data_1MNP # _entry.id 1MNP # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 1MNP WWPDB D_1000175092 # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 1MNP _pdbx_database_status.recvd_initial_deposition_date 1995-01-27 _pdbx_database_status.deposit_site ? _pdbx_database_status.process_site ? _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Sundaramoorthy, M.' 1 'Poulos, T.L.' 2 # 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 'Preliminary crystallographic analysis of manganese peroxidase from Phanerochaete chrysosporium.' J.Mol.Biol. 238 845 848 1994 JMOBAK UK 0022-2836 0070 ? 8182752 10.1006/jmbi.1994.1338 1 'The Crystal Structure of Manganese Peroxidase from Phanerochaete Chrysosporium at 2.06 Angstroms Resolution' J.Biol.Chem. 269 32759 ? 1994 JBCHA3 US 0021-9258 0071 ? ? ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Sundaramoorthy, M.' 1 primary 'Kishi, K.' 2 primary 'Gold, M.H.' 3 primary 'Poulos, T.L.' 4 1 'Sundaramoorthy, M.' 5 1 'Kishi, K.' 6 1 'Gold, M.H.' 7 1 'Poulos, T.L.' 8 # _cell.entry_id 1MNP _cell.length_a 163.240 _cell.length_b 45.970 _cell.length_c 53.715 _cell.angle_alpha 90.00 _cell.angle_beta 97.16 _cell.angle_gamma 90.00 _cell.Z_PDB 4 _cell.pdbx_unique_axis ? # _symmetry.entry_id 1MNP _symmetry.space_group_name_H-M 'C 1 2 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 5 # 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 nat 'MANGANESE PEROXIDASE' 37482.973 1 1.11.1.7 ? ? ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 2 ? ? ? ? 3 non-polymer syn 'CALCIUM ION' 40.078 2 ? ? ? ? 4 non-polymer syn 'MANGANESE (II) ION' 54.938 1 ? ? ? ? 5 non-polymer syn 'PROTOPORPHYRIN IX CONTAINING FE' 616.487 1 ? ? ? ? 6 water nat water 18.015 250 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name MNP # _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 ;AVCPDGTRVSHAACCAFIPLAQDLQETIFQNECGEDAHEVIRLTFHDAIAISRSQGPKAGGGADGSMLLFPTVEPNFSAN NGIDDSVNNLIPFMQKHNTISAADLVQFAGAVALSNCPGAPRLEFLAGRPNKTIAAVDGLIPEPQDSVTKILQRFEDAGG FTPFEVVSLLASHSVARADKVDQTIDAAPFDSTPFTFDTQVFLEVLLKGVGFPGSANNTGEVASPLPLGSGSDTGEMRLQ SDFALAHDPRTACIWQGFVNEQAFMAASFRAAMSKLAVLGHNRNSLIDCSDVVPVPKPATGQPAMFPASTGPQDLELSCP SERFPTLTTQPGASQSLIAHCPDGSMSCPGVQFNGPA ; _entity_poly.pdbx_seq_one_letter_code_can ;AVCPDGTRVSHAACCAFIPLAQDLQETIFQNECGEDAHEVIRLTFHDAIAISRSQGPKAGGGADGSMLLFPTVEPNFSAN NGIDDSVNNLIPFMQKHNTISAADLVQFAGAVALSNCPGAPRLEFLAGRPNKTIAAVDGLIPEPQDSVTKILQRFEDAGG FTPFEVVSLLASHSVARADKVDQTIDAAPFDSTPFTFDTQVFLEVLLKGVGFPGSANNTGEVASPLPLGSGSDTGEMRLQ SDFALAHDPRTACIWQGFVNEQAFMAASFRAAMSKLAVLGHNRNSLIDCSDVVPVPKPATGQPAMFPASTGPQDLELSCP SERFPTLTTQPGASQSLIAHCPDGSMSCPGVQFNGPA ; _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 ALA n 1 2 VAL n 1 3 CYS n 1 4 PRO n 1 5 ASP n 1 6 GLY n 1 7 THR n 1 8 ARG n 1 9 VAL n 1 10 SER n 1 11 HIS n 1 12 ALA n 1 13 ALA n 1 14 CYS n 1 15 CYS n 1 16 ALA n 1 17 PHE n 1 18 ILE n 1 19 PRO n 1 20 LEU n 1 21 ALA n 1 22 GLN n 1 23 ASP n 1 24 LEU n 1 25 GLN n 1 26 GLU n 1 27 THR n 1 28 ILE n 1 29 PHE n 1 30 GLN n 1 31 ASN n 1 32 GLU n 1 33 CYS n 1 34 GLY n 1 35 GLU n 1 36 ASP n 1 37 ALA n 1 38 HIS n 1 39 GLU n 1 40 VAL n 1 41 ILE n 1 42 ARG n 1 43 LEU n 1 44 THR n 1 45 PHE n 1 46 HIS n 1 47 ASP n 1 48 ALA n 1 49 ILE n 1 50 ALA n 1 51 ILE n 1 52 SER n 1 53 ARG n 1 54 SER n 1 55 GLN n 1 56 GLY n 1 57 PRO n 1 58 LYS n 1 59 ALA n 1 60 GLY n 1 61 GLY n 1 62 GLY n 1 63 ALA n 1 64 ASP n 1 65 GLY n 1 66 SER n 1 67 MET n 1 68 LEU n 1 69 LEU n 1 70 PHE n 1 71 PRO n 1 72 THR n 1 73 VAL n 1 74 GLU n 1 75 PRO n 1 76 ASN n 1 77 PHE n 1 78 SER n 1 79 ALA n 1 80 ASN n 1 81 ASN n 1 82 GLY n 1 83 ILE n 1 84 ASP n 1 85 ASP n 1 86 SER n 1 87 VAL n 1 88 ASN n 1 89 ASN n 1 90 LEU n 1 91 ILE n 1 92 PRO n 1 93 PHE n 1 94 MET n 1 95 GLN n 1 96 LYS n 1 97 HIS n 1 98 ASN n 1 99 THR n 1 100 ILE n 1 101 SER n 1 102 ALA n 1 103 ALA n 1 104 ASP n 1 105 LEU n 1 106 VAL n 1 107 GLN n 1 108 PHE n 1 109 ALA n 1 110 GLY n 1 111 ALA n 1 112 VAL n 1 113 ALA n 1 114 LEU n 1 115 SER n 1 116 ASN n 1 117 CYS n 1 118 PRO n 1 119 GLY n 1 120 ALA n 1 121 PRO n 1 122 ARG n 1 123 LEU n 1 124 GLU n 1 125 PHE n 1 126 LEU n 1 127 ALA n 1 128 GLY n 1 129 ARG n 1 130 PRO n 1 131 ASN n 1 132 LYS n 1 133 THR n 1 134 ILE n 1 135 ALA n 1 136 ALA n 1 137 VAL n 1 138 ASP n 1 139 GLY n 1 140 LEU n 1 141 ILE n 1 142 PRO n 1 143 GLU n 1 144 PRO n 1 145 GLN n 1 146 ASP n 1 147 SER n 1 148 VAL n 1 149 THR n 1 150 LYS n 1 151 ILE n 1 152 LEU n 1 153 GLN n 1 154 ARG n 1 155 PHE n 1 156 GLU n 1 157 ASP n 1 158 ALA n 1 159 GLY n 1 160 GLY n 1 161 PHE n 1 162 THR n 1 163 PRO n 1 164 PHE n 1 165 GLU n 1 166 VAL n 1 167 VAL n 1 168 SER n 1 169 LEU n 1 170 LEU n 1 171 ALA n 1 172 SER n 1 173 HIS n 1 174 SER n 1 175 VAL n 1 176 ALA n 1 177 ARG n 1 178 ALA n 1 179 ASP n 1 180 LYS n 1 181 VAL n 1 182 ASP n 1 183 GLN n 1 184 THR n 1 185 ILE n 1 186 ASP n 1 187 ALA n 1 188 ALA n 1 189 PRO n 1 190 PHE n 1 191 ASP n 1 192 SER n 1 193 THR n 1 194 PRO n 1 195 PHE n 1 196 THR n 1 197 PHE n 1 198 ASP n 1 199 THR n 1 200 GLN n 1 201 VAL n 1 202 PHE n 1 203 LEU n 1 204 GLU n 1 205 VAL n 1 206 LEU n 1 207 LEU n 1 208 LYS n 1 209 GLY n 1 210 VAL n 1 211 GLY n 1 212 PHE n 1 213 PRO n 1 214 GLY n 1 215 SER n 1 216 ALA n 1 217 ASN n 1 218 ASN n 1 219 THR n 1 220 GLY n 1 221 GLU n 1 222 VAL n 1 223 ALA n 1 224 SER n 1 225 PRO n 1 226 LEU n 1 227 PRO n 1 228 LEU n 1 229 GLY n 1 230 SER n 1 231 GLY n 1 232 SER n 1 233 ASP n 1 234 THR n 1 235 GLY n 1 236 GLU n 1 237 MET n 1 238 ARG n 1 239 LEU n 1 240 GLN n 1 241 SER n 1 242 ASP n 1 243 PHE n 1 244 ALA n 1 245 LEU n 1 246 ALA n 1 247 HIS n 1 248 ASP n 1 249 PRO n 1 250 ARG n 1 251 THR n 1 252 ALA n 1 253 CYS n 1 254 ILE n 1 255 TRP n 1 256 GLN n 1 257 GLY n 1 258 PHE n 1 259 VAL n 1 260 ASN n 1 261 GLU n 1 262 GLN n 1 263 ALA n 1 264 PHE n 1 265 MET n 1 266 ALA n 1 267 ALA n 1 268 SER n 1 269 PHE n 1 270 ARG n 1 271 ALA n 1 272 ALA n 1 273 MET n 1 274 SER n 1 275 LYS n 1 276 LEU n 1 277 ALA n 1 278 VAL n 1 279 LEU n 1 280 GLY n 1 281 HIS n 1 282 ASN n 1 283 ARG n 1 284 ASN n 1 285 SER n 1 286 LEU n 1 287 ILE n 1 288 ASP n 1 289 CYS n 1 290 SER n 1 291 ASP n 1 292 VAL n 1 293 VAL n 1 294 PRO n 1 295 VAL n 1 296 PRO n 1 297 LYS n 1 298 PRO n 1 299 ALA n 1 300 THR n 1 301 GLY n 1 302 GLN n 1 303 PRO n 1 304 ALA n 1 305 MET n 1 306 PHE n 1 307 PRO n 1 308 ALA n 1 309 SER n 1 310 THR n 1 311 GLY n 1 312 PRO n 1 313 GLN n 1 314 ASP n 1 315 LEU n 1 316 GLU n 1 317 LEU n 1 318 SER n 1 319 CYS n 1 320 PRO n 1 321 SER n 1 322 GLU n 1 323 ARG n 1 324 PHE n 1 325 PRO n 1 326 THR n 1 327 LEU n 1 328 THR n 1 329 THR n 1 330 GLN n 1 331 PRO n 1 332 GLY n 1 333 ALA n 1 334 SER n 1 335 GLN n 1 336 SER n 1 337 LEU n 1 338 ILE n 1 339 ALA n 1 340 HIS n 1 341 CYS n 1 342 PRO n 1 343 ASP n 1 344 GLY n 1 345 SER n 1 346 MET n 1 347 SER n 1 348 CYS n 1 349 PRO n 1 350 GLY n 1 351 VAL n 1 352 GLN n 1 353 PHE n 1 354 ASN n 1 355 GLY n 1 356 PRO n 1 357 ALA n # _entity_src_nat.entity_id 1 _entity_src_nat.pdbx_src_id 1 _entity_src_nat.pdbx_alt_source_flag sample _entity_src_nat.pdbx_beg_seq_num ? _entity_src_nat.pdbx_end_seq_num ? _entity_src_nat.common_name ? _entity_src_nat.pdbx_organism_scientific 'Phanerochaete chrysosporium' _entity_src_nat.pdbx_ncbi_taxonomy_id 5306 _entity_src_nat.genus Phanerochaete _entity_src_nat.species ? _entity_src_nat.strain OGC101 _entity_src_nat.tissue ? _entity_src_nat.tissue_fraction ? _entity_src_nat.pdbx_secretion ? _entity_src_nat.pdbx_fragment ? _entity_src_nat.pdbx_variant ? _entity_src_nat.pdbx_cell_line ? _entity_src_nat.pdbx_atcc ? _entity_src_nat.pdbx_cellular_location ? _entity_src_nat.pdbx_organ ? _entity_src_nat.pdbx_organelle ? _entity_src_nat.pdbx_cell ? _entity_src_nat.pdbx_plasmid_name ? _entity_src_nat.pdbx_plasmid_details ? _entity_src_nat.details ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code PEM1_PHACH _struct_ref.entity_id 1 _struct_ref.pdbx_db_accession Q02567 _struct_ref.pdbx_align_begin 1 _struct_ref.pdbx_seq_one_letter_code ;MAFKSLIAFVALAAAVRAAPTAVCPDGTRVSHAACCAFIPLAQDLQETIFQNECGEDAHEVIRLTFHDAIAISRSQGPKA GGGADGSMLLFPTVEPNFSANNGIDDSVNNLIPFMQKHNTISAADLVQFAGAVALSNCPGAPRLEFLAGRPNKTIAAVDG LIPEPQDSVTKILQRFEDAGGFTPFEVVSLLASHSVARADKVDQTIDAAPFDSTPFTFDTQVFLEVLLKGVGFPGSANNT GEVASPLPLGSGSDTGEMRLQSDFALAHDPRTACIWQGFVNEQAFMAASFRAAMSKLAVLGHNRNSLIDCSDVVPVPKPA TGQPAMFPASTGPQDLELSCPSERFPTLTTQPGASQSLIAHCPDGSMSCPGVQFNGPA ; _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 1MNP _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 357 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession Q02567 _struct_ref_seq.db_align_beg 22 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 378 _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 357 # 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 CA non-polymer . 'CALCIUM ION' ? 'Ca 2' 40.078 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 HEM non-polymer . 'PROTOPORPHYRIN IX CONTAINING FE' HEME 'C34 H32 Fe N4 O4' 616.487 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 MN non-polymer . 'MANGANESE (II) ION' ? 'Mn 2' 54.938 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 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 1MNP _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.67 _exptl_crystal.density_percent_sol 53.85 _exptl_crystal.description ? # _diffrn.id 1 _diffrn.ambient_temp ? _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector ? _diffrn_detector.type SIEMENS _diffrn_detector.pdbx_collection_date 1993-06-18 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator ? _diffrn_radiation.pdbx_diffrn_protocol ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.5418 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source ? _diffrn_source.type ? _diffrn_source.pdbx_synchrotron_site ? _diffrn_source.pdbx_synchrotron_beamline ? _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.5418 # _reflns.entry_id 1MNP _reflns.observed_criterion_sigma_I 2.1 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low ? _reflns.d_resolution_high ? _reflns.number_obs 27040 _reflns.number_all ? _reflns.percent_possible_obs 99. _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI ? _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 5.15 _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _refine.entry_id 1MNP _refine.ls_number_reflns_obs 22370 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 2. _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 8.0 _refine.ls_d_res_high 2.0 _refine.ls_percent_reflns_obs ? _refine.ls_R_factor_obs 0.2 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.2 _refine.ls_R_factor_R_free ? _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free ? _refine.ls_number_reflns_R_free ? _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.B_iso_mean 13.8 _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.solvent_model_details ? _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ? _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML ? _refine.overall_SU_B ? _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _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.pdbx_overall_phase_error ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_analyze.entry_id 1MNP _refine_analyze.Luzzati_coordinate_error_obs 0.20 _refine_analyze.Luzzati_sigma_a_obs ? _refine_analyze.Luzzati_d_res_low_obs ? _refine_analyze.Luzzati_coordinate_error_free ? _refine_analyze.Luzzati_sigma_a_free ? _refine_analyze.Luzzati_d_res_low_free ? _refine_analyze.number_disordered_residues ? _refine_analyze.occupancy_sum_hydrogen ? _refine_analyze.occupancy_sum_non_hydrogen ? _refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION' # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 2629 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 74 _refine_hist.number_atoms_solvent 250 _refine_hist.number_atoms_total 2953 _refine_hist.d_res_high 2.0 _refine_hist.d_res_low 8.0 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function x_bond_d 0.008 ? ? ? 'X-RAY DIFFRACTION' ? x_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_deg 1.370 ? ? ? 'X-RAY DIFFRACTION' ? x_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_dihedral_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? x_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_improper_angle_d ? ? ? ? 'X-RAY DIFFRACTION' ? x_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION' ? x_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION' ? x_mcbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? x_mcangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? x_scbond_it ? ? ? ? 'X-RAY DIFFRACTION' ? x_scangle_it ? ? ? ? 'X-RAY DIFFRACTION' ? # _struct.entry_id 1MNP _struct.title 'MANGANESE PEROXIDASE' _struct.pdbx_descriptor 'MANGANESE PEROXIDASE, PROTOPORPHYRIN IX CONTAINING FE' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1MNP _struct_keywords.pdbx_keywords 'PEROXIDASE (DONOR: H2O2 OXIDOREDUCTASE)' _struct_keywords.text 'HEME PEROXIDASE, PEROXIDASE (DONOR: H2O2 OXIDOREDUCTASE)' # 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 3 ? E N N 3 ? F N N 4 ? G N N 5 ? H N N 6 ? # _struct_biol.id 1 # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 A ALA A 16 ? ILE A 28 ? ALA A 16 ILE A 28 1 ? 13 HELX_P HELX_P2 B GLY A 34 ? ILE A 49 ? GLY A 34 ILE A 49 1 ? 16 HELX_P HELX_P3 "B'" GLY A 65 ? PHE A 70 ? GLY A 65 PHE A 70 1 ? 6 HELX_P HELX_P4 C ILE A 83 ? HIS A 97 ? ILE A 83 HIS A 97 1 ? 15 HELX_P HELX_P5 D SER A 101 ? SER A 115 ? SER A 101 SER A 115 1 ? 15 HELX_P HELX_P6 E SER A 147 ? GLY A 159 ? SER A 147 GLY A 159 1 ? 13 HELX_P HELX_P7 F THR A 162 ? LEU A 170 ? THR A 162 LEU A 170 1 ? 9 HELX_P HELX_P8 G THR A 199 ? VAL A 205 ? THR A 199 VAL A 205 1 ? 7 HELX_P HELX_P9 H LEU A 239 ? HIS A 247 ? LEU A 239 HIS A 247 1 ? 9 HELX_P HELX_P10 I THR A 251 ? GLY A 257 ? THR A 251 GLY A 257 1 ? 7 HELX_P HELX_P11 J GLU A 261 ? ALA A 277 ? GLU A 261 ALA A 277 1 ? 17 # _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 3 SG ? ? ? 1_555 A CYS 15 SG ? ? A CYS 3 A CYS 15 1_555 ? ? ? ? ? ? ? 2.032 ? disulf2 disulf ? ? A CYS 14 SG ? ? ? 1_555 A CYS 289 SG ? ? A CYS 14 A CYS 289 1_555 ? ? ? ? ? ? ? 2.025 ? disulf3 disulf ? ? A CYS 33 SG ? ? ? 1_555 A CYS 117 SG ? ? A CYS 33 A CYS 117 1_555 ? ? ? ? ? ? ? 2.031 ? disulf4 disulf ? ? A CYS 253 SG ? ? ? 1_555 A CYS 319 SG ? ? A CYS 253 A CYS 319 1_555 ? ? ? ? ? ? ? 2.033 ? disulf5 disulf ? ? A CYS 341 SG ? ? ? 1_555 A CYS 348 SG ? ? A CYS 341 A CYS 348 1_555 ? ? ? ? ? ? ? 2.030 ? covale1 covale ? ? A ASN 131 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 131 A NAG 361 1_555 ? ? ? ? ? ? ? 1.448 ? covale2 covale ? ? B NAG . O4 ? ? ? 1_555 C NAG . C1 ? ? A NAG 361 A NAG 362 1_555 ? ? ? ? ? ? ? 1.390 ? metalc1 metalc ? ? D CA . CA ? ? ? 1_555 A ASP 191 OD2 ? ? A CA 371 A ASP 191 1_555 ? ? ? ? ? ? ? 2.482 ? metalc2 metalc ? ? D CA . CA ? ? ? 1_555 A ASP 198 OD1 ? ? A CA 371 A ASP 198 1_555 ? ? ? ? ? ? ? 2.493 ? metalc3 metalc ? ? D CA . CA ? ? ? 1_555 A SER 174 OG ? ? A CA 371 A SER 174 1_555 ? ? ? ? ? ? ? 2.536 ? metalc4 metalc ? ? D CA . CA ? ? ? 1_555 A ASP 191 OD1 ? ? A CA 371 A ASP 191 1_555 ? ? ? ? ? ? ? 2.870 ? metalc5 metalc ? ? D CA . CA ? ? ? 1_555 A THR 193 O ? ? A CA 371 A THR 193 1_555 ? ? ? ? ? ? ? 2.257 ? metalc6 metalc ? ? D CA . CA ? ? ? 1_555 A THR 193 OG1 ? ? A CA 371 A THR 193 1_555 ? ? ? ? ? ? ? 2.681 ? metalc7 metalc ? ? D CA . CA ? ? ? 1_555 A SER 174 O ? ? A CA 371 A SER 174 1_555 ? ? ? ? ? ? ? 2.313 ? metalc8 metalc ? ? D CA . CA ? ? ? 1_555 A THR 196 O ? ? A CA 371 A THR 196 1_555 ? ? ? ? ? ? ? 2.339 ? metalc9 metalc ? ? E CA . CA ? ? ? 1_555 H HOH . O ? ? A CA 372 A HOH 493 1_555 ? ? ? ? ? ? ? 2.451 ? metalc10 metalc ? ? E CA . CA ? ? ? 