25.733 1.00 45.03 ? 190 VAL A CG2 1 ATOM 1550 N N . VAL A 1 191 ? 44.116 75.812 26.319 1.00 48.68 ? 191 VAL A N 1 ATOM 1551 C CA . VAL A 1 191 ? 44.569 74.664 27.081 1.00 45.95 ? 191 VAL A CA 1 ATOM 1552 C C . VAL A 1 191 ? 45.090 75.154 28.417 1.00 47.96 ? 191 VAL A C 1 ATOM 1553 O O . VAL A 1 191 ? 45.767 76.174 28.494 1.00 45.57 ? 191 VAL A O 1 ATOM 1554 C CB . VAL A 1 191 ? 45.677 73.911 26.350 1.00 42.43 ? 191 VAL A CB 1 ATOM 1555 C CG1 . VAL A 1 191 ? 46.329 72.918 27.287 1.00 44.54 ? 191 VAL A CG1 1 ATOM 1556 C CG2 . VAL A 1 191 ? 45.089 73.182 25.156 1.00 34.19 ? 191 VAL A CG2 1 ATOM 1557 N N . THR A 1 192 ? 44.754 74.418 29.468 1.00 52.99 ? 192 THR A N 1 ATOM 1558 C CA . THR A 1 192 ? 45.151 74.763 30.821 1.00 48.85 ? 192 THR A CA 1 ATOM 1559 C C . THR A 1 192 ? 45.246 73.488 31.665 1.00 51.19 ? 192 THR A C 1 ATOM 1560 O O . THR A 1 192 ? 44.586 72.488 31.372 1.00 52.64 ? 192 THR A O 1 ATOM 1561 C CB . THR A 1 192 ? 44.129 75.737 31.437 1.00 43.62 ? 192 THR A CB 1 ATOM 1562 O OG1 . THR A 1 192 ? 44.477 75.993 32.797 1.00 60.71 ? 192 THR A OG1 1 ATOM 1563 C CG2 . THR A 1 192 ? 42.730 75.153 31.382 1.00 38.80 ? 192 THR A CG2 1 ATOM 1564 N N . SER A 1 193 ? 46.076 73.519 32.703 1.00 63.97 ? 193 SER A N 1 ATOM 1565 C CA . SER A 1 193 ? 46.256 72.352 33.561 1.00 68.65 ? 193 SER A CA 1 ATOM 1566 C C . SER A 1 193 ? 46.139 72.680 35.040 1.00 67.60 ? 193 SER A C 1 ATOM 1567 O O . SER A 1 193 ? 46.441 73.792 35.469 1.00 63.03 ? 193 SER A O 1 ATOM 1568 C CB . SER A 1 193 ? 47.624 71.712 33.303 1.00 86.37 ? 193 SER A CB 1 ATOM 1569 O OG . SER A 1 193 ? 48.680 72.603 33.627 1.00 89.70 ? 193 SER A OG 1 ATOM 1570 N N . HIS A 1 194 ? 45.693 71.700 35.819 1.00 77.65 ? 194 HIS A N 1 ATOM 1571 C CA . HIS A 1 194 ? 45.564 71.882 37.254 1.00 83.31 ? 194 HIS A CA 1 ATOM 1572 C C . HIS A 1 194 ? 46.009 70.618 37.977 1.00 81.69 ? 194 HIS A C 1 ATOM 1573 O O . HIS A 1 194 ? 45.723 69.499 37.540 1.00 70.09 ? 194 HIS A O 1 ATOM 1574 C CB . HIS A 1 194 ? 44.126 72.228 37.628 1.00 74.34 ? 194 HIS A CB 1 ATOM 1575 C CG . HIS A 1 194 ? 43.979 72.720 39.033 1.00 85.65 ? 194 HIS A CG 1 ATOM 1576 N ND1 . HIS A 1 194 ? 44.216 71.919 40.129 1.00 89.41 ? 194 HIS A ND1 1 ATOM 1577 C CD2 . HIS A 1 194 ? 43.656 73.941 39.521 1.00 89.35 ? 194 HIS A CD2 1 ATOM 1578 C CE1 . HIS A 1 194 ? 44.045 72.625 41.232 1.00 94.54 ? 194 HIS A CE1 1 ATOM 1579 N NE2 . HIS A 1 194 ? 43.705 73.855 40.891 1.00 93.50 ? 194 HIS A NE2 1 ATOM 1580 N N . GLN A 1 195 ? 46.719 70.810 39.083 1.00 99.22 ? 195 GLN A N 1 ATOM 1581 C CA . GLN A 1 195 ? 47.236 69.703 39.876 1.00 109.23 ? 195 GLN A CA 1 ATOM 1582 C C . GLN A 1 195 ? 46.599 69.646 41.258 1.00 111.84 ? 195 GLN A C 1 ATOM 1583 O O . GLN A 1 195 ? 46.939 70.434 42.141 1.00 108.61 ? 195 GLN A O 1 ATOM 1584 C CB . GLN A 1 195 ? 48.752 69.842 40.027 1.00 119.74 ? 195 GLN A CB 1 ATOM 1585 C CG . GLN A 1 195 ? 49.413 68.736 40.827 1.00 120.25 ? 195 GLN A CG 1 ATOM 1586 C CD . GLN A 1 195 ? 49.370 67.406 40.112 1.00 122.60 ? 195 GLN A CD 1 ATOM 1587 O OE1 . GLN A 1 195 ? 48.297 66.892 39.802 1.00 126.00 ? 195 GLN A OE1 1 ATOM 1588 N NE2 . GLN A 1 195 ? 50.542 66.841 39.842 1.00 119.38 ? 195 GLN A NE2 1 ATOM 1589 N N . ALA A 1 196 ? 45.673 68.711 41.444 1.00 142.32 ? 196 ALA A N 1 ATOM 1590 C CA . ALA A 1 196 ? 45.013 68.557 42.733 1.00 146.81 ? 196 ALA A CA 1 ATOM 1591 C C . ALA A 1 196 ? 45.991 67.891 43.693 1.00 148.21 ? 196 ALA A C 1 ATOM 1592 O O . ALA A 1 196 ? 46.608 66.877 43.362 1.00 148.55 ? 196 ALA A O 1 ATOM 1593 C CB . ALA A 1 196 ? 43.758 67.707 42.584 1.00 86.85 ? 196 ALA A CB 1 ATOM 1594 N N . PRO A 1 197 ? 46.148 68.457 44.898 1.00 116.10 ? 197 PRO A N 1 ATOM 1595 C CA . PRO A 1 197 ? 47.065 67.901 45.898 1.00 116.10 ? 197 PRO A CA 1 ATOM 1596 C C . PRO A 1 197 ? 46.804 66.427 46.202 1.00 115.73 ? 197 PRO A C 1 ATOM 1597 O O . PRO A 1 197 ? 45.923 66.094 46.996 1.00 117.73 ? 197 PRO A O 1 ATOM 1598 C CB . PRO A 1 197 ? 46.835 68.801 47.111 1.00 108.59 ? 197 PRO A CB 1 ATOM 1599 C CG . PRO A 1 197 ? 45.405 69.235 46.948 1.00 110.50 ? 197 PRO A CG 1 ATOM 1600 C CD . PRO A 1 197 ? 45.345 69.549 45.475 1.00 112.27 ? 197 PRO A CD 1 ATOM 1601 N N . GLY A 1 198 ? 47.572 65.550 45.561 1.00 71.87 ? 198 GLY A N 1 ATOM 1602 C CA . GLY A 1 198 ? 47.412 64.124 45.779 1.00 68.84 ? 198 GLY A CA 1 ATOM 1603 C C . GLY A 1 198 ? 47.035 63.346 44.533 1.00 69.90 ? 198 GLY A C 1 ATOM 1604 O O . GLY A 1 198 ? 47.351 62.162 44.415 1.00 70.86 ? 198 GLY A O 1 ATOM 1605 N N . GLU A 1 199 ? 46.362 64.007 43.596 1.00 119.46 ? 199 GLU A N 1 ATOM 1606 C CA . GLU A 1 199 ? 45.940 63.361 42.356 1.00 116.59 ? 199 GLU A CA 1 ATOM 1607 C C . GLU A 1 199 ? 46.937 63.616 41.232 1.00 113.09 ? 199 GLU A C 1 ATOM 1608 O O . GLU A 1 199 ? 47.940 64.303 41.427 1.00 108.40 ? 199 GLU A O 1 ATOM 1609 C CB . GLU A 1 199 ? 44.574 63.892 41.933 1.00 102.26 ? 199 GLU A CB 1 ATOM 1610 C CG . GLU A 1 199 ? 43.523 63.833 43.014 1.00 104.67 ? 199 GLU A CG 1 ATOM 1611 C CD . GLU A 1 199 ? 42.248 64.528 42.599 1.00 106.14 ? 199 GLU A CD 1 ATOM 1612 O OE1 . GLU A 1 199 ? 41.634 64.095 41.601 1.00 107.34 ? 199 GLU A OE1 1 ATOM 1613 O OE2 . GLU A 1 199 ? 41.864 65.510 43.267 1.00 105.45 ? 199 GLU A OE2 1 ATOM 1614 N N . LYS A 1 200 ? 46.657 63.056 40.057 1.00 72.17 ? 200 LYS A N 1 ATOM 1615 C CA . LYS A 1 200 ? 47.524 63.254 38.901 1.00 69.38 ? 200 LYS A CA 1 ATOM 1616 C C . LYS A 1 200 ? 47.243 64.658 38.369 1.00 70.71 ? 200 LYS A C 1 ATOM 1617 O O . LYS A 1 200 ? 46.275 65.308 38.778 1.00 70.24 ? 200 LYS A O 1 ATOM 1618 C CB . LYS A 1 200 ? 47.201 62.258 37.784 1.00 79.89 ? 200 LYS A CB 1 ATOM 1619 C CG . LYS A 1 200 ? 46.995 60.810 38.194 1.00 78.81 ? 200 LYS A CG 1 ATOM 1620 C CD . LYS A 1 200 ? 46.537 60.008 36.973 1.00 75.20 ? 200 LYS A CD 1 ATOM 1621 C CE . LYS A 1 200 ? 46.104 58.593 37.321 1.00 85.87 ? 200 LYS A CE 1 ATOM 1622 N NZ . LYS A 1 200 ? 47.240 57.726 37.740 1.00 86.49 ? 200 LYS A NZ 1 ATOM 1623 N N . LYS A 1 201 ? 48.086 65.129 37.459 1.00 85.00 ? 201 LYS A N 1 ATOM 1624 C CA . LYS A 1 201 ? 47.871 66.440 36.867 1.00 81.33 ? 201 LYS A CA 1 ATOM 1625 C C . LYS A 1 201 ? 46.816 66.213 35.790 1.00 77.85 ? 201 LYS A C 1 ATOM 1626 O O . LYS A 1 201 ? 46.801 65.161 35.142 1.00 74.07 ? 201 LYS A O 1 ATOM 1627 C CB . LYS A 1 201 ? 49.159 66.970 36.230 1.00 101.00 ? 201 LYS A CB 1 ATOM 1628 C CG . LYS A 1 201 ? 49.010 68.354 35.613 1.00 102.56 ? 201 LYS A CG 1 ATOM 1629 C CD . LYS A 1 201 ? 50.200 68.727 34.741 1.00 102.80 ? 201 LYS A CD 1 ATOM 1630 C CE . LYS A 1 201 ? 51.480 68.855 35.547 1.00 105.01 ? 201 LYS A CE 1 ATOM 1631 N NZ . LYS A 1 201 ? 52.619 69.295 34.695 1.00 106.77 ? 201 LYS A NZ 1 ATOM 1632 N N . LYS A 1 202 ? 45.929 67.186 35.604 1.00 70.04 ? 202 LYS A N 1 ATOM 1633 C CA . LYS A 1 202 ? 44.880 67.060 34.595 1.00 68.50 ? 202 LYS A CA 1 ATOM 1634 C C . LYS A 1 202 ? 44.902 68.208 33.588 1.00 63.25 ? 202 LYS A C 1 ATOM 1635 O O . LYS A 1 202 ? 45.099 69.371 33.949 1.00 54.53 ? 202 LYS A O 1 ATOM 1636 C CB . LYS A 1 202 ? 43.518 66.968 35.285 1.00 72.23 ? 202 LYS A CB 1 ATOM 1637 C CG . LYS A 1 202 ? 43.409 65.763 36.211 1.00 77.81 ? 202 LYS A CG 1 ATOM 1638 C CD . LYS A 1 202 ? 42.126 65.784 37.011 1.00 85.73 ? 202 LYS A CD 1 ATOM 1639 C CE . LYS A 1 202 ? 42.062 64.617 37.977 1.00 85.74 ? 202 LYS A CE 1 ATOM 1640 N NZ . LYS A 1 202 ? 40.830 64.683 38.808 1.00 91.59 ? 202 LYS A NZ 1 ATOM 1641 N N . LEU A 1 203 ? 44.709 67.866 32.319 1.00 68.26 ? 203 LEU A N 1 ATOM 1642 C CA . LEU A 1 203 ? 44.720 68.851 31.247 1.00 70.71 ? 203 LEU A CA 1 ATOM 1643 C C . LEU A 1 203 ? 43.322 69.134 30.730 1.00 67.71 ? 203 LEU A C 1 ATOM 1644 O O . LEU A 1 203 ? 42.576 68.215 30.386 1.00 63.28 ? 203 LEU A O 1 ATOM 1645 C CB . LEU A 1 203 ? 45.596 68.361 30.095 1.00 72.36 ? 203 LEU A CB 1 ATOM 1646 C CG . LEU A 1 203 ? 47.049 68.074 30.468 1.00 75.82 ? 203 LEU A CG 1 ATOM 1647 C CD1 . LEU A 1 203 ? 47.792 67.552 29.253 1.00 72.42 ? 203 LEU A CD1 1 ATOM 1648 C CD2 . LEU A 1 203 ? 47.691 69.340 31.011 1.00 69.49 ? 203 LEU A CD2 1 ATOM 1649 N N . LYS A 1 204 ? 42.977 70.415 30.666 1.00 54.30 ? 204 LYS A N 1 ATOM 1650 C CA . LYS A 1 204 ? 41.666 70.818 30.191 1.00 50.79 ? 204 LYS A CA 1 ATOM 1651 C C . LYS A 1 204 ? 41.696 71.733 28.964 1.00 53.55 ? 204 LYS A C 1 ATOM 1652 O O . LYS A 1 204 ? 42.237 72.842 29.007 1.00 54.59 ? 204 LYS A O 1 ATOM 1653 C CB . LYS A 1 204 ? 40.897 71.510 31.314 1.00 31.22 ? 204 LYS A CB 1 ATOM 1654 C CG . LYS A 1 204 ? 39.534 72.046 30.886 1.00 39.06 ? 204 LYS A CG 1 ATOM 1655 C CD . LYS A 1 204 ? 38.967 72.989 31.925 1.00 43.03 ? 204 LYS A CD 1 ATOM 1656 C CE . LYS A 1 204 ? 37.789 73.737 31.377 1.00 57.94 ? 204 LYS A CE 1 ATOM 1657 N NZ . LYS A 1 204 ? 37.352 74.763 32.341 1.00 55.72 ? 204 LYS A NZ 1 ATOM 1658 N N . CYS A 1 205 ? 41.094 71.253 27.880 1.00 45.21 ? 205 CYS A N 1 ATOM 1659 C CA . CYS A 1 205 ? 41.005 71.998 26.635 1.00 45.08 ? 205 CYS A CA 1 ATOM 1660 C C . CYS A 1 205 ? 39.650 72.694 26.585 1.00 45.19 ? 205 CYS A C 1 ATOM 1661 O O . CYS A 1 205 ? 38.620 72.054 26.784 1.00 44.27 ? 205 CYS A O 1 ATOM 1662 C CB . CYS A 1 205 ? 41.110 71.053 25.450 1.00 63.41 ? 205 CYS A CB 1 ATOM 1663 S SG . CYS A 1 205 ? 41.246 71.923 23.863 1.00 83.34 ? 205 CYS A SG 1 ATOM 1664 N N . LEU A 1 206 ? 39.644 73.994 26.302 1.00 41.75 ? 206 LEU A N 1 ATOM 1665 C CA . LEU A 1 206 ? 38.393 74.741 26.241 1.00 34.83 ? 206 LEU A CA 1 ATOM 1666 C C . LEU A 1 206 ? 38.132 75.539 24.971 1.00 45.08 ? 206 LEU A C 1 ATOM 1667 O O . LEU A 1 206 ? 38.795 76.536 24.716 1.00 38.72 ? 206 LEU A O 1 ATOM 1668 C CB . LEU A 1 206 ? 38.283 75.698 27.435 1.00 17.70 ? 206 LEU A CB 1 ATOM 1669 C CG . LEU A 1 206 ? 37.111 76.694 27.361 1.00 23.22 ? 206 LEU A CG 1 ATOM 1670 C CD1 . LEU A 1 206 ? 35.790 75.947 27.204 1.00 32.39 ? 206 LEU A CD1 1 ATOM 1671 C CD2 . LEU A 1 206 ? 37.089 77.550 28.605 1.00 23.54 ? 206 LEU A CD2 1 ATOM 1672 N N . ALA A 1 207 ? 37.143 75.108 24.195 1.00 31.84 ? 207 ALA A N 1 ATOM 1673 C CA . ALA A 1 207 ? 36.754 75.820 22.980 1.00 30.89 ? 207 ALA A CA 1 ATOM 1674 C C . ALA A 1 207 ? 35.587 76.742 23.345 1.00 36.38 ? 207 ALA A C 1 ATOM 1675 O O . ALA A 1 207 ? 34.596 76.287 23.915 1.00 36.89 ? 207 ALA A O 1 ATOM 1676 C CB . ALA A 1 207 ? 36.319 74.838 21.905 1.00 5.81 ? 207 ALA A CB 1 ATOM 1677 N N . TYR A 1 208 ? 35.706 78.032 23.037 1.00 27.89 ? 208 TYR A N 1 ATOM 1678 C CA . TYR A 1 208 ? 34.631 78.966 23.352 1.00 27.89 ? 208 TYR A CA 1 ATOM 1679 C C . TYR A 1 208 ? 34.347 80.018 22.280 1.00 27.89 ? 208 TYR A C 1 ATOM 1680 O O . TYR A 1 208 ? 35.081 80.151 21.301 1.00 28.74 ? 208 TYR A O 1 ATOM 1681 C CB . TYR A 1 208 ? 34.892 79.659 24.695 1.00 38.81 ? 208 TYR A CB 1 ATOM 1682 C CG . TYR A 1 208 ? 36.207 80.380 24.768 1.00 44.08 ? 208 TYR A CG 1 ATOM 1683 C CD1 . TYR A 1 208 ? 37.399 79.680 24.950 1.00 49.88 ? 208 TYR A CD1 1 ATOM 1684 C CD2 . TYR A 1 208 ? 36.272 81.760 24.607 1.00 47.22 ? 208 TYR A CD2 1 ATOM 1685 C CE1 . TYR A 1 208 ? 38.628 80.344 24.962 1.00 51.47 ? 208 TYR A CE1 1 ATOM 1686 C CE2 . TYR A 1 208 ? 37.490 82.432 24.617 1.00 45.54 ? 208 TYR A CE2 1 ATOM 1687 C CZ . TYR A 1 208 ? 38.664 81.721 24.794 1.00 59.63 ? 208 TYR A CZ 1 ATOM 1688 O OH . TYR A 1 208 ? 39.868 82.388 24.797 1.00 67.75 ? 208 TYR A OH 1 ATOM 1689 N N . ASP A 1 209 ? 33.256 80.751 22.493 1.00 23.61 ? 209 ASP A N 1 ATOM 1690 C CA . ASP A 1 209 ? 32.784 81.798 21.597 1.00 28.74 ? 209 ASP A CA 1 ATOM 1691 C C . ASP A 1 209 ? 32.454 81.326 20.197 1.00 32.99 ? 209 ASP A C 1 ATOM 1692 O O . ASP A 1 209 ? 32.341 82.142 19.294 1.00 29.23 ? 209 ASP A O 1 ATOM 1693 C CB . ASP A 1 209 ? 33.797 82.928 21.502 1.00 37.10 ? 209 ASP A CB 1 ATOM 1694 C CG . ASP A 1 209 ? 33.915 83.707 22.782 1.00 39.13 ? 209 ASP A CG 1 ATOM 1695 O OD1 . ASP A 1 209 ? 32.878 83.961 23.426 1.00 37.68 ? 209 ASP A OD1 1 ATOM 1696 O OD2 . ASP A 1 209 ? 35.048 84.077 23.137 1.00 45.94 ? 209 ASP A OD2 1 ATOM 1697 N N . PHE A 1 210 ? 32.282 80.021 20.013 1.00 19.38 ? 210 PHE A N 1 ATOM 1698 C CA . PHE A 1 210 ? 31.973 79.467 18.696 1.00 19.38 ? 210 PHE A CA 1 ATOM 1699 C C . PHE A 1 210 ? 30.495 79.184 18.476 1.00 19.78 ? 210 PHE A C 1 ATOM 1700 O O . PHE A 1 210 ? 29.747 78.984 19.425 1.00 19.38 ? 210 PHE A O 1 ATOM 1701 C CB . PHE A 1 210 ? 32.762 78.182 18.484 1.00 28.14 ? 210 PHE A CB 1 ATOM 1702 C CG . PHE A 1 210 ? 32.329 77.052 19.369 1.00 35.98 ? 210 PHE A CG 1 ATOM 1703 C CD1 . PHE A 1 210 ? 31.186 76.313 19.068 1.00 28.14 ? 210 PHE A CD1 1 ATOM 1704 C CD2 . PHE A 1 210 ? 33.069 76.718 20.505 1.00 28.14 ? 210 PHE A CD2 1 ATOM 1705 C CE1 . PHE A 1 210 ? 30.789 75.257 19.881 1.00 28.14 ? 210 PHE A CE1 1 ATOM 1706 C CE2 . PHE A 1 210 ? 32.681 75.662 21.328 1.00 33.01 ? 210 PHE A CE2 1 ATOM 1707 C CZ . PHE A 1 210 ? 31.539 74.929 21.017 1.00 28.14 ? 210 PHE A CZ 1 ATOM 1708 N N . TYR A 1 211 ? 30.091 79.165 17.209 1.00 31.03 ? 211 TYR A N 1 ATOM 1709 C CA . TYR A 1 211 ? 28.713 78.899 16.801 1.00 31.03 ? 211 TYR A CA 1 ATOM 1710 C C . TYR A 1 211 ? 28.727 78.411 15.355 1.00 31.03 ? 211 TYR A C 1 ATOM 1711 O O . TYR A 1 211 ? 29.481 78.921 14.528 1.00 34.43 ? 211 TYR A O 1 ATOM 1712 C CB . TYR A 1 211 ? 27.877 80.170 16.873 1.00 31.25 ? 211 TYR A CB 1 ATOM 1713 C CG . TYR A 1 211 ? 26.402 79.931 16.604 1.00 31.25 ? 211 TYR A CG 1 ATOM 1714 C CD1 . TYR A 1 211 ? 25.544 79.493 17.623 1.00 31.25 ? 211 TYR A CD1 1 ATOM 1715 C CD2 . TYR A 1 211 ? 25.857 80.151 15.339 1.00 31.25 ? 211 TYR A CD2 1 ATOM 1716 C CE1 . TYR A 1 211 ? 24.186 79.293 17.386 1.00 31.25 ? 211 TYR A CE1 1 ATOM 1717 C CE2 . TYR A 1 211 ? 24.505 79.949 15.094 1.00 34.27 ? 211 TYR A CE2 1 ATOM 1718 C CZ . TYR A 1 211 ? 23.674 79.525 16.123 1.00 31.92 ? 211 TYR A CZ 1 ATOM 1719 O OH . TYR A 1 211 ? 22.322 79.359 15.885 1.00 31.25 ? 211 TYR A OH 1 ATOM 1720 N N . PRO A 1 212 ? 27.888 77.425 15.015 1.00 33.47 ? 212 PRO A N 1 ATOM 1721 C CA . PRO A 1 212 ? 26.906 76.674 15.793 1.00 33.35 ? 212 PRO A CA 1 ATOM 1722 C C . PRO A 1 212 ? 27.508 75.726 16.833 1.00 35.43 ? 212 PRO A C 1 ATOM 1723 O O . PRO A 1 212 ? 28.723 75.691 17.034 1.00 33.35 ? 212 PRO A O 1 ATOM 1724 C CB . PRO A 1 212 ? 26.139 75.927 14.713 1.00 20.34 ? 212 PRO A CB 1 ATOM 1725 C CG . PRO A 1 212 ? 26.214 76.853 13.557 1.00 32.62 ? 212 PRO A CG 1 ATOM 1726 C CD . PRO A 1 212 ? 27.658 77.203 13.580 1.00 20.34 ? 212 PRO A CD 1 ATOM 1727 N N . GLY A 1 213 ? 26.640 74.944 17.475 1.00 24.29 ? 213 GLY A N 1 ATOM 1728 C CA . GLY A 1 213 ? 27.064 74.019 18.509 1.00 22.90 ? 213 GLY A CA 1 ATOM 1729 C C . GLY A 1 213 ? 27.874 72.823 18.060 1.00 22.90 ? 213 GLY A C 1 ATOM 1730 O O . GLY A 1 213 ? 28.898 72.517 18.655 1.00 25.74 ? 213 GLY A O 1 ATOM 1731 N N . LYS A 1 214 ? 27.414 72.133 17.026 1.00 34.42 ? 214 LYS A N 1 ATOM 1732 C CA . LYS A 1 214 ? 28.113 70.954 16.522 1.00 35.42 ? 