1_555 A GLY 62 O ? ? A CA 372 A GLY 62 1_555 ? ? ? ? ? ? ? 2.415 ? metalc11 metalc ? ? E CA . CA ? ? ? 1_555 H HOH . O ? ? A CA 372 A HOH 545 1_555 ? ? ? ? ? ? ? 2.397 ? metalc12 metalc ? ? E CA . CA ? ? ? 1_555 A ASP 47 OD1 ? ? A CA 372 A ASP 47 1_555 ? ? ? ? ? ? ? 2.484 ? metalc13 metalc ? ? E CA . CA ? ? ? 1_555 A ASP 64 OD1 ? ? A CA 372 A ASP 64 1_555 ? ? ? ? ? ? ? 2.577 ? metalc14 metalc ? ? E CA . CA ? ? ? 1_555 A SER 66 OG ? ? A CA 372 A SER 66 1_555 ? ? ? ? ? ? ? 2.531 ? metalc15 metalc ? ? E CA . CA ? ? ? 1_555 A ASP 47 O ? ? A CA 372 A ASP 47 1_555 ? ? ? ? ? ? ? 2.427 ? metalc16 metalc ? ? F MN . MN ? ? ? 1_555 H HOH . O ? ? A MN 381 A HOH 441 1_555 ? ? ? ? ? ? ? 2.570 ? metalc17 metalc ? ? F MN . MN ? ? ? 1_555 A GLU 35 OE2 ? ? A MN 381 A GLU 35 1_555 ? ? ? ? ? ? ? 2.689 ? metalc18 metalc ? ? F MN . MN ? ? ? 1_555 G HEM . O1D ? ? A MN 381 A HEM 396 1_555 ? ? ? ? ? ? ? 2.337 ? metalc19 metalc ? ? F MN . MN ? ? ? 1_555 A ASP 179 OD2 ? ? A MN 381 A ASP 179 1_555 ? ? ? ? ? ? ? 2.573 ? metalc20 metalc ? ? F MN . MN ? ? ? 1_555 H HOH . O ? ? A MN 381 A HOH 520 1_555 ? ? ? ? ? ? ? 2.349 ? metalc21 metalc ? ? G HEM . FE ? ? ? 1_555 H HOH . O ? ? A HEM 396 A HOH 556 1_555 ? ? ? ? ? ? ? 2.800 ? metalc22 metalc ? ? G HEM . FE ? ? ? 1_555 A HIS 173 NE2 ? ? A HEM 396 A HIS 173 1_555 ? ? ? ? ? ? ? 2.278 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 2 ? B ? 2 ? C ? 2 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel B 1 2 ? anti-parallel C 1 2 ? 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 LEU A 126 ? ALA A 127 ? LEU A 126 ALA A 127 A 2 ILE A 287 ? ASP A 288 ? ILE A 287 ASP A 288 B 1 ARG A 177 ? ALA A 178 ? ARG A 177 ALA A 178 B 2 ALA A 188 ? PRO A 189 ? ALA A 188 PRO A 189 C 1 GLU A 221 ? VAL A 222 ? GLU A 221 VAL A 222 C 2 ARG A 238 ? LEU A 239 ? ARG A 238 LEU A 239 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N ALA A 127 ? N ALA A 127 O ILE A 287 ? O ILE A 287 B 1 2 O ALA A 178 ? O ALA A 178 N ALA A 188 ? N ALA A 188 C 1 2 N VAL A 222 ? N VAL A 222 O ARG A 238 ? O ARG A 238 # 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 GL1 Author ? ? ? ? 3 'CARBOHYDRATE BINDING SITE' CA1 Author ? ? ? ? 6 'PROXIMAL CALCIUM BINDING SITE' CA2 Author ? ? ? ? 7 'DISTAL CALCIUM BINDING SITE' MN Author ? ? ? ? 7 'MANGANESE BINDING SITE' AC1 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE NAG A 361' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 362' AC3 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE CA A 371' AC4 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE CA A 372' AC5 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE MN A 381' AC6 Software ? ? ? ? 20 'BINDING SITE FOR RESIDUE HEM A 396' # 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 GL1 3 NAG B . ? NAG A 361 . ? 1_555 ? 2 GL1 3 NAG C . ? NAG A 362 . ? 1_555 ? 3 GL1 3 ASN A 131 ? ASN A 131 . ? 1_555 ? 4 CA1 6 CA D . ? CA A 371 . ? 1_555 ? 5 CA1 6 THR A 196 ? THR A 196 . ? 1_555 ? 6 CA1 6 ASP A 191 ? ASP A 191 . ? 1_555 ? 7 CA1 6 SER A 174 ? SER A 174 . ? 1_555 ? 8 CA1 6 THR A 193 ? THR A 193 . ? 1_555 ? 9 CA1 6 ASP A 198 ? ASP A 198 . ? 1_555 ? 10 CA2 7 CA E . ? CA A 372 . ? 1_555 ? 11 CA2 7 ASP A 47 ? ASP A 47 . ? 1_555 ? 12 CA2 7 GLY A 62 ? GLY A 62 . ? 1_555 ? 13 CA2 7 SER A 66 ? SER A 66 . ? 1_555 ? 14 CA2 7 ASP A 64 ? ASP A 64 . ? 1_555 ? 15 CA2 7 HOH H . ? HOH A 493 . ? 1_555 ? 16 CA2 7 HOH H . ? HOH A 545 . ? 1_555 ? 17 MN 7 MN F . ? MN A 381 . ? 1_555 ? 18 MN 7 HEM G . ? HEM A 396 . ? 1_555 ? 19 MN 7 GLU A 35 ? GLU A 35 . ? 1_555 ? 20 MN 7 GLU A 39 ? GLU A 39 . ? 1_555 ? 21 MN 7 ASP A 179 ? ASP A 179 . ? 1_555 ? 22 MN 7 HOH H . ? HOH A 441 . ? 1_555 ? 23 MN 7 HOH H . ? HOH A 520 . ? 1_555 ? 24 AC1 6 ASN A 98 ? ASN A 98 . ? 1_555 ? 25 AC1 6 THR A 99 ? THR A 99 . ? 1_555 ? 26 AC1 6 ILE A 100 ? ILE A 100 . ? 1_555 ? 27 AC1 6 ASN A 131 ? ASN A 131 . ? 1_555 ? 28 AC1 6 NAG C . ? NAG A 362 . ? 1_555 ? 29 AC1 6 HOH H . ? HOH A 498 . ? 1_555 ? 30 AC2 4 MET A 94 ? MET A 94 . ? 1_555 ? 31 AC2 4 GLN A 95 ? GLN A 95 . ? 1_555 ? 32 AC2 4 ASN A 98 ? ASN A 98 . ? 1_555 ? 33 AC2 4 NAG B . ? NAG A 361 . ? 1_555 ? 34 AC3 5 SER A 174 ? SER A 174 . ? 1_555 ? 35 AC3 5 ASP A 191 ? ASP A 191 . ? 1_555 ? 36 AC3 5 THR A 193 ? THR A 193 . ? 1_555 ? 37 AC3 5 THR A 196 ? THR A 196 . ? 1_555 ? 38 AC3 5 ASP A 198 ? ASP A 198 . ? 1_555 ? 39 AC4 6 ASP A 47 ? ASP A 47 . ? 1_555 ? 40 AC4 6 GLY A 62 ? GLY A 62 . ? 1_555 ? 41 AC4 6 ASP A 64 ? ASP A 64 . ? 1_555 ? 42 AC4 6 SER A 66 ? SER A 66 . ? 1_555 ? 43 AC4 6 HOH H . ? HOH A 493 . ? 1_555 ? 44 AC4 6 HOH H . ? HOH A 545 . ? 1_555 ? 45 AC5 6 GLU A 35 ? GLU A 35 . ? 1_555 ? 46 AC5 6 GLU A 39 ? GLU A 39 . ? 1_555 ? 47 AC5 6 ASP A 179 ? ASP A 179 . ? 1_555 ? 48 AC5 6 HEM G . ? HEM A 396 . ? 1_555 ? 49 AC5 6 HOH H . ? HOH A 441 . ? 1_555 ? 50 AC5 6 HOH H . ? HOH A 520 . ? 1_555 ? 51 AC6 20 HIS A 38 ? HIS A 38 . ? 1_555 ? 52 AC6 20 GLU A 39 ? GLU A 39 . ? 1_555 ? 53 AC6 20 ARG A 42 ? ARG A 42 . ? 1_555 ? 54 AC6 20 PHE A 45 ? PHE A 45 . ? 1_555 ? 55 AC6 20 GLU A 143 ? GLU A 143 . ? 1_555 ? 56 AC6 20 PRO A 144 ? PRO A 144 . ? 1_555 ? 57 AC6 20 LEU A 169 ? LEU A 169 . ? 1_555 ? 58 AC6 20 SER A 172 ? SER A 172 . ? 1_555 ? 59 AC6 20 HIS A 173 ? HIS A 173 . ? 1_555 ? 60 AC6 20 ALA A 176 ? ALA A 176 . ? 1_555 ? 61 AC6 20 ARG A 177 ? ARG A 177 . ? 1_555 ? 62 AC6 20 ALA A 178 ? ALA A 178 . ? 1_555 ? 63 AC6 20 ASP A 179 ? ASP A 179 . ? 1_555 ? 64 AC6 20 LYS A 180 ? LYS A 180 . ? 1_555 ? 65 AC6 20 VAL A 181 ? VAL A 181 . ? 1_555 ? 66 AC6 20 MN F . ? MN A 381 . ? 1_555 ? 67 AC6 20 HOH H . ? HOH A 478 . ? 1_555 ? 68 AC6 20 HOH H . ? HOH A 520 . ? 1_555 ? 69 AC6 20 HOH H . ? HOH A 556 . ? 1_555 ? 70 AC6 20 HOH H . ? HOH A 650 . ? 1_555 ? # _database_PDB_matrix.entry_id 1MNP _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 1MNP _atom_sites.fract_transf_matrix[1][1] 0.006126 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000770 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.021753 _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] 0.018763 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C CA FE H MN 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 . ALA A 1 1 ? 37.929 36.862 65.459 1.00 45.63 ? 1 ALA A N 1 ATOM 2 C CA . ALA A 1 1 ? 38.580 38.187 65.678 1.00 44.67 ? 1 ALA A CA 1 ATOM 3 C C . ALA A 1 1 ? 38.152 39.139 64.567 1.00 44.85 ? 1 ALA A C 1 ATOM 4 O O . ALA A 1 1 ? 37.361 38.770 63.698 1.00 45.87 ? 1 ALA A O 1 ATOM 5 C CB . ALA A 1 1 ? 40.102 38.039 65.694 1.00 43.68 ? 1 ALA A CB 1 ATOM 6 N N . VAL A 1 2 ? 38.649 40.368 64.623 1.00 43.54 ? 2 VAL A N 1 ATOM 7 C CA . VAL A 1 2 ? 38.333 41.375 63.622 1.00 43.42 ? 2 VAL A CA 1 ATOM 8 C C . VAL A 1 2 ? 39.598 42.202 63.422 1.00 42.76 ? 2 VAL A C 1 ATOM 9 O O . VAL A 1 2 ? 40.223 42.646 64.391 1.00 42.02 ? 2 VAL A O 1 ATOM 10 C CB . VAL A 1 2 ? 37.125 42.266 64.049 1.00 43.49 ? 2 VAL A CB 1 ATOM 11 C CG1 . VAL A 1 2 ? 37.379 42.900 65.413 1.00 43.54 ? 2 VAL A CG1 1 ATOM 12 C CG2 . VAL A 1 2 ? 36.852 43.338 62.996 1.00 43.41 ? 2 VAL A CG2 1 ATOM 13 N N . CYS A 1 3 ? 39.997 42.347 62.163 1.00 41.36 ? 3 CYS A N 1 ATOM 14 C CA . CYS A 1 3 ? 41.200 43.081 61.813 1.00 40.40 ? 3 CYS A CA 1 ATOM 15 C C . CYS A 1 3 ? 40.927 44.567 61.566 1.00 42.72 ? 3 CYS A C 1 ATOM 16 O O . CYS A 1 3 ? 39.779 44.962 61.328 1.00 44.13 ? 3 CYS A O 1 ATOM 17 C CB . CYS A 1 3 ? 41.855 42.419 60.600 1.00 35.58 ? 3 CYS A CB 1 ATOM 18 S SG . CYS A 1 3 ? 42.028 40.610 60.771 1.00 32.87 ? 3 CYS A SG 1 ATOM 19 N N . PRO A 1 4 ? 41.982 45.409 61.584 1.00 44.20 ? 4 PRO A N 1 ATOM 20 C CA . PRO A 1 4 ? 41.885 46.860 61.372 1.00 45.79 ? 4 PRO A CA 1 ATOM 21 C C . PRO A 1 4 ? 41.287 47.321 60.041 1.00 46.69 ? 4 PRO A C 1 ATOM 22 O O . PRO A 1 4 ? 41.380 48.497 59.687 1.00 47.41 ? 4 PRO A O 1 ATOM 23 C CB . PRO A 1 4 ? 43.336 47.325 61.528 1.00 45.35 ? 4 PRO A CB 1 ATOM 24 C CG . PRO A 1 4 ? 44.125 46.136 61.074 1.00 45.57 ? 4 PRO A CG 1 ATOM 25 C CD . PRO A 1 4 ? 43.391 45.017 61.770 1.00 45.38 ? 4 PRO A CD 1 ATOM 26 N N . ASP A 1 5 ? 40.663 46.399 59.318 1.00 48.01 ? 5 ASP A N 1 ATOM 27 C CA . ASP A 1 5 ? 40.045 46.704 58.037 1.00 48.40 ? 5 ASP A CA 1 ATOM 28 C C . ASP A 1 5 ? 38.629 46.137 58.046 1.00 49.18 ? 5 ASP A C 1 ATOM 29 O O . ASP A 1 5 ? 38.023 45.920 56.994 1.00 50.03 ? 5 ASP A O 1 ATOM 30 C CB . ASP A 1 5 ? 40.862 46.094 56.894 1.00 47.98 ? 5 ASP A CB 1 ATOM 31 C CG . ASP A 1 5 ? 40.860 44.571 56.911 1.00 48.28 ? 5 ASP A CG 1 ATOM 32 O OD1 . ASP A 1 5 ? 40.842 43.969 58.005 1.00 48.82 ? 5 ASP A OD1 1 ATOM 33 O OD2 . ASP A 1 5 ? 40.872 43.980 55.814 1.00 49.13 ? 5 ASP A OD2 1 ATOM 34 N N . GLY A 1 6 ? 38.140 45.842 59.249 1.00 48.71 ? 6 GLY A N 1 ATOM 35 C CA . GLY A 1 6 ? 36.802 45.303 59.399 1.00 48.55 ? 6 GLY A CA 1 ATOM 36 C C . GLY A 1 6 ? 36.681 43.821 59.105 1.00 48.02 ? 6 GLY A C 1 ATOM 37 O O . GLY A 1 6 ? 35.705 43.183 59.516 1.00 48.71 ? 6 GLY A O 1 ATOM 38 N N . THR A 1 7 ? 37.655 43.262 58.399 1.00 47.06 ? 7 THR A N 1 ATOM 39 C CA . THR A 1 7 ? 37.621 41.845 58.071 1.00 45.55 ? 7 THR A CA 1 ATOM 40 C C . THR A 1 7 ? 37.610 41.002 59.345 1.00 45.08 ? 7 THR A C 1 ATOM 41 O O . THR A 1 7 ? 38.509 41.110 60.182 1.00 45.47 ? 7 THR A O 1 ATOM 42 C CB . THR A 1 7 ? 38.816 41.444 57.182 1.00 44.09 ? 7 THR A CB 1 ATOM 43 O OG1 . THR A 1 7 ? 38.834 42.272 56.013 1.00 44.12 ? 7 THR A OG1 1 ATOM 44 C CG2 . THR A 1 7 ? 38.712 39.981 56.756 1.00 42.00 ? 7 THR A CG2 1 ATOM 45 N N . ARG A 1 8 ? 36.548 40.221 59.515 1.00 43.76 ? 8 ARG A N 1 ATOM 46 C CA . ARG A 1 8 ? 36.429 39.348 60.670 1.00 43.25 ? 8 ARG A CA 1 ATOM 47 C C . ARG A 1 8 ? 37.202 38.058 60.411 1.00 41.49 ? 8 ARG A C 1 ATOM 48 O O . ARG A 1 8 ? 36.743 37.175 59.683 1.00 43.12 ? 8 ARG A O 1 ATOM 49 C CB . ARG A 1 8 ? 34.962 39.048 60.977 1.00 43.90 ? 8 ARG A CB 1 ATOM 50 C CG . ARG A 1 8 ? 34.221 40.212 61.611 1.00 44.42 ? 8 ARG A CG 1 ATOM 51 C CD . ARG A 1 8 ? 32.862 39.780 62.142 1.00 46.17 ? 8 ARG A CD 1 ATOM 52 N NE . ARG A 1 8 ? 32.970 38.673 63.094 1.00 46.57 ? 8 ARG A NE 1 ATOM 53 C CZ . ARG A 1 8 ? 32.401 37.483 62.921 1.00 47.83 ? 8 ARG A CZ 1 ATOM 54 N NH1 . ARG A 1 8 ? 31.675 37.242 61.833 1.00 48.28 ? 8 ARG A NH1 1 ATOM 55 N NH2 . ARG A 1 8 ? 32.591 36.517 63.813 1.00 47.49 ? 8 ARG A NH2 1 ATOM 56 N N . VAL A 1 9 ? 38.408 37.989 60.958 1.00 38.84 ? 9 VAL A N 1 ATOM 57 C CA . VAL A 1 9 ? 39.268 36.826 60.796 1.00 35.97 ? 9 VAL A CA 1 ATOM 58 C C . VAL A 1 9 ? 39.041 35.829 61.936 1.00 34.50 ? 9 VAL A C 1 ATOM 59 O O . VAL A 1 9 ? 38.425 36.165 62.949 1.00 34.84 ? 9 VAL A O 1 ATOM 60 C CB . VAL A 1 9 ? 40.754 37.261 60.740 1.00 34.13 ? 9 VAL A CB 1 ATOM 61 C CG1 . VAL A 1 9 ? 41.177 37.889 62.052 1.00 33.68 ? 9 VAL A CG1 1 ATOM 62 C CG2 . VAL A 1 9 ? 41.639 36.090 60.392 1.00 35.47 ? 9 VAL A CG2 1 ATOM 63 N N . SER A 1 10 ? 39.522 34.603 61.756 1.00 33.70 ? 10 SER A N 1 ATOM 64 C CA . SER A 1 10 ? 39.399 33.539 62.748 1.00 32.81 ? 10 SER A CA 1 ATOM 65 C C . SER A 1 10 ? 40.272 33.801 63.981 1.00 32.60 ? 10 SER A C 1 ATOM 66 O O . SER A 1 10 ? 39.795 33.752 65.117 1.00 31.55 ? 10 SER A O 1 ATOM 67 C CB . SER A 1 10 ? 39.799 32.203 62.111 1.00 32.64 ? 10 SER A CB 1 ATOM 68 O OG . SER A 1 10 ? 41.071 32.305 61.476 1.00 34.13 ? 10 SER A OG 1 ATOM 69 N N . HIS A 1 11 ? 41.558 34.045 63.746 1.00 32.19 ? 11 HIS A N 1 ATOM 70 C CA . HIS A 1 11 ? 42.513 34.318 64.813 1.00 30.93 ? 11 HIS A CA 1 ATOM 71 C C . HIS A 1 11 ? 43.174 35.646 64.496 1.00 30.81 ? 11 HIS A C 1 ATOM 72 O O . HIS A 1 11 ? 43.553 35.889 63.351 1.00 31.52 ? 11 HIS A O 1 ATOM 73 C CB . HIS A 1 11 ? 43.594 33.239 64.855 1.00 31.98 ? 11 HIS A CB 1 ATOM 74 C CG . HIS A 1 11 ? 43.059 31.840 64.881 1.00 35.08 ? 11 HIS A CG 1 ATOM 75 N ND1 . HIS A 1 11 ? 42.047 31.441 65.724 1.00 36.30 ? 11 HIS A ND1 1 ATOM 76 C CD2 . HIS A 1 11 ? 43.421 30.741 64.177 1.00 34.55 ? 11 HIS A CD2 1 ATOM 77 C CE1 . HIS A 1 11 ? 41.808 30.153 65.545 1.00 36.85 ? 11 HIS A CE1 1 ATOM 78 N NE2 . HIS A 1 11 ? 42.627 29.706 64.612 1.00 36.81 ? 11 HIS A NE2 1 ATOM 79 N N . ALA A 1 12 ? 43.363 36.483 65.510 1.00 29.13 ? 12 ALA A N 1 ATOM 80 C CA . ALA A 1 12 ? 43.983 37.792 65.313 1.00 27.70 ? 12 ALA A CA 1 ATOM 81 C C . ALA A 1 12 ? 45.383 37.703 64.698 1.00 25.57 ? 12 ALA A C 1 ATOM 82 O O . ALA A 1 12 ? 45.877 38.668 64.118 1.00 24.25 ? 12 ALA A O 1 ATOM 83 C CB . ALA A 1 12 ? 44.032 38.560 66.632 1.00 30.11 ? 12 ALA A CB 1 ATOM 84 N N . ALA A 1 13 ? 46.030 36.554 64.849 1.00 23.33 ? 13 ALA A N 1 ATOM 85 C CA . ALA A 1 13 ? 47.364 36.360 64.289 1.00 24.30 ? 13 ALA A CA 1 ATOM 86 C C . ALA A 1 13 ? 47.327 36.371 62.755 1.00 22.74 ? 13 ALA A C 1 ATOM 87 O O . ALA A 1 13 ? 48.284 36.784 62.100 1.00 21.96 ? 13 ALA A O 1 ATOM 88 C CB . ALA A 1 13 ? 47.961 35.059 64.800 1.00 25.31 ? 13 ALA A CB 1 ATOM 89 N N . CYS A 1 14 ? 46.192 35.967 62.196 1.00 22.11 ? 14 CYS A N 1 ATOM 90 C CA . CYS A 1 14 ? 46.008 35.913 60.746 1.00 20.64 ? 14 CYS A CA 1 ATOM 91 C C . CYS A 1 14 ? 45.896 37.287 60.087 1.00 20.26 ? 14 CYS A C 1 ATOM 92 O O . CYS A 1 14 ? 46.229 37.441 58.910 1.00 20.32 ? 14 CYS A O 1 ATOM 93 C CB . CYS A 1 14 ? 44.769 35.085 60.415 1.00 15.05 ? 14 CYS A CB 1 ATOM 94 S SG . CYS A 1 14 ? 44.750 33.447 61.199 1.00 13.33 ? 14 CYS A SG 1 ATOM 95 N N . CYS A 1 15 ? 45.496 38.294 60.861 1.00 19.44 ? 15 CYS A N 1 ATOM 96 C CA . CYS A 1 15 ? 45.326 39.652 60.342 1.00 21.71 ? 15 CYS A CA 1 ATOM 97 C C . CYS A 1 15 ? 46.494 40.220 59.539 1.00 20.50 ? 15 CYS A C 1 ATOM 98 O O . CYS A 1 15 ? 46.283 41.003 58.614 1.00 19.40 ? 15 CYS A O 1 ATOM 99 C CB . CYS A 1 15 ? 44.980 40.633 61.468 1.00 23.60 ? 15 CYS A CB 1 ATOM 100 S SG . CYS A 1 15 ? 43.371 40.359 62.275 1.00 28.90 ? 15 CYS A SG 1 ATOM 101 N N . ALA A 1 16 ? 47.716 39.826 59.879 1.00 18.20 ? 16 ALA A N 1 ATOM 102 C CA . ALA A 1 16 ? 48.898 40.338 59.190 1.00 17.22 ? 16 ALA A CA 1 ATOM 103 C C . ALA A 1 16 ? 48.999 39.881 57.736 1.00 15.46 ? 16 ALA A C 1 ATOM 104 O O . ALA A 1 16 ? 49.641 40.541 56.916 1.00 14.99 ? 16 ALA A O 1 ATOM 105 C CB . ALA A 1 16 ? 50.167 39.956 59.955 1.00 17.81 ? 16 ALA A CB 1 ATOM 106 N N . PHE A 1 17 ? 48.357 38.764 57.415 1.00 14.17 ? 17 PHE A N 1 ATOM 107 C CA . PHE A 1 17 ? 48.408 38.236 56.057 1.00 14.19 ? 17 PHE A CA 1 ATOM 108 C C . PHE A 1 17 ? 47.550 38.996 55.057 1.00 14.42 ? 17 PHE A C 1 ATOM 109 O O . PHE A 1 17 ? 47.833 38.980 53.860 1.00 16.76 ? 17 PHE A O 1 ATOM 110 C CB . PHE A 1 17 ? 48.083 36.750 56.054 1.00 12.17 ? 17 PHE A CB 1 ATOM 111 C CG . PHE A 1 17 ? 49.138 35.913 56.712 1.00 13.20 ? 17 PHE A CG 1 ATOM 112 C CD1 . PHE A 1 17 ? 50.308 35.597 56.034 1.00 11.19 ? 17 PHE A CD1 1 ATOM 113 C CD2 . PHE A 1 17 ? 48.977 35.467 58.022 1.00 16.00 ? 17 PHE A CD2 1 ATOM 114 C CE1 . PHE A 1 17 ? 51.313 34.849 56.644 1.00 14.55 ? 17 PHE A CE1 1 ATOM 115 C CE2 . PHE A 1 17 ? 49.979 34.715 58.649 1.00 16.61 ? 17 PHE A CE2 1 ATOM 116 C CZ . PHE A 1 17 ? 51.150 34.406 57.956 1.00 13.42 ? 17 PHE A CZ 1 ATOM 117 N N . ILE A 1 18 ? 46.549 39.714 55.554 1.00 14.23 ? 18 ILE A N 1 ATOM 118 C CA . ILE A 1 18 ? 45.668 40.499 54.696 1.00 16.16 ? 18 ILE A CA 1 ATOM 119 C C . ILE A 1 18 ? 46.449 41.589 53.957 1.00 17.58 ? 18 ILE A C 1 ATOM 120 O O . ILE A 1 18 ? 46.345 41.704 52.740 1.00 16.29 ? 18 ILE A O 1 ATOM 121 C CB . ILE A 1 18 ? 44.496 41.105 55.494 1.00 15.01 ? 18 ILE A CB 1 ATOM 122 C CG1 . ILE A 1 18 ? 43.615 39.976 56.032 1.00 13.76 ? 18 ILE A CG1 1 ATOM 123 C CG2 . ILE A 1 18 ? 43.690 42.068 54.617 1.00 16.09 ? 18 ILE A CG2 1 ATOM 124 C CD1 . ILE A 1 18 ? 42.534 40.437 56.973 1.00 17.35 ? 18 ILE A CD1 1 ATOM 125 N N . PRO A 1 19 ? 47.263 42.390 54.678 1.00 17.76 ? 19 PRO A N 1 ATOM 126 C CA . PRO A 1 19 ? 48.029 43.440 53.997 1.00 15.47 ? 19 PRO A CA 1 ATOM 127 C C . PRO A 1 19 ? 49.091 42.850 53.069 1.00 13.28 ? 