214 LYS A CA 1 ATOM 1733 C C . LYS A 1 214 ? 29.612 71.220 16.561 1.00 38.41 ? 214 LYS A C 1 ATOM 1734 O O . LYS A 1 214 ? 30.071 72.242 16.051 1.00 34.31 ? 214 LYS A O 1 ATOM 1735 C CB . LYS A 1 214 ? 27.647 70.675 15.091 1.00 46.21 ? 214 LYS A CB 1 ATOM 1736 C CG . LYS A 1 214 ? 28.397 69.591 14.330 1.00 61.35 ? 214 LYS A CG 1 ATOM 1737 C CD . LYS A 1 214 ? 28.168 68.216 14.910 1.00 73.68 ? 214 LYS A CD 1 ATOM 1738 C CE . LYS A 1 214 ? 28.599 67.147 13.928 1.00 78.51 ? 214 LYS A CE 1 ATOM 1739 N NZ . LYS A 1 214 ? 27.755 67.205 12.706 1.00 85.85 ? 214 LYS A NZ 1 ATOM 1740 N N . ILE A 1 215 ? 30.377 70.326 17.176 1.00 57.33 ? 215 ILE A N 1 ATOM 1741 C CA . ILE A 1 215 ? 31.818 70.535 17.258 1.00 60.32 ? 215 ILE A CA 1 ATOM 1742 C C . ILE A 1 215 ? 32.551 69.324 17.817 1.00 67.84 ? 215 ILE A C 1 ATOM 1743 O O . ILE A 1 215 ? 31.987 68.550 18.588 1.00 59.25 ? 215 ILE A O 1 ATOM 1744 C CB . ILE A 1 215 ? 32.143 71.753 18.140 1.00 41.39 ? 215 ILE A CB 1 ATOM 1745 C CG1 . ILE A 1 215 ? 33.630 72.103 18.020 1.00 45.77 ? 215 ILE A CG1 1 ATOM 1746 C CG2 . ILE A 1 215 ? 31.786 71.454 19.581 1.00 42.72 ? 215 ILE A CG2 1 ATOM 1747 C CD1 . ILE A 1 215 ? 34.062 73.332 18.832 1.00 38.74 ? 215 ILE A CD1 1 ATOM 1748 N N . ASP A 1 216 ? 33.813 69.169 17.429 1.00 58.98 ? 216 ASP A N 1 ATOM 1749 C CA . ASP A 1 216 ? 34.626 68.047 17.888 1.00 53.28 ? 216 ASP A CA 1 ATOM 1750 C C . ASP A 1 216 ? 35.811 68.555 18.700 1.00 59.97 ? 216 ASP A C 1 ATOM 1751 O O . ASP A 1 216 ? 36.509 69.468 18.275 1.00 59.86 ? 216 ASP A O 1 ATOM 1752 C CB . ASP A 1 216 ? 35.139 67.253 16.690 1.00 68.98 ? 216 ASP A CB 1 ATOM 1753 C CG . ASP A 1 216 ? 35.823 65.966 17.097 1.00 86.11 ? 216 ASP A CG 1 ATOM 1754 O OD1 . ASP A 1 216 ? 36.613 65.993 18.068 1.00 88.39 ? 216 ASP A OD1 1 ATOM 1755 O OD2 . ASP A 1 216 ? 35.575 64.930 16.438 1.00 91.12 ? 216 ASP A OD2 1 ATOM 1756 N N . VAL A 1 217 ? 36.047 67.955 19.860 1.00 34.08 ? 217 VAL A N 1 ATOM 1757 C CA . VAL A 1 217 ? 37.149 68.379 20.713 1.00 42.69 ? 217 VAL A CA 1 ATOM 1758 C C . VAL A 1 217 ? 37.743 67.200 21.462 1.00 51.59 ? 217 VAL A C 1 ATOM 1759 O O . VAL A 1 217 ? 37.085 66.621 22.317 1.00 50.82 ? 217 VAL A O 1 ATOM 1760 C CB . VAL A 1 217 ? 36.677 69.391 21.771 1.00 23.39 ? 217 VAL A CB 1 ATOM 1761 C CG1 . VAL A 1 217 ? 37.859 69.829 22.619 1.00 24.49 ? 217 VAL A CG1 1 ATOM 1762 C CG2 . VAL A 1 217 ? 36.001 70.575 21.112 1.00 24.51 ? 217 VAL A CG2 1 ATOM 1763 N N . HIS A 1 218 ? 38.989 66.856 21.166 1.00 49.33 ? 218 HIS A N 1 ATOM 1764 C CA . HIS A 1 218 ? 39.627 65.733 21.845 1.00 53.00 ? 218 HIS A CA 1 ATOM 1765 C C . HIS A 1 218 ? 41.122 65.928 22.056 1.00 55.43 ? 218 HIS A C 1 ATOM 1766 O O . HIS A 1 218 ? 41.785 66.619 21.288 1.00 55.18 ? 218 HIS A O 1 ATOM 1767 C CB . HIS A 1 218 ? 39.419 64.449 21.052 1.00 64.32 ? 218 HIS A CB 1 ATOM 1768 C CG . HIS A 1 218 ? 40.039 64.486 19.693 1.00 70.76 ? 218 HIS A CG 1 ATOM 1769 N ND1 . HIS A 1 218 ? 39.491 65.194 18.645 1.00 72.53 ? 218 HIS A ND1 1 ATOM 1770 C CD2 . HIS A 1 218 ? 41.188 63.947 19.223 1.00 74.22 ? 218 HIS A CD2 1 ATOM 1771 C CE1 . HIS A 1 218 ? 40.276 65.090 17.589 1.00 68.45 ? 218 HIS A CE1 1 ATOM 1772 N NE2 . HIS A 1 218 ? 41.314 64.339 17.913 1.00 75.11 ? 218 HIS A NE2 1 ATOM 1773 N N . TRP A 1 219 ? 41.641 65.301 23.108 1.00 67.69 ? 219 TRP A N 1 ATOM 1774 C CA . TRP A 1 219 ? 43.059 65.365 23.426 1.00 66.64 ? 219 TRP A CA 1 ATOM 1775 C C . TRP A 1 219 ? 43.778 64.236 22.706 1.00 69.45 ? 219 TRP A C 1 ATOM 1776 O O . TRP A 1 219 ? 43.162 63.246 22.304 1.00 70.28 ? 219 TRP A O 1 ATOM 1777 C CB . TRP A 1 219 ? 43.300 65.184 24.921 1.00 48.76 ? 219 TRP A CB 1 ATOM 1778 C CG . TRP A 1 219 ? 43.098 66.399 25.775 1.00 51.75 ? 219 TRP A CG 1 ATOM 1779 C CD1 . TRP A 1 219 ? 42.067 66.625 26.641 1.00 43.84 ? 219 TRP A CD1 1 ATOM 1780 C CD2 . TRP A 1 219 ? 44.009 67.498 25.942 1.00 51.05 ? 219 TRP A CD2 1 ATOM 1781 N NE1 . TRP A 1 219 ? 42.283 67.787 27.348 1.00 48.38 ? 219 TRP A NE1 1 ATOM 1782 C CE2 . TRP A 1 219 ? 43.466 68.344 26.938 1.00 49.02 ? 219 TRP A CE2 1 ATOM 1783 C CE3 . TRP A 1 219 ? 45.232 67.846 25.353 1.00 55.34 ? 219 TRP A CE3 1 ATOM 1784 C CZ2 . TRP A 1 219 ? 44.107 69.518 27.359 1.00 53.58 ? 219 TRP A CZ2 1 ATOM 1785 C CZ3 . TRP A 1 219 ? 45.870 69.013 25.774 1.00 45.46 ? 219 TRP A CZ3 1 ATOM 1786 C CH2 . TRP A 1 219 ? 45.304 69.833 26.769 1.00 50.12 ? 219 TRP A CH2 1 ATOM 1787 N N . THR A 1 220 ? 45.089 64.399 22.550 1.00 87.49 ? 220 THR A N 1 ATOM 1788 C CA . THR A 1 220 ? 45.939 63.397 21.915 1.00 89.40 ? 220 THR A CA 1 ATOM 1789 C C . THR A 1 220 ? 47.237 63.320 22.699 1.00 91.33 ? 220 THR A C 1 ATOM 1790 O O . THR A 1 220 ? 47.977 64.299 22.809 1.00 88.82 ? 220 THR A O 1 ATOM 1791 C CB . THR A 1 220 ? 46.275 63.740 20.442 1.00 85.23 ? 220 THR A CB 1 ATOM 1792 O OG1 . THR A 1 220 ? 46.897 65.029 20.371 1.00 86.25 ? 220 THR A OG1 1 ATOM 1793 C CG2 . THR A 1 220 ? 45.017 63.724 19.591 1.00 90.17 ? 220 THR A CG2 1 ATOM 1794 N N . ARG A 1 221 ? 47.488 62.151 23.270 1.00 93.79 ? 221 ARG A N 1 ATOM 1795 C CA . ARG A 1 221 ? 48.693 61.912 24.041 1.00 96.59 ? 221 ARG A CA 1 ATOM 1796 C C . ARG A 1 221 ? 49.584 61.092 23.120 1.00 97.14 ? 221 ARG A C 1 ATOM 1797 O O . ARG A 1 221 ? 49.429 59.875 23.003 1.00 96.96 ? 221 ARG A O 1 ATOM 1798 C CB . ARG A 1 221 ? 48.342 61.147 25.320 1.00 87.92 ? 221 ARG A CB 1 ATOM 1799 C CG . ARG A 1 221 ? 49.493 60.882 26.263 1.00 91.03 ? 221 ARG A CG 1 ATOM 1800 C CD . ARG A 1 221 ? 50.080 59.503 26.042 1.00 93.58 ? 221 ARG A CD 1 ATOM 1801 N NE . ARG A 1 221 ? 51.160 59.225 26.982 1.00 90.63 ? 221 ARG A NE 1 ATOM 1802 C CZ . ARG A 1 221 ? 51.882 58.111 26.982 1.00 90.32 ? 221 ARG A CZ 1 ATOM 1803 N NH1 . ARG A 1 221 ? 51.638 57.163 26.088 1.00 90.32 ? 221 ARG A NH1 1 ATOM 1804 N NH2 . ARG A 1 221 ? 52.848 57.947 27.872 1.00 91.92 ? 221 ARG A NH2 1 ATOM 1805 N N . ALA A 1 222 ? 50.495 61.788 22.445 1.00 64.12 ? 222 ALA A N 1 ATOM 1806 C CA . ALA A 1 222 ? 51.419 61.173 21.502 1.00 64.47 ? 222 ALA A CA 1 ATOM 1807 C C . ALA A 1 222 ? 50.702 60.838 20.196 1.00 63.27 ? 222 ALA A C 1 ATOM 1808 O O . ALA A 1 222 ? 50.861 59.747 19.652 1.00 63.74 ? 222 ALA A O 1 ATOM 1809 C CB . ALA A 1 222 ? 52.034 59.913 22.106 1.00 112.46 ? 222 ALA A CB 1 ATOM 1810 N N . GLY A 1 223 ? 49.913 61.788 19.700 1.00 78.20 ? 223 GLY A N 1 ATOM 1811 C CA . GLY A 1 223 ? 49.187 61.587 18.458 1.00 77.04 ? 223 GLY A CA 1 ATOM 1812 C C . GLY A 1 223 ? 48.073 60.568 18.589 1.00 81.59 ? 223 GLY A C 1 ATOM 1813 O O . GLY A 1 223 ? 47.369 60.271 17.622 1.00 82.33 ? 223 GLY A O 1 ATOM 1814 N N . GLU A 1 224 ? 47.917 60.027 19.792 1.00 106.88 ? 224 GLU A N 1 ATOM 1815 C CA . GLU A 1 224 ? 46.882 59.040 20.058 1.00 110.17 ? 224 GLU A CA 1 ATOM 1816 C C . GLU A 1 224 ? 45.679 59.718 20.694 1.00 105.91 ? 224 GLU A C 1 ATOM 1817 O O . GLU A 1 224 ? 45.817 60.449 21.675 1.00 102.12 ? 224 GLU A O 1 ATOM 1818 C CB . GLU A 1 224 ? 47.415 57.954 20.994 1.00 101.40 ? 224 GLU A CB 1 ATOM 1819 C CG . GLU A 1 224 ? 48.555 57.142 20.406 1.00 108.46 ? 224 GLU A CG 1 ATOM 1820 C CD . GLU A 1 224 ? 48.139 56.365 19.172 1.00 110.86 ? 224 GLU A CD 1 ATOM 1821 O OE1 . GLU A 1 224 ? 47.289 55.460 19.303 1.00 111.55 ? 224 GLU A OE1 1 ATOM 1822 O OE2 . GLU A 1 224 ? 48.660 56.661 18.074 1.00 108.90 ? 224 GLU A OE2 1 ATOM 1823 N N . VAL A 1 225 ? 44.501 59.478 20.130 1.00 71.94 ? 225 VAL A N 1 ATOM 1824 C CA . VAL A 1 225 ? 43.281 60.075 20.652 1.00 73.04 ? 225 VAL A CA 1 ATOM 1825 C C . VAL A 1 225 ? 42.932 59.486 22.019 1.00 69.04 ? 225 VAL A C 1 ATOM 1826 O O . VAL A 1 225 ? 42.548 58.320 22.143 1.00 67.31 ? 225 VAL A O 1 ATOM 1827 C CB . VAL A 1 225 ? 42.103 59.874 19.674 1.00 84.77 ? 225 VAL A CB 1 ATOM 1828 C CG1 . VAL A 1 225 ? 41.899 58.390 19.400 1.00 89.13 ? 225 VAL A CG1 1 ATOM 1829 C CG2 . VAL A 1 225 ? 40.842 60.511 20.243 1.00 80.95 ? 225 VAL A CG2 1 ATOM 1830 N N . GLN A 1 226 ? 43.078 60.314 23.046 1.00 64.17 ? 226 GLN A N 1 ATOM 1831 C CA . GLN A 1 226 ? 42.800 59.903 24.412 1.00 66.47 ? 226 GLN A CA 1 ATOM 1832 C C . GLN A 1 226 ? 41.318 59.858 24.723 1.00 70.92 ? 226 GLN A C 1 ATOM 1833 O O . GLN A 1 226 ? 40.494 60.410 23.994 1.00 73.47 ? 226 GLN A O 1 ATOM 1834 C CB . GLN A 1 226 ? 43.477 60.857 25.392 1.00 74.00 ? 226 GLN A CB 1 ATOM 1835 C CG . GLN A 1 226 ? 44.953 60.940 25.182 1.00 77.83 ? 226 GLN A CG 1 ATOM 1836 C CD . GLN A 1 226 ? 45.594 59.577 25.225 1.00 71.91 ? 226 GLN A CD 1 ATOM 1837 O OE1 . GLN A 1 226 ? 45.732 58.978 26.292 1.00 71.89 ? 226 GLN A OE1 1 ATOM 1838 N NE2 . GLN A 1 226 ? 45.979 59.066 24.059 1.00 66.49 ? 226 GLN A NE2 1 ATOM 1839 N N . GLU A 1 227 ? 40.997 59.182 25.819 1.00 85.71 ? 227 GLU A N 1 ATOM 1840 C CA . GLU A 1 227 ? 39.627 59.069 26.288 1.00 80.61 ? 227 GLU A CA 1 ATOM 1841 C C . GLU A 1 227 ? 39.489 60.149 27.348 1.00 71.75 ? 227 GLU A C 1 ATOM 1842 O O . GLU A 1 227 ? 40.240 60.177 28.317 1.00 71.68 ? 227 GLU A O 1 ATOM 1843 C CB . GLU A 1 227 ? 39.383 57.691 26.903 1.00 125.18 ? 227 GLU A CB 1 ATOM 1844 C CG . GLU A 1 227 ? 38.024 57.539 27.562 1.00 136.82 ? 227 GLU A CG 1 ATOM 1845 C CD . GLU A 1 227 ? 36.888 57.924 26.639 1.00 141.98 ? 227 GLU A CD 1 ATOM 1846 O OE1 . GLU A 1 227 ? 36.835 57.389 25.512 1.00 143.07 ? 227 GLU A OE1 1 ATOM 1847 O OE2 . GLU A 1 227 ? 36.049 58.757 27.042 1.00 145.84 ? 227 GLU A OE2 1 ATOM 1848 N N . PRO A 1 228 ? 38.538 61.068 27.168 1.00 50.52 ? 228 PRO A N 1 ATOM 1849 C CA . PRO A 1 228 ? 38.368 62.130 28.159 1.00 49.33 ? 228 PRO A CA 1 ATOM 1850 C C . PRO A 1 228 ? 37.957 61.626 29.538 1.00 49.95 ? 228 PRO A C 1 ATOM 1851 O O . PRO A 1 228 ? 37.178 60.685 29.665 1.00 50.03 ? 228 PRO A O 1 ATOM 1852 C CB . PRO A 1 228 ? 37.311 63.026 27.520 1.00 55.29 ? 228 PRO A CB 1 ATOM 1853 C CG . PRO A 1 228 ? 36.505 62.062 26.691 1.00 50.73 ? 228 PRO A CG 1 ATOM 1854 C CD . PRO A 1 228 ? 37.563 61.197 26.071 1.00 54.50 ? 228 PRO A CD 1 ATOM 1855 N N . GLU A 1 229 ? 38.502 62.257 30.569 1.00 48.36 ? 229 GLU A N 1 ATOM 1856 C CA . GLU A 1 229 ? 38.185 61.901 31.941 1.00 47.64 ? 229 GLU A CA 1 ATOM 1857 C C . GLU A 1 229 ? 36.895 62.606 32.342 1.00 55.89 ? 229 GLU A C 1 ATOM 1858 O O . GLU A 1 229 ? 36.153 62.139 33.203 1.00 57.81 ? 229 GLU A O 1 ATOM 1859 C CB . GLU A 1 229 ? 39.318 62.333 32.873 1.00 61.58 ? 229 GLU A CB 1 ATOM 1860 C CG . GLU A 1 229 ? 38.928 62.381 34.338 1.00 68.63 ? 229 GLU A CG 1 ATOM 1861 C CD . GLU A 1 229 ? 40.112 62.598 35.256 1.00 74.41 ? 229 GLU A CD 1 ATOM 1862 O OE1 . GLU A 1 229 ? 40.969 61.694 35.345 1.00 74.45 ? 229 GLU A OE1 1 ATOM 1863 O OE2 . GLU A 1 229 ? 40.187 63.672 35.887 1.00 72.46 ? 229 GLU A OE2 1 ATOM 1864 N N . LEU A 1 230 ? 36.635 63.740 31.708 1.00 60.63 ? 230 LEU A N 1 ATOM 1865 C CA . LEU A 1 230 ? 35.443 64.519 31.996 1.00 59.06 ? 230 LEU A CA 1 ATOM 1866 C C . LEU A 1 230 ? 35.194 65.430 30.820 1.00 63.96 ? 230 LEU A C 1 ATOM 1867 O O . LEU A 1 230 ? 36.094 66.121 30.362 1.00 64.33 ? 230 LEU A O 1 ATOM 1868 C CB . LEU A 1 230 ? 35.646 65.360 33.254 1.00 41.36 ? 230 LEU A CB 1 ATOM 1869 C CG . LEU A 1 230 ? 34.461 66.222 33.684 1.00 49.71 ? 230 LEU A CG 1 ATOM 1870 C CD1 . LEU A 1 230 ? 33.284 65.328 34.056 1.00 55.64 ? 230 LEU A CD1 1 ATOM 1871 C CD2 . LEU A 1 230 ? 34.861 67.091 34.862 1.00 45.15 ? 230 LEU A CD2 1 ATOM 1872 N N . ARG A 1 231 ? 33.965 65.429 30.333 1.00 54.88 ? 231 ARG A N 1 ATOM 1873 C CA . ARG A 1 231 ? 33.599 66.255 29.195 1.00 49.93 ? 231 ARG A CA 1 ATOM 1874 C C . ARG A 1 231 ? 32.485 67.219 29.609 1.00 54.44 ? 231 ARG A C 1 ATOM 1875 O O . ARG A 1 231 ? 31.888 67.084 30.680 1.00 47.55 ? 231 ARG A O 1 ATOM 1876 C CB . ARG A 1 231 ? 33.134 65.347 28.058 1.00 63.26 ? 231 ARG A CB 1 ATOM 1877 C CG . ARG A 1 231 ? 33.037 66.012 26.714 1.00 76.47 ? 231 ARG A CG 1 ATOM 1878 C CD . ARG A 1 231 ? 32.616 65.000 25.658 1.00 84.13 ? 231 ARG A CD 1 ATOM 1879 N NE . ARG A 1 231 ? 33.502 63.838 25.623 1.00 92.30 ? 231 ARG A NE 1 ATOM 1880 C CZ . ARG A 1 231 ? 33.401 62.850 24.740 1.00 94.33 ? 231 ARG A CZ 1 ATOM 1881 N NH1 . ARG A 1 231 ? 32.452 62.880 23.815 1.00 91.51 ? 231 ARG A NH1 1 ATOM 1882 N NH2 . ARG A 1 231 ? 34.252 61.833 24.778 1.00 100.30 ? 231 ARG A NH2 1 ATOM 1883 N N . GLY A 1 232 ? 32.211 68.203 28.767 1.00 34.08 ? 232 GLY A N 1 ATOM 1884 C CA . GLY A 1 232 ? 31.157 69.143 29.091 1.00 34.04 ? 232 GLY A CA 1 ATOM 1885 C C . GLY A 1 232 ? 31.045 70.260 28.083 1.00 42.03 ? 232 GLY A C 1 ATOM 1886 O O . GLY A 1 232 ? 32.016 70.605 27.410 1.00 35.53 ? 232 GLY A O 1 ATOM 1887 N N . ASP A 1 233 ? 29.849 70.817 27.956 1.00 40.72 ? 233 ASP A N 1 ATOM 1888 C CA . ASP A 1 233 ? 29.639 71.933 27.047 1.00 32.96 ? 233 ASP A CA 1 ATOM 1889 C C . ASP A 1 233 ? 28.487 72.780 27.551 1.00 38.99 ? 233 ASP A C 1 ATOM 1890 O O . ASP A 1 233 ? 27.828 72.419 28.527 1.00 35.20 ? 233 ASP A O 1 ATOM 1891 C CB . ASP A 1 233 ? 29.371 71.446 25.621 1.00 17.69 ? 233 ASP A CB 1 ATOM 1892 C CG . ASP A 1 233 ? 28.150 70.577 25.522 1.00 23.02 ? 233 ASP A CG 1 ATOM 1893 O OD1 . ASP A 1 233 ? 27.090 70.979 26.045 1.00 28.44 ? 233 ASP A OD1 1 ATOM 1894 O OD2 . ASP A 1 233 ? 28.251 69.497 24.905 1.00 26.11 ? 233 ASP A OD2 1 ATOM 1895 N N . VAL A 1 234 ? 28.251 73.910 26.895 1.00 27.86 ? 234 VAL A N 1 ATOM 1896 C CA . VAL A 1 234 ? 27.186 74.806 27.311 1.00 27.86 ? 234 VAL A CA 1 ATOM 1897 C C . VAL A 1 234 ? 26.823 75.745 26.182 1.00 28.11 ? 234 VAL A C 1 ATOM 1898 O O . VAL A 1 234 ? 27.524 75.834 25.179 1.00 27.86 ? 234 VAL A O 1 ATOM 1899 C CB . VAL A 1 234 ? 27.617 75.662 28.552 1.00 6.06 ? 234 VAL A CB 1 ATOM 1900 C CG1 . VAL A 1 234 ? 28.732 76.611 28.165 1.00 6.06 ? 234 VAL A CG1 1 ATOM 1901 C CG2 . VAL A 1 234 ? 26.424 76.447 29.117 1.00 8.24 ? 234 VAL A CG2 1 ATOM 1902 N N . LEU A 1 235 ? 25.704 76.435 26.367 1.00 25.24 ? 235 LEU A N 1 ATOM 1903 C CA . LEU A 1 235 ? 25.204 77.410 25.420 1.00 25.24 ? 235 LEU A CA 1 ATOM 1904 C C . LEU A 1 235 ? 24.865 78.651 26.220 1.00 25.24 ? 235 LEU A C 1 ATOM 1905 O O . LEU A 1 235 ? 24.149 78.575 27.208 1.00 25.24 ? 235 LEU A O 1 ATOM 1906 C CB . LEU A 1 235 ? 23.948 76.896 24.725 1.00 19.36 ? 235 LEU A CB 1 ATOM 1907 C CG . LEU A 1 235 ? 23.113 77.996 24.067 1.00 19.36 ? 235 LEU A CG 1 ATOM 1908 C CD1 . LEU A 1 235 ? 23.943 78.746 23.046 1.00 19.36 ? 235 LEU A CD1 1 ATOM 1909 C CD2 . LEU A 1 235 ? 21.899 77.387 23.408 1.00 19.36 ? 235 LEU A CD2 1 ATOM 1910 N N . HIS A 1 236 ? 25.413 79.787 25.809 1.00 23.62 ? 236 HIS A N 1 ATOM 1911 C CA . HIS A 1 236 ? 25.145 81.061 26.468 1.00 23.62 ? 236 HIS A CA 1 ATOM 1912 C C . HIS A 1 236 ? 24.218 81.802 25.531 1.00 23.62 ? 236 HIS A C 1 ATOM 1913 O O . HIS A 1 236 ? 24.631 82.285 24.481 1.00 23.62 ? 236 HIS A O 1 ATOM 1914 C CB . HIS A 1 236 ? 26.442 81.841 26.676 1.00 29.79 ? 236 HIS A CB 1 ATOM 1915 C CG . HIS A 1 236 ? 27.360 81.213 27.673 1.00 31.19 ? 236 HIS A CG 1 ATOM 1916 N ND1 . HIS A 1 236 ? 27.072 81.167 29.020 1.00 27.54 ? 236 HIS A ND1 1 ATOM 1917 C CD2 . HIS A 1 236 ? 28.534 80.558 27.517 1.00 29.24 ? 236 HIS A CD2 1 ATOM 1918 C CE1 . HIS A 1 236 ? 28.028 80.508 29.651 1.00 34.70 ? 236 HIS A CE1 1 ATOM 1919 N NE2 . HIS A 1 236 ? 28.928 80.127 28.763 1.00 35.24 ? 236 HIS A NE2 1 ATOM 1920 N N . ASN A 1 237 ? 22.956 81.869 25.914 1.00 35.94 ? 237 ASN A N 1 ATOM 1921 C CA . ASN A 1 237 ? 21.947 82.500 25.094 1.00 37.11 ? 237 ASN A CA 1 ATOM 1922 C C . ASN A 1 237 ? 22.109 84.003 24.901 1.00 35.94 ? 237 ASN A C 1 ATOM 1923 O O . ASN A 1 237 ? 21.892 84.515 23.794 1.00 35.94 ? 237 ASN A O 1 ATOM 1924 C CB . ASN A 1 237 ? 20.565 82.207 25.670 1.00 22.83 ? 237 ASN A CB 1 ATOM 1925 C CG . ASN A 1 237 ? 19.458 82.571 24.720 1.00 22.59 ? 237 ASN A CG 1 ATOM 1926 O OD1 . ASN A 1 237 ? 19.243 81.899 23.712 1.00 22.59 ? 237 ASN A OD1 1 ATOM 1927 N ND2 . ASN A 1 237 ? 18.753 83.650 25.025 1.00 22.59 ? 237 ASN A ND2 1 ATOM 1928 N N . GLY A 1 238 ? 22.484 84.714 25.959 1.00 19.30 ? 238 GLY A N 1 ATOM 1929 C CA . GLY A 1 238 ? 22.625 86.159 25.842 1.00 19.30 ? 238 GLY A CA 1 ATOM 1930 C C . GLY A 1 238 ? 23.667 86.531 24.817 1.00 19.30 ? 238 GLY A C 1 ATOM 1931 O O . GLY A 1 238 ? 23.540 87.479 24.050 1.00 21.21 ? 238 GLY A O 1 ATOM 1932 N N . ASN A 1 239 ? 24.709 85.726 24.811 1.00 32.38 ? 239 ASN A N 1 ATOM 1933 C CA . ASN A 1 239 ? 25.847 85.880 23.934 1.00 39.22 ? 239 ASN A CA 1 ATOM 1934 C C . ASN A 1 239 ? 25.536 85.218 22.599 1.00 34.13 ? 239 ASN A C 1 ATOM 1935 O O . ASN A 1 239 ? 25.867 85.739 21.533 1.00 32.38 ? 239 ASN A O 1 ATOM 1936 C CB . ASN A 1 239 ? 27.023 85.180 24.595 1.00 42.33 ? 239 ASN A CB 1 ATOM 1937 C CG . ASN A 1 239 ? 28.324 85.646 24.080 1.00 53.75 ? 239 ASN A CG 1 ATOM 1938 O OD1 . ASN A 1 239 ? 28.588 85.562 22.886 1.00 77.90 ? 239 ASN A OD1 1 ATOM 1939 N ND2 . ASN A 1 239 ? 29.154 86.144 24.985 1.00 39.97 ? 239 ASN A ND2 1 ATOM 1940 N N . GLY A 1 240 ? 24.897 84.054 22.679 1.00 26.98 ? 240 GLY A N 1 ATOM 1941 C CA . GLY A 1 240 ? 24.567 83.293 21.493 1.00 26.98 ? 240 GLY A CA 1 ATOM 1942 C C . GLY A 1 240 ? 25.758 82.429 21.117 1.00 26.98 ? 240 GLY A C 1 ATOM 1943 O O . GLY A 1 240 ? 25.918 82.047 19.955 1.00 26.98 ? 240 GLY A O 1 ATOM 1944 N N . THR A 1 241 ? 26.592 82.110 22.109 1.00 37.36 ? 241 THR A N 1 ATOM 1945 C CA . THR A 1 241 ? 27.789 81.302 21.876 1.00 37.36 ? 241 THR A CA 1 ATOM 1946 C C . THR A 1 241 ? 27.831 79.996 22.647 1.00 37.36 ? 241 THR A C 1 ATOM 1947 O O . THR A 1 241 ? 27.154 79.828 23.657 1.00 37.36 ? 241 THR A O 1 ATOM 1948 C CB . THR A 1 241 ? 29.070 82.067 22.248 1.00 45.29 ? 241 THR A CB 1 ATOM 1949 O OG1 . THR A 1 241 ? 28.962 82.532 23.597 1.00 43.57 ? 241 THR A OG1 1 ATOM 1950 C CG2 . THR A 1 241 ? 29.294 83.243 21.308 1.00 45.17 ? 241 THR A CG2 1 ATOM 1951 N N . TYR A 1 242 ? 28.660 79.083 22.155 1.00 36.13 ? 242 TYR A N 1 ATOM 1952 C CA . TYR A 1 242 ? 28.840 77.778 22.765 1.00 36.13 ? 242 TYR A CA 1 ATOM 1953 C C . TYR A 1 242 ? 30.244 77.592 23.295 1.00 39.32 ? 242 TYR A C 1 ATOM 1954 O O . TYR A 1 242 ? 31.210 78.125 22.753 1.00 36.13 ? 242 TYR A O 1 ATOM 1955 C CB . TYR A 1 242 ? 28.611 76.661 21.756 1.00 28.01 ? 242 TYR A CB 1 ATOM 1956 C CG . TYR A 1 242 ? 27.184 76.315 21.489 1.00 32.39 ? 242 TYR A CG 1 ATOM 1957 C CD1 . TYR A 1 242 ? 26.514 76.841 20.390 1.00 31.02 ? 242 TYR A CD1 1 ATOM 1958 C CD2 . TYR A 1 242 ? 26.503 75.441 22.326 1.00 28.01 ? 242 TYR A CD2 1 ATOM 1959 C CE1 . TYR A 1 242 ? 25.198 76.500 20.125 1.00 28.01 ? 242 TYR A CE1 1 ATOM 1960 C CE2 . TYR A 1 242 ? 25.186 75.093 22.075 1.00 28.01 ? 242 TYR A CE2 1 ATOM 1961 C CZ . TYR A 1 242 ? 24.538 75.625 20.973 1.00 28.38 ? 242 TYR A CZ 1 ATOM 1962 O OH . TYR A 1 242 ? 23.232 75.285 20.730 1.00 28.01 ? 242 TYR A OH 1 ATOM 1963 N N . GLN A 1 243 ? 30.345 76.810 24.354 1.00 36.39 ? 243 GLN A N 1 ATOM 1964 C CA . GLN A 1 243 ? 31.626 76.476 24.929 1.00 36.39 ? 243 GLN A CA 1 ATOM 1965 C C . GLN A 1 243 ? 31.601 74.969 25.086 1.00 40.64 ? 243 GLN A C 1 ATOM 1966 O O . GLN A 1 243 ? 30.549 74.376 25.297 1.00 39.05 ? 243 GLN A O 1 ATOM 1967 C CB . GLN A 1 243 ? 31.812 77.153 26.275 1.00 24.05 ? 243 GLN A CB 1 ATOM 1968 C CG . GLN A 1 243 ? 32.141 78.615 26.168 1.00 26.62 ? 243 GLN A CG 1 ATOM 1969 C CD . GLN A 1 243 ? 32.385 79.242 27.514 1.00 26.56 ? 243 GLN A CD 1 ATOM 1970 O OE1 . GLN A 1 243 ? 33.164 78.732 28.312 1.00 31.73 ? 243 GLN A OE1 1 ATOM 1971 N NE2 . GLN A 1 243 ? 31.725 80.360 27.776 1.00 28.48 ? 243 GLN A NE2 1 ATOM 1972 N N . SER A 1 244 ? 32.755 74.342 24.953 1.00 35.83 ? 244 SER A N 1 ATOM 1973 C CA . SER A 1 244 ? 32.834 72.902 25.084 1.00 35.02 ? 244 SER A CA 1 ATOM 1974 C C . SER A 1 244 ? 34.222 72.534 25.584 1.00 46.45 ? 244 SER A C 1 ATOM 1975 O O . SER A 1 244 ? 35.223 73.077 25.115 1.00 42.59 ? 244 SER A O 1 ATOM 1976 C CB . SER A 1 244 ? 32.568 72.250 23.736 1.00 22.53 ? 244 SER A CB 1 ATOM 1977 O OG . SER A 1 244 ? 32.682 70.849 23.846 1.00 26.42 ? 244 SER A OG 1 ATOM 1978 N N . TRP A 1 245 ? 34.289 71.620 26.542 1.00 46.16 ? 245 TRP A N 1 ATOM 1979 C CA . TRP A 1 245 ? 35.579 71.235 27.080 1.00 42.32 ? 245 TRP A CA 1 ATOM 1980 C C . TRP A 1 245 ? 35.788 69.733 27.228 1.00 54.86 ? 245 TRP A C 1 ATOM 1981 O O . TRP A 1 245 ? 34.859 68.928 27.083 1.00 47.77 ? 245 TRP A O 1 ATOM 1982 C CB . TRP A 1 245 ? 35.795 71.935 28.419 1.00 45.03 ? 245 TRP A CB 1 ATOM 1983 C CG . TRP A 1 245 ? 34.715 71.673 29.408 1.00 54.68 ? 245 TRP A CG 1 ATOM 1984 C CD1 . TRP A 1 245 ? 34.681 70.680 30.345 1.00 56.89 ? 245 TRP A CD1 1 ATOM 1985 C CD2 . TRP A 1 245 ? 33.500 72.408 29.556 1.00 61.47 ? 245 TRP A CD2 1 ATOM 1986 N NE1 . TRP A 1 245 ? 33.518 70.754 31.069 1.00 57.67 ? 245 TRP A NE1 1 ATOM 1987 C CE2 . TRP A 1 245 ? 32.773 71.807 30.606 1.00 61.77 ? 245 TRP A CE2 1 ATOM 1988 C CE3 . TRP A 1 245 ? 32.951 73.519 28.902 1.00 63.33 ? 245 TRP A CE3 1 ATOM 1989 C CZ2 . TRP A 1 245 ? 31.523 72.280 31.021 1.00 67.45 ? 245 TRP A CZ2 1 ATOM 1990 C CZ3 . TRP A 1 245 ? 31.705 73.993 29.313 1.00 70.90 ? 245 TRP A CZ3 1 ATOM 1991 C CH2 . TRP A 1 245 ? 31.006 73.371 30.365 1.00 68.82 ? 245 TRP A CH2 1 ATOM 1992 N N . VAL A 1 246 ? 37.040 69.376 27.497 1.00 47.63 ? 246 VAL A N 1 ATOM 1993 C CA . VAL A 1 246 ? 37.462 67.996 27.678 1.00 54.52 ? 246 VAL A CA 1 ATOM 1994 C C . VAL A 1 246 ? 38.624 68.013 28.652 1.00 58.16 ? 246 VAL A C 1 ATOM 1995 O O . VAL A 1 246 ? 39.436 68.936 28.638 1.00 53.45 ? 246 VAL A O 1 ATOM 1996 C CB . VAL A 1 246 ? 37.960 67.366 26.365 1.00 41.65 ? 246 VAL A CB 1 ATOM 1997 C CG1 . VAL A 1 246 ? 38.349 65.926 26.608 1.00 50.46 ? 246 VAL A CG1 1 ATOM 1998 C CG2 . VAL A 1 246 ? 36.884 67.445 25.294 1.00 44.01 ? 246 VAL A CG2 1 ATOM 1999 N N . VAL A 1 247 ? 38.706 66.992 29.495 1.00 52.49 ? 247 VAL A N 1 ATOM 2000 C CA . VAL A 1 247 ? 39.777 66.906 30.479 1.00 56.94 ? 247 VAL A CA 1 ATOM 2001 C C . VAL A 1 247 ? 40.397 65.521 30.480 1.00 58.56 ? 247 VAL A C 1 ATOM 2002 O O . VAL A 1 247 ? 39.712 64.521 30.263 1.00 57.89 ? 247 VAL A O 1 ATOM 2003 C CB . VAL A 1 247 ? 39.259 67.220 31.914 1.00 24.40 ? 247 VAL A CB 1 ATOM 2004 C CG1 . VAL A 1 247 ? 40.391 67.107 32.913 1.00 26.14 ? 247 VAL A CG1 1 ATOM 2005 C CG2 . VAL A 1 247 ? 38.668 68.624 31.965 1.00 22.48 ? 247 VAL A CG2 1 ATOM 2006 N N . VAL A 1 248 ? 41.704 65.477 30.706 1.00 63.91 ? 248 VAL A N 1 ATOM 2007 C CA . VAL A 1 248 ? 42.440 64.219 30.772 1.00 62.60 ? 248 VAL A CA 1 ATOM 2008 C C . VAL A 1 248 ? 43.409 64.267 31.951 1.00 64.61 ? 248 VAL A C 1 ATOM 2009 O O . VAL A 1 248 ? 43.974 65.319 32.270 1.00 59.55 ? 248 VAL A O 1 ATOM 2010 C CB . VAL A 1 248 ? 43.243 63.933 29.461 1.00 50.75 ? 248 VAL A CB 1 ATOM 2011 C CG1 . VAL A 1 248 ? 42.293 63.592 28.326 1.00 44.54 ? 248 VAL A CG1 1 ATOM 2012 C CG2 . VAL A 1 248 ? 44.090 65.141 29.084 1.00 46.76 ? 248 VAL A CG2 1 ATOM 2013 N N . ALA A 1 249 ? 43.567 63.132 32.621 1.00 78.30 ? 249 ALA A N 1 ATOM 2014 C CA . ALA A 1 249 ? 44.487 63.045 33.744 1.00 80.43 ? 249 ALA A CA 1 ATOM 2015 C C . ALA A 1 249 ? 45.772 62.503 33.149 1.00 78.05 ? 249 ALA A C 1 ATOM 2016 O O . ALA A 1 249 ? 45.744 61.569 32.345 1.00 69.10 ? 249 ALA A O 1 ATOM 2017 C CB . ALA A 1 249 ? 43.952 62.094 34.802 1.00 51.60 ? 249 ALA A CB 1 ATOM 2018 N N . VAL A 1 250 ? 46.898 63.094 33.525 1.00 84.89 ? 250 VAL A N 1 ATOM 2019 C CA . VAL A 1 250 ? 48.173 62.646 32.996 1.00 94.28 ? 250 VAL A CA 1 ATOM 2020 C C . VAL A 1 250 ? 49.028 61.965 34.068 1.00 92.91 ? 250 VAL A C 1 ATOM 2021 O O . VAL A 1 250 ? 49.227 62.507 35.162 1.00 90.45 ? 250 VAL A O 1 ATOM 2022 C CB . VAL A 1 250 ? 48.943 63.832 32.342 1.00 52.32 ? 250 VAL A CB 1 ATOM 2023 C CG1 . VAL A 1 250 ? 49.053 64.994 33.315 1.00 48.33 ? 250 VAL A CG1 1 ATOM 2024 C CG2 . VAL A 1 250 ? 50.314 63.371 31.884 1.00 52.20 ? 250 VAL A CG2 1 ATOM 2025 N N . PRO A 1 251 ? 49.524 60.748 33.767 1.00 93.67 ? 251 PRO A N 1 ATOM 2026 C CA . PRO A 1 251 ? 50.360 59.958 34.677 1.00 99.38 ? 251 PRO A CA 1 ATOM 2027 C C . PRO A 1 251 ? 51.454 60.805 35.321 1.00 104.31 ? 251 PRO A C 1 ATOM 2028 O O . PRO A 1 251 ? 52.087 61.624 34.656 1.00 103.52 ? 251 PRO A O 1 ATOM 2029 C CB . PRO A 1 251 ? 50.924 58.876 33.764 1.00 55.68 ? 251 PRO A CB 1 ATOM 2030 C CG . PRO A 1 251 ? 49.784 58.629 32.827 1.00 54.25 ? 251 PRO A CG 1 ATOM 2031 C CD . PRO A 1 251 ? 49.328 60.034 32.490 1.00 52.33 ? 251 PRO A CD 1 ATOM 2032 N N . PRO A 1 252 ? 51.695 60.609 36.627 1.00 112.64 ? 252 PRO A N 1 ATOM 2033 C CA . PRO A 1 252 ? 52.720 61.371 37.350 1.00 113.77 ? 252 PRO A CA 1 ATOM 2034 C C . PRO A 1 252 ? 54.105 61.264 36.715 1.00 114.71 ? 252 PRO A C 1 ATOM 2035 O O . PRO A 1 252 ? 54.954 62.140 36.900 1.00 115.04 ? 252 PRO A O 1 ATOM 2036 C CB . PRO A 1 252 ? 52.671 60.765 38.751 1.00 110.23 ? 252 PRO A CB 1 ATOM 2037 C CG . PRO A 1 252 ? 52.297 59.340 38.476 1.00 111.11 ? 252 PRO A CG 1 ATOM 2038 C CD . PRO A 1 252 ? 51.194 59.498 37.455 1.00 109.58 ? 252 PRO A CD 1 ATOM 2039 N N . GLN A 1 253 ? 54.319 60.187 35.962 1.00 147.43 ? 253 GLN A N 1 ATOM 2040 C CA . GLN A 1 253 ? 55.595 59.952 35.297 1.00 150.37 ? 253 GLN A CA 1 ATOM 2041 C C . GLN A 1 253 ? 55.420 59.887 33.781 1.00 150.13 ? 253 GLN A C 1 ATOM 2042 O O . GLN A 1 253 ? 55.956 58.995 33.125 1.00 148.68 ? 253 GLN A O 1 ATOM 2043 C CB . GLN A 1 253 ? 56.217 58.643 35.805 1.00 149.34 ? 253 GLN A CB 1 ATOM 2044 C CG . GLN A 1 253 ? 57.631 58.376 35.298 1.00 152.10 ? 253 GLN A CG 1 ATOM 2045 C CD . GLN A 1 253 ? 58.223 57.088 35.845 1.00 157.78 ? 253 GLN A CD 1 ATOM 2046 O OE1 . GLN A 1 253 ? 58.395 56.931 37.055 1.00 159.39 ? 253 GLN A OE1 1 ATOM 2047 N NE2 . GLN A 1 253 ? 58.542 56.158 34.953 1.00 155.81 ? 253 GLN A NE2 1 ATOM 2048 N N . ASP A 1 254 ? 54.665 60.829 33.224 1.00 120.48 ? 254 ASP A N 1 ATOM 2049 C CA . ASP A 1 254 ? 54.449 60.849 31.783 1.00 119.15 ? 254 ASP A CA 1 ATOM 2050 C C . ASP A 1 254 ? 55.151 62.040 31.153 1.00 115.12 ? 254 ASP A C 1 ATOM 2051 O O . ASP A 1 254 ? 55.120 63.149 31.687 1.00 110.78 ? 254 ASP A O 1 ATOM 2052 C CB . ASP A 1 254 ? 52.958 60.905 31.451 1.00 87.80 ? 254 ASP A CB 1 ATOM 2053 C CG . ASP A 1 254 ? 52.675 60.536 30.004 1.00 89.45 ? 254 ASP A CG 1 ATOM 2054 O OD1 . ASP A 1 254 ? 53.286 61.147 29.103 1.00 92.09 ? 254 ASP A OD1 1 ATOM 2055 O OD2 . ASP A 1 254 ? 51.845 59.632 29.767 1.00 93.49 ? 254 ASP A OD2 1 ATOM 2056 N N . THR A 1 255 ? 55.777 61.800 30.006 1.00 98.21 ? 255 THR A N 1 ATOM 2057 C CA . THR A 1 255 ? 56.507 62.837 29.294 1.00 99.19 ? 255 THR A CA 1 ATOM 2058 C C . THR A 1 255 ? 55.964 63.034 27.885 1.00 95.11 ? 255 THR A C 1 ATOM 2059 O O . THR A 1 255 ? 56.236 64.051 27.245 1.00 95.05 ? 255 THR A O 1 ATOM 2060 C CB . THR A 1 255 ? 57.998 62.478 29.197 1.00 110.68 ? 255 THR A CB 1 ATOM 2061 O OG1 . THR A 1 255 ? 58.506 62.220 30.511 1.00 108.50 ? 255 THR A OG1 1 ATOM 2062 C CG2 . THR A 1 255 ? 58.789 63.618 28.562 1.00 111.23 ? 255 THR A CG2 1 ATOM 2063 N N . ALA A 1 256 ? 55.200 62.056 27.407 1.00 72.25 ? 256 ALA A N 1 ATOM 2064 C CA . ALA A 1 256 ? 54.617 62.112 26.071 1.00 70.63 ? 256 ALA A CA 1 ATOM 2065 C C . ALA A 1 256 ? 54.067 63.504 25.753 1.00 68.76 ? 256 ALA A C 1 ATOM 2066 O O . ALA A 1 256 ? 53.863 64.326 26.646 1.00 57.40 ? 256 ALA A O 1 ATOM 2067 C CB . ALA A 1 256 ? 53.514 61.073 25.946 1.00 72.83 ? 256 ALA A CB 1 ATOM 2068 N N . PRO A 1 257 ? 53.827 63.788 24.467 1.00 102.89 ? 257 PRO A N 1 ATOM 2069 C CA . PRO A 1 257 ? 53.300 65.095 24.066 1.00 101.60 ? 257 PRO A CA 1 ATOM 2070 C C . PRO A 1 257 ? 51.768 65.163 24.062 1.00 99.65 ? 257 PRO A C 1 ATOM 2071 O O . PRO A 1 257 ? 51.099 64.278 23.522 1.00 96.91 ? 257 PRO A O 1 ATOM 2072 C CB . PRO A 1 257 ? 53.891 65.273 22.677 1.00 65.89 ? 257 PRO A CB 1 ATOM 2073 C CG . PRO A 1 257 ? 53.802 63.872 22.130 1.00 68.54 ? 257 PRO A CG 1 ATOM 2074 C CD . PRO A 1 257 ? 54.272 63.013 23.293 1.00 68.33 ? 257 PRO A CD 1 ATOM 2075 N N . TYR A 1 258 ? 51.221 66.215 24.670 1.00 88.28 ? 258 TYR A N 1 ATOM 2076 C CA . TYR A 1 258 ? 49.773 66.404 24.727 1.00 88.40 ? 258 TYR A CA 1 ATOM 2077 C C . TYR A 1 258 ? 49.310 67.579 23.875 1.00 84.66 ? 258 TYR A C 1 ATOM 2078 O O . TYR A 1 258 ? 49.742 68.716 24.079 1.00 83.97 ? 258 TYR A O 1 ATOM 2079 C CB . TYR A 1 258 ? 49.306 66.635 26.167 1.00 92.43 ? 258 TYR A CB 1 ATOM 2080 C CG . TYR A 1 258 ? 49.286 65.395 27.030 1.00 99.85 ? 258 TYR A CG 1 ATOM 2081 C CD1 . TYR A 1 258 ? 50.434 64.956 27.682 1.00 96.46 ? 258 TYR A CD1 1 ATOM 2082 C CD2 . TYR A 1 258 ? 48.111 64.659 27.197 1.00 98.67 ? 258 TYR A CD2 1 ATOM 2083 C CE1 . TYR A 1 258 ? 50.414 63.815 28.484 1.00 100.87 ? 258 TYR A CE1 1 ATOM 2084 C CE2 . TYR A 1 258 ? 48.081 63.517 27.995 1.00 102.09 ? 258 TYR A CE2 1 ATOM 2085 C CZ . TYR A 1 258 ? 49.236 63.102 28.636 1.00 102.02 ? 258 TYR A CZ 1 ATOM 2086 O OH . TYR A 1 258 ? 49.219 61.979 29.428 1.00 100.72 ? 258 TYR A OH 1 ATOM 2087 N N . SER A 1 259 ? 48.422 67.296 22.927 1.00 90.82 ? 259 SER A N 1 ATOM 2088 C CA . SER A 1 259 ? 47.881 68.325 22.047 1.00 92.97 ? 259 SER A CA 1 ATOM 2089 C C . SER A 1 259 ? 46.363 68.235 21.966 1.00 90.66 ? 259 SER A C 1 ATOM 2090 O O . SER A 1 259 ? 45.796 67.143 21.960 1.00 81.13 ? 259 SER A O 1 ATOM 2091 C CB . SER A 1 259 ? 48.469 68.192 20.640 1.00 99.95 ? 259 SER A CB 1 ATOM 2092 O OG . SER A 1 259 ? 49.833 68.567 20.619 1.00 116.99 ? 259 SER A OG 1 ATOM 2093 N N . CYS A 1 260 ? 45.705 69.389 21.909 1.00 74.22 ? 260 CYS A N 1 ATOM 2094 C CA . CYS A 1 260 ? 44.255 69.414 21.811 1.00 70.70 ? 260 CYS A CA 1 ATOM 2095 C C . CYS A 1 260 ? 43.802 69.686 20.393 1.00 67.87 ? 260 CYS A C 1 ATOM 2096 O O . CYS A 1 260 ? 44.345 70.551 19.708 1.00 68.22 ? 260 CYS A O 1 ATOM 2097 C CB . CYS A 1 260 ? 43.651 70.480 22.715 1.00 75.36 ? 260 CYS A CB 1 ATOM 2098 S SG . CYS A 1 260 ? 41.835 70.473 22.580 1.00 79.37 ? 260 CYS A SG 1 ATOM 2099 N N . HIS A 1 261 ? 42.788 68.952 19.962 1.00 75.97 ? 261 HIS A N 1 ATOM 2100 C CA . HIS A 1 261 ? 42.260 69.114 18.620 1.00 72.96 ? 261 HIS A CA 1 ATOM 2101 C C . HIS A 1 261 ? 40.828 69.631 18.633 1.00 81.90 ? 261 HIS A C 1 ATOM 2102 O O . HIS A 1 261 ? 40.010 69.224 19.464 1.00 73.32 ? 261 HIS A O 1 ATOM 2103 C CB . HIS A 1 261 ? 42.329 67.785 17.871 1.00 69.55 ? 261 HIS A CB 1 ATOM 2104 C CG . HIS A 1 261 ? 43.709 67.214 17.794 1.00 82.25 ? 261 HIS A CG 1 ATOM 2105 N ND1 . HIS A 1 261 ? 44.153 66.485 16.711 1.00 83.81 ? 261 HIS A ND1 1 ATOM 2106 C CD2 . HIS A 1 261 ? 44.746 67.270 18.663 1.00 86.42 ? 261 HIS A CD2 1 ATOM 2107 C CE1 . HIS A 1 261 ? 45.406 66.120 16.916 1.00 88.76 ? 261 HIS A CE1 1 ATOM 2108 N NE2 . HIS A 1 261 ? 45.789 66.583 18.093 1.00 89.17 ? 261 HIS A NE2 1 ATOM 2109 N N . VAL A 1 262 ? 40.530 70.533 17.704 1.00 54.57 ? 262 VAL A N 1 ATOM 2110 C CA . VAL A 1 262 ? 39.197 71.103 17.615 1.00 45.70 ? 262 VAL A CA 1 ATOM 2111 C C . VAL A 1 262 ? 38.722 71.275 16.181 1.00 53.03 ? 262 VAL A C 1 ATOM 2112 O O . VAL A 1 262 ? 39.238 72.113 15.449 1.00 54.16 ? 262 VAL A O 1 ATOM 2113 C CB . VAL A 1 262 ? 39.131 72.483 18.316 1.00 37.56 ? 262 VAL A CB 1 ATOM 2114 C CG1 . VAL A 1 262 ? 37.733 73.063 18.187 1.00 38.65 ? 262 VAL A CG1 1 ATOM 2115 C CG2 . VAL A 1 262 ? 39.503 72.349 19.776 1.00 36.12 ? 262 VAL A CG2 1 ATOM 2116 N N . GLN A 1 263 ? 37.745 70.473 15.777 1.00 44.99 ? 263 GLN A N 1 ATOM 2117 C CA . GLN A 1 263 ? 37.184 70.594 14.436 1.00 42.21 ? 263 GLN A CA 1 ATOM 2118 C C . GLN A 1 263 ? 35.836 71.303 14.549 1.00 49.86 ? 263 GLN A C 1 ATOM 2119 O O . GLN A 1 263 ? 35.037 71.000 15.440 1.00 48.65 ? 263 GLN A O 1 ATOM 2120 C CB . GLN A 1 263 ? 36.998 69.223 13.783 1.00 53.26 ? 263 GLN A CB 1 ATOM 2121 C CG . GLN A 1 263 ? 36.305 69.275 12.421 1.00 63.40 ? 263 GLN A CG 1 ATOM 2122 C CD . GLN A 1 263 ? 36.955 70.257 11.451 1.00 81.08 ? 263 GLN A CD 1 ATOM 2123 O OE1 . GLN A 1 263 ? 36.903 71.471 11.647 1.00 82.13 ? 263 GLN A OE1 1 ATOM 2124 N NE2 . GLN A 1 263 ? 37.574 69.730 10.400 1.00 87.16 ? 263 GLN A NE2 1 ATOM 2125 N N . HIS A 1 264 ? 35.591 72.254 13.653 1.00 31.35 ? 264 HIS A N 1 ATOM 2126 C CA . HIS A 1 264 ? 34.346 73.010 13.665 1.00 31.99 ? 264 HIS A CA 1 ATOM 2127 C C . HIS A 1 264 ? 33.974 73.469 12.264 1.00 36.13 ? 264 HIS A C 1 ATOM 2128 O O . HIS A 1 264 ? 34.833 73.873 11.497 1.00 37.30 ? 264 HIS A O 1 ATOM 2129 C CB . HIS A 1 264 ? 34.486 74.214 14.591 1.00 30.50 ? 264 HIS A CB 1 ATOM 2130 C CG . HIS A 1 264 ? 33.220 74.983 14.767 1.00 38.24 ? 264 HIS A CG 1 ATOM 2131 N ND1 . HIS A 1 264 ? 32.734 75.843 13.809 1.00 30.50 ? 264 HIS A ND1 1 ATOM 2132 C CD2 . HIS A 1 264 ? 32.328 75.008 15.784 1.00 30.50 ? 264 HIS A CD2 1 ATOM 2133 C CE1 . HIS A 1 264 ? 31.597 76.370 14.229 1.00 39.28 ? 264 HIS A CE1 1 ATOM 2134 N NE2 . HIS A 1 264 ? 31.329 75.881 15.425 1.00 32.31 ? 264 HIS A NE2 1 ATOM 2135 N N . SER A 1 265 ? 32.686 73.415 11.943 1.00 41.08 ? 265 SER A N 1 ATOM 2136 C CA . SER A 1 265 ? 32.192 73.801 10.622 1.00 42.98 ? 265 SER A CA 1 ATOM 2137 C C . SER A 1 265 ? 32.756 75.109 10.065 1.00 43.07 ? 265 SER A C 1 ATOM 2138 O O . SER A 1 265 ? 32.739 75.327 8.853 1.00 47.90 ? 265 SER A O 1 ATOM 2139 C CB . SER A 1 265 ? 30.671 73.906 10.644 1.00 38.86 ? 265 SER A CB 1 ATOM 2140 O OG . SER A 1 265 ? 30.264 75.060 11.357 1.00 39.30 ? 265 SER A OG 1 ATOM 2141 N N . SER A 1 266 ? 33.255 75.975 10.941 1.00 41.66 ? 266 SER A N 1 ATOM 2142 C CA . SER A 1 266 ? 33.789 77.260 10.512 1.00 39.91 ? 266 SER A CA 1 ATOM 2143 C C . SER A 1 266 ? 35.300 77.269 10.341 1.00 45.49 ? 266 SER A C 1 ATOM 2144 O O . SER A 1 266 ? 35.905 78.332 10.244 1.00 45.52 ? 266 SER A O 1 ATOM 2145 C CB . SER A 1 266 ? 33.397 78.343 11.516 1.00 33.57 ? 266 SER A CB 1 ATOM 2146 O OG . SER A 1 266 ? 34.104 78.173 12.732 1.00 33.66 ? 266 SER A OG 1 ATOM 2147 N N . LEU A 1 267 ? 35.913 76.095 10.305 1.00 43.84 ? 267 LEU A N 1 ATOM 2148 C CA . LEU A 1 267 ? 37.363 76.013 10.156 1.00 45.04 ? 267 LEU A CA 1 ATOM 2149 C C . LEU A 1 267 ? 37.764 75.331 8.868 1.00 54.20 ? 267 LEU A C 1 ATOM 2150 O O . LEU A 1 267 ? 37.256 74.259 8.544 1.00 53.40 ? 267 LEU A O 1 ATOM 2151 C CB . LEU A 1 267 ? 37.981 75.248 11.321 1.00 30.46 ? 267 LEU A CB 1 ATOM 2152 C CG . LEU A 1 267 ? 37.784 75.827 12.717 1.00 34.04 ? 267 LEU A CG 1 ATOM 2153 C CD1 . LEU A 1 267 ? 38.358 74.838 13.728 1.00 31.74 ? 267 LEU A CD1 1 ATOM 2154 C CD2 . LEU A 1 267 ? 38.443 77.191 12.828 1.00 28.73 ? 267 LEU A CD2 1 ATOM 2155 N N . ALA A 1 268 ? 38.690 75.948 8.142 1.00 59.83 ? 268 ALA A N 1 ATOM 2156 C CA . ALA A 1 268 ? 39.159 75.389 6.883 1.00 64.38 ? 268 ALA A CA 1 ATOM 2157 C C . ALA A 1 268 ? 39.846 74.058 7.146 1.00 63.38 ? 268 ALA A C 1 ATOM 2158 O O . ALA A 1 268 ? 39.789 73.150 6.321 1.00 60.75 ? 268 ALA A O 1 ATOM 2159 C CB . ALA A 1 268 ? 40.125 76.354 6.213 1.00 86.78 ? 268 ALA A CB 1 ATOM 2160 N N . GLN A 1 269 ? 40.495 73.961 8.305 1.00 52.78 ? 269 GLN A N 1 ATOM 2161 C CA . GLN A 1 269 ? 41.217 72.762 8.727 1.00 50.69 ? 269 GLN A CA 1 ATOM 2162 C C . GLN A 1 269 ? 41.217 72.784 10.246 1.00 47.62 ? 269 GLN A C 1 ATOM 2163 O O . GLN A 1 269 ? 41.266 73.852 10.851 1.00 44.63 ? 269 GLN A O 1 ATOM 2164 C CB . GLN A 1 269 ? 42.667 72.788 8.223 1.00 121.45 ? 269 GLN A CB 1 ATOM 2165 C CG . GLN A 1 269 ? 42.990 73.897 7.217 1.00 139.08 ? 269 GLN A CG 1 ATOM 2166 C CD . GLN A 1 269 ? 43.227 75.258 7.865 1.00 133.63 ? 269 GLN A CD 1 ATOM 2167 O OE1 . GLN A 1 269 ? 42.390 75.766 8.613 1.00 131.03 ? 269 GLN A OE1 1 ATOM 2168 N NE2 . GLN A 1 269 ? 44.374 75.857 7.566 1.00 142.93 ? 269 GLN A NE2 1 ATOM 2169 N N . PRO A 1 270 ? 41.170 71.608 10.886 1.00 57.75 ? 270 PRO A N 1 ATOM 2170 C CA . PRO A 1 270 ? 41.163 71.530 12.350 1.00 60.87 ? 270 PRO A CA 1 ATOM 2171 C C . PRO A 1 270 ? 42.274 72.308 13.050 1.00 62.52 ? 270 PRO A C 1 ATOM 2172 O O . PRO A 1 270 ? 43.293 72.643 12.449 1.00 64.07 ? 270 PRO A O 1 ATOM 2173 C CB . PRO A 1 270 ? 41.243 70.026 12.619 1.00 59.36 ? 270 PRO A CB 1 ATOM 2174 C CG . PRO A 1 270 ? 41.927 69.494 11.404 1.00 59.15 ? 270 PRO A CG 1 ATOM 2175 C CD . PRO A 1 270 ? 41.258 70.263 10.298 1.00 61.89 ? 270 PRO A CD 1 ATOM 2176 N N . LEU A 1 271 ? 42.055 72.599 14.328 1.00 43.59 ? 271 LEU A N 1 ATOM 2177 C CA . LEU A 1 271 ? 43.021 73.328 15.142 1.00 40.67 ? 271 LEU A CA 1 ATOM 2178 C C . LEU A 1 271 ? 43.707 72.378 16.108 1.00 44.55 ? 271 LEU A C 1 ATOM 2179 O O . LEU A 1 271 ? 43.111 71.405 16.569 1.00 46.82 ? 271 LEU A O 1 ATOM 2180 C CB . LEU A 1 271 ? 42.324 74.439 15.931 1.00 37.91 ? 271 LEU A CB 1 ATOM 2181 C CG . LEU A 1 271 ? 42.136 75.788 15.239 1.00 52.28 ? 271 LEU A CG 1 ATOM 2182 C CD1 . LEU A 1 271 ? 41.559 75.609 13.852 1.00 64.60 ? 271 LEU A CD1 1 ATOM 2183 C CD2 . LEU A 1 271 ? 41.234 76.651 16.091 1.00 49.14 ? 271 LEU A CD2 1 ATOM 2184 N N . VAL A 1 272 ? 44.967 72.664 16.411 1.00 48.40 ? 272 VAL A N 1 ATOM 2185 C CA . VAL A 1 272 ? 45.725 71.833 17.330 1.00 47.24 ? 272 VAL A CA 1 ATOM 2186 C C . VAL A 1 272 ? 46.495 72.695 18.308 1.00 49.04 ? 272 VAL A C 1 ATOM 2187 O O . VAL A 1 272 ? 47.442 73.384 17.933 1.00 52.33 ? 272 VAL A O 1 ATOM 2188 C CB . VAL A 1 272 ? 46.741 70.946 16.597 1.00 45.37 ? 272 VAL A CB 1 ATOM 2189 C CG1 . VAL A 1 272 ? 47.375 69.992 17.585 1.00 45.17 ? 272 VAL A CG1 1 ATOM 2190 C CG2 . VAL A 1 272 ? 46.067 70.187 15.460 1.00 39.74 ? 