19 PRO A C 1 ATOM 128 O O . PRO A 1 19 ? 49.509 43.489 52.101 1.00 15.48 ? 19 PRO A O 1 ATOM 129 C CB . PRO A 1 19 ? 48.682 44.194 55.163 1.00 16.91 ? 19 PRO A CB 1 ATOM 130 C CG . PRO A 1 19 ? 47.721 43.986 56.291 1.00 16.93 ? 19 PRO A CG 1 ATOM 131 C CD . PRO A 1 19 ? 47.382 42.534 56.141 1.00 19.43 ? 19 PRO A CD 1 ATOM 132 N N . LEU A 1 20 ? 49.577 41.661 53.412 1.00 9.56 ? 20 LEU A N 1 ATOM 133 C CA . LEU A 1 20 ? 50.594 40.998 52.608 1.00 10.89 ? 20 LEU A CA 1 ATOM 134 C C . LEU A 1 20 ? 49.996 40.534 51.278 1.00 11.07 ? 20 LEU A C 1 ATOM 135 O O . LEU A 1 20 ? 50.632 40.664 50.237 1.00 10.76 ? 20 LEU A O 1 ATOM 136 C CB . LEU A 1 20 ? 51.208 39.811 53.358 1.00 7.55 ? 20 LEU A CB 1 ATOM 137 C CG . LEU A 1 20 ? 52.172 38.929 52.563 1.00 4.14 ? 20 LEU A CG 1 ATOM 138 C CD1 . LEU A 1 20 ? 53.354 39.733 52.049 1.00 7.81 ? 20 LEU A CD1 1 ATOM 139 C CD2 . LEU A 1 20 ? 52.625 37.754 53.402 1.00 7.87 ? 20 LEU A CD2 1 ATOM 140 N N . ALA A 1 21 ? 48.793 39.971 51.326 1.00 9.50 ? 21 ALA A N 1 ATOM 141 C CA . ALA A 1 21 ? 48.109 39.514 50.117 1.00 12.00 ? 21 ALA A CA 1 ATOM 142 C C . ALA A 1 21 ? 47.930 40.687 49.149 1.00 10.63 ? 21 ALA A C 1 ATOM 143 O O . ALA A 1 21 ? 48.262 40.578 47.975 1.00 12.23 ? 21 ALA A O 1 ATOM 144 C CB . ALA A 1 21 ? 46.761 38.892 50.470 1.00 7.88 ? 21 ALA A CB 1 ATOM 145 N N . GLN A 1 22 ? 47.471 41.826 49.653 1.00 13.37 ? 22 GLN A N 1 ATOM 146 C CA . GLN A 1 22 ? 47.290 42.999 48.806 1.00 14.60 ? 22 GLN A CA 1 ATOM 147 C C . GLN A 1 22 ? 48.591 43.496 48.187 1.00 14.71 ? 22 GLN A C 1 ATOM 148 O O . GLN A 1 22 ? 48.614 43.902 47.026 1.00 11.61 ? 22 GLN A O 1 ATOM 149 C CB . GLN A 1 22 ? 46.621 44.135 49.578 1.00 18.23 ? 22 GLN A CB 1 ATOM 150 C CG . GLN A 1 22 ? 45.105 44.212 49.404 1.00 30.75 ? 22 GLN A CG 1 ATOM 151 C CD . GLN A 1 22 ? 44.644 44.639 47.992 1.00 36.10 ? 22 GLN A CD 1 ATOM 152 O OE1 . GLN A 1 22 ? 43.443 44.751 47.737 1.00 38.33 ? 22 GLN A OE1 1 ATOM 153 N NE2 . GLN A 1 22 ? 45.592 44.888 47.085 1.00 37.78 ? 22 GLN A NE2 1 ATOM 154 N N . ASP A 1 23 ? 49.667 43.458 48.963 1.00 14.03 ? 23 ASP A N 1 ATOM 155 C CA . ASP A 1 23 ? 50.975 43.913 48.503 1.00 13.58 ? 23 ASP A CA 1 ATOM 156 C C . ASP A 1 23 ? 51.547 42.986 47.425 1.00 11.22 ? 23 ASP A C 1 ATOM 157 O O . ASP A 1 23 ? 52.179 43.450 46.468 1.00 10.11 ? 23 ASP A O 1 ATOM 158 C CB . ASP A 1 23 ? 51.938 44.006 49.695 1.00 17.29 ? 23 ASP A CB 1 ATOM 159 C CG . ASP A 1 23 ? 53.081 44.983 49.461 1.00 23.61 ? 23 ASP A CG 1 ATOM 160 O OD1 . ASP A 1 23 ? 53.007 45.799 48.520 1.00 26.48 ? 23 ASP A OD1 1 ATOM 161 O OD2 . ASP A 1 23 ? 54.058 44.943 50.239 1.00 27.45 ? 23 ASP A OD2 1 ATOM 162 N N . LEU A 1 24 ? 51.349 41.682 47.600 1.00 8.26 ? 24 LEU A N 1 ATOM 163 C CA . LEU A 1 24 ? 51.821 40.687 46.643 1.00 10.92 ? 24 LEU A CA 1 ATOM 164 C C . LEU A 1 24 ? 51.110 40.881 45.291 1.00 11.43 ? 24 LEU A C 1 ATOM 165 O O . LEU A 1 24 ? 51.759 40.935 44.235 1.00 13.66 ? 24 LEU A O 1 ATOM 166 C CB . LEU A 1 24 ? 51.575 39.276 47.183 1.00 9.67 ? 24 LEU A CB 1 ATOM 167 C CG . LEU A 1 24 ? 52.470 38.821 48.345 1.00 11.38 ? 24 LEU A CG 1 ATOM 168 C CD1 . LEU A 1 24 ? 51.936 37.529 48.974 1.00 8.42 ? 24 LEU A CD1 1 ATOM 169 C CD2 . LEU A 1 24 ? 53.889 38.634 47.839 1.00 9.26 ? 24 LEU A CD2 1 ATOM 170 N N . GLN A 1 25 ? 49.786 41.001 45.331 1.00 11.51 ? 25 GLN A N 1 ATOM 171 C CA . GLN A 1 25 ? 48.991 41.210 44.118 1.00 14.34 ? 25 GLN A CA 1 ATOM 172 C C . GLN A 1 25 ? 49.438 42.487 43.407 1.00 14.96 ? 25 GLN A C 1 ATOM 173 O O . GLN A 1 25 ? 49.982 42.432 42.313 1.00 16.72 ? 25 GLN A O 1 ATOM 174 C CB . GLN A 1 25 ? 47.494 41.306 44.448 1.00 10.38 ? 25 GLN A CB 1 ATOM 175 C CG . GLN A 1 25 ? 46.862 40.012 44.941 1.00 13.23 ? 25 GLN A CG 1 ATOM 176 C CD . GLN A 1 25 ? 46.702 38.953 43.855 1.00 12.73 ? 25 GLN A CD 1 ATOM 177 O OE1 . GLN A 1 25 ? 47.488 38.883 42.906 1.00 15.32 ? 25 GLN A OE1 1 ATOM 178 N NE2 . GLN A 1 25 ? 45.687 38.115 44.000 1.00 12.78 ? 25 GLN A NE2 1 ATOM 179 N N . GLU A 1 26 ? 49.316 43.617 44.082 1.00 15.91 ? 26 GLU A N 1 ATOM 180 C CA . GLU A 1 26 ? 49.684 44.918 43.523 1.00 16.55 ? 26 GLU A CA 1 ATOM 181 C C . GLU A 1 26 ? 51.093 45.024 42.981 1.00 16.77 ? 26 GLU A C 1 ATOM 182 O O . GLU A 1 26 ? 51.309 45.614 41.918 1.00 16.02 ? 26 GLU A O 1 ATOM 183 C CB . GLU A 1 26 ? 49.463 46.015 44.545 1.00 19.39 ? 26 GLU A CB 1 ATOM 184 C CG . GLU A 1 26 ? 48.019 46.245 44.954 1.00 28.98 ? 26 GLU A CG 1 ATOM 185 C CD . GLU A 1 26 ? 47.855 47.270 46.067 1.00 33.55 ? 26 GLU A CD 1 ATOM 186 O OE1 . GLU A 1 26 ? 48.848 47.949 46.432 1.00 37.59 ? 26 GLU A OE1 1 ATOM 187 O OE2 . GLU A 1 26 ? 46.730 47.414 46.594 1.00 35.15 ? 26 GLU A OE2 1 ATOM 188 H H . GLU A 1 26 ? 48.977 43.585 45.006 1.00 0.00 ? 26 GLU A H 1 ATOM 189 N N . THR A 1 27 ? 52.048 44.457 43.686 1.00 15.48 ? 27 THR A N 1 ATOM 190 C CA . THR A 1 27 ? 53.450 44.553 43.293 1.00 12.26 ? 27 THR A CA 1 ATOM 191 C C . THR A 1 27 ? 54.004 43.549 42.293 1.00 11.33 ? 27 THR A C 1 ATOM 192 O O . THR A 1 27 ? 54.750 43.934 41.393 1.00 11.01 ? 27 THR A O 1 ATOM 193 C CB . THR A 1 27 ? 54.398 44.563 44.535 1.00 12.84 ? 27 THR A CB 1 ATOM 194 O OG1 . THR A 1 27 ? 53.911 45.490 45.514 1.00 12.68 ? 27 THR A OG1 1 ATOM 195 C CG2 . THR A 1 27 ? 55.807 44.985 44.134 1.00 8.22 ? 27 THR A CG2 1 ATOM 196 N N . ILE A 1 28 ? 53.691 42.268 42.443 1.00 10.35 ? 28 ILE A N 1 ATOM 197 C CA . ILE A 1 28 ? 54.265 41.305 41.519 1.00 12.09 ? 28 ILE A CA 1 ATOM 198 C C . ILE A 1 28 ? 53.322 40.402 40.718 1.00 11.12 ? 28 ILE A C 1 ATOM 199 O O . ILE A 1 28 ? 53.704 39.915 39.652 1.00 12.52 ? 28 ILE A O 1 ATOM 200 C CB . ILE A 1 28 ? 55.368 40.438 42.208 1.00 12.87 ? 28 ILE A CB 1 ATOM 201 C CG1 . ILE A 1 28 ? 54.796 39.667 43.398 1.00 12.82 ? 28 ILE A CG1 1 ATOM 202 C CG2 . ILE A 1 28 ? 56.537 41.325 42.657 1.00 14.11 ? 28 ILE A CG2 1 ATOM 203 C CD1 . ILE A 1 28 ? 55.757 38.645 43.977 1.00 15.50 ? 28 ILE A CD1 1 ATOM 204 N N . PHE A 1 29 ? 52.102 40.190 41.200 1.00 10.91 ? 29 PHE A N 1 ATOM 205 C CA . PHE A 1 29 ? 51.164 39.306 40.502 1.00 11.22 ? 29 PHE A CA 1 ATOM 206 C C . PHE A 1 29 ? 50.177 39.999 39.564 1.00 12.43 ? 29 PHE A C 1 ATOM 207 O O . PHE A 1 29 ? 49.832 39.459 38.511 1.00 11.75 ? 29 PHE A O 1 ATOM 208 C CB . PHE A 1 29 ? 50.373 38.463 41.508 1.00 9.93 ? 29 PHE A CB 1 ATOM 209 C CG . PHE A 1 29 ? 51.219 37.515 42.324 1.00 11.90 ? 29 PHE A CG 1 ATOM 210 C CD1 . PHE A 1 29 ? 52.419 37.010 41.828 1.00 9.78 ? 29 PHE A CD1 1 ATOM 211 C CD2 . PHE A 1 29 ? 50.802 37.118 43.589 1.00 9.34 ? 29 PHE A CD2 1 ATOM 212 C CE1 . PHE A 1 29 ? 53.189 36.120 42.583 1.00 9.88 ? 29 PHE A CE1 1 ATOM 213 C CE2 . PHE A 1 29 ? 51.563 36.233 44.346 1.00 5.21 ? 29 PHE A CE2 1 ATOM 214 C CZ . PHE A 1 29 ? 52.756 35.734 43.845 1.00 4.52 ? 29 PHE A CZ 1 ATOM 215 N N . GLN A 1 30 ? 49.718 41.179 39.968 1.00 12.62 ? 30 GLN A N 1 ATOM 216 C CA . GLN A 1 30 ? 48.735 41.971 39.229 1.00 14.29 ? 30 GLN A CA 1 ATOM 217 C C . GLN A 1 30 ? 47.458 41.175 38.970 1.00 15.99 ? 30 GLN A C 1 ATOM 218 O O . GLN A 1 30 ? 46.818 41.293 37.926 1.00 17.20 ? 30 GLN A O 1 ATOM 219 C CB . GLN A 1 30 ? 49.319 42.546 37.938 1.00 15.63 ? 30 GLN A CB 1 ATOM 220 C CG . GLN A 1 30 ? 50.226 43.753 38.145 1.00 15.13 ? 30 GLN A CG 1 ATOM 221 C CD . GLN A 1 30 ? 51.657 43.367 38.449 1.00 18.60 ? 30 GLN A CD 1 ATOM 222 O OE1 . GLN A 1 30 ? 52.222 42.482 37.800 1.00 19.67 ? 30 GLN A OE1 1 ATOM 223 N NE2 . GLN A 1 30 ? 52.262 44.039 39.427 1.00 17.10 ? 30 GLN A NE2 1 ATOM 224 N N . ASN A 1 31 ? 47.109 40.351 39.952 1.00 16.00 ? 31 ASN A N 1 ATOM 225 C CA . ASN A 1 31 ? 45.913 39.524 39.917 1.00 17.67 ? 31 ASN A CA 1 ATOM 226 C C . ASN A 1 31 ? 45.788 38.613 38.708 1.00 16.54 ? 31 ASN A C 1 ATOM 227 O O . ASN A 1 31 ? 44.682 38.324 38.264 1.00 18.04 ? 31 ASN A O 1 ATOM 228 C CB . ASN A 1 31 ? 44.646 40.381 40.056 1.00 21.02 ? 31 ASN A CB 1 ATOM 229 C CG . ASN A 1 31 ? 44.508 41.010 41.429 1.00 24.21 ? 31 ASN A CG 1 ATOM 230 O OD1 . ASN A 1 31 ? 45.103 42.051 41.707 1.00 27.12 ? 31 ASN A OD1 1 ATOM 231 N ND2 . ASN A 1 31 ? 43.717 40.382 42.296 1.00 27.19 ? 31 ASN A ND2 1 ATOM 232 N N . GLU A 1 32 ? 46.910 38.148 38.183 1.00 15.10 ? 32 GLU A N 1 ATOM 233 C CA . GLU A 1 32 ? 46.868 37.254 37.043 1.00 15.17 ? 32 GLU A CA 1 ATOM 234 C C . GLU A 1 32 ? 47.759 36.041 37.243 1.00 14.61 ? 32 GLU A C 1 ATOM 235 O O . GLU A 1 32 ? 48.678 36.049 38.080 1.00 12.41 ? 32 GLU A O 1 ATOM 236 C CB . GLU A 1 32 ? 47.227 37.989 35.752 1.00 18.11 ? 32 GLU A CB 1 ATOM 237 C CG . GLU A 1 32 ? 48.601 38.590 35.707 1.00 25.44 ? 32 GLU A CG 1 ATOM 238 C CD . GLU A 1 32 ? 48.832 39.409 34.447 1.00 32.87 ? 32 GLU A CD 1 ATOM 239 O OE1 . GLU A 1 32 ? 48.041 40.350 34.197 1.00 35.83 ? 32 GLU A OE1 1 ATOM 240 O OE2 . GLU A 1 32 ? 49.805 39.116 33.714 1.00 36.55 ? 32 GLU A OE2 1 ATOM 241 N N . CYS A 1 33 ? 47.460 34.990 36.493 1.00 8.96 ? 33 CYS A N 1 ATOM 242 C CA . CYS A 1 33 ? 48.212 33.748 36.564 1.00 9.17 ? 33 CYS A CA 1 ATOM 243 C C . CYS A 1 33 ? 49.394 33.789 35.599 1.00 8.55 ? 33 CYS A C 1 ATOM 244 O O . CYS A 1 33 ? 49.599 32.863 34.808 1.00 11.60 ? 33 CYS A O 1 ATOM 245 C CB . CYS A 1 33 ? 47.276 32.586 36.239 1.00 5.70 ? 33 CYS A CB 1 ATOM 246 S SG . CYS A 1 33 ? 47.964 30.933 36.513 1.00 12.94 ? 33 CYS A SG 1 ATOM 247 N N . GLY A 1 34 ? 50.211 34.830 35.739 1.00 8.49 ? 34 GLY A N 1 ATOM 248 C CA . GLY A 1 34 ? 51.357 35.030 34.868 1.00 5.34 ? 34 GLY A CA 1 ATOM 249 C C . GLY A 1 34 ? 52.697 34.470 35.302 1.00 8.31 ? 34 GLY A C 1 ATOM 250 O O . GLY A 1 34 ? 52.780 33.599 36.175 1.00 7.46 ? 34 GLY A O 1 ATOM 251 N N . GLU A 1 35 ? 53.750 34.985 34.669 1.00 5.81 ? 35 GLU A N 1 ATOM 252 C CA . GLU A 1 35 ? 55.125 34.567 34.903 1.00 9.21 ? 35 GLU A CA 1 ATOM 253 C C . GLU A 1 35 ? 55.561 34.605 36.370 1.00 8.87 ? 35 GLU A C 1 ATOM 254 O O . GLU A 1 35 ? 56.074 33.611 36.881 1.00 10.73 ? 35 GLU A O 1 ATOM 255 C CB . GLU A 1 35 ? 56.062 35.423 34.048 1.00 8.62 ? 35 GLU A CB 1 ATOM 256 C CG . GLU A 1 35 ? 57.549 35.086 34.139 1.00 14.76 ? 35 GLU A CG 1 ATOM 257 C CD . GLU A 1 35 ? 57.915 33.679 33.670 1.00 20.80 ? 35 GLU A CD 1 ATOM 258 O OE1 . GLU A 1 35 ? 57.102 33.004 33.000 1.00 22.96 ? 35 GLU A OE1 1 ATOM 259 O OE2 . GLU A 1 35 ? 59.042 33.240 33.972 1.00 27.27 ? 35 GLU A OE2 1 ATOM 260 N N . ASP A 1 36 ? 55.356 35.739 37.036 1.00 10.63 ? 36 ASP A N 1 ATOM 261 C CA . ASP A 1 36 ? 55.751 35.882 38.441 1.00 12.24 ? 36 ASP A CA 1 ATOM 262 C C . ASP A 1 36 ? 55.000 34.900 39.338 1.00 11.93 ? 36 ASP A C 1 ATOM 263 O O . ASP A 1 36 ? 55.604 34.238 40.190 1.00 13.71 ? 36 ASP A O 1 ATOM 264 C CB . ASP A 1 36 ? 55.571 37.327 38.923 1.00 9.72 ? 36 ASP A CB 1 ATOM 265 C CG . ASP A 1 36 ? 56.724 38.241 38.510 1.00 10.52 ? 36 ASP A CG 1 ATOM 266 O OD1 . ASP A 1 36 ? 57.585 37.826 37.710 1.00 13.41 ? 36 ASP A OD1 1 ATOM 267 O OD2 . ASP A 1 36 ? 56.774 39.392 38.993 1.00 11.05 ? 36 ASP A OD2 1 ATOM 268 N N . ALA A 1 37 ? 53.703 34.739 39.082 1.00 10.94 ? 37 ALA A N 1 ATOM 269 C CA . ALA A 1 37 ? 52.876 33.812 39.848 1.00 9.67 ? 37 ALA A CA 1 ATOM 270 C C . ALA A 1 37 ? 53.383 32.376 39.707 1.00 12.34 ? 37 ALA A C 1 ATOM 271 O O . ALA A 1 37 ? 53.482 31.641 40.701 1.00 9.00 ? 37 ALA A O 1 ATOM 272 C CB . ALA A 1 37 ? 51.414 33.903 39.411 1.00 10.78 ? 37 ALA A CB 1 ATOM 273 N N . HIS A 1 38 ? 53.737 31.993 38.480 1.00 9.22 ? 38 HIS A N 1 ATOM 274 C CA . HIS A 1 38 ? 54.237 30.644 38.194 1.00 10.22 ? 38 HIS A CA 1 ATOM 275 C C . HIS A 1 38 ? 55.539 30.358 38.944 1.00 8.82 ? 38 HIS A C 1 ATOM 276 O O . HIS A 1 38 ? 55.694 29.295 39.543 1.00 7.16 ? 38 HIS A O 1 ATOM 277 C CB . HIS A 1 38 ? 54.456 30.445 36.680 1.00 13.65 ? 38 HIS A CB 1 ATOM 278 C CG . HIS A 1 38 ? 53.193 30.480 35.871 1.00 17.32 ? 38 HIS A CG 1 ATOM 279 N ND1 . HIS A 1 38 ? 53.188 30.661 34.501 1.00 14.46 ? 38 HIS A ND1 1 ATOM 280 C CD2 . HIS A 1 38 ? 51.893 30.366 36.241 1.00 17.00 ? 38 HIS A CD2 1 ATOM 281 C CE1 . HIS A 1 38 ? 51.940 30.653 34.066 1.00 14.51 ? 38 HIS A CE1 1 ATOM 282 N NE2 . HIS A 1 38 ? 51.136 30.479 35.094 1.00 16.90 ? 38 HIS A NE2 1 ATOM 283 N N . GLU A 1 39 ? 56.461 31.315 38.919 1.00 6.55 ? 39 GLU A N 1 ATOM 284 C CA . GLU A 1 39 ? 57.751 31.172 39.592 1.00 9.34 ? 39 GLU A CA 1 ATOM 285 C C . GLU A 1 39 ? 57.568 30.922 41.086 1.00 8.86 ? 39 GLU A C 1 ATOM 286 O O . GLU A 1 39 ? 58.233 30.061 41.667 1.00 12.07 ? 39 GLU A O 1 ATOM 287 C CB . GLU A 1 39 ? 58.577 32.437 39.411 1.00 12.44 ? 39 GLU A CB 1 ATOM 288 C CG . GLU A 1 39 ? 58.747 32.866 37.987 1.00 18.74 ? 39 GLU A CG 1 ATOM 289 C CD . GLU A 1 39 ? 60.133 32.601 37.474 1.00 24.75 ? 39 GLU A CD 1 ATOM 290 O OE1 . GLU A 1 39 ? 60.389 31.467 37.025 1.00 26.75 ? 39 GLU A OE1 1 ATOM 291 O OE2 . GLU A 1 39 ? 60.968 33.531 37.523 1.00 30.52 ? 39 GLU A OE2 1 ATOM 292 N N . VAL A 1 40 ? 56.680 31.692 41.704 1.00 7.97 ? 40 VAL A N 1 ATOM 293 C CA . VAL A 1 40 ? 56.398 31.562 43.124 1.00 7.46 ? 40 VAL A CA 1 ATOM 294 C C . VAL A 1 40 ? 55.800 30.204 43.467 1.00 9.38 ? 40 VAL A C 1 ATOM 295 O O . VAL A 1 40 ? 56.220 29.578 44.438 1.00 10.33 ? 40 VAL A O 1 ATOM 296 C CB . VAL A 1 40 ? 55.537 32.738 43.625 1.00 5.68 ? 40 VAL A CB 1 ATOM 297 C CG1 . VAL A 1 40 ? 54.939 32.455 44.982 1.00 6.29 ? 40 VAL A CG1 1 ATOM 298 C CG2 . VAL A 1 40 ? 56.393 33.978 43.695 1.00 7.03 ? 40 VAL A CG2 1 ATOM 299 N N . ILE A 1 41 ? 54.874 29.707 42.647 1.00 6.24 ? 41 ILE A N 1 ATOM 300 C CA . ILE A 1 41 ? 54.272 28.397 42.904 1.00 4.53 ? 41 ILE A CA 1 ATOM 301 C C . ILE A 1 41 ? 55.361 27.320 42.870 1.00 5.11 ? 41 ILE A C 1 ATOM 302 O O . ILE A 1 41 ? 55.322 26.342 43.632 1.00 6.70 ? 41 ILE A O 1 ATOM 303 C CB . ILE A 1 41 ? 53.147 28.051 41.869 1.00 5.73 ? 41 ILE A CB 1 ATOM 304 C CG1 . ILE A 1 41 ? 51.999 29.062 41.973 1.00 8.76 ? 41 ILE A CG1 1 ATOM 305 C CG2 . ILE A 1 41 ? 52.609 26.648 42.112 1.00 5.36 ? 41 ILE A CG2 1 ATOM 306 C CD1 . ILE A 1 41 ? 51.077 29.104 40.753 1.00 7.19 ? 41 ILE A CD1 1 ATOM 307 N N . ARG A 1 42 ? 56.335 27.490 41.981 1.00 4.63 ? 42 ARG A N 1 ATOM 308 C CA . ARG A 1 42 ? 57.429 26.538 41.878 1.00 4.04 ? 42 ARG A CA 1 ATOM 309 C C . ARG A 1 42 ? 58.306 26.609 43.147 1.00 4.74 ? 42 ARG A C 1 ATOM 310 O O . ARG A 1 42 ? 58.754 25.579 43.644 1.00 4.22 ? 42 ARG A O 1 ATOM 311 C CB . ARG A 1 42 ? 58.299 26.838 40.654 1.00 2.00 ? 42 ARG A CB 1 ATOM 312 C CG . ARG A 1 42 ? 59.413 25.831 40.452 1.00 2.00 ? 42 ARG A CG 1 ATOM 313 C CD . ARG A 1 42 ? 60.359 26.269 39.359 1.00 6.74 ? 42 ARG A CD 1 ATOM 314 N NE . ARG A 1 42 ? 61.396 25.278 39.104 1.00 10.42 ? 42 ARG A NE 1 ATOM 315 C CZ . ARG A 1 42 ? 62.595 25.563 38.596 1.00 11.00 ? 42 ARG A CZ 1 ATOM 316 N NH1 . ARG A 1 42 ? 62.917 26.816 38.284 1.00 12.33 ? 42 ARG A NH1 1 ATOM 317 N NH2 . ARG A 1 42 ? 63.475 24.591 38.393 1.00 18.36 ? 42 ARG A NH2 1 ATOM 318 N N . LEU A 1 43 ? 58.562 27.826 43.628 1.00 7.28 ? 43 LEU A N 1 ATOM 319 C CA . LEU A 1 43 ? 59.385 28.044 44.828 1.00 9.41 ? 43 LEU A CA 1 ATOM 320 C C . LEU A 1 43 ? 58.792 27.311 46.021 1.00 10.30 ? 43 LEU A C 1 ATOM 321 O O . LEU A 1 43 ? 59.516 26.661 46.782 1.00 11.28 ? 43 LEU A O 1 ATOM 322 C CB . LEU A 1 43 ? 59.486 29.534 45.158 1.00 5.65 ? 43 LEU A CB 1 ATOM 323 C CG . LEU A 1 43 ? 60.276 29.906 46.425 1.00 6.20 ? 43 LEU A CG 1 ATOM 324 C CD1 . LEU A 1 43 ? 61.717 29.437 46.294 1.00 6.18 ? 43 LEU A CD1 1 ATOM 325 C CD2 . LEU A 1 43 ? 60.236 31.396 46.644 1.00 4.62 ? 43 LEU A CD2 1 ATOM 326 N N . THR A 1 44 ? 57.472 27.393 46.152 1.00 11.56 ? 44 THR A N 1 ATOM 327 C CA . THR A 1 44 ? 56.741 26.742 47.228 1.00 11.48 ? 44 THR A CA 1 ATOM 328 C C . THR A 1 44 ? 57.141 25.271 47.345 1.00 13.27 ? 44 THR A C 1 ATOM 329 O O . THR A 1 44 ? 57.422 24.774 48.440 1.00 13.81 ? 44 THR A O 1 ATOM 330 C CB . THR A 1 44 ? 55.223 26.862 46.991 1.00 14.48 ? 44 THR A CB 1 ATOM 331 O OG1 . THR A 1 44 ? 54.829 28.235 47.125 1.00 16.42 ? 44 THR A OG1 1 ATOM 332 C CG2 . THR A 1 44 ? 54.445 26.015 47.971 1.00 18.48 ? 44 THR A CG2 1 ATOM 333 N N . PHE A 1 45 ? 57.231 24.608 46.197 1.00 11.06 ? 45 PHE A N 1 ATOM 334 C CA . PHE A 1 45 ? 57.605 23.198 46.113 1.00 9.54 ? 45 PHE A CA 1 ATOM 335 C C . PHE A 1 45 ? 59.100 22.947 46.415 1.00 7.13 ? 45 PHE A C 1 ATOM 336 O O . PHE A 1 45 ? 59.437 21.987 47.105 1.00 4.69 ? 45 PHE A O 1 ATOM 337 C CB . PHE A 1 45 ? 57.218 22.656 44.717 1.00 7.50 ? 45 PHE A CB 1 ATOM 338 C CG . PHE A 1 45 ? 57.858 21.346 44.368 1.00 5.90 ? 45 PHE A CG 1 ATOM 339 C CD1 . PHE A 1 45 ? 57.586 20.199 45.107 1.00 8.41 ? 45 PHE A CD1 1 ATOM 340 C CD2 . PHE A 1 45 ? 58.756 21.262 43.313 1.00 5.01 ? 45 PHE A CD2 1 ATOM 341 C CE1 . PHE A 1 45 ? 58.205 18.986 44.806 1.00 7.99 ? 45 PHE A CE1 1 ATOM 342 C CE2 . PHE A 1 45 ? 59.382 20.053 43.001 1.00 7.75 ? 45 PHE A CE2 1 ATOM 343 C CZ . PHE A 1 45 ? 59.108 18.913 43.749 1.00 6.93 ? 45 PHE A CZ 1 ATOM 344 N N . HIS A 1 46 ? 59.983 23.771 45.853 1.00 7.47 ? 46 HIS A N 1 ATOM 345 C CA . HIS A 1 46 ? 61.422 23.630 46.062 1.00 9.30 ? 46 HIS A CA 1 ATOM 346 C C . HIS A 1 46 ? 61.820 23.908 47.523 1.00 10.97 ? 46 HIS A C 1 ATOM 347 O O . HIS A 1 46 ? 62.800 23.353 48.033 1.00 8.16 ? 46 HIS A O 1 ATOM 348 C CB . HIS A 1 46 ? 62.195 24.554 45.114 1.00 11.78 ? 46 HIS A CB 1 ATOM 349 C CG . HIS A 1 46 ? 62.310 24.030 43.710 1.00 13.99 ? 46 HIS A CG 1 ATOM 350 N ND1 . HIS A 1 46 ? 63.514 23.936 43.048 1.00 14.97 ? 46 HIS A ND1 1 ATOM 351 C CD2 . HIS A 1 46 ? 61.373 23.563 42.848 1.00 14.13 ? 46 HIS A CD2 1 ATOM 352 C CE1 . HIS A 1 46 ? 63.320 23.435 41.842 1.00 13.92 ? 46 HIS A CE1 1 ATOM 353 N NE2 . HIS A 1 46 ? 62.028 23.200 41.697 1.00 13.81 ? 46 HIS A NE2 1 ATOM 354 N N . ASP A 1 47 ? 61.076 24.790 48.183 1.00 10.19 ? 47 ASP A N 1 ATOM 355 C CA . ASP A 1 47 ? 61.340 25.098 49.583 1.00 11.47 ? 47 ASP A CA 1 ATOM 356 C C . ASP A 1 47 ? 60.919 23.898 50.444 1.00 10.13 ? 47 ASP A C 1 ATOM 357 O O . ASP A 1 47 ? 61.732 23.351 51.196 1.00 8.62 ? 47 ASP A O 1 ATOM 358 C CB . ASP A 1 47 ? 60.578 26.354 50.035 1.00 8.77 ? 47 ASP A CB 1 ATOM 359 C CG . ASP A 1 47 ? 61.000 26.825 51.437 1.00 13.68 ? 47 ASP A CG 1 ATOM 360 O OD1 . ASP A 1 47 ? 62.117 26.487 51.865 1.00 8.08 ? 47 ASP A OD1 1 ATOM 361 O OD2 . ASP A 1 47 ? 60.233 27.539 52.110 1.00 10.54 ? 47 ASP A OD2 1 ATOM 362 N N . ALA A 1 48 ? 59.687 23.442 50.257 1.00 9.77 ? 48 ALA A N 1 ATOM 363 C CA . ALA A 1 48 ? 59.132 22.332 51.029 1.00 9.85 ? 48 ALA A CA 1 ATOM 364 C C . ALA A 1 48 ? 59.761 20.952 50.888 1.00 10.44 ? 48 ALA A C 1 ATOM 365 O O . ALA A 1 48 ? 59.991 20.271 51.892 1.00 7.25 ? 48 ALA A O 1 ATOM 366 C CB . ALA A 1 48 ? 57.640 22.233 50.774 1.00 10.06 ? 48 ALA A CB 1 ATOM 367 N N . ILE A 1 49 ? 60.077 20.552 49.659 1.00 8.79 ? 49 ILE A N 1 ATOM 368 C CA . ILE A 1 49 ? 60.610 19.215 49.408 1.00 8.57 ? 49 ILE A CA 1 ATOM 369 C C . ILE A 1 49 ? 62.012 18.886 49.926 1.00 8.31 ? 49 ILE A C 1 ATOM 370 O O . ILE A 1 49 ? 62.364 17.713 50.023 1.00 7.39 ? 49 ILE A O 1 ATOM 371 C CB . ILE A 1 49 ? 60.503 18.835 47.896 1.00 9.42 ? 49 ILE A CB 1 ATOM 372 C CG1 . ILE A 1 49 ? 60.294 17.329 47.739 1.00 7.16 ? 49 ILE A CG1 1 ATOM 373 C CG2 . ILE A 1 49 ? 61.739 19.301 47.119 1.00 4.35 ? 49 ILE A CG2 1 ATOM 374 C CD1 . ILE A 1 49 ? 58.972 16.846 48.291 1.00 6.91 ? 49 ILE A CD1 1 ATOM 375 N N . ALA A 1 50 ? 62.815 19.910 50.208 1.00 8.53 ? 50 ALA A N 1 ATOM 376 C CA . ALA A 1 50 ? 64.169 19.706 50.718 1.00 10.97 ? 50 ALA A CA 1 ATOM 377 C C . ALA A 1 50 ? 64.144 19.280 52.199 1.00 12.10 ? 50 ALA A C 1 ATOM 378 O O . ALA A 1 50 ? 64.361 20.097 53.119 1.00 13.53 ? 50 ALA A O 1 ATOM 379 C CB . ALA A 1 50 ? 64.996 20.966 50.522 1.00 8.68 ? 50 ALA A CB 1 ATOM 380 N N . ILE A 1 51 ? 63.781 18.019 52.410 1.00 9.79 ? 51 ILE A N 1 ATOM 381 C CA . ILE A 1 51 ? 63.699 17.408 53.726 1.00 11.85 ? 51 ILE A CA 1 ATOM 382 C C . ILE A 1 51 ? 63.872 15.914 53.471 1.00 14.14 ? 51 ILE A C 1 ATOM 383 O O . ILE A 1 51 ? 63.574 15.439 52.371 1.00 15.49 ? 51 ILE A O 1 ATOM 384 C CB . ILE A 1 51 ? 62.343 17.732 54.446 1.00 10.11 ? 51 ILE A CB 1 ATOM 385 C CG1 . ILE A 1 51 ? 62.330 17.139 55.859 1.00 11.17 ? 51 ILE A CG1 1 ATOM 386 C CG2 . ILE A 1 51 ? 61.151 17.212 53.660 1.00 9.21 ? 51 ILE A CG2 1 ATOM 387 C CD1 . ILE A 1 51 ? 61.151 17.619 56.716 1.00 9.19 ? 51 ILE A CD1 1 ATOM 388 N N . SER A 1 52 ? 64.381 15.180 54.457 1.00 10.81 ? 52 SER A N 1 ATOM 389 C CA . SER A 1 52 ? 64.618 13.758 54.298 1.00 8.69 ? 52 SER A CA 1 ATOM 390 C C . SER A 1 52 ? 64.522 12.997 55.611 1.00 13.71 ? 52 SER A C 1 ATOM 391 O O . SER A 1 52 ? 65.301 13.224 56.538 1.00 14.41 ? 52 SER A O 1 ATOM 392 C CB . SER A 1 52 ? 65.989 13.539 53.658 1.00 7.16 ? 52 SER A CB 1 ATOM 393 O OG . SER A 1 52 ? 66.401 12.185 53.741 1.00 7.26 ? 52 SER A OG 1 ATOM 394 N N . ARG A 1 53 ? 63.564 12.086 55.682 1.00 14.98 ? 53 ARG A N 1 ATOM 395 C CA . ARG A 1 53 ? 63.365 11.271 56.870 1.00 18.70 ? 53 ARG A CA 1 ATOM 396 C C . ARG A 1 53 ? 64.577 10.396 57.167 1.00 20.57 ? 53 ARG A C 1 ATOM 397 O O . ARG A 1 53 ? 65.084 10.395 58.286 1.00 23.48 ? 53 ARG A O 1 ATOM 398 C CB . ARG A 1 53 ? 62.143 10.378 56.689 1.00 18.46 ? 53 ARG A CB 1 ATOM 399 C CG . ARG A 1 53 ? 60.821 11.105 56.682 1.00 21.22 ? 53 ARG A CG 1 ATOM 400 C CD . ARG A 1 53 ? 59.865 10.318 55.828 1.00 24.92 ? 53 ARG A CD 1 ATOM 401 N NE . ARG A 1 53 ? 58.536 10.193 56.405 1.00 28.82 ? 53 ARG A NE 1 ATOM 402 C CZ . ARG A 1 53 ? 57.720 9.177 56.141 1.00 31.91 ? 53 ARG A CZ 1 ATOM 403 N NH1 . ARG A 1 53 ? 58.108 8.206 55.316 1.00 30.65 ? 53 ARG A NH1 1 ATOM 404 N NH2 . ARG A 1 53 ? 56.510 9.138 56.683 1.00 33.09 ? 53 ARG A NH2 1 ATOM 405 N N . SER A 1 54 ? 65.054 9.672 56.159 1.00 20.63 ? 54 SER A N 1 ATOM 406 C CA . SER A 1 54 ? 66.191 8.778 56.327 1.00 22.26 ? 54 SER A CA 1 ATOM 407 C C . SER A 1 54 ? 67.498 9.470 56.718 1.00 24.25 ? 54 SER A C 1 ATOM 408 O O . SER A 1 54 ? 68.260 8.951 57.535 1.00 25.27 ? 54 SER A O 1 ATOM 409 C CB . SER A 1 54 ? 66.407 7.953 55.062 1.00 23.74 ? 54 SER A CB 1 ATOM 410 O OG . SER A 1 54 ? 66.763 8.778 53.966 1.00 27.74 ? 54 SER A OG 1 ATOM 411 N N . GLN A 1 55 ? 67.773 10.624 56.119 1.00 22.45 ? 55 GLN A N 1 ATOM 412 C CA . GLN A 1 55 ? 68.999 11.353 56.419 1.00 22.89 ? 55 GLN A CA 1 ATOM 413 C C . GLN A 1 55 ? 68.951 12.146 57.731 1.00 22.73 ? 55 GLN A C 1 ATOM 414 O O . GLN A 1 55 ? 69.991 12.490 58.296 1.00 25.63 ? 55 GLN A O 1 ATOM 415 C CB . GLN A 1 55 ? 69.366 12.280 55.264 1.00 22.99 ? 55 GLN A CB 1 ATOM 416 C CG . GLN A 1 55 ? 69.690 11.573 53.961 1.00 24.06 ? 55 GLN A CG 1 ATOM 417 C CD . GLN A 1 55 ? 70.154 12.543 52.892 1.00 26.89 ? 55 GLN A CD 1 ATOM 418 O OE1 . GLN A 1 55 ? 71.088 13.315 53.106 1.00 29.23 ? 55 GLN A OE1 1 ATOM 419 N NE2 . GLN A 1 55 ? 69.494 12.522 51.742 1.00 30.74 ? 55 GLN A NE2 1 ATOM 420 N N . GLY A 1 56 ? 67.755 12.460 58.207 1.00 20.82 ? 56 GLY A N 1 ATOM 421 C CA . GLY A 1 56 ? 67.643 13.205 59.444 1.00 19.66 ? 56 GLY A CA 1 ATOM 422 C C . GLY A 1 56 ? 67.587 14.712 59.271 1.00 20.18 ? 56 GLY A C 1 ATOM 423 O O . GLY A 1 56 ? 67.859 15.239 58.187 1.00 19.75 ? 56 GLY A O 1 ATOM 424 N N . PRO A 1 57 ? 67.293 15.443 60.360 1.00 19.04 ? 57 PRO A N 1 ATOM 425 C CA . PRO A 1 57 ? 67.175 16.906 60.424 1.00 19.13 ? 57 PRO A CA 1 ATOM 426 C C . PRO A 1 57 ? 68.304 17.719 59.793 1.00 17.61 ? 57 PRO A C 1 ATOM 427 O O . PRO A 1 57 ? 68.064 18.799 59.258 1.00 18.58 ? 57 PRO A O 1 ATOM 428 C CB . PRO A 1 57 ? 67.078 17.169 61.929 1.00 21.19 ? 57 PRO A CB 1 ATOM 429 C CG . PRO A 1 57 ? 66.377 15.950 62.435 1.00 19.70 ? 57 PRO A CG 1 ATOM 430 C CD . PRO A 1 57 ? 67.093 14.850 61.694 1.00 19.64 ? 57 PRO A CD 1 ATOM 431 N N . LYS A 1 58 ? 69.529 17.216 59.853 1.00 17.42 ? 58 LYS A N 1 ATOM 432 C CA . LYS A 1 58 ? 70.662 17.949 59.292 1.00 20.07 ? 58 LYS A CA 1 ATOM 433 C C . LYS A 1 58 ? 70.625 18.111 57.784 1.00 18.46 ? 58 LYS A C 1 ATOM 434 O O . LYS A 1 58 ? 71.346 18.945 57.231 1.00 17.77 ? 58 LYS A O 1 ATOM 435 C CB . LYS A 1 58 ? 71.989 17.307 59.696 1.00 24.19 ? 58 LYS A CB 1 ATOM 436 C CG . LYS A 1 58 ? 72.585 17.857 60.985 1.00 29.43 ? 58 LYS A CG 1 ATOM 437 C CD . LYS A 1 58 ? 71.714 17.556 62.198 1.00 32.43 ? 58 LYS A CD 1 ATOM 438 C CE . LYS A 1 58 ? 72.429 17.949 63.477 1.00 35.56 ? 58 LYS A CE 1 ATOM 439 N NZ . LYS A 1 58 ? 73.780 17.313 63.555 1.00 36.67 ? 58 LYS A NZ 1 ATOM 440 N N . ALA A 1 59 ? 69.818 17.285 57.126 1.00 17.50 ? 59 ALA A N 1 ATOM 441 C CA . ALA A 1 59 ? 69.685 17.322 55.671 1.00 15.24 ? 59 ALA A CA 1 ATOM 442 C C . ALA A 1 59 ? 68.848 18.515 55.187 1.00 13.78 ? 59 ALA A C 1 ATOM 443 O O . ALA A 1 59 ? 69.062 19.022 54.082 1.00 15.91 ? 59 ALA A O 1 ATOM 444 C CB . ALA A 1 59 ? 69.092 16.006 55.175 1.00 15.93 ? 59 ALA A CB 1 ATOM 445 N N . GLY A 1 60 ? 67.898 18.956 56.012 1.00 10.34 ? 60 GLY A N 1 ATOM 446 C CA . GLY A 1 60 ? 67.052 20.077 55.645 1.00 10.53 ? 60 GLY A CA 1 ATOM 447 C C . GLY A 1 60 ? 65.787 20.120 56.480 1.00 9.25 ? 60 GLY A C 1 ATOM 448 O O . GLY A 1 60 ? 65.337 19.084 56.985 1.00 11.70 ? 60 GLY A O 1 ATOM 449 N N . GLY A 1 61 ? 65.188 21.300 56.595 1.00 6.76 ? 61 GLY A N 1 ATOM 450 C CA . GLY A 1 61 ? 63.984 21.433 57.403 1.00 8.63 ? 61 GLY A CA 1 ATOM 451 C C . GLY A 1 61 ? 62.644 21.520 56.692 1.00 7.29 ? 61 GLY A C 1 ATOM 452 O O . GLY A 1 61 ? 61.631 21.841 57.318 1.00 5.58 ? 61 GLY A O 1 ATOM 453 N N . GLY A 1 62 ? 62.621 21.229 55.394 1.00 7.89 ? 62 GLY A N 1 ATOM 454 C CA . GLY A 1 62 ? 61.364 21.286 54.657 1.00 6.51 ? 62 GLY A CA 1 ATOM 455 C C . GLY A 1 62 ? 60.856 22.688 54.388 1.00 3.87 ? 62 GLY A C 1 ATOM 456 O O . GLY A 1 62 ? 61.613 23.566 53.945 1.00 7.94 ? 62 GLY A O 1 ATOM 457 N N . ALA A 1 63 ? 59.564 22.899 54.630 1.00 9.22 ? 63 ALA A N 1 ATOM 458 C CA . ALA A 1 63 ? 58.917 24.196 54.409 1.00 10.45 ? 63 ALA A CA 1 ATOM 459 C C . ALA A 1 63 ? 59.371 25.140 55.514 1.00 11.28 ? 63 ALA A C 1 ATOM 460 O O . ALA A 1 63 ? 58.607 25.457 56.428 1.00 12.04 ? 63 ALA A O 1 ATOM 461 C CB . ALA A 1 63 ? 57.398 24.033 54.429 1.00 5.97 ? 63 ALA A CB 1 ATOM 462 N N . ASP A 1 64 ? 60.598 25.625 55.377 1.00 13.62 ? 64 ASP A N 1 ATOM 463 C CA . ASP A 1 64 ? 61.220 26.475 56.386 1.00 12.56 ? 64 ASP A CA 1 ATOM 464 C C . ASP A 1 64 ? 61.750 27.827 55.926 1.00 13.26 ? 64 ASP A C 1 ATOM 465 O O . ASP A 1 64 ? 62.355 28.560 56.716 1.00 12.73 ? 64 ASP A O 1 ATOM 466 C CB . ASP A 1 64 ? 62.364 25.690 57.051 1.00 12.18 ? 64 ASP A CB 1 ATOM 467 C CG . ASP A 1 64 ? 63.422 25.219 56.057 1.00 12.94 ? 64 ASP A CG 1 ATOM 468 O OD1 . ASP A 1 64 ? 63.372 25.629 54.879 1.00 10.75 ? 64 ASP A OD1 1 ATOM 469 O OD2 . ASP A 1 64 ? 64.320 24.444 56.451 1.00 9.83 ? 64 ASP A OD2 1 ATOM 470 N N . GLY A 1 65 ? 61.551 28.156 54.651 1.00 10.34 ? 65 GLY A N 1 ATOM 471 C CA . GLY A 1 65 ? 62.043 29.427 54.146 1.00 6.48 ? 65 GLY A CA 1 ATOM 472 C C . GLY A 1 65 ? 63.554 29.484 53.975 1.00 5.19 ? 65 GLY A C 1 ATOM 473 O O . GLY A 1 65 ? 64.128 30.563 53.880 1.00 5.11 ? 65 GLY A O 1 ATOM 474 N N . SER A 1 66 ? 64.199 28.325 53.906 1.00 6.76 ? 66 SER A N 1 ATOM 475 C CA . SER A 1 66 ? 65.655 28.275 53.737 1.00 7.05 ? 66 SER A CA 1 ATOM 476 C C . SER A 1 66 ? 66.184 28.929 52.468 1.00 8.31 ? 66 SER A C 1 ATOM 477 O O . SER A 1 66 ? 67.331 29.389 52.432 1.00 6.41 ? 66 SER A O 1 ATOM 478 C CB . SER A 1 66 ? 66.177 26.833 53.827 1.00 8.18 ? 66 SER A CB 1 ATOM 479 O OG . SER A 1 66 ? 65.416 25.901 53.063 1.00 11.05 ? 66 SER A OG 1 ATOM 480 N N . MET A 1 67 ? 65.355 28.963 51.422 1.00 9.74 ? 67 MET A N 1 ATOM 481 C CA . MET A 1 67 ? 65.744 29.563 50.140 1.00 7.13 ? 67 MET A CA 1 ATOM 482 C C . MET A 1 67 ? 65.926 31.057 50.306 1.00 4.41 ? 67 MET A C 1 ATOM 483 O O . MET A 1 67 ? 66.755 31.668 49.634 1.00 7.30 ? 67 MET A O 1 ATOM 484 C CB . MET A 1 67 ? 64.673 29.290 49.076 1.00 12.70 ? 67 MET A CB 1 ATOM 485 C CG . MET A 1 67 ? 64.491 27.823 48.725 1.00 14.71 ? 67 MET A CG 1 ATOM 486 S SD . MET A 1 67 ? 65.543 27.310 47.377 1.00 19.11 ? 67 MET A SD 1 ATOM 487 C CE . MET A 1 67 ? 65.006 25.664 47.146 1.00 14.60 ? 67 MET A CE 1 ATOM 488 N N . LEU A 1 68 ? 65.128 31.645 51.196 1.00 5.73 ? 68 LEU A N 1 ATOM 489 C CA . LEU A 1 68 ? 65.183 33.076 51.482 1.00 7.61 ? 68 LEU A CA 1 ATOM 490 C C . LEU A 1 68 ? 66.218 33.405 52.567 1.00 9.16 ? 68 LEU A C 1 ATOM 491 O O . LEU A 1 68 ? 66.914 34.416 52.474 1.00 9.39 ? 68 LEU A O 1 ATOM 492 C CB . LEU A 1 68 ? 63.807 33.590 51.922 1.00 8.32 ? 68 LEU A CB 1 ATOM 493 C CG . LEU A 1 68 ? 62.795 34.022 50.854 1.00 11.10 ? 68 LEU A CG 1 ATOM 494 C CD1 . LEU A 1 68 ? 62.609 32.944 49.806 1.00 10.21 ? 68 LEU A CD1 1 ATOM 495 C CD2 . LEU A 1 68 ? 61.475 34.348 51.513 1.00 10.34 ? 68 LEU A CD2 1 ATOM 496 N N . LEU A 1 69 ? 66.320 32.536 53.576 1.00 10.79 ? 69 LEU A N 1 ATOM 497 C CA . LEU A 1 69 ? 67.255 32.726 54.694 1.00 11.32 ? 69 LEU A CA 1 ATOM 498 C C . LEU A 1 69 ? 68.708 32.474 54.326 1.00 10.30 ? 69 LEU A C 1 ATOM 499 O O . LEU A 1 69 ? 69.610 33.080 54.907 1.00 11.52 ? 69 LEU A O 1 ATOM 500 C CB . LEU A 1 69 ? 66.845 31.858 55.886 1.00 10.26 ? 69 LEU A CB 1 ATOM 501 C CG . LEU A 1 69 ? 65.933 32.479 56.953 1.00 11.85 ? 69 LEU A CG 1 ATOM 502 C CD1 . LEU A 1 69 ? 65.264 33.749 56.472 1.00 13.97 ? 69 LEU A CD1 1 ATOM 503 C CD2 . LEU A 1 69 ? 64.927 31.461 57.432 1.00 9.87 ? 69 LEU A CD2 1 ATOM 504 N N . PHE A 1 70 ? 68.935 31.570 53.377 1.00 9.09 ? 70 PHE A N 1 ATOM 505 C CA . PHE A 1 70 ? 70.287 31.262 52.916 1.00 12.02 ? 70 PHE A CA 1 ATOM 506 C C . PHE A 1 70 ? 70.282 31.340 51.377 1.00 10.80 ? 70 PHE A C 1 ATOM 507 O O . PHE A 1 70 ? 70.559 30.352 50.694 1.00 10.34 ? 70 PHE A O 1 ATOM 508 C CB . PHE A 1 70 ? 70.710 29.859 53.399 1.00 11.57 ? 70 PHE A CB 1 ATOM 509 C CG . PHE A 1 70 ? 70.717 29.705 54.909 1.00 12.78 ? 70 PHE A CG 1 ATOM 510 C CD1 . PHE A 1 70 ? 69.564 29.307 55.589 1.00 12.17 ? 70 PHE A CD1 1 ATOM 511 C CD2 . PHE A 1 70 ? 71.867 29.983 55.650 1.00 12.17 ? 70 PHE A CD2 1 ATOM 512 C CE1 . PHE A 1 70 ? 69.550 29.191 56.986 1.00 15.62 ? 70 PHE A CE1 1 ATOM 513 C CE2 . PHE A 1 70 ? 71.870 29.870 57.050 1.00 13.24 ? 70 PHE A CE2 1 ATOM 514 C CZ . PHE A 1 70 ? 70.710 29.474 57.720 1.00 14.30 ? 70 PHE A CZ 1 ATOM 515 N N . PRO A 1 71 ? 70.046 32.545 50.821 1.00 12.87 ? 71 PRO A N 1 ATOM 516 C CA . PRO A 1 71 ? 69.985 32.800 49.376 1.00 12.65 ? 71 PRO A CA 1 ATOM 517 C C . PRO A 1 71 ? 71.182 32.442 48.517 1.00 13.62 ? 71 PRO A C 1 ATOM 518 O O . PRO A 1 71 ? 71.027 32.280 47.312 1.00 14.93 ? 71 PRO A O 1 ATOM 519 C CB . PRO A 1 71 ? 69.670 34.293 49.306 1.00 13.20 ? 71 PRO A CB 1 ATOM 520 C CG . PRO A 1 71 ? 70.394 34.829 50.508 1.00 13.61 ? 71 PRO A CG 1 ATOM 521 C CD . PRO A 1 71 ? 70.009 33.822 51.562 1.00 12.06 ? 71 PRO A CD 1 ATOM 522 N N . THR A 1 72 ? 72.370 32.308 49.100 1.00 13.11 ? 72 THR A N 1 ATOM 523 C CA . THR A 1 72 ? 73.539 31.965 48.291 1.00 10.03 ? 72 THR A CA 1 ATOM 524 C C . THR A 1 72 ? 73.870 30.483 48.316 1.00 9.51 ? 72 THR A C 1 ATOM 525 O O . THR A 1 72 ? 74.862 30.052 47.729 1.00 9.08 ? 72 THR A O 1 ATOM 526 C CB . THR A 1 72 ? 74.786 32.745 48.734 1.00 13.78 ? 72 THR A CB 1 ATOM 527 O OG1 . THR A 1 72 ? 75.159 32.340 50.056 1.00 13.38 ? 72 THR A OG1 1 ATOM 528 C CG2 . THR A 1 72 ? 74.513 34.239 48.724 1.00 11.21 ? 72 THR A CG2 1 ATOM 529 N N . VAL A 1 73 ? 73.041 29.688 48.978 1.00 7.06 ? 73 VAL A N 1 ATOM 530 C CA . VAL A 1 73 ? 73.316 28.262 49.062 1.00 7.58 ? 73 VAL A CA 1 ATOM 531 C C . VAL A 1 73 ? 72.485 27.391 48.114 1.00 7.75 ? 73 VAL A C 1 ATOM 532 O O . VAL A 1 73 ? 72.975 26.994 47.061 1.00 6.23 ? 73 VAL A O 1 ATOM 533 C CB . VAL A 1 73 ? 73.185 27.750 50.520 1.00 5.71 ? 73 VAL A CB 1 ATOM 534 C CG1 . VAL A 1 73 ? 73.530 26.269 50.600 1.00 2.91 ? 73 VAL A CG1 1 ATOM 535 C CG2 . VAL A 1 73 ? 74.114 28.557 51.426 1.00 9.51 ? 73 VAL A CG2 1 ATOM 536 N N . GLU A 1 74 ? 