272 VAL A CG2 1 ATOM 2191 N N . VAL A 1 273 ? 46.084 72.664 19.566 1.00 41.38 ? 273 VAL A N 1 ATOM 2192 C CA . VAL A 1 273 ? 46.776 73.441 20.572 1.00 48.03 ? 273 VAL A CA 1 ATOM 2193 C C . VAL A 1 273 ? 47.510 72.524 21.520 1.00 57.51 ? 273 VAL A C 1 ATOM 2194 O O . VAL A 1 273 ? 46.902 71.840 22.342 1.00 61.37 ? 273 VAL A O 1 ATOM 2195 C CB . VAL A 1 273 ? 45.815 74.309 21.361 1.00 32.27 ? 273 VAL A CB 1 ATOM 2196 C CG1 . VAL A 1 273 ? 46.551 74.986 22.520 1.00 32.39 ? 273 VAL A CG1 1 ATOM 2197 C CG2 . VAL A 1 273 ? 45.219 75.336 20.433 1.00 31.44 ? 273 VAL A CG2 1 ATOM 2198 N N . PRO A 1 274 ? 48.842 72.486 21.402 1.00 64.93 ? 274 PRO A N 1 ATOM 2199 C CA . PRO A 1 274 ? 49.658 71.634 22.265 1.00 65.96 ? 274 PRO A CA 1 ATOM 2200 C C . PRO A 1 274 ? 49.863 72.243 23.646 1.00 66.02 ? 274 PRO A C 1 ATOM 2201 O O . PRO A 1 274 ? 49.937 73.464 23.792 1.00 63.14 ? 274 PRO A O 1 ATOM 2202 C CB . PRO A 1 274 ? 50.959 71.513 21.481 1.00 49.11 ? 274 PRO A CB 1 ATOM 2203 C CG . PRO A 1 274 ? 51.066 72.860 20.841 1.00 47.72 ? 274 PRO A CG 1 ATOM 2204 C CD . PRO A 1 274 ? 49.663 73.102 20.342 1.00 44.87 ? 274 PRO A CD 1 ATOM 2205 N N . TRP A 1 275 ? 49.933 71.387 24.659 1.00 56.61 ? 275 TRP A N 1 ATOM 2206 C CA . TRP A 1 275 ? 50.159 71.853 26.016 1.00 63.75 ? 275 TRP A CA 1 ATOM 2207 C C . TRP A 1 275 ? 51.653 71.821 26.305 1.00 70.39 ? 275 TRP A C 1 ATOM 2208 O O . TRP A 1 275 ? 52.312 70.789 26.131 1.00 68.21 ? 275 TRP A O 1 ATOM 2209 C CB . TRP A 1 275 ? 49.433 70.976 27.032 1.00 62.77 ? 275 TRP A CB 1 ATOM 2210 C CG . TRP A 1 275 ? 49.783 71.339 28.439 1.00 55.03 ? 275 TRP A CG 1 ATOM 2211 C CD1 . TRP A 1 275 ? 49.600 72.551 29.043 1.00 55.94 ? 275 TRP A CD1 1 ATOM 2212 C CD2 . TRP A 1 275 ? 50.403 70.493 29.416 1.00 53.00 ? 275 TRP A CD2 1 ATOM 2213 N NE1 . TRP A 1 275 ? 50.069 72.516 30.336 1.00 60.04 ? 275 TRP A NE1 1 ATOM 2214 C CE2 . TRP A 1 275 ? 50.567 71.265 30.593 1.00 56.31 ? 275 TRP A CE2 1 ATOM 2215 C CE3 . TRP A 1 275 ? 50.837 69.158 29.414 1.00 55.39 ? 275 TRP A CE3 1 ATOM 2216 C CZ2 . TRP A 1 275 ? 51.146 70.743 31.760 1.00 58.37 ? 275 TRP A CZ2 1 ATOM 2217 C CZ3 . TRP A 1 275 ? 51.413 68.638 30.575 1.00 64.10 ? 275 TRP A CZ3 1 ATOM 2218 C CH2 . TRP A 1 275 ? 51.562 69.431 31.731 1.00 64.48 ? 275 TRP A CH2 1 ATOM 2219 N N . GLU A 1 276 ? 52.182 72.958 26.744 1.00 80.60 ? 276 GLU A N 1 ATOM 2220 C CA . GLU A 1 276 ? 53.596 73.064 27.058 1.00 88.54 ? 276 GLU A CA 1 ATOM 2221 C C . GLU A 1 276 ? 53.795 72.902 28.556 1.00 92.14 ? 276 GLU A C 1 ATOM 2222 O O . GLU A 1 276 ? 53.402 73.767 29.339 1.00 91.51 ? 276 GLU A O 1 ATOM 2223 C CB . GLU A 1 276 ? 54.139 74.418 26.593 1.00 99.79 ? 276 GLU A CB 1 ATOM 2224 C CG . GLU A 1 276 ? 53.965 74.676 25.096 1.00 107.52 ? 276 GLU A CG 1 ATOM 2225 C CD . GLU A 1 276 ? 54.618 73.610 24.233 1.00 112.09 ? 276 GLU A CD 1 ATOM 2226 O OE1 . GLU A 1 276 ? 55.847 73.421 24.347 1.00 115.52 ? 276 GLU A OE1 1 ATOM 2227 O OE2 . GLU A 1 276 ? 53.905 72.960 23.440 1.00 112.27 ? 276 GLU A OE2 1 ATOM 2228 N N . ALA A 1 277 ? 54.400 71.784 28.945 1.00 103.64 ? 277 ALA A N 1 ATOM 2229 C CA . ALA A 1 277 ? 54.652 71.493 30.349 1.00 106.60 ? 277 ALA A CA 1 ATOM 2230 C C . ALA A 1 277 ? 55.498 72.594 30.968 1.00 109.73 ? 277 ALA A C 1 ATOM 2231 O O . ALA A 1 277 ? 55.973 73.462 30.207 1.00 110.13 ? 277 ALA A O 1 ATOM 2232 C CB . ALA A 1 277 ? 55.359 70.151 30.484 1.00 101.23 ? 277 ALA A CB 1 HETATM 2233 C C1 . NAG B 2 . ? 11.318 82.958 -0.480 1.00 71.68 ? 310 NAG A C1 1 HETATM 2234 C C2 . NAG B 2 . ? 10.258 84.039 -0.202 1.00 72.29 ? 310 NAG A C2 1 HETATM 2235 C C3 . NAG B 2 . ? 10.206 85.045 -1.369 1.00 76.02 ? 310 NAG A C3 1 HETATM 2236 C C4 . NAG B 2 . ? 11.611 85.599 -1.634 1.00 79.36 ? 310 NAG A C4 1 HETATM 2237 C C5 . NAG B 2 . ? 12.559 84.424 -1.908 1.00 81.30 ? 310 NAG A C5 1 HETATM 2238 C C6 . NAG B 2 . ? 13.991 84.828 -2.193 1.00 83.95 ? 310 NAG A C6 1 HETATM 2239 C C7 . NAG B 2 . ? 8.017 83.427 -0.918 1.00 83.14 ? 310 NAG A C7 1 HETATM 2240 C C8 . NAG B 2 . ? 7.843 82.163 -1.743 1.00 77.69 ? 310 NAG A C8 1 HETATM 2241 N N2 . NAG B 2 . ? 8.958 83.423 0.021 1.00 72.04 ? 310 NAG A N2 1 HETATM 2242 O O3 . NAG B 2 . ? 9.319 86.111 -1.059 1.00 72.11 ? 310 NAG A O3 1 HETATM 2243 O O4 . NAG B 2 . ? 11.590 86.486 -2.743 1.00 83.90 ? 310 NAG A O4 1 HETATM 2244 O O5 . NAG B 2 . ? 12.592 83.552 -0.761 1.00 78.09 ? 310 NAG A O5 1 HETATM 2245 O O6 . NAG B 2 . ? 14.857 83.704 -2.117 1.00 80.40 ? 310 NAG A O6 1 HETATM 2246 O O7 . NAG B 2 . ? 7.290 84.394 -1.127 1.00 88.02 ? 310 NAG A O7 1 HETATM 2247 C C1 . NAG C 2 . ? 29.938 85.254 25.817 1.00 23.77 ? 320 NAG A C1 1 HETATM 2248 C C2 . NAG C 2 . ? 31.338 85.838 26.018 1.00 32.15 ? 320 NAG A C2 1 HETATM 2249 C C3 . NAG C 2 . ? 32.160 84.942 26.935 1.00 35.19 ? 320 NAG A C3 1 HETATM 2250 C C4 . NAG C 2 . ? 31.402 84.678 28.243 1.00 33.91 ? 320 NAG A C4 1 HETATM 2251 C C5 . NAG C 2 . ? 30.007 84.135 27.934 1.00 31.98 ? 320 NAG A C5 1 HETATM 2252 C C6 . NAG C 2 . ? 29.191 83.983 29.188 1.00 35.51 ? 320 NAG A C6 1 HETATM 2253 C C7 . NAG C 2 . ? 31.656 86.908 23.872 1.00 31.27 ? 320 NAG A C7 1 HETATM 2254 C C8 . NAG C 2 . ? 31.868 86.582 22.406 1.00 29.13 ? 320 NAG A C8 1 HETATM 2255 N N2 . NAG C 2 . ? 32.029 85.979 24.749 1.00 27.88 ? 320 NAG A N2 1 HETATM 2256 O O3 . NAG C 2 . ? 33.392 85.589 27.212 1.00 36.42 ? 320 NAG A O3 1 HETATM 2257 O O4 . NAG C 2 . ? 32.125 83.732 29.063 1.00 39.64 ? 320 NAG A O4 1 HETATM 2258 O O5 . NAG C 2 . ? 29.298 85.060 27.088 1.00 29.15 ? 320 NAG A O5 1 HETATM 2259 O O6 . NAG C 2 . ? 28.810 85.254 29.681 1.00 32.33 ? 320 NAG A O6 1 HETATM 2260 O O7 . NAG C 2 . ? 31.152 87.989 24.201 1.00 27.83 ? 320 NAG A O7 1 HETATM 2261 C C1 . NAG D 2 . ? 32.733 84.251 30.194 1.00 94.92 ? 321 NAG A C1 1 HETATM 2262 C C2 . NAG D 2 . ? 33.041 83.111 31.174 1.00 101.09 ? 321 NAG A C2 1 HETATM 2263 C C3 . NAG D 2 . ? 33.936 83.590 32.325 1.00 111.23 ? 321 NAG A C3 1 HETATM 2264 C C4 . NAG D 2 . ? 35.156 84.336 31.786 1.00 115.12 ? 321 NAG A C4 1 HETATM 2265 C C5 . NAG D 2 . ? 34.666 85.467 30.888 1.00 116.55 ? 321 NAG A C5 1 HETATM 2266 C C6 . NAG D 2 . ? 35.774 86.328 30.315 1.00 115.48 ? 321 NAG A C6 1 HETATM 2267 C C7 . NAG D 2 . ? 31.611 81.288 31.812 1.00 107.87 ? 321 NAG A C7 1 HETATM 2268 C C8 . NAG D 2 . ? 31.969 80.631 33.136 1.00 113.98 ? 321 NAG A C8 1 HETATM 2269 N N2 . NAG D 2 . ? 31.798 82.598 31.714 1.00 99.20 ? 321 NAG A N2 1 HETATM 2270 O O3 . NAG D 2 . ? 34.362 82.476 33.093 1.00 106.92 ? 321 NAG A O3 1 HETATM 2271 O O4 . NAG D 2 . ? 35.919 84.859 32.864 1.00 123.69 ? 321 NAG A O4 1 HETATM 2272 O O5 . NAG D 2 . ? 33.937 84.909 29.780 1.00 108.28 ? 321 NAG A O5 1 HETATM 2273 O O6 . NAG D 2 . ? 35.288 87.618 29.965 1.00 115.53 ? 321 NAG A O6 1 HETATM 2274 O O7 . NAG D 2 . ? 31.172 80.607 30.887 1.00 111.80 ? 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 ? ? 51.86 -127.91 2 1 LYS A 44 ? ? -89.30 -70.96 3 1 LYS A 89 ? ? 38.33 56.91 4 1 ASP A 90 ? ? -153.45 77.27 5 1 ASN A 108 ? ? 48.07 14.67 6 1 TRP A 115 ? ? -166.46 99.73 7 1 GLU A 164 ? ? -126.56 -66.31 8 1 ASN A 179 ? ? -67.09 14.29 9 1 ILE A 180 ? ? -129.82 -58.00 10 1 ASP A 185 ? ? -59.68 108.33 11 1 PRO A 197 ? ? -54.27 97.53 12 1 PRO A 212 ? ? -69.37 -174.38 13 1 LYS A 214 ? ? -39.72 127.49 14 1 ALA A 222 ? ? 75.95 45.50 15 1 ALA A 256 ? ? -42.21 163.10 # 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 #