71.245 27.089 48.491 1.00 8.97 ? 74 GLU A N 1 ATOM 537 C CA . GLU A 1 74 ? 70.373 26.250 47.670 1.00 11.72 ? 74 GLU A CA 1 ATOM 538 C C . GLU A 1 74 ? 70.101 26.754 46.244 1.00 12.19 ? 74 GLU A C 1 ATOM 539 O O . GLU A 1 74 ? 70.216 25.983 45.293 1.00 12.05 ? 74 GLU A O 1 ATOM 540 C CB . GLU A 1 74 ? 69.062 25.971 48.396 1.00 10.35 ? 74 GLU A CB 1 ATOM 541 C CG . GLU A 1 74 ? 69.202 24.991 49.542 1.00 10.24 ? 74 GLU A CG 1 ATOM 542 C CD . GLU A 1 74 ? 67.928 24.847 50.322 1.00 13.28 ? 74 GLU A CD 1 ATOM 543 O OE1 . GLU A 1 74 ? 67.096 23.999 49.944 1.00 11.35 ? 74 GLU A OE1 1 ATOM 544 O OE2 . GLU A 1 74 ? 67.753 25.581 51.318 1.00 12.68 ? 74 GLU A OE2 1 ATOM 545 N N . PRO A 1 75 ? 69.771 28.053 46.073 1.00 12.88 ? 75 PRO A N 1 ATOM 546 C CA . PRO A 1 75 ? 69.503 28.599 44.732 1.00 13.05 ? 75 PRO A CA 1 ATOM 547 C C . PRO A 1 75 ? 70.580 28.272 43.707 1.00 15.90 ? 75 PRO A C 1 ATOM 548 O O . PRO A 1 75 ? 70.308 28.244 42.507 1.00 16.51 ? 75 PRO A O 1 ATOM 549 C CB . PRO A 1 75 ? 69.447 30.099 44.986 1.00 13.10 ? 75 PRO A CB 1 ATOM 550 C CG . PRO A 1 75 ? 68.783 30.160 46.332 1.00 13.81 ? 75 PRO A CG 1 ATOM 551 C CD . PRO A 1 75 ? 69.528 29.081 47.104 1.00 13.08 ? 75 PRO A CD 1 ATOM 552 N N . ASN A 1 76 ? 71.786 27.975 44.184 1.00 14.07 ? 76 ASN A N 1 ATOM 553 C CA . ASN A 1 76 ? 72.899 27.664 43.300 1.00 13.63 ? 76 ASN A CA 1 ATOM 554 C C . ASN A 1 76 ? 73.126 26.192 42.987 1.00 12.81 ? 76 ASN A C 1 ATOM 555 O O . ASN A 1 76 ? 74.092 25.851 42.300 1.00 16.04 ? 76 ASN A O 1 ATOM 556 C CB . ASN A 1 76 ? 74.193 28.306 43.805 1.00 16.00 ? 76 ASN A CB 1 ATOM 557 C CG . ASN A 1 76 ? 74.175 29.802 43.686 1.00 18.83 ? 76 ASN A CG 1 ATOM 558 O OD1 . ASN A 1 76 ? 73.891 30.348 42.621 1.00 24.74 ? 76 ASN A OD1 1 ATOM 559 N ND2 . ASN A 1 76 ? 74.469 30.486 44.778 1.00 22.25 ? 76 ASN A ND2 1 ATOM 560 N N . PHE A 1 77 ? 72.302 25.306 43.532 1.00 10.59 ? 77 PHE A N 1 ATOM 561 C CA . PHE A 1 77 ? 72.444 23.886 43.220 1.00 11.16 ? 77 PHE A CA 1 ATOM 562 C C . PHE A 1 77 ? 71.901 23.741 41.793 1.00 14.14 ? 77 PHE A C 1 ATOM 563 O O . PHE A 1 77 ? 70.982 24.471 41.415 1.00 13.36 ? 77 PHE A O 1 ATOM 564 C CB . PHE A 1 77 ? 71.601 23.016 44.163 1.00 10.92 ? 77 PHE A CB 1 ATOM 565 C CG . PHE A 1 77 ? 72.063 23.026 45.595 1.00 13.47 ? 77 PHE A CG 1 ATOM 566 C CD1 . PHE A 1 77 ? 73.377 23.354 45.931 1.00 10.30 ? 77 PHE A CD1 1 ATOM 567 C CD2 . PHE A 1 77 ? 71.174 22.697 46.618 1.00 12.85 ? 77 PHE A CD2 1 ATOM 568 C CE1 . PHE A 1 77 ? 73.802 23.352 47.272 1.00 14.26 ? 77 PHE A CE1 1 ATOM 569 C CE2 . PHE A 1 77 ? 71.591 22.692 47.960 1.00 13.57 ? 77 PHE A CE2 1 ATOM 570 C CZ . PHE A 1 77 ? 72.903 23.023 48.282 1.00 11.25 ? 77 PHE A CZ 1 ATOM 571 N N . SER A 1 78 ? 72.444 22.803 41.021 1.00 15.53 ? 78 SER A N 1 ATOM 572 C CA . SER A 1 78 ? 72.003 22.572 39.643 1.00 16.73 ? 78 SER A CA 1 ATOM 573 C C . SER A 1 78 ? 70.491 22.448 39.546 1.00 14.56 ? 78 SER A C 1 ATOM 574 O O . SER A 1 78 ? 69.849 23.200 38.820 1.00 17.07 ? 78 SER A O 1 ATOM 575 C CB . SER A 1 78 ? 72.622 21.294 39.070 1.00 15.41 ? 78 SER A CB 1 ATOM 576 O OG . SER A 1 78 ? 74.025 21.406 38.950 1.00 24.75 ? 78 SER A OG 1 ATOM 577 N N . ALA A 1 79 ? 69.931 21.520 40.317 1.00 13.51 ? 79 ALA A N 1 ATOM 578 C CA . ALA A 1 79 ? 68.494 21.262 40.329 1.00 10.25 ? 79 ALA A CA 1 ATOM 579 C C . ALA A 1 79 ? 67.617 22.454 40.677 1.00 10.81 ? 79 ALA A C 1 ATOM 580 O O . ALA A 1 79 ? 66.399 22.385 40.526 1.00 11.18 ? 79 ALA A O 1 ATOM 581 C CB . ALA A 1 79 ? 68.180 20.095 41.255 1.00 7.91 ? 79 ALA A CB 1 ATOM 582 N N . ASN A 1 80 ? 68.220 23.546 41.143 1.00 10.36 ? 80 ASN A N 1 ATOM 583 C CA . ASN A 1 80 ? 67.452 24.735 41.506 1.00 10.44 ? 80 ASN A CA 1 ATOM 584 C C . ASN A 1 80 ? 67.645 25.882 40.514 1.00 9.51 ? 80 ASN A C 1 ATOM 585 O O . ASN A 1 80 ? 67.199 27.002 40.758 1.00 8.43 ? 80 ASN A O 1 ATOM 586 C CB . ASN A 1 80 ? 67.808 25.193 42.934 1.00 10.80 ? 80 ASN A CB 1 ATOM 587 C CG . ASN A 1 80 ? 67.219 24.281 44.004 1.00 12.27 ? 80 ASN A CG 1 ATOM 588 O OD1 . ASN A 1 80 ? 66.037 23.946 43.965 1.00 11.76 ? 80 ASN A OD1 1 ATOM 589 N ND2 . ASN A 1 80 ? 68.042 23.880 44.960 1.00 11.92 ? 80 ASN A ND2 1 ATOM 590 N N . ASN A 1 81 ? 68.281 25.590 39.383 1.00 10.79 ? 81 ASN A N 1 ATOM 591 C CA . ASN A 1 81 ? 68.539 26.594 38.344 1.00 10.41 ? 81 ASN A CA 1 ATOM 592 C C . ASN A 1 81 ? 67.290 27.397 37.964 1.00 10.98 ? 81 ASN A C 1 ATOM 593 O O . ASN A 1 81 ? 66.267 26.825 37.576 1.00 10.25 ? 81 ASN A O 1 ATOM 594 C CB . ASN A 1 81 ? 69.124 25.916 37.105 1.00 13.24 ? 81 ASN A CB 1 ATOM 595 C CG . ASN A 1 81 ? 69.757 26.899 36.147 1.00 19.82 ? 81 ASN A CG 1 ATOM 596 O OD1 . ASN A 1 81 ? 69.827 28.102 36.415 1.00 24.39 ? 81 ASN A OD1 1 ATOM 597 N ND2 . ASN A 1 81 ? 70.235 26.394 35.019 1.00 21.38 ? 81 ASN A ND2 1 ATOM 598 N N . GLY A 1 82 ? 67.373 28.717 38.100 1.00 9.95 ? 82 GLY A N 1 ATOM 599 C CA . GLY A 1 82 ? 66.241 29.574 37.788 1.00 10.34 ? 82 GLY A CA 1 ATOM 600 C C . GLY A 1 82 ? 65.373 29.952 38.982 1.00 11.66 ? 82 GLY A C 1 ATOM 601 O O . GLY A 1 82 ? 64.492 30.801 38.855 1.00 9.31 ? 82 GLY A O 1 ATOM 602 N N . ILE A 1 83 ? 65.632 29.362 40.152 1.00 13.42 ? 83 ILE A N 1 ATOM 603 C CA . ILE A 1 83 ? 64.836 29.662 41.350 1.00 12.03 ? 83 ILE A CA 1 ATOM 604 C C . ILE A 1 83 ? 65.184 31.041 41.933 1.00 9.43 ? 83 ILE A C 1 ATOM 605 O O . ILE A 1 83 ? 64.380 31.651 42.642 1.00 7.85 ? 83 ILE A O 1 ATOM 606 C CB . ILE A 1 83 ? 64.998 28.544 42.433 1.00 15.38 ? 83 ILE A CB 1 ATOM 607 C CG1 . ILE A 1 83 ? 63.724 28.412 43.266 1.00 14.80 ? 83 ILE A CG1 1 ATOM 608 C CG2 . ILE A 1 83 ? 66.164 28.846 43.362 1.00 15.61 ? 83 ILE A CG2 1 ATOM 609 C CD1 . ILE A 1 83 ? 62.604 27.670 42.573 1.00 13.73 ? 83 ILE A CD1 1 ATOM 610 N N . ASP A 1 84 ? 66.356 31.554 41.566 1.00 9.25 ? 84 ASP A N 1 ATOM 611 C CA . ASP A 1 84 ? 66.826 32.851 42.048 1.00 10.81 ? 84 ASP A CA 1 ATOM 612 C C . ASP A 1 84 ? 65.854 33.996 41.836 1.00 15.08 ? 84 ASP A C 1 ATOM 613 O O . ASP A 1 84 ? 65.717 34.865 42.699 1.00 14.64 ? 84 ASP A O 1 ATOM 614 C CB . ASP A 1 84 ? 68.200 33.212 41.449 1.00 14.26 ? 84 ASP A CB 1 ATOM 615 C CG . ASP A 1 84 ? 68.221 33.205 39.914 1.00 17.66 ? 84 ASP A CG 1 ATOM 616 O OD1 . ASP A 1 84 ? 67.271 32.715 39.277 1.00 20.77 ? 84 ASP A OD1 1 ATOM 617 O OD2 . ASP A 1 84 ? 69.219 33.680 39.333 1.00 20.90 ? 84 ASP A OD2 1 ATOM 618 N N . ASP A 1 85 ? 65.141 33.973 40.713 1.00 12.95 ? 85 ASP A N 1 ATOM 619 C CA . ASP A 1 85 ? 64.192 35.033 40.403 1.00 10.30 ? 85 ASP A CA 1 ATOM 620 C C . ASP A 1 85 ? 63.068 35.145 41.423 1.00 7.88 ? 85 ASP A C 1 ATOM 621 O O . ASP A 1 85 ? 62.731 36.244 41.841 1.00 10.11 ? 85 ASP A O 1 ATOM 622 C CB . ASP A 1 85 ? 63.614 34.858 38.991 1.00 14.41 ? 85 ASP A CB 1 ATOM 623 C CG . ASP A 1 85 ? 64.659 35.036 37.895 1.00 17.43 ? 85 ASP A CG 1 ATOM 624 O OD1 . ASP A 1 85 ? 65.426 36.027 37.930 1.00 19.70 ? 85 ASP A OD1 1 ATOM 625 O OD2 . ASP A 1 85 ? 64.718 34.174 36.993 1.00 26.46 ? 85 ASP A OD2 1 ATOM 626 N N . SER A 1 86 ? 62.480 34.024 41.826 1.00 7.69 ? 86 SER A N 1 ATOM 627 C CA . SER A 1 86 ? 61.391 34.066 42.807 1.00 5.73 ? 86 SER A CA 1 ATOM 628 C C . SER A 1 86 ? 61.896 34.497 44.184 1.00 7.90 ? 86 SER A C 1 ATOM 629 O O . SER A 1 86 ? 61.218 35.254 44.896 1.00 7.72 ? 86 SER A O 1 ATOM 630 C CB . SER A 1 86 ? 60.690 32.718 42.908 1.00 3.61 ? 86 SER A CB 1 ATOM 631 O OG . SER A 1 86 ? 61.603 31.669 43.166 1.00 7.35 ? 86 SER A OG 1 ATOM 632 N N . VAL A 1 87 ? 63.093 34.023 44.539 1.00 8.34 ? 87 VAL A N 1 ATOM 633 C CA . VAL A 1 87 ? 63.724 34.353 45.816 1.00 7.46 ? 87 VAL A CA 1 ATOM 634 C C . VAL A 1 87 ? 63.920 35.864 45.923 1.00 7.01 ? 87 VAL A C 1 ATOM 635 O O . VAL A 1 87 ? 63.425 36.494 46.864 1.00 9.47 ? 87 VAL A O 1 ATOM 636 C CB . VAL A 1 87 ? 65.080 33.607 45.983 1.00 5.36 ? 87 VAL A CB 1 ATOM 637 C CG1 . VAL A 1 87 ? 65.837 34.106 47.224 1.00 8.32 ? 87 VAL A CG1 1 ATOM 638 C CG2 . VAL A 1 87 ? 64.828 32.121 46.116 1.00 6.55 ? 87 VAL A CG2 1 ATOM 639 N N . ASN A 1 88 ? 64.586 36.452 44.930 1.00 8.45 ? 88 ASN A N 1 ATOM 640 C CA . ASN A 1 88 ? 64.827 37.891 44.909 1.00 8.23 ? 88 ASN A CA 1 ATOM 641 C C . ASN A 1 88 ? 63.554 38.724 44.897 1.00 8.60 ? 88 ASN A C 1 ATOM 642 O O . ASN A 1 88 ? 63.542 39.850 45.406 1.00 6.45 ? 88 ASN A O 1 ATOM 643 C CB . ASN A 1 88 ? 65.726 38.262 43.732 1.00 10.19 ? 88 ASN A CB 1 ATOM 644 C CG . ASN A 1 88 ? 67.130 37.723 43.890 1.00 17.13 ? 88 ASN A CG 1 ATOM 645 O OD1 . ASN A 1 88 ? 67.602 37.529 45.014 1.00 18.80 ? 88 ASN A OD1 1 ATOM 646 N ND2 . ASN A 1 88 ? 67.813 37.485 42.779 1.00 18.95 ? 88 ASN A ND2 1 ATOM 647 N N . ASN A 1 89 ? 62.483 38.184 44.315 1.00 8.03 ? 89 ASN A N 1 ATOM 648 C CA . ASN A 1 89 ? 61.203 38.888 44.269 1.00 9.60 ? 89 ASN A CA 1 ATOM 649 C C . ASN A 1 89 ? 60.490 38.857 45.630 1.00 11.10 ? 89 ASN A C 1 ATOM 650 O O . ASN A 1 89 ? 59.727 39.766 45.956 1.00 11.52 ? 89 ASN A O 1 ATOM 651 C CB . ASN A 1 89 ? 60.277 38.262 43.206 1.00 12.31 ? 89 ASN A CB 1 ATOM 652 C CG . ASN A 1 89 ? 60.303 39.014 41.873 1.00 11.45 ? 89 ASN A CG 1 ATOM 653 O OD1 . ASN A 1 89 ? 61.033 39.986 41.700 1.00 12.74 ? 89 ASN A OD1 1 ATOM 654 N ND2 . ASN A 1 89 ? 59.495 38.555 40.922 1.00 12.84 ? 89 ASN A ND2 1 ATOM 655 N N . LEU A 1 90 ? 60.748 37.818 46.425 1.00 10.60 ? 90 LEU A N 1 ATOM 656 C CA . LEU A 1 90 ? 60.106 37.666 47.739 1.00 10.93 ? 90 LEU A CA 1 ATOM 657 C C . LEU A 1 90 ? 60.846 38.283 48.937 1.00 11.38 ? 90 LEU A C 1 ATOM 658 O O . LEU A 1 90 ? 60.220 38.684 49.923 1.00 9.07 ? 90 LEU A O 1 ATOM 659 C CB . LEU A 1 90 ? 59.828 36.191 48.011 1.00 9.07 ? 90 LEU A CB 1 ATOM 660 C CG . LEU A 1 90 ? 58.373 35.733 48.007 1.00 13.53 ? 90 LEU A CG 1 ATOM 661 C CD1 . LEU A 1 90 ? 57.582 36.356 46.851 1.00 11.28 ? 90 LEU A CD1 1 ATOM 662 C CD2 . LEU A 1 90 ? 58.337 34.228 47.954 1.00 9.13 ? 90 LEU A CD2 1 ATOM 663 N N . ILE A 1 91 ? 62.167 38.357 48.852 1.00 12.39 ? 91 ILE A N 1 ATOM 664 C CA . ILE A 1 91 ? 62.978 38.930 49.931 1.00 13.58 ? 91 ILE A CA 1 ATOM 665 C C . ILE A 1 91 ? 62.490 40.307 50.414 1.00 15.77 ? 91 ILE A C 1 ATOM 666 O O . ILE A 1 91 ? 62.367 40.529 51.621 1.00 14.04 ? 91 ILE A O 1 ATOM 667 C CB . ILE A 1 91 ? 64.478 38.928 49.562 1.00 13.18 ? 91 ILE A CB 1 ATOM 668 C CG1 . ILE A 1 91 ? 65.003 37.495 49.665 1.00 11.94 ? 91 ILE A CG1 1 ATOM 669 C CG2 . ILE A 1 91 ? 65.278 39.877 50.464 1.00 16.11 ? 91 ILE A CG2 1 ATOM 670 C CD1 . ILE A 1 91 ? 66.422 37.314 49.269 1.00 9.28 ? 91 ILE A CD1 1 ATOM 671 N N . PRO A 1 92 ? 62.135 41.223 49.486 1.00 16.25 ? 92 PRO A N 1 ATOM 672 C CA . PRO A 1 92 ? 61.664 42.539 49.934 1.00 14.63 ? 92 PRO A CA 1 ATOM 673 C C . PRO A 1 92 ? 60.441 42.489 50.850 1.00 15.55 ? 92 PRO A C 1 ATOM 674 O O . PRO A 1 92 ? 60.295 43.330 51.739 1.00 16.74 ? 92 PRO A O 1 ATOM 675 C CB . PRO A 1 92 ? 61.359 43.251 48.622 1.00 15.70 ? 92 PRO A CB 1 ATOM 676 C CG . PRO A 1 92 ? 62.419 42.704 47.722 1.00 16.53 ? 92 PRO A CG 1 ATOM 677 C CD . PRO A 1 92 ? 62.362 41.227 48.029 1.00 16.02 ? 92 PRO A CD 1 ATOM 678 N N . PHE A 1 93 ? 59.568 41.508 50.649 1.00 16.59 ? 93 PHE A N 1 ATOM 679 C CA . PHE A 1 93 ? 58.377 41.390 51.486 1.00 16.08 ? 93 PHE A CA 1 ATOM 680 C C . PHE A 1 93 ? 58.745 40.875 52.865 1.00 16.54 ? 93 PHE A C 1 ATOM 681 O O . PHE A 1 93 ? 58.110 41.239 53.851 1.00 17.86 ? 93 PHE A O 1 ATOM 682 C CB . PHE A 1 93 ? 57.327 40.482 50.840 1.00 15.67 ? 93 PHE A CB 1 ATOM 683 C CG . PHE A 1 93 ? 56.742 41.043 49.571 1.00 16.46 ? 93 PHE A CG 1 ATOM 684 C CD1 . PHE A 1 93 ? 55.626 41.874 49.614 1.00 16.07 ? 93 PHE A CD1 1 ATOM 685 C CD2 . PHE A 1 93 ? 57.317 40.756 48.332 1.00 16.31 ? 93 PHE A CD2 1 ATOM 686 C CE1 . PHE A 1 93 ? 55.091 42.412 48.445 1.00 15.94 ? 93 PHE A CE1 1 ATOM 687 C CE2 . PHE A 1 93 ? 56.785 41.294 47.154 1.00 13.06 ? 93 PHE A CE2 1 ATOM 688 C CZ . PHE A 1 93 ? 55.675 42.120 47.213 1.00 14.77 ? 93 PHE A CZ 1 ATOM 689 N N . MET A 1 94 ? 59.771 40.032 52.927 1.00 17.51 ? 94 MET A N 1 ATOM 690 C CA . MET A 1 94 ? 60.244 39.477 54.193 1.00 19.65 ? 94 MET A CA 1 ATOM 691 C C . MET A 1 94 ? 60.672 40.622 55.091 1.00 20.14 ? 94 MET A C 1 ATOM 692 O O . MET A 1 94 ? 60.238 40.731 56.242 1.00 22.48 ? 94 MET A O 1 ATOM 693 C CB . MET A 1 94 ? 61.434 38.540 53.949 1.00 18.99 ? 94 MET A CB 1 ATOM 694 C CG . MET A 1 94 ? 62.117 38.024 55.209 1.00 16.09 ? 94 MET A CG 1 ATOM 695 S SD . MET A 1 94 ? 63.374 36.798 54.863 1.00 16.75 ? 94 MET A SD 1 ATOM 696 C CE . MET A 1 94 ? 64.728 37.800 54.359 1.00 13.06 ? 94 MET A CE 1 ATOM 697 N N . GLN A 1 95 ? 61.487 41.501 54.525 1.00 20.60 ? 95 GLN A N 1 ATOM 698 C CA . GLN A 1 95 ? 62.007 42.657 55.234 1.00 23.97 ? 95 GLN A CA 1 ATOM 699 C C . GLN A 1 95 ? 60.914 43.644 55.625 1.00 26.34 ? 95 GLN A C 1 ATOM 700 O O . GLN A 1 95 ? 61.004 44.290 56.667 1.00 28.49 ? 95 GLN A O 1 ATOM 701 C CB . GLN A 1 95 ? 63.053 43.366 54.371 1.00 23.22 ? 95 GLN A CB 1 ATOM 702 C CG . GLN A 1 95 ? 64.216 42.470 53.962 1.00 23.75 ? 95 GLN A CG 1 ATOM 703 C CD . GLN A 1 95 ? 65.205 43.152 53.035 1.00 25.53 ? 95 GLN A CD 1 ATOM 704 O OE1 . GLN A 1 95 ? 66.322 42.677 52.852 1.00 25.89 ? 95 GLN A OE1 1 ATOM 705 N NE2 . GLN A 1 95 ? 64.794 44.262 52.433 1.00 26.88 ? 95 GLN A NE2 1 ATOM 706 N N . LYS A 1 96 ? 59.892 43.765 54.785 1.00 27.48 ? 96 LYS A N 1 ATOM 707 C CA . LYS A 1 96 ? 58.800 44.698 55.035 1.00 27.77 ? 96 LYS A CA 1 ATOM 708 C C . LYS A 1 96 ? 57.800 44.167 56.057 1.00 28.36 ? 96 LYS A C 1 ATOM 709 O O . LYS A 1 96 ? 57.634 44.743 57.128 1.00 28.87 ? 96 LYS A O 1 ATOM 710 C CB . LYS A 1 96 ? 58.091 45.041 53.721 1.00 30.32 ? 96 LYS A CB 1 ATOM 711 C CG . LYS A 1 96 ? 57.101 46.182 53.842 1.00 33.62 ? 96 LYS A CG 1 ATOM 712 C CD . LYS A 1 96 ? 56.357 46.425 52.547 1.00 37.72 ? 96 LYS A CD 1 ATOM 713 C CE . LYS A 1 96 ? 55.316 47.517 52.726 1.00 39.14 ? 96 LYS A CE 1 ATOM 714 N NZ . LYS A 1 96 ? 54.500 47.738 51.497 1.00 40.09 ? 96 LYS A NZ 1 ATOM 715 N N . HIS A 1 97 ? 57.125 43.075 55.715 1.00 27.71 ? 97 HIS A N 1 ATOM 716 C CA . HIS A 1 97 ? 56.139 42.450 56.598 1.00 26.35 ? 97 HIS A CA 1 ATOM 717 C C . HIS A 1 97 ? 56.906 41.569 57.582 1.00 26.21 ? 97 HIS A C 1 ATOM 718 O O . HIS A 1 97 ? 56.749 40.345 57.620 1.00 23.30 ? 97 HIS A O 1 ATOM 719 C CB . HIS A 1 97 ? 55.136 41.637 55.763 1.00 24.69 ? 97 HIS A CB 1 ATOM 720 C CG . HIS A 1 97 ? 54.406 42.460 54.746 1.00 26.00 ? 97 HIS A CG 1 ATOM 721 N ND1 . HIS A 1 97 ? 53.176 43.032 54.992 1.00 23.76 ? 97 HIS A ND1 1 ATOM 722 C CD2 . HIS A 1 97 ? 54.751 42.847 53.493 1.00 23.87 ? 97 HIS A CD2 1 ATOM 723 C CE1 . HIS A 1 97 ? 52.795 43.735 53.940 1.00 22.00 ? 97 HIS A CE1 1 ATOM 724 N NE2 . HIS A 1 97 ? 53.734 43.639 53.018 1.00 23.52 ? 97 HIS A NE2 1 ATOM 725 N N . ASN A 1 98 ? 57.714 42.232 58.407 1.00 28.42 ? 98 ASN A N 1 ATOM 726 C CA . ASN A 1 98 ? 58.578 41.591 59.387 1.00 29.40 ? 98 ASN A CA 1 ATOM 727 C C . ASN A 1 98 ? 57.969 40.916 60.619 1.00 28.82 ? 98 ASN A C 1 ATOM 728 O O . ASN A 1 98 ? 58.670 40.678 61.599 1.00 31.78 ? 98 ASN A O 1 ATOM 729 C CB . ASN A 1 98 ? 59.684 42.558 59.817 1.00 32.51 ? 98 ASN A CB 1 ATOM 730 C CG . ASN A 1 98 ? 59.149 43.773 60.555 1.00 34.44 ? 98 ASN A CG 1 ATOM 731 O OD1 . ASN A 1 98 ? 57.941 44.027 60.589 1.00 36.72 ? 98 ASN A OD1 1 ATOM 732 N ND2 . ASN A 1 98 ? 60.053 44.534 61.151 1.00 37.03 ? 98 ASN A ND2 1 ATOM 733 N N . THR A 1 99 ? 56.671 40.636 60.603 1.00 26.77 ? 99 THR A N 1 ATOM 734 C CA . THR A 1 99 ? 56.066 39.918 61.724 1.00 24.29 ? 99 THR A CA 1 ATOM 735 C C . THR A 1 99 ? 55.727 38.503 61.244 1.00 22.75 ? 99 THR A C 1 ATOM 736 O O . THR A 1 99 ? 55.297 37.651 62.025 1.00 23.52 ? 99 THR A O 1 ATOM 737 C CB . THR A 1 99 ? 54.793 40.613 62.264 1.00 24.66 ? 99 THR A CB 1 ATOM 738 O OG1 . THR A 1 99 ? 53.741 40.546 61.293 1.00 24.98 ? 99 THR A OG1 1 ATOM 739 C CG2 . THR A 1 99 ? 55.082 42.068 62.601 1.00 26.51 ? 99 THR A CG2 1 ATOM 740 N N . ILE A 1 100 ? 55.935 38.266 59.947 1.00 20.42 ? 100 ILE A N 1 ATOM 741 C CA . ILE A 1 100 ? 55.663 36.984 59.303 1.00 15.28 ? 100 ILE A CA 1 ATOM 742 C C . ILE A 1 100 ? 56.993 36.344 58.914 1.00 12.66 ? 100 ILE A C 1 ATOM 743 O O . ILE A 1 100 ? 57.846 36.997 58.318 1.00 11.77 ? 100 ILE A O 1 ATOM 744 C CB . ILE A 1 100 ? 54.772 37.209 58.054 1.00 17.48 ? 100 ILE A CB 1 ATOM 745 C CG1 . ILE A 1 100 ? 53.378 37.663 58.505 1.00 17.26 ? 100 ILE A CG1 1 ATOM 746 C CG2 . ILE A 1 100 ? 54.722 35.954 57.179 1.00 12.55 ? 100 ILE A CG2 1 ATOM 747 C CD1 . ILE A 1 100 ? 52.549 38.307 57.422 1.00 21.23 ? 100 ILE A CD1 1 ATOM 748 N N . SER A 1 101 ? 57.167 35.071 59.260 1.00 12.43 ? 101 SER A N 1 ATOM 749 C CA . SER A 1 101 ? 58.403 34.349 58.971 1.00 11.83 ? 101 SER A CA 1 ATOM 750 C C . SER A 1 101 ? 58.603 34.064 57.484 1.00 14.93 ? 101 SER A C 1 ATOM 751 O O . SER A 1 101 ? 57.632 33.959 56.726 1.00 15.11 ? 101 SER A O 1 ATOM 752 C CB . SER A 1 101 ? 58.436 33.035 59.757 1.00 10.93 ? 101 SER A CB 1 ATOM 753 O OG . SER A 1 101 ? 57.327 32.214 59.434 1.00 11.65 ? 101 SER A OG 1 ATOM 754 N N . ALA A 1 102 ? 59.860 33.883 57.086 1.00 13.53 ? 102 ALA A N 1 ATOM 755 C CA . ALA A 1 102 ? 60.202 33.592 55.699 1.00 13.86 ? 102 ALA A CA 1 ATOM 756 C C . ALA A 1 102 ? 59.453 32.346 55.205 1.00 14.91 ? 102 ALA A C 1 ATOM 757 O O . ALA A 1 102 ? 58.991 32.312 54.064 1.00 15.86 ? 102 ALA A O 1 ATOM 758 C CB . ALA A 1 102 ? 61.700 33.404 55.559 1.00 10.71 ? 102 ALA A CB 1 ATOM 759 N N . ALA A 1 103 ? 59.300 31.352 56.081 1.00 11.84 ? 103 ALA A N 1 ATOM 760 C CA . ALA A 1 103 ? 58.601 30.112 55.750 1.00 10.94 ? 103 ALA A CA 1 ATOM 761 C C . ALA A 1 103 ? 57.102 30.319 55.505 1.00 13.54 ? 103 ALA A C 1 ATOM 762 O O . ALA A 1 103 ? 56.534 29.767 54.553 1.00 10.83 ? 103 ALA A O 1 ATOM 763 C CB . ALA A 1 103 ? 58.812 29.090 56.842 1.00 11.23 ? 103 ALA A CB 1 ATOM 764 N N . ASP A 1 104 ? 56.461 31.101 56.372 1.00 11.38 ? 104 ASP A N 1 ATOM 765 C CA . ASP A 1 104 ? 55.035 31.381 56.233 1.00 11.14 ? 104 ASP A CA 1 ATOM 766 C C . ASP A 1 104 ? 54.817 32.161 54.939 1.00 11.76 ? 104 ASP A C 1 ATOM 767 O O . ASP A 1 104 ? 53.892 31.879 54.179 1.00 11.46 ? 104 ASP A O 1 ATOM 768 C CB . ASP A 1 104 ? 54.523 32.212 57.418 1.00 7.99 ? 104 ASP A CB 1 ATOM 769 C CG . ASP A 1 104 ? 54.094 31.363 58.606 1.00 8.82 ? 104 ASP A CG 1 ATOM 770 O OD1 . ASP A 1 104 ? 54.366 30.141 58.641 1.00 8.77 ? 104 ASP A OD1 1 ATOM 771 O OD2 . ASP A 1 104 ? 53.460 31.929 59.518 1.00 10.15 ? 104 ASP A OD2 1 ATOM 772 N N . LEU A 1 105 ? 55.692 33.132 54.704 1.00 11.83 ? 105 LEU A N 1 ATOM 773 C CA . LEU A 1 105 ? 55.654 33.978 53.520 1.00 11.79 ? 105 LEU A CA 1 ATOM 774 C C . LEU A 1 105 ? 55.653 33.149 52.235 1.00 11.45 ? 105 LEU A C 1 ATOM 775 O O . LEU A 1 105 ? 54.806 33.350 51.368 1.00 12.35 ? 105 LEU A O 1 ATOM 776 C CB . LEU A 1 105 ? 56.855 34.921 53.526 1.00 9.14 ? 105 LEU A CB 1 ATOM 777 C CG . LEU A 1 105 ? 57.116 35.775 52.284 1.00 9.32 ? 105 LEU A CG 1 ATOM 778 C CD1 . LEU A 1 105 ? 55.942 36.700 52.009 1.00 7.25 ? 105 LEU A CD1 1 ATOM 779 C CD2 . LEU A 1 105 ? 58.397 36.571 52.481 1.00 10.36 ? 105 LEU A CD2 1 ATOM 780 N N . VAL A 1 106 ? 56.588 32.213 52.133 1.00 11.23 ? 106 VAL A N 1 ATOM 781 C CA . VAL A 1 106 ? 56.708 31.354 50.963 1.00 10.89 ? 106 VAL A CA 1 ATOM 782 C C . VAL A 1 106 ? 55.420 30.593 50.664 1.00 12.63 ? 106 VAL A C 1 ATOM 783 O O . VAL A 1 106 ? 54.928 30.623 49.530 1.00 12.92 ? 106 VAL A O 1 ATOM 784 C CB . VAL A 1 106 ? 57.885 30.357 51.118 1.00 10.36 ? 106 VAL A CB 1 ATOM 785 C CG1 . VAL A 1 106 ? 57.854 29.297 50.022 1.00 8.69 ? 106 VAL A CG1 1 ATOM 786 C CG2 . VAL A 1 106 ? 59.200 31.104 51.060 1.00 7.71 ? 106 VAL A CG2 1 ATOM 787 N N . GLN A 1 107 ? 54.863 29.932 51.676 1.00 12.10 ? 107 GLN A N 1 ATOM 788 C CA . GLN A 1 107 ? 53.638 29.166 51.489 1.00 10.98 ? 107 GLN A CA 1 ATOM 789 C C . GLN A 1 107 ? 52.423 30.029 51.184 1.00 12.96 ? 107 GLN A C 1 ATOM 790 O O . GLN A 1 107 ? 51.606 29.679 50.324 1.00 13.61 ? 107 GLN A O 1 ATOM 791 C CB . GLN A 1 107 ? 53.349 28.272 52.693 1.00 9.88 ? 107 GLN A CB 1 ATOM 792 C CG . GLN A 1 107 ? 54.394 27.200 52.949 1.00 9.11 ? 107 GLN A CG 1 ATOM 793 C CD . GLN A 1 107 ? 54.693 26.327 51.736 1.00 8.90 ? 107 GLN A CD 1 ATOM 794 O OE1 . GLN A 1 107 ? 55.853 26.163 51.352 1.00 11.42 ? 107 GLN A OE1 1 ATOM 795 N NE2 . GLN A 1 107 ? 53.659 25.764 51.137 1.00 4.85 ? 107 GLN A NE2 1 ATOM 796 N N . PHE A 1 108 ? 52.299 31.155 51.874 1.00 11.31 ? 108 PHE A N 1 ATOM 797 C CA . PHE A 1 108 ? 51.166 32.035 51.652 1.00 11.42 ? 108 PHE A CA 1 ATOM 798 C C . PHE A 1 108 ? 51.221 32.612 50.239 1.00 12.52 ? 108 PHE A C 1 ATOM 799 O O . PHE A 1 108 ? 50.200 32.649 49.549 1.00 16.15 ? 108 PHE A O 1 ATOM 800 C CB . PHE A 1 108 ? 51.122 33.164 52.692 1.00 7.60 ? 108 PHE A CB 1 ATOM 801 C CG . PHE A 1 108 ? 49.870 33.998 52.629 1.00 4.05 ? 108 PHE A CG 1 ATOM 802 C CD1 . PHE A 1 108 ? 48.633 33.445 52.939 1.00 4.81 ? 108 PHE A CD1 1 ATOM 803 C CD2 . PHE A 1 108 ? 49.923 35.321 52.244 1.00 4.38 ? 108 PHE A CD2 1 ATOM 804 C CE1 . PHE A 1 108 ? 47.476 34.204 52.860 1.00 7.04 ? 108 PHE A CE1 1 ATOM 805 C CE2 . PHE A 1 108 ? 48.767 36.090 52.161 1.00 6.86 ? 108 PHE A CE2 1 ATOM 806 C CZ . PHE A 1 108 ? 47.545 35.532 52.469 1.00 4.66 ? 108 PHE A CZ 1 ATOM 807 N N . ALA A 1 109 ? 52.406 33.058 49.823 1.00 10.72 ? 109 ALA A N 1 ATOM 808 C CA . ALA A 1 109 ? 52.601 33.626 48.495 1.00 11.25 ? 109 ALA A CA 1 ATOM 809 C C . ALA A 1 109 ? 52.116 32.648 47.416 1.00 12.53 ? 109 ALA A C 1 ATOM 810 O O . ALA A 1 109 ? 51.391 33.044 46.504 1.00 12.16 ? 109 ALA A O 1 ATOM 811 C CB . ALA A 1 109 ? 54.053 33.985 48.276 1.00 8.08 ? 109 ALA A CB 1 ATOM 812 N N . GLY A 1 110 ? 52.484 31.377 47.551 1.00 11.52 ? 110 GLY A N 1 ATOM 813 C CA . GLY A 1 110 ? 52.059 30.366 46.595 1.00 11.24 ? 110 GLY A CA 1 ATOM 814 C C . GLY A 1 110 ? 50.546 30.204 46.569 1.00 13.75 ? 110 GLY A C 1 ATOM 815 O O . GLY A 1 110 ? 49.958 29.967 45.508 1.00 14.67 ? 110 GLY A O 1 ATOM 816 N N . ALA A 1 111 ? 49.908 30.323 47.734 1.00 12.14 ? 111 ALA A N 1 ATOM 817 C CA . ALA A 1 111 ? 48.454 30.204 47.834 1.00 10.98 ? 111 ALA A CA 1 ATOM 818 C C . ALA A 1 111 ? 47.770 31.378 47.127 1.00 12.12 ? 111 ALA A C 1 ATOM 819 O O . ALA A 1 111 ? 46.737 31.211 46.462 1.00 11.45 ? 111 ALA A O 1 ATOM 820 C CB . ALA A 1 111 ? 48.024 30.132 49.301 1.00 10.72 ? 111 ALA A CB 1 ATOM 821 N N . VAL A 1 112 ? 48.353 32.563 47.275 1.00 10.56 ? 112 VAL A N 1 ATOM 822 C CA . VAL A 1 112 ? 47.844 33.782 46.654 1.00 11.81 ? 112 VAL A CA 1 ATOM 823 C C . VAL A 1 112 ? 48.032 33.710 45.129 1.00 12.04 ? 112 VAL A C 1 ATOM 824 O O . VAL A 1 112 ? 47.102 33.997 44.364 1.00 10.23 ? 112 VAL A O 1 ATOM 825 C CB . VAL A 1 112 ? 48.579 35.026 47.208 1.00 12.41 ? 112 VAL A CB 1 ATOM 826 C CG1 . VAL A 1 112 ? 48.132 36.291 46.480 1.00 13.34 ? 112 VAL A CG1 1 ATOM 827 C CG2 . VAL A 1 112 ? 48.301 35.164 48.701 1.00 12.51 ? 112 VAL A CG2 1 ATOM 828 N N . ALA A 1 113 ? 49.232 33.310 44.708 1.00 10.13 ? 113 ALA A N 1 ATOM 829 C CA . ALA A 1 113 ? 49.578 33.183 43.293 1.00 11.77 ? 113 ALA A CA 1 ATOM 830 C C . ALA A 1 113 ? 48.604 32.239 42.582 1.00 13.30 ? 113 ALA A C 1 ATOM 831 O O . ALA A 1 113 ? 48.031 32.592 41.543 1.00 13.00 ? 113 ALA A O 1 ATOM 832 C CB . ALA A 1 113 ? 51.001 32.677 43.146 1.00 7.19 ? 113 ALA A CB 1 ATOM 833 N N . LEU A 1 114 ? 48.380 31.072 43.185 1.00 11.25 ? 114 LEU A N 1 ATOM 834 C CA . LEU A 1 114 ? 47.477 30.061 42.644 1.00 12.32 ? 114 LEU A CA 1 ATOM 835 C C . LEU A 1 114 ? 46.025 30.509 42.549 1.00 12.08 ? 114 LEU A C 1 ATOM 836 O O . LEU A 1 114 ? 45.290 30.048 41.672 1.00 12.28 ? 114 LEU A O 1 ATOM 837 C CB . LEU A 1 114 ? 47.544 28.780 43.478 1.00 14.13 ? 114 LEU A CB 1 ATOM 838 C CG . LEU A 1 114 ? 48.394 27.624 42.954 1.00 18.36 ? 114 LEU A CG 1 ATOM 839 C CD1 . LEU A 1 114 ? 48.694 26.634 44.075 1.00 21.75 ? 114 LEU A CD1 1 ATOM 840 C CD2 . LEU A 1 114 ? 47.671 26.945 41.799 1.00 15.57 ? 114 LEU A CD2 1 ATOM 841 N N . SER A 1 115 ? 45.602 31.395 43.446 1.00 9.92 ? 115 SER A N 1 ATOM 842 C CA . SER A 1 115 ? 44.221 31.855 43.429 1.00 12.41 ? 115 SER A CA 1 ATOM 843 C C . SER A 1 115 ? 43.924 32.726 42.196 1.00 11.23 ? 115 SER A C 1 ATOM 844 O O . SER A 1 115 ? 42.767 32.983 41.877 1.00 9.97 ? 115 SER A O 1 ATOM 845 C CB . SER A 1 115 ? 43.867 32.594 44.731 1.00 7.86 ? 115 SER A CB 1 ATOM 846 O OG . SER A 1 115 ? 44.310 33.943 44.710 1.00 14.86 ? 115 SER A OG 1 ATOM 847 N N . ASN A 1 116 ? 44.980 33.159 41.508 1.00 12.93 ? 116 ASN A N 1 ATOM 848 C CA . ASN A 1 116 ? 44.861 33.975 40.305 1.00 11.93 ? 116 ASN A CA 1 ATOM 849 C C . ASN A 1 116 ? 44.617 33.105 39.068 1.00 12.88 ? 116 ASN A C 1 ATOM 850 O O . ASN A 1 116 ? 44.369 33.626 37.980 1.00 11.46 ? 116 ASN A O 1 ATOM 851 C CB . ASN A 1 116 ? 46.143 34.776 40.062 1.00 8.79 ? 116 ASN A CB 1 ATOM 852 C CG . ASN A 1 116 ? 46.308 35.942 41.005 1.00 8.28 ? 116 ASN A CG 1 ATOM 853 O OD1 . ASN A 1 116 ? 45.349 36.428 41.610 1.00 11.43 ? 116 ASN A OD1 1 ATOM 854 N ND2 . ASN A 1 116 ? 47.532 36.433 41.107 1.00 6.26 ? 116 ASN A ND2 1 ATOM 855 N N . CYS A 1 117 ? 44.746 31.792 39.219 1.00 12.83 ? 117 CYS A N 1 ATOM 856 C CA . CYS A 1 117 ? 44.560 30.874 38.102 1.00 13.46 ? 117 CYS A CA 1 ATOM 857 C C . CYS A 1 117 ? 43.151 30.270 38.113 1.00 14.30 ? 117 CYS A C 1 ATOM 858 O O . CYS A 1 117 ? 42.780 29.546 39.042 1.00 14.08 ? 117 CYS A O 1 ATOM 859 C CB . CYS A 1 117 ? 45.632 29.777 38.142 1.00 14.92 ? 117 CYS A CB 1 ATOM 860 S SG . CYS A 1 117 ? 47.328 30.418 38.372 1.00 11.09 ? 117 CYS A SG 1 ATOM 861 N N . PRO A 1 118 ? 42.349 30.561 37.071 1.00 11.20 ? 118 PRO A N 1 ATOM 862 C CA . PRO A 1 118 ? 40.980 30.048 36.970 1.00 8.72 ? 118 PRO A CA 1 ATOM 863 C C . PRO A 1 118 ? 40.962 28.541 37.128 1.00 4.33 ? 118 PRO A C 1 ATOM 864 O O . PRO A 1 118 ? 41.783 27.847 36.535 1.00 4.77 ? 118 PRO A O 1 ATOM 865 C CB . PRO A 1 118 ? 40.555 30.477 35.560 1.00 10.81 ? 118 PRO A CB 1 ATOM 866 C CG . PRO A 1 118 ? 41.316 31.753 35.359 1.00 12.13 ? 118 PRO A CG 1 ATOM 867 C CD . PRO A 1 118 ? 42.689 31.393 35.904 1.00 12.29 ? 118 PRO A CD 1 ATOM 868 N N . GLY A 1 119 ? 40.050 28.041 37.955 1.00 4.73 ? 119 GLY A N 1 ATOM 869 C CA . GLY A 1 119 ? 39.967 26.609 38.180 1.00 4.44 ? 119 GLY A CA 1 ATOM 870 C C . GLY A 1 119 ? 40.792 26.099 39.360 1.00 5.89 ? 119 GLY A C 1 ATOM 871 O O . GLY A 1 119 ? 40.582 24.972 39.821 1.00 5.30 ? 119 GLY A O 1 ATOM 872 N N . ALA A 1 120 ? 41.739 26.896 39.844 1.00 5.95 ? 120 ALA A N 1 ATOM 873 C CA . ALA A 1 120 ? 42.565 26.468 40.981 1.00 8.66 ? 120 ALA A CA 1 ATOM 874 C C . ALA A 1 120 ? 41.750 26.410 42.274 1.00 8.67 ? 120 ALA A C 1 ATOM 875 O O . ALA A 1 120 ? 40.784 27.145 42.438 1.00 7.75 ? 120 ALA A O 1 ATOM 876 C CB . ALA A 1 120 ? 43.742 27.408 41.161 1.00 8.20 ? 120 ALA A CB 1 ATOM 877 N N . PRO A 1 121 ? 42.101 25.486 43.186 1.00 10.15 ? 121 PRO A N 1 ATOM 878 C CA . PRO A 1 121 ? 41.370 25.379 44.451 1.00 10.30 ? 121 PRO A CA 1 ATOM 879 C C . PRO A 1 121 ? 41.879 26.430 45.450 1.00 9.36 ? 121 PRO A C 1 ATOM 880 O O . PRO A 1 121 ? 42.914 27.069 45.218 1.00 7.74 ? 121 PRO A O 1 ATOM 881 C CB . PRO A 1 121 ? 41.710 23.961 44.912 1.00 11.38 ? 121 PRO A CB 1 ATOM 882 C CG . PRO A 1 121 ? 43.129 23.793 44.448 1.00 9.50 ? 121 PRO A CG 1 ATOM 883 C CD . PRO A 1 121 ? 43.101 24.409 43.056 1.00 11.90 ? 121 PRO A CD 1 ATOM 884 N N . ARG A 1 122 ? 41.093 26.674 46.497 1.00 8.91 ? 122 ARG A N 1 ATOM 885 C CA . ARG A 1 122 ? 41.464 27.613 47.557 1.00 8.50 ? 122 ARG A CA 1 ATOM 886 C C . ARG A 1 122 ? 42.265 26.782 48.559 1.00 6.44 ? 122 ARG A C 1 ATOM 887 O O . ARG A 1 122 ? 41.712 25.946 49.261 1.00 7.59 ? 122 ARG A O 1 ATOM 888 C CB . ARG A 1 122 ? 40.221 28.172 48.246 1.00 6.56 ? 122 ARG A CB 1 ATOM 889 C CG . ARG A 1 122 ? 40.481 29.437 49.043 1.00 9.27 ? 122 ARG A CG 1 ATOM 890 C CD . ARG A 1 122 ? 39.237 29.870 49.780 1.00 11.04 ? 122 ARG A CD 1 ATOM 891 N NE . ARG A 1 122 ? 39.428 31.139 50.475 1.00 14.94 ? 122 ARG A NE 1 ATOM 892 C CZ . ARG A 1 122 ? 38.530 31.671 51.299 1.00 19.44 ? 122 ARG A CZ 1 ATOM 893 N NH1 . ARG A 1 122 ? 37.383 31.042 51.525 1.00 23.72 ? 122 ARG A NH1 1 ATOM 894 N NH2 . ARG A 1 122 ? 38.781 32.819 51.917 1.00 20.83 ? 122 ARG A NH2 1 ATOM 895 N N . LEU A 1 123 ? 43.571 26.983 48.579 1.00 7.37 ? 123 LEU A N 1 ATOM 896 C CA . LEU A 1 123 ? 44.458 26.230 49.464 1.00 10.44 ? 123 LEU A CA 1 ATOM 897 C C . LEU A 1 123 ? 44.271 26.491 50.961 1.00 9.94 ? 123 LEU A C 1 ATOM 898 O O . LEU A 1 123 ? 43.870 27.586 51.379 1.00 8.96 ? 123 LEU A O 1 ATOM 899 C CB . LEU A 1 123 ? 45.907 26.514 49.086 1.00 7.53 ? 123 LEU A CB 1 ATOM 900 C CG . LEU A 1 123 ? 46.678 25.502 48.239 1.00 12.69 ? 123 LEU A CG 1 ATOM 901 C CD1 . LEU A 1 123 ? 45.804 24.805 47.200 1.00 8.93 ? 123 LEU A CD1 1 ATOM 902 C CD2 . LEU A 1 123 ? 47.851 26.210 47.610 1.00 10.89 ? 123 LEU A CD2 1 ATOM 903 N N . GLU A 1 124 ? 44.491 25.446 51.751 1.00 12.19 ? 124 GLU A N 1 ATOM 904 C CA . GLU A 1 124 ? 44.436 25.547 53.206 1.00 12.04 ? 124 GLU A CA 1 ATOM 905 C C . GLU A 1 124 ? 45.714 26.303 53.567 1.00 10.61 ? 124 GLU A C 1 ATOM 906 O O . GLU A 1 124 ? 46.746 26.116 52.914 1.00 11.72 ? 124 GLU A O 1 ATOM 907 C CB . GLU A 1 124 ? 44.481 24.138 53.824 1.00 13.37 ? 124 GLU A CB 1 ATOM 908 C CG . GLU A 1 124 ? 44.857 24.080 55.323 1.00 15.56 ? 124 GLU A CG 1 ATOM 909 C CD . GLU A 1 124 ? 45.013 22.651 55.840 1.00 13.95 ? 124 GLU A CD 1 ATOM 910 O OE1 . GLU A 1 124 ? 46.010 21.991 55.491 1.00 16.45 ? 124 GLU A OE1 1 ATOM 911 O OE2 . GLU A 1 124 ? 44.131 22.175 56.583 1.00 14.74 ? 124 GLU A OE2 1 ATOM 912 N N . PHE A 1 125 ? 45.634 27.220 54.529 1.00 11.64 ? 125 PHE A N 1 ATOM 913 C CA . PHE A 1 125 ? 46.826 27.948 54.967 1.00 12.63 ? 125 PHE A CA 1 ATOM 914 C C . PHE A 1 125 ? 46.959 28.024 56.494 1.00 14.18 ? 125 PHE A C 1 ATOM 915 O O . PHE A 1 125 ? 46.198 28.727 57.166 1.00 12.16 ? 125 PHE A O 1 ATOM 916 C CB . PHE A 1 125 ? 46.926 29.355 54.366 1.00 10.07 ? 125 PHE A CB 1 ATOM 917 C CG . PHE A 1 125 ? 48.134 30.134 54.851 1.00 9.64 ? 125 PHE A CG 1 ATOM 918 C CD1 . PHE A 1 125 ? 49.425 29.688 54.576 1.00 9.91 ? 125 PHE A CD1 1 ATOM 919 C CD2 . PHE A 1 125 ? 47.980 31.273 55.634 1.00 9.82 ? 125 PHE A CD2 1 ATOM 920 C CE1 . PHE A 1 125 ? 50.543 30.363 55.079 1.00 10.49 ? 125 PHE A CE1 1 ATOM 921 C CE2 . PHE A 1 125 ? 49.094 31.955 56.139 1.00 8.97 ? 125 PHE A CE2 1 ATOM 922 C CZ . PHE A 1 125 ? 50.372 31.497 55.862 1.00 6.89 ? 125 PHE A CZ 1 ATOM 923 N N . LEU A 1 126 ? 47.921 27.267 57.015 1.00 14.23 ? 126 LEU A N 1 ATOM 924 C CA . LEU A 1 126 ? 48.243 27.218 58.441 1.00 13.02 ? 126 LEU A CA 1 ATOM 925 C C . LEU A 1 126 ? 49.478 28.111 58.637 1.00 12.51 ? 126 LEU A C 1 ATOM 926 O O . LEU A 1 126 ? 50.380 28.111 57.792 1.00 9.46 ? 126 LEU A O 1 ATOM 927 C CB . LEU A 1 126 ? 48.570 25.776 58.832 1.00 12.00 ? 126 LEU A CB 1 ATOM 928 C CG . LEU A 1 126 ? 47.457 24.849 59.340 1.00 15.17 ? 126 LEU A CG 1 ATOM 929 C CD1 . LEU A 1 126 ? 46.104 25.199 58.784 1.00 13.89 ? 126 LEU A CD1 1 ATOM 930 C CD2 . LEU A 1 126 ? 47.833 23.409 59.034 1.00 13.19 ? 126 LEU A CD2 1 ATOM 931 N N . ALA A 1 127 ? 49.516 28.872 59.731 1.00 10.82 ? 127 ALA A N 1 ATOM 932 C CA . ALA A 1 127 ? 50.629 29.785 60.010 1.00 10.73 ? 127 ALA A CA 1 ATOM 933 C C . ALA A 1 127 ? 51.341 29.522 61.346 1.00 10.75 ? 127 ALA A C 1 ATOM 934 O O . ALA A 1 127 ? 50.814 28.852 62.227 1.00 12.32 ? 127 ALA A O 1 ATOM 935 C CB . ALA A 1 127 ? 50.139 31.214 59.968 1.00 6.67 ? 127 ALA A CB 1 ATOM 936 N N . GLY A 1 128 ? 52.547 30.065 61.482 1.00 14.47 ? 128 GLY A N 1 ATOM 937 C CA . GLY A 1 128 ? 53.305 29.900 62.712 1.00 14.37 ? 128 GLY A CA 1 ATOM 938 C C . GLY A 1 128 ? 54.639 29.180 62.597 1.00 15.70 ? 128 GLY A C 1 ATOM 939 O O . GLY A 1 128 ? 55.190 28.739 63.609 1.00 17.10 ? 128 GLY A O 1 ATOM 940 N N . ARG A 1 129 ? 55.157 29.031 61.382 1.00 12.29 ? 129 ARG A N 1 ATOM 941 C CA . ARG A 1 129 ? 56.439 28.363 61.189 1.00 10.93 ? 129 ARG A CA 1 ATOM 942 C C . ARG A 1 129 ? 57.560 29.286 61.673 1.00 11.48 ? 129 ARG A C 1 ATOM 943 O O . ARG A 1 129 ? 57.472 30.503 61.514 1.00 9.35 ? 129 ARG A O 1 ATOM 944 C CB . ARG A 1 129 ? 56.642 28.011 59.713 1.00 14.16 ? 129 ARG A CB 1 ATOM 945 C CG . ARG A 1 129 ? 55.830 26.804 59.238 1.00 17.34 ? 129 ARG A CG 1 ATOM 946 C CD . ARG A 1 129 ? 55.743 26.726 57.715 1.00 19.19 ? 129 ARG A CD 1 ATOM 947 N NE . ARG A 1 129 ? 54.702 27.623 57.230 1.00 25.40 ? 129 ARG A NE 1 ATOM 948 C CZ . ARG A 1 129 ? 53.518 27.232 56.768 1.00 21.58 ? 129 ARG A CZ 1 ATOM 949 N NH1 . ARG A 1 129 ? 53.207 25.947 56.696 1.00 23.05 ? 129 ARG A NH1 1 ATOM 950 N NH2 . ARG A 1 129 ? 52.617 28.143 56.445 1.00 24.03 ? 129 ARG A NH2 1 ATOM 951 N N . PRO A 1 130 ? 58.585 28.725 62.341 1.00 13.72 ? 130 PRO A N 1 ATOM 952 C CA . PRO A 1 130 ? 59.732 29.491 62.860 1.00 14.46 ? 130 PRO A CA 1 ATOM 953 C C . PRO A 1 130 ? 60.523 30.232 61.776 1.00 15.16 ? 130 PRO A C 1 ATOM 954 O O . PRO A 1 130 ? 60.627 29.772 60.632 1.00 16.11 ? 130 PRO A O 1 ATOM 955 C CB . PRO A 1 130 ? 60.604 28.408 63.506 1.00 13.24 ? 130 PRO A CB 1 ATOM 956 C CG . PRO A 1 130 ? 59.612 27.412 63.973 1.00 13.47 ? 130 PRO A CG 1 ATOM 957 C CD . PRO A 1 130 ? 58.647 27.325 62.805 1.00 13.93 ? 130 PRO A CD 1 ATOM 958 N N . ASN A 1 131 ? 61.133 31.350 62.163 1.00 14.68 ? 131 ASN A N 1 ATOM 959 C CA . ASN A 1 131 ? 61.935 32.155 61.250 1.00 14.72 ? 131 ASN A CA 1 ATOM 960 C C . ASN A 1 131 ? 63.418 31.780 61.342 1.00 14.90 ? 131 ASN A C 1 ATOM 961 O O . ASN A 1 131 ? 64.293 32.578 61.002 1.00 15.27 ? 131 ASN A O 1 ATOM 962 C CB . ASN A 1 131 ? 61.754 33.636 61.577 1.00 16.01 ? 131 ASN A CB 1 ATOM 963 C CG . ASN A 1 131 ? 62.111 34.541 60.416 1.00 18.29 ? 131 ASN A CG 1 ATOM 964 O OD1 . ASN A 1 131 ? 61.815 34.227 59.264 1.00 17.31 ? 131 ASN A OD1 1 ATOM 965 N ND2 . ASN A 1 131 ? 62.728 35.679 60.721 1.00 16.30 ? 131 ASN A ND2 1 ATOM 966 N N . LYS A 1 132 ? 63.701 30.566 61.807 1.00 16.44 ? 132 LYS A N 1 ATOM 967 C CA . LYS A 1 132 ? 65.079 30.092 61.945 1.00 17.82 ? 132 LYS A CA 1 ATOM 968 C C . LYS A 1 132 ? 65.188 28.664 61.434 1.00 14.23 ? 132 LYS A C 1 ATOM 969 O O . LYS A 1 132 ? 64.332 27.828 61.729 1.00 16.37 ? 132 LYS A O 1 ATOM 970 C CB . LYS A 1 132 ? 65.519 30.145 63.413 1.00 22.23 ? 132 LYS A CB 1 ATOM 971 C CG . LYS A 1 132 ? 64.607 29.356 64.364 1.00 29.84 ? 132 LYS A CG 1 ATOM 972 C CD . LYS A 1 132 ? 65.023 29.476 65.836 1.00 36.28 ? 132 LYS A CD 1 ATOM 973 C CE . LYS A 1 132 ? 66.320 28.722 66.150 1.00 39.74 ? 132 LYS A CE 1 ATOM 974 N NZ . LYS A 1 132 ? 66.681 28.803 67.602 1.00 39.81 ? 132 LYS A NZ 1 ATOM 975 N N . THR A 1 133 ? 66.247 28.382 60.684 1.00 10.12 ? 133 THR A N 1 ATOM 976 C CA . THR A 1 133 ? 66.464 27.049 60.142 1.00 10.06 ? 133 THR A CA 1 ATOM 977 C C . THR A 1 133 ? 67.911 26.903 59.652 1.00 10.26 ? 133 THR A C 1 ATOM 978 O O . THR A 1 133 ? 68.763 27.735 59.970 1.00 12.27 ? 133 THR A O 1 ATOM 979 C CB . THR A 1 133 ? 65.454 26.758 58.984 1.00 7.43 ? 133 THR A CB 1 ATOM 980 O OG1 . THR A 1 133 ? 65.502 25.369 58.651 1.00 7.33 ? 133 THR A OG1 1 ATOM 981 C CG2 . THR A 1 133 ? 65.782 27.591 57.748 1.00 10.66 ? 133 THR A CG2 1 ATOM 982 N N . ILE A 1 134 ? 68.178 25.858 58.877 1.00 12.26 ? 134 ILE A N 1 ATOM 983 C CA . ILE A 1 134 ? 69.502 25.598 58.318 1.00 12.76 ? 134 ILE A CA 1 ATOM 984 C C . ILE A 1 134 ? 69.409 25.493 56.787 1.00 14.83 ? 134 ILE A C 1 ATOM 985 O O . ILE A 1 134 ? 68.330 25.262 56.244 1.00 15.92 ? 134 ILE A O 1 ATOM 986 C CB . ILE A 1 134 ? 70.075 24.250 58.841 1.00 14.33 ? 134 ILE A CB 1 ATOM 987 C CG1 . ILE A 1 134 ? 69.026 23.141 58.699 1.00 12.40 ? 134 ILE A CG1 1 ATOM 988 C CG2 . ILE A 1 134 ? 70.517 24.384 60.296 1.00 18.25 ? 134 ILE A CG2 1 ATOM 989 C CD1 . ILE A 1 134 ? 69.543 21.753 58.940 1.00 14.61 ? 134 ILE A CD1 1 ATOM 990 N N . ALA A 1 135 ? 70.529 25.677 56.096 1.00 12.94 ? 135 ALA A N 1 ATOM 991 C CA . ALA A 1 135 ? 70.570 25.546 54.642 1.00 11.54 ? 135 ALA A CA 1 ATOM 992 C C . ALA A 1 135 ? 70.496 24.055 54.370 1.00 10.94 ? 135 ALA A C 1 ATOM 993 O O . ALA A 1 135 ? 71.138 23.268 55.065 1.00 11.77 ? 135 ALA A O 1 ATOM 994 C CB . ALA A 1 135 ? 71.875 26.111 54.091 1.00 8.22 ? 135 ALA A CB 1 ATOM 995 N N . ALA A 1 136 ? 69.693 23.654 53.388 1.00 10.56 ? 136 ALA A N 1 ATOM 996 C CA . ALA A 1 136 ? 69.557 22.238 53.061 1.00 5.64 ? 136 ALA A CA 1 ATOM 997 C C . ALA A 1 136 ? 70.721 21.720 52.245 1.00 5.01 ? 136 ALA A C 1 ATOM 998 O O . ALA A 1 136 ? 71.518 22.493 51.708 1.00 6.57 ? 136 ALA A O 1 ATOM 999 C CB . ALA A 1 136 ? 68.240 21.979 52.329 1.00 5.33 ? 136 ALA A CB 1 ATOM 1000 N N . VAL A 1 137 ? 70.828 20.398 52.188 1.00 6.42 ? 137 VAL A N 1 ATOM 1001 C CA . VAL A 1 137 ? 71.872 19.713 51.439 1.00 10.47 ? 137 VAL A CA 1 ATOM 1002 C C . VAL A 1 137 ? 71.413 19.482 49.985 1.00 11.59 ? 137 VAL A C 1 ATOM 1003 O O . VAL A 1 137 ? 70.216 19.377 49.718 1.00 9.13 ? 137 VAL A O 1 ATOM 1004 C CB . VAL A 1 137 ? 72.203 18.359 52.124 1.00 12.29 ? 137 VAL A CB 1 ATOM 1005 C CG1 . VAL A 1 137 ? 73.008 17.467 51.204 1.00 16.19 ? 137 VAL A CG1 1 ATOM 1006 C CG2 . VAL A 1 137 ? 72.979 18.612 53.430 1.00 14.49 ? 137 VAL A CG2 1 ATOM 1007 N N . ASP A 1 138 ? 72.373 19.406 49.065 1.00 11.65 ? 138 ASP A N 1 ATOM 1008 C CA . ASP A 1 138 ? 72.117 19.197 47.637 1.00 13.48 ? 138 ASP A CA 1 ATOM 1009 C C . ASP A 1 138 ? 71.632 17.771 47.372 1.00 14.43 ? 138 ASP A C 1 ATOM 1010 O O . ASP A 1 138 ? 71.972 16.849 48.116 1.00 15.90 ? 138 ASP A O 1 ATOM 1011 C CB . ASP A 1 138 ? 73.415 19.464 46.847 1.00 14.07 ? 138 ASP A CB 1 ATOM 1012 C CG . ASP A 1 138 ? 73.199 19.590 45.329 1.00 16.06 ? 138 ASP A CG 1 ATOM 1013 O OD1 . ASP A 1 138 ? 72.057 19.499 44.837 1.00 15.89 ? 138 ASP A OD1 1 ATOM 1014 O OD2 . ASP A 1 138 ? 74.193 19.807 44.616 1.00 13.51 ? 138 ASP A OD2 1 ATOM 1015 N N . GLY A 1 139 ? 70.796 17.606 46.346 1.00 14.66 ? 139 GLY A N 1 ATOM 1016 C CA . GLY A 1 139 ? 70.310 16.283 45.979 1.00 11.52 ? 139 GLY A CA 1 ATOM 1017 C C . GLY A 1 139 ? 68.912 15.897 46.408 1.00 9.89 ? 139 GLY A C 1 ATOM 1018 O O . GLY A 1 139 ? 68.463 14.793 46.098 1.00 13.31 ? 139 GLY A O 1 ATOM 1019 N N . LEU A 1 140 ? 68.198 16.797 47.076 1.00 8.94 ? 140 LEU A N 1 ATOM 1020 C CA . LEU A 1 140 ? 66.847 16.485 47.540 1.00 8.91 ? 140 LEU A CA 1 ATOM 1021 C C . LEU A 1 140 ? 65.741 16.979 46.587 1.00 11.20 ? 140 LEU A C 1 ATOM 1022 O O . LEU A 1 140 ? 64.547 16.820 46.876 1.00 10.17 ? 140 LEU A O 1 ATOM 1023 C CB . LEU A 1 140 ? 66.631 17.068 48.949 1.00 9.35 ? 140 LEU A CB 1 ATOM 1024 C CG . LEU A 1 140 ? 67.615 16.628 50.052 1.00 9.03 ? 140 LEU A CG 1 ATOM 1025 C CD1 . LEU A 1 140 ? 67.440 17.498 51.293 1.00 5.57 ? 140 LEU A CD1 1 ATOM 1026 C CD2 . LEU A 1 140 ? 67.414 15.160 50.387 1.00 7.72 ? 140 LEU A CD2 1 ATOM 1027 N N . ILE A 1 141 ? 66.136 17.598 45.478 1.00 8.49 ? 141 ILE A N 1 ATOM 1028 C CA . ILE A 1 141 ? 65.178 18.126 44.504 1.00 10.06 ? 141 ILE A CA 1 ATOM 1029 C C . ILE A 1 141 ? 65.082 17.172 43.324 1.00 8.06 ? 141 ILE A C 1 ATOM 1030 O O . ILE A 1 141 ? 66.089 16.866 42.683 1.00 9.91 ? 141 ILE A O 1 ATOM 1031 C CB . ILE A 1 141 ? 65.622 19.497 43.954 1.00 9.84 ? 141 ILE A CB 1 ATOM 1032 C CG1 . ILE A 1 141 ? 65.938 20.466 45.100 1.00 10.64 ? 141 ILE A CG1 1 ATOM 1033 C CG2 . ILE A 1 141 ? 64.537 20.072 43.037 1.00 7.75 ? 141 ILE A CG2 1 ATOM 1034 C CD1 . ILE A 1 141 ? 64.722 20.864 45.945 1.00 6.52 ? 141 ILE A CD1 1 ATOM 1035 N N . PRO A 1 142 ? 63.888 16.628 43.064 1.00 11.33 ? 142 PRO A N 1 ATOM 1036 C CA . PRO A 1 142 ? 63.738 15.707 41.931 1.00 11.63 ? 142 PRO A CA 1 ATOM 1037 C C . PRO A 1 142 ? 63.998 16.421 40.589 1.00 10.58 ? 142 PRO A C 1 ATOM 1038 O O . PRO A 1 142 ? 63.720 17.618 40.441 1.00 7.96 ? 142 PRO A O 1 ATOM 1039 C CB . PRO A 1 142 ? 62.301 15.191 42.089 1.00 12.87 ? 142 PRO A CB 1 ATOM 1040 C CG . PRO A 1 142 ? 61.605 16.277 42.848 1.00 15.03 ? 142 PRO A CG 1 ATOM 1041 C CD . PRO A 1 142 ? 62.636 16.752 43.833 1.00 10.78 ? 142 PRO A CD 1 ATOM 1042 N N . GLU A 1 143 ? 64.604 15.701 39.647 1.00 12.33 ? 143 GLU A N 1 ATOM 1043 C CA . GLU A 1 143 ? 64.941 16.261 38.339 1.00 13.34 ? 143 GLU A CA 1 ATOM 1044 C C . GLU A 1 143 ? 64.211 15.582 37.173 1.00 14.12 ? 143 GLU A C 1 ATOM 1045 O O . GLU A 1 143 ? 63.798 14.427 37.287 1.00 11.75 ? 143 GLU A O 1 ATOM 1046 C CB . GLU A 1 143 ? 66.457 16.228 38.136 1.00 13.59 ? 143 GLU A CB 1 ATOM 1047 C CG . GLU A 1 143 ? 67.205 17.165 39.082 1.00 17.97 ? 143 GLU A CG 1 ATOM 1048 C CD . GLU A 1 143 ? 68.672 17.295 38.746 1.00 22.23 ? 143 GLU A CD 1 ATOM 1049 O OE1 . GLU A 1 143 ? 69.026 18.188 37.944 1.00 25.19 ? 143 GLU A OE1 1 ATOM 1050 O OE2 . GLU A 1 143 ? 69.474 16.508 39.287 1.00 24.56 ? 143 GLU A OE2 1 ATOM 1051 N N . PRO A 1 144 ? 64.055 16.296 36.032 1.00 15.06 ? 144 PRO A N 1 ATOM 1052 C CA . PRO A 1 144 ? 63.381 15.834 34.806 1.00 15.31 ? 144 PRO A CA 1 ATOM 1053 C C . PRO A 1 144 ? 63.868 14.495 34.267 1.00 14.19 ? 144 PRO A C 1 ATOM 1054 O O . PRO A 1 144 ? 63.080 13.719 33.728 1.00 16.61 ? 144 PRO A O 1 ATOM 1055 C CB . PRO A 1 144 ? 63.689 16.946 33.798 1.00 16.20 ? 144 PRO A CB 1 ATOM 1056 C CG . PRO A 1 144 ? 63.848 18.137 34.628 1.00 18.32 ? 144 PRO A CG 1 ATOM 1057 C CD . PRO A 1 144 ? 64.625 17.638 35.821 1.00 15.85 ? 144 PRO A CD 1 ATOM 1058 N N . GLN A 1 145 ? 65.169 14.251 34.369 1.00 13.93 ? 145 GLN A N 1 ATOM 1059 C CA . GLN A 1 145 ? 65.757 13.007 33.887 1.00 14.06 ? 145 GLN A CA 1 ATOM 1060 C C . GLN A 1 145 ? 65.655 11.827 34.853 1.00 15.17 ? 145 GLN A C 1 ATOM 1061 O O . GLN A 1 145 ? 66.109 10.732 34.530 1.00 14.72 ? 145 GLN A O 1 ATOM 1062 C CB . GLN A 1 145 ? 67.228 13.217 33.511 1.00 17.11 ? 145 GLN A CB 1 ATOM 1063 C CG . GLN A 1 145 ? 68.164 13.524 34.687 1.00 18.05 ? 145 GLN A CG 1 ATOM 1064 C CD . GLN A 1 145 ? 68.250 15.005 35.024 1.00 20.44 ? 145 GLN A CD 1 ATOM 1065 O OE1 . GLN A 1 145 ? 67.396 15.805 34.636 1.00 18.88 ? 145 GLN A OE1 1 ATOM 1066 N NE2 . GLN A 1 145 ? 69.292 15.377 35.755 1.00 22.66 ? 145 GLN A NE2 1 ATOM 1067 N N . ASP A 1 146 ? 65.083 12.045 36.036 1.00 15.40 ? 146 ASP A N 1 ATOM 1068 C CA . ASP A 1 146 ? 64.956 10.972 37.022 1.00 14.24 ? 146 ASP A CA 1 ATOM 1069 C C . ASP A 1 146 ? 63.936 9.917 36.615 1.00 14.69 ? 146 ASP A C 1 ATOM 1070 O O . ASP A 1 146 ? 62.952 10.216 35.936 1.00 12.92 ? 146 ASP A O 1 ATOM 1071 C CB . ASP A 1 146 ? 64.576 11.531 38.404 1.00 13.35 ? 146 ASP A CB 1 ATOM 1072 C CG . ASP A 1 146 ? 65.706 12.329 39.051 1.00 12.31 ? 146 ASP A CG 1 ATOM 1073 O OD1 . ASP A 1 146 ? 66.845 12.310 38.545 1.00 13.07 ? 146 ASP A OD1 1 ATOM 1074 O OD2 . ASP A 1 146 ? 65.445 12.985 40.075 1.00 14.07 ? 146 ASP A OD2 1 ATOM 1075 N N . SER A 1 147 ? 64.187 8.678 37.023 1.00 13.71 ? 147 SER A N 1 ATOM 1076 C CA . SER A 1 147 ? 63.281 7.579 36.729 1.00 14.38 ? 147 SER A CA 1 ATOM 1077 C C . SER A 1 147 ? 62.092 7.662 37.685 1.00 14.37 ? 147 SER A C 1 ATOM 1078 O O . SER A 1 147 ? 62.167 8.327 38.727 1.00 12.13 ? 147 SER A O 1 ATOM 1079 C CB . SER A 1 147 ? 63.998 6.239 36.909 1.00 17.58 ? 147 SER A CB 1 ATOM 1080 O OG . SER A 1 147 ? 64.323 6.009 38.270 1.00 17.50 ? 147 SER A OG 1 ATOM 1081 N N . VAL A 1 148 ? 61.015 6.959 37.354 1.00 8.92 ? 148 VAL A N 1 ATOM 1082 C CA . VAL A 1 148 ? 59.826 6.953 38.189 1.00 9.55 ? 148 VAL A CA 1 ATOM 1083 C C . VAL A 1 148 ? 60.150 6.388 39.582 1.00 9.80 ? 148 VAL A C 1 ATOM 1084 O O . VAL A 1 148 ? 59.683 6.908 40.592 1.00 6.56 ? 148 VAL A O 1 ATOM 1085 C CB . VAL A 1 148 ? 58.686 6.136 37.536 1.00 9.74 ? 148 VAL A CB 1 ATOM 1086 C CG1 . VAL A 1 148 ? 57.496 6.046 38.478 1.00 8.57 ? 148 VAL A CG1 1 ATOM 1087 C CG2 . VAL A 1 148 ? 58.257 6.793 36.216 1.00 7.76 ? 148 VAL A CG2 1 ATOM 1088 N N . THR A 1 149 ? 60.939 5.321 39.629 1.00 9.47 ? 149 THR A N 1 ATOM 1089 C CA . THR A 1 149 ? 61.315 4.721 40.906 1.00 12.16 ? 149 THR A CA 1 ATOM 1090 C C . THR A 1 149 ? 62.036 5.748 41.796 1.00 10.46 ? 149 THR A C 1 ATOM 1091 O O . THR A 1 149 ? 61.634 5.987 42.941 1.00 11.51 ? 149 THR A O 1 ATOM 1092 C CB . THR A 1 149 ? 62.168 3.463 40.681 1.00 13.97 ? 149 THR A CB 1 ATOM 1093 O OG1 . THR A 1 149 ? 61.322 2.411 40.197 1.00 14.89 ? 149 THR A OG1 1 ATOM 1094 C CG2 . THR A 1 149 ? 62.853 3.009 41.973 1.00 15.60 ? 149 THR A CG2 1 ATOM 1095 N N . LYS A 1 150 ? 63.056 6.392 41.243 1.00 7.46 ? 150 LYS A N 1 ATOM 1096 C CA . LYS A 1 150 ? 63.807 7.408 41.967 1.00 10.77 ? 150 LYS A CA 1 ATOM 1097 C C . LYS A 1 150 ? 62.904 8.545 42.454 1.00 12.00 ? 150 LYS A C 1 ATOM 1098 O O . LYS A 1 150 ? 63.041 9.012 43.588 1.00 8.20 ? 150 LYS A O 1 ATOM 1099 C CB . LYS A 1 150 ? 64.916 7.960 41.074 1.00 13.02 ? 150 LYS A CB 1 ATOM 1100 C CG . LYS A 1 150 ? 65.739 9.054 41.707 1.00 18.24 ? 150 LYS A CG 1 ATOM 1101 C CD . LYS A 1 150 ? 66.942 9.383 40.847 1.00 21.74 ? 150 LYS A CD 1 ATOM 1102 C CE . LYS A 1 150 ? 67.754 10.521 41.446 1.00 26.21 ? 150 LYS A CE 1 ATOM 1103 N NZ . LYS A 1 150 ? 68.971 10.792 40.634 1.00 30.70 ? 150 LYS A NZ 1 ATOM 1104 N N . ILE A 1 151 ? 61.971 8.978 41.600 1.00 11.83 ? 151 ILE A N 1 ATOM 1105 C CA . ILE A 1 151 ? 61.046 10.063 41.934 1.00 10.34 ? 151 ILE A CA 1 ATOM 1106 C C . ILE A 1 151 ? 60.104 9.687 43.076 1.00 9.43 ? 151 ILE A C 1 ATOM 1107 O O . ILE A 1 151 ? 59.924 10.454 44.025 1.00 8.54 ? 151 ILE A O 1 ATOM 1108 C CB . ILE A 1 151 ? 60.211 10.501 40.694 1.00 11.37 ? 151 ILE A CB 1 ATOM 1109 C CG1 . ILE A 1 151 ? 61.114 11.202 39.678 1.00 12.84 ? 151 ILE A CG1 1 ATOM 1110 C CG2 . ILE A 1 151 ? 59.061 11.409 41.109 1.00 7.56 ? 151 ILE A CG2 1 ATOM 1111 C CD1 . ILE A 1 151 ? 60.445 11.466 38.344 1.00 15.67 ? 151 ILE A CD1 1 ATOM 1112 N N . LEU A 1 152 ? 59.486 8.517 42.966 1.00 9.94 ? 152 LEU A N 1 ATOM 1113 C CA . LEU A 1 152 ? 58.559 8.029 43.981 1.00 12.41 ? 152 LEU A CA 1 ATOM 1114 C C . LEU A 1 152 ? 59.283 7.849 45.326 1.00 13.51 ? 152 LEU A C 1 ATOM 1115 O O . LEU A 1 152 ? 58.737 8.187 46.383 1.00 13.23 ? 152 LEU A O 1 ATOM 1116 C CB . LEU A 1 152 ? 57.916 6.711 43.519 1.00 7.94 ? 152 LEU A CB 1 ATOM 1117 C CG . LEU A 1 152 ? 56.454 6.738 43.015 1.00 11.77 ? 152 LEU A CG 1 ATOM 1118 C CD1 . LEU A 1 152 ? 56.095 8.053 42.367 1.00 7.29 ? 152 LEU A CD1 1 ATOM 1119 C CD2 . LEU A 1 152 ? 56.202 5.575 42.070 1.00 11.41 ? 152 LEU A CD2 1 ATOM 1120 N N . GLN A 1 153 ? 60.515 7.348 45.278 1.00 13.40 ? 153 GLN A N 1 ATOM 1121 C CA . GLN A 1 153 ? 61.306 7.154 46.492 1.00 14.69 ? 153 GLN A CA 1 ATOM 1122 C C . GLN A 1 153 ? 61.622 8.490 47.160 1.00 13.93 ? 153 GLN A C 1 ATOM 1123 O O . GLN A 1 153 ? 61.522 8.617 48.377 1.00 18.30 ? 153 GLN A O 1 ATOM 1124 C CB . GLN A 1 153 ? 62.596 6.399 46.187 1.00 14.59 ? 153 GLN A CB 1 ATOM 1125 C CG . GLN A 1 153 ? 62.378 4.931 45.938 1.00 23.45 ? 153 GLN A CG 1 ATOM 1126 C CD . GLN A 1 153 ? 63.651 4.191 45.570 1.00 29.93 ? 153 GLN A CD 1 ATOM 1127 O OE1 . GLN A 1 153 ? 64.680 4.802 45.251 1.00 33.94 ? 153 GLN A OE1 1 ATOM 1128 N NE2 . GLN A 1 153 ? 63.586 2.862 45.595 1.00 28.91 ? 153 GLN A NE2 1 ATOM 1129 N N . ARG A 1 154 ? 61.957 9.492 46.358 1.00 12.33 ? 154 ARG A N 1 ATOM 1130 C CA . ARG A 1 154 ? 62.267 10.825 46.866 1.00 10.42 ? 154 ARG A CA 1 ATOM 1131 C C . ARG A 1 154 ? 61.066 11.406 47.625 1.00 12.08 ? 154 ARG A C 1 ATOM 1132 O O . ARG A 1 154 ? 61.219 11.922 48.742 1.00 9.72 ? 154 ARG A O 1 ATOM 1133 C CB . ARG A 1 154 ? 62.680 11.736 45.698 1.00 11.12 ? 154 ARG A CB 1 ATOM 1134 C CG . ARG A 1 154 ? 63.061 13.178 46.052 1.00 11.83 ? 154 ARG A CG 1 ATOM 1135 C CD . ARG A 1 154 ? 64.416 13.299 46.781 1.00 12.85 ? 154 ARG A CD 1 ATOM 1136 N NE . ARG A 1 154 ? 64.323 12.949 48.192 1.00 10.29 ? 154 ARG A NE 1 ATOM 1137 C CZ . ARG A 1 154 ? 63.934 13.777 49.155 1.00 9.84 ? 154 ARG A CZ 1 ATOM 1138 N NH1 . ARG A 1 154 ? 63.602 15.035 48.882 1.00 10.46 ? 154 ARG A NH1 1 ATOM 1139 N NH2 . ARG A 1 154 ? 63.800 13.320 50.385 1.00 11.66 ? 154 ARG A NH2 1 ATOM 1140 N N . PHE A 1 155 ? 59.869 11.303 47.044 1.00 8.63 ? 155 PHE A N 1 ATOM 1141 C CA . PHE A 1 155 ? 58.658 11.819 47.687 1.00 7.50 ? 155 PHE A CA 1 ATOM 1142 C C . PHE A 1 155 ? 58.268 11.035 48.936 1.00 9.32 ? 155 PHE A C 1 ATOM 1143 O O . PHE A 1 155 ? 57.702 11.590 49.889 1.00 10.02 ? 155 PHE A O 1 ATOM 1144 C CB . PHE A 1 155 ? 57.471 11.841 46.710 1.00 7.29 ? 155 PHE A CB 1 ATOM 1145 C CG . PHE A 1 155 ? 57.466 13.029 45.800 1.00 4.05 ? 155 PHE A CG 1 ATOM 1146 C CD1 . PHE A 1 155 ? 58.261 13.050 44.660 1.00 6.00 ? 155 PHE A CD1 1 ATOM 1147 C CD2 . PHE A 1 155 ? 56.675 14.126 46.080 1.00 7.60 ? 155 PHE A CD2 1 ATOM 1148 C CE1 . PHE A 1 155 ? 58.264 14.151 43.812 1.00 7.44 ? 155 PHE A CE1 1 ATOM 1149 C CE2 . PHE A 1 155 ? 56.673 15.240 45.229 1.00 8.80 ? 155 PHE A CE2 1 ATOM 1150 C CZ . PHE A 1 155 ? 57.468 15.243 44.100 1.00 4.59 ? 155 PHE A CZ 1 ATOM 1151 N N . GLU A 1 156 ? 58.542 9.740 48.924 1.00 10.40 ? 156 GLU A N 1 ATOM 1152 C CA . GLU A 1 156 ? 58.224 8.900 50.062 1.00 15.44 ? 156 GLU A CA 1 ATOM 1153 C C . GLU A 1 156 ? 59.144 9.271 51.227 1.00 13.29 ? 156 GLU A C 1 ATOM 1154 O O . GLU A 1 156 ? 58.693 9.449 52.356 1.00 12.48 ? 156 GLU A O 1 ATOM 1155 C CB . GLU A 1 156 ? 58.401 7.431 49.694 1.00 18.38 ? 156 GLU A CB 1 ATOM 1156 C CG . GLU A 1 156 ? 58.056 6.479 50.822 1.00 26.32 ? 156 GLU A CG 1 ATOM 1157 C CD . GLU A 1 156 ? 58.154 5.033 50.407 1.00 30.53 ? 156 GLU A CD 1 ATOM 1158 O OE1 . GLU A 1 156 ? 59.231 4.623 49.914 1.00 32.58 ? 156 GLU A OE1 1 ATOM 1159 O OE2 . GLU A 1 156 ? 57.144 4.312 50.567 1.00 34.62 ? 156 GLU A OE2 1 ATOM 1160 N N . ASP A 1 157 ? 60.417 9.466 50.905 1.00 12.46 ? 157 ASP A N 1 ATOM 1161 C CA . ASP A 1 157 ? 61.438 9.825 51.887 1.00 13.86 ? 157 ASP A CA 1 ATOM 1162 C C . ASP A 1 157 ? 61.239 11.229 52.450 1.00 14.64 ? 157 ASP A C 1 ATOM 1163 O O . ASP A 1 157 ? 61.611 11.511 53.589 1.00 18.62 ? 157 ASP A O 1 ATOM 1164 C CB . ASP A 1 157 ? 62.822 9.712 51.253 1.00 13.70 ? 157 ASP A CB 1 ATOM 1165 C CG . ASP A 1 157 ? 63.937 10.069 52.218 1.00 16.94 ? 157 ASP A CG 1 ATOM 1166 O OD1 . ASP A 1 157 ? 64.039 9.412 53.272 1.00 14.26 ? 157 ASP A OD1 1 ATOM 1167 O OD2 . ASP A 1 157 ? 64.702 11.010 51.925 1.00 13.13 ? 157 ASP A OD2 1 ATOM 1168 N N . ALA A 1 158 ? 60.655 12.115 51.656 1.00 13.50 ? 158 ALA A N 1 ATOM 1169 C CA . ALA A 1 158 ? 60.423 13.479 52.096 1.00 11.88 ? 158 ALA A CA 1 ATOM 1170 C C . ALA A 1 158 ? 59.245 13.607 53.064 1.00 13.46 ? 158 ALA A C 1 ATOM 1171 O O . ALA A 1 158 ? 59.326 14.344 54.052 1.00 12.62 ? 158 ALA A O 1 ATOM 1172 C CB . ALA A 1 158 ? 60.226 14.403 50.885 1.00 14.10 ? 158 ALA A CB 1 ATOM 1173 N N . GLY A 1 159 ? 58.163 12.879 52.805 1.00 11.78 ? 159 GLY A N 1 ATOM 1174 C CA . GLY A 1 159 ? 57.006 12.987 53.672 1.00 8.90 ? 159 GLY A CA 1 ATOM 1175 C C . GLY A 1 159 ? 55.966 11.893 53.569 1.00 8.05 ? 159 GLY A C 1 ATOM 1176 O O . GLY A 1 159 ? 54.813 12.113 53.930 1.00 11.01 ? 159 GLY A O 1 ATOM 1177 N N . GLY A 1 160 ? 56.373 10.709 53.126 1.00 9.13 ? 160 GLY A N 1 ATOM 1178 C CA . GLY A 1 160 ? 55.439 9.602 53.002 1.00 11.90 ? 160 GLY A CA 1 ATOM 1179 C C . GLY A 1 160 ? 54.371 9.746 51.918 1.00 13.28 ? 160 GLY A C 1 ATOM 1180 O O . GLY A 1 160 ? 53.316 9.121 52.006 1.00 12.47 ? 160 GLY A O 1 ATOM 1181 N N . PHE A 1 161 ? 54.643 10.548 50.891 1.00 13.04 ? 161 PHE A N 1 ATOM 1182 C CA . PHE A 1 161 ? 53.686 10.748 49.798 1.00 13.05 ? 161 PHE A CA 1 ATOM 1183 C C . PHE A 1 161 ? 53.459 9.477 48.991 1.00 10.06 ? 161 PHE A C 1 ATOM 1184 O O . PHE A 1 161 ? 54.416 8.815 48.589 1.00 11.99 ? 161 PHE A O 1 ATOM 1185 C CB . PHE A 1 161 ? 54.176 11.837 48.843 1.00 9.31 ? 161 PHE A CB 1 ATOM 1186 C CG . PHE A 1 161 ? 54.121 13.216 49.415 1.00 10.24 ? 161 PHE A CG 1 ATOM 1187 C CD1 . PHE A 1 161 ? 52.910 13.892 49.515 1.00 7.26 ? 161 PHE A CD1 1 ATOM 1188 C CD2 . PHE A 1 161 ? 55.284 13.850 49.844 1.00 9.48 ? 161 PHE A CD2 1 ATOM 1189 C CE1 . PHE A 1 161 ? 52.855 15.182 50.031 1.00 8.13 ? 161 PHE A CE1 1 ATOM 1190 C CE2 . PHE A 1 161 ? 55.239 15.132 50.359 1.00 9.53 ? 161 PHE A CE2 1 ATOM 1191 C CZ . PHE A 1 161 ? 54.018 15.800 50.452 1.00 9.41 ? 161 PHE A CZ 1 ATOM 1192 N N . THR A 1 162 ? 52.193 9.137 48.769 1.00 11.41 ? 162 THR A N 1 ATOM 1193 C CA . THR A 1 162 ? 51.837 7.961 47.968 1.00 12.04 ? 162 THR A CA 1 ATOM 1194 C C . THR A 1 162 ? 51.929 8.363 46.486 1.00 11.54 ? 162 THR A C 1 ATOM 1195 O O . THR A 1 162 ? 51.984 9.551 46.170 1.00 10.89 ? 162 THR A O 1 ATOM 1196 C CB . THR A 1 162 ? 50.377 7.526 48.232 1.00 11.62 ? 162 THR A CB 1 ATOM 1197 O OG1 . THR A 1 162 ? 49.481 8.573 47.829 1.00 11.80 ? 162 THR A OG1 1 ATOM 1198 C CG2 . THR A 1 162 ? 50.156 7.213 49.707 1.00 13.83 ? 162 THR A CG2 1 ATOM 1199 N N . PRO A 1 163 ? 51.942 7.379 45.562 1.00 12.17 ? 163 PRO A N 1 ATOM 1200 C CA . PRO A 1 163 ? 52.021 7.707 44.132 1.00 11.88 ? 163 PRO A CA 1 ATOM 1201 C C . PRO A 1 163 ? 50.836 8.577 43.701 1.00 10.21 ? 163 PRO A C 1 ATOM 1202 O O . PRO A 1 163 ? 50.987 9.485 42.890 1.00 12.53 ? 163 PRO A O 1 ATOM 1203 C CB . PRO A 1 163 ? 52.006 6.333 43.476 1.00 13.36 ? 163 PRO A CB 1 ATOM 1204 C CG . PRO A 1 163 ? 52.766 5.513 44.464 1.00 12.14 ? 163 PRO A CG 1 ATOM 1205 C CD . PRO A 1 163 ? 52.135 5.935 45.771 1.00 11.26 ? 163 PRO A CD 1 ATOM 1206 N N . PHE A 1 164 ? 49.674 8.345 44.296 1.00 8.92 ? 164 PHE A N 1 ATOM 1207 C CA . PHE A 1 164 ? 48.510 9.147 43.972 1.00 9.51 ? 164 PHE A CA 1 ATOM 1208 C C . PHE A 1 164 ? 48.740 10.621 44.305 1.00 11.65 ? 164 PHE A C 1 ATOM 1209 O O . PHE A 1 164 ? 48.396 11.504 43.516 1.00 11.49 ? 164 PHE A O 1 ATOM 1210 C CB . PHE A 1 164 ? 47.274 8.631 44.703 1.00 8.94 ? 164 PHE A CB 1 ATOM 1211 C CG . PHE A 1 164 ? 46.026 9.397 44.382 1.00 12.23 ? 164 PHE A CG 1 ATOM 1212 C CD1 . PHE A 1 164 ? 45.246 9.052 43.285 1.00 11.60 ? 164 PHE A CD1 1 ATOM 1213 C CD2 . PHE A 1 164 ? 45.629 10.474 45.173 1.00 13.16 ? 164 PHE A CD2 1 ATOM 1214 C CE1 . PHE A 1 164 ? 44.089 9.765 42.980 1.00 11.18 ? 164 PHE A CE1 1 ATOM 1215 C CE2 . PHE A 1 164 ? 44.472 11.197 44.875 1.00 14.69 ? 164 PHE A CE2 1 ATOM 1216 C CZ . PHE A 1 164 ? 43.698 10.838 43.773 1.00 10.78 ? 164 PHE A CZ 1 ATOM 1217 N N . GLU A 1 165 ? 49.340 10.893 45.460 1.00 9.83 ? 165 GLU A N 1 ATOM 1218 C CA . GLU A 1 165 ? 49.594 12.271 45.863 1.00 6.55 ? 165 GLU A CA 1 ATOM 1219 C C . GLU A 1 165 ? 50.647 12.916 44.973 1.00 4.89 ? 165 GLU A C 1 ATOM 1220 O O . GLU A 1 165 ? 50.561 14.110 44.681 1.00 6.05 ? 165 GLU A O 1 ATOM 1221 C CB . GLU A 1 165 ? 50.006 12.331 47.340 1.00 9.41 ? 165 GLU A CB 1 ATOM 1222 C CG . GLU A 1 165 ? 48.884 11.908 48.276 1.00 10.91 ? 165 GLU A CG 1 ATOM 1223 C CD . GLU A 1 165 ? 49.315 11.726 49.722 1.00 12.91 ? 165 GLU A CD 1 ATOM 1224 O OE1 . GLU A 1 165 ? 50.432 11.239 49.979 1.00 11.14 ? 165 GLU A OE1 1 ATOM 1225 O OE2 . GLU A 1 165 ? 48.508 12.051 50.612 1.00 14.46 ? 165 GLU A OE2 1 ATOM 1226 N N . VAL A 1 166 ? 51.630 12.130 44.533 1.00 4.29 ? 166 VAL A N 1 ATOM 1227 C CA . VAL A 1 166 ? 52.679 12.652 43.658 1.00 4.78 ? 166 VAL A CA 1 ATOM 1228 C C . VAL A 1 166 ? 52.053 13.136 42.334 1.00 6.63 ? 166 VAL A C 1 ATOM 1229 O O . VAL A 1 166 ? 52.310 14.261 41.894 1.00 5.18 ? 166 VAL A O 1 ATOM 1230 C CB . VAL A 1 166 ? 53.762 11.580 43.372 1.00 4.42 ? 166 VAL A CB 1 ATOM 1231 C CG1 . VAL A 1 166 ? 54.854 12.143 42.468 1.00 4.88 ? 166 VAL A CG1 1 ATOM 1232 C CG2 . VAL A 1 166 ? 54.375 11.097 44.669 1.00 8.79 ? 166 VAL A CG2 1 ATOM 1233 N N . VAL A 1 167 ? 51.194 12.317 41.728 1.00 8.24 ? 167 VAL A N 1 ATOM 1234 C CA . VAL A 1 167 ? 50.550 12.705 40.461 1.00 7.79 ? 167 VAL A CA 1 ATOM 1235 C C . VAL A 1 167 ? 49.661 13.921 40.676 1.00 5.83 ? 167 VAL A C 1 ATOM 1236 O O . VAL A 1 167 ? 49.688 14.851 39.880 1.00 8.66 ? 167 VAL A O 1 ATOM 1237 C CB . VAL A 1 167 ? 49.722 11.548 39.835 1.00 8.90 ? 167 VAL A CB 1 ATOM 1238 C CG1 . VAL A 1 167 ? 49.076 12.009 38.521 1.00 8.26 ? 167 VAL A CG1 1 ATOM 1239 C CG2 . VAL A 1 167 ? 50.610 10.352 39.572 1.00 6.82 ? 167 VAL A CG2 1 ATOM 1240 N N . SER A 1 168 ? 48.914 13.933 41.781 1.00 8.52 ? 168 SER A N 1 ATOM 1241 C CA . SER A 1 168 ? 48.046 15.054 42.123 1.00 6.55 ? 168 SER A CA 1 ATOM 1242 C C . SER A 1 168 ? 48.832 16.361 42.167 1.00 8.09 ? 168 SER A C 1 ATOM 1243 O O . SER A 1 168 ? 48.362 17.394 41.674 1.00 8.12 ? 168 SER A O 1 ATOM 1244 C CB . SER A 1 168 ? 47.368 14.832 43.487 1.00 5.54 ? 168 SER A CB 1 ATOM 1245 O OG . SER A 1 168 ? 46.561 13.667 43.503 1.00 6.52 ? 168 SER A OG 1 ATOM 1246 N N . LEU A 1 169 ? 50.025 16.320 42.758 1.00 6.46 ? 169 LEU A N 1 ATOM 1247 C CA . LEU A 1 169 ? 50.864 17.514 42.864 1.00 6.93 ? 169 LEU A CA 1 ATOM 1248 C C . LEU A 1 169 ? 51.300 18.041 41.504 1.00 6.43 ? 169 LEU A C 1 ATOM 1249 O O . LEU A 1 169 ? 51.491 19.239 41.343 1.00 7.88 ? 169 LEU A O 1 ATOM 1250 C CB . LEU A 1 169 ? 52.100 17.244 43.741 1.00 5.59 ? 169 LEU A CB 1 ATOM 1251 C CG . LEU A 1 169 ? 51.807 17.195 45.244 1.00 7.34 ? 169 LEU A CG 1 ATOM 1252 C CD1 . LEU A 1 169 ? 53.024 16.703 46.025 1.00 7.01 ? 169 LEU A CD1 1 ATOM 1253 C CD2 . LEU A 1 169 ? 51.379 18.568 45.698 1.00 2.22 ? 169 LEU A CD2 1 ATOM 1254 N N . LEU A 1 170 ? 51.430 17.148 40.525 1.00 10.25 ? 170 LEU A N 1 ATOM 1255 C CA . LEU A 1 170 ? 51.837 17.541 39.177 1.00 11.32 ? 170 LEU A CA 1 ATOM 1256 C C . LEU A 1 170 ? 50.740 18.274 38.405 1.00 11.82 ? 170 LEU A C 1 ATOM 1257 O O . LEU A 1 170 ? 50.925 18.652 37.248 1.00 15.32 ? 170 LEU A O 1 ATOM 1258 C CB . LEU A 1 170 ? 52.363 16.341 38.398 1.00 12.30 ? 170 LEU A CB 1 ATOM 1259 C CG . LEU A 1 170 ? 53.814 16.005 38.744 1.00 14.56 ? 170 LEU A CG 1 ATOM 1260 C CD1 . LEU A 1 170 ? 54.155 14.624 38.245 1.00 17.34 ? 170 LEU A CD1 1 ATOM 1261 C CD2 . LEU A 1 170 ? 54.753 17.042 38.135 1.00 15.14 ? 170 LEU A CD2 1 ATOM 1262 N N . ALA A 1 171 ? 49.607 18.500 39.056 1.00 11.94 ? 171 ALA A N 1 ATOM 1263 C CA . ALA A 1 171 ? 48.525 19.246 38.438 1.00 8.22 ? 171 ALA A CA 1 ATOM 1264 C C . ALA A 1 171 ? 49.033 20.676 38.245 1.00 9.69 ? 171 ALA A C 1 ATOM 1265 O O . ALA A 1 171 ? 48.511 21.421 37.419 1.00 9.71 ? 171 ALA A O 1 ATOM 1266 C CB . ALA A 1 171 ? 47.293 19.237 39.330 1.00 4.81 ? 171 ALA A CB 1 ATOM 1267 N N . SER A 1 172 ? 50.065 21.059 38.994 1.00 6.10 ? 172 SER A N 1 ATOM 1268 C CA . SER A 1 172 ? 50.633 22.400 38.889 1.00 5.63 ? 172 SER A CA 1 ATOM 1269 C C . SER A 1 172 ? 51.357 22.620 37.552 1.00 6.66 ? 172 SER A C 1 ATOM 1270 O O . SER A 1 172 ? 51.653 23.754 37.174 1.00 8.96 ? 172 SER A O 1 ATOM 1271 C CB . SER A 1 172 ? 51.610 22.632 40.038 1.00 8.88 ? 172 SER A CB 1 ATOM 1272 O OG . SER A 1 172 ? 52.533 21.562 40.081 1.00 5.14 ? 172 SER A OG 1 ATOM 1273 N N . HIS A 1 173 ? 51.687 21.538 36.857 1.00 6.08 ? 173 HIS A N 1 ATOM 1274 C CA . HIS A 1 173 ? 52.337 21.673 35.558 1.00 8.22 ? 173 HIS A CA 1 ATOM 1275 C C . HIS A 1 173 ? 51.323 22.151 34.479 1.00 7.93 ? 173 HIS A C 1 ATOM 1276 O O . HIS A 1 173 ? 51.676 22.370 33.324 1.00 8.50 ? 173 HIS A O 1 ATOM 1277 C CB . HIS A 1 173 ? 53.023 20.365 35.163 1.00 6.44 ? 173 HIS A CB 1 ATOM 1278 C CG . HIS A 1 173 ? 54.428 20.215 35.794 1.00 7.07 ? 173 HIS A CG 1 ATOM 1279 N ND1 . HIS A 1 173 ? 55.339 19.232 35.400 1.00 6.33 ? 173 HIS A ND1 1 ATOM 1280 C CD2 . HIS A 1 173 ? 55.038 21.114 36.704 1.00 4.79 ? 173 HIS A CD2 1 ATOM 1281 C CE1 . HIS A 1 173 ? 56.508 19.539 36.011 1.00 6.08 ? 173 HIS A CE1 1 ATOM 1282 N NE2 . HIS A 1 173 ? 56.338 20.571 36.792 1.00 5.63 ? 173 HIS A NE2 1 ATOM 1283 N N . SER A 1 174 ? 50.074 22.351 34.898 1.00 9.60 ? 174 SER A N 1 ATOM 1284 C CA . SER A 1 174 ? 49.010 22.857 34.031 1.00 8.56 ? 174 SER A CA 1 ATOM 1285 C C . SER A 1 174 ? 49.151 24.372 33.882 1.00 9.65 ? 174 SER A C 1 ATOM 1286 O O . SER A 1 174 ? 48.497 24.986 33.032 1.00 7.89 ? 174 SER A O 1 ATOM 1287 C CB . SER A 1 174 ? 47.639 22.519 34.627 1.00 5.89 ? 174 SER A CB 1 ATOM 1288 O OG . SER A 1 174 ? 46.565 23.026 33.832 1.00 7.90 ? 174 SER A OG 1 ATOM 1289 N N . VAL A 1 175 ? 49.959 24.983 34.745 1.00 9.73 ? 175 VAL A N 1 ATOM 1290 C CA . VAL A 1 175 ? 50.210 26.422 34.710 1.00 8.82 ? 175 VAL A CA 1 ATOM 1291 C C . VAL A 1 175 ? 51.721 26.602 34.891 1.00 12.59 ? 175 VAL A C 1 ATOM 1292 O O . VAL A 1 175 ? 52.175 27.360 35.755 1.00 16.05 ? 175 VAL A O 1 ATOM 1293 C CB . VAL A 1 175 ? 49.410 27.194 35.813 1.00 10.79 ? 175 VAL A CB 1 ATOM 1294 C CG1 . VAL A 1 175 ? 47.909 27.120 35.533 1.00 5.82 ? 175 VAL A CG1 1 ATOM 1295 C CG2 . VAL A 1 175 ? 49.722 26.639 37.225 1.00 9.79 ? 175 VAL A CG2 1 ATOM 1296 N N . ALA A 1 176 ? 52.488 25.929 34.032 1.00 12.12 ? 176 ALA A N 1 ATOM 1297 C CA . ALA A 1 176 ? 53.948 25.945 34.089 1.00 12.30 ? 176 ALA A CA 1 ATOM 1298 C C . ALA A 1 176 ? 54.627 26.052 32.719 1.00 12.86 ? 176 ALA A C 1 ATOM 1299 O O . ALA A 1 176 ? 54.087 25.602 31.698 1.00 13.94 ? 176 ALA A O 1 ATOM 1300 C CB . ALA A 1 176 ? 54.427 24.667 34.794 1.00 10.53 ? 176 ALA A CB 1 ATOM 1301 N N . ARG A 1 177 ? 55.816 26.641 32.706 1.00 10.33 ? 177 ARG A N 1 ATOM 1302 C CA . ARG A 1 177 ? 56.613 26.798 31.486 1.00 11.27 ? 177 ARG A CA 1 ATOM 1303 C C . ARG A 1 177 ? 58.075 26.594 31.889 1.00 11.51 ? 177 ARG A C 1 ATOM 1304 O O . ARG A 1 177 ? 58.407 26.678 33.076 1.00 10.99 ? 177 ARG A O 1 ATOM 1305 C CB . ARG A 1 177 ? 56.410 28.192 30.875 1.00 7.21 ? 177 ARG A CB 1 ATOM 1306 C CG . ARG A 1 177 ? 54.938 28.539 30.628 1.00 8.87 ? 177 ARG A CG 1 ATOM 1307 C CD . ARG A 1 177 ? 54.746 29.817 29.840 1.00 8.26 ? 177 ARG A CD 1 ATOM 1308 N NE . ARG A 1 177 ? 55.159 31.016 30.563 1.00 11.70 ? 177 ARG A NE 1 ATOM 1309 C CZ . ARG A 1 177 ? 54.846 32.253 30.188 1.00 15.16 ? 177 ARG A CZ 1 ATOM 1310 N NH1 . ARG A 1 177 ? 54.121 32.460 29.095 1.00 14.96 ? 177 ARG A NH1 1 ATOM 1311 N NH2 . ARG A 1 177 ? 55.228 33.291 30.919 1.00 12.62 ? 177 ARG A NH2 1 ATOM 1312 N N . ALA A 1 178 ? 58.943 26.360 30.913 1.00 11.05 ? 178 ALA A N 1 ATOM 1313 C CA . ALA A 1 178 ? 60.361 26.140 31.173 1.00 12.79 ? 178 ALA A CA 1 ATOM 1314 C C . ALA A 1 178 ? 61.265 27.171 30.500 1.00 15.39 ? 178 ALA A C 1 ATOM 1315 O O . ALA A 1 178 ? 61.047 27.531 29.334 1.00 15.04 ? 178 ALA A O 1 ATOM 1316 C CB . ALA A 1 178 ? 60.751 24.740 30.732 1.00 8.98 ? 178 ALA A CB 1 ATOM 1317 N N . ASP A 1 179 ? 62.267 27.642 31.243 1.00 12.34 ? 179 ASP A N 1 ATOM 1318 C CA . ASP A 1 179 ? 63.236 28.629 30.766 1.00 13.02 ? 179 ASP A CA 1 ATOM 1319 C C . ASP A 1 179 ? 64.663 28.080 30.720 1.00 13.99 ? 179 ASP A C 1 ATOM 1320 O O . ASP A 1 179 ? 65.506 28.597 29.988 1.00 14.69 ? 179 ASP A O 1 ATOM 1321 C CB . ASP A 1 179 ? 63.284 29.852 31.689 1.00 16.31 ? 179 ASP A CB 1 ATOM 1322 C CG . ASP A 1 179 ? 61.945 30.533 31.858 1.00 20.95 ? 179 ASP A CG 1 ATOM 1323 O OD1 . ASP A 1 179 ? 61.105 30.507 30.937 1.00 22.22 ? 179 ASP A OD1 1 ATOM 1324 O OD2 . ASP A 1 179 ? 61.749 31.134 32.933 1.00 22.37 ? 179 ASP A OD2 1 ATOM 1325 N N . LYS A 1 180 ? 64.935 27.049 31.513 1.00 13.30 ? 180 LYS A N 1 ATOM 1326 C CA . LYS A 1 180 ? 66.279 26.491 31.599 1.00 14.69 ? 180 LYS A CA 1 ATOM 1327 C C . LYS A 1 180 ? 66.523 25.133 30.970 1.00 14.55 ? 180 LYS A C 1 ATOM 1328 O O . LYS A 1 180 ? 67.674 24.737 30.811 1.00 16.88 ? 180 LYS A O 1 ATOM 1329 C CB . LYS A 1 180 ? 66.715 26.423 33.070 1.00 15.26 ? 180 LYS A CB 1 ATOM 1330 C CG . LYS A 1 180 ? 66.464 27.691 33.857 1.00 14.81 ? 180 LYS A CG 1 ATOM 1331 C CD . LYS A 1 180 ? 67.350 28.824 33.383 1.00 20.24 ? 180 LYS A CD 1 ATOM 1332 C CE . LYS A 1 180 ? 66.958 30.128 34.063 1.00 22.22 ? 180 LYS A CE 1 ATOM 1333 N NZ . LYS A 1 180 ? 67.817 31.250 33.608 1.00 26.03 ? 180 LYS A NZ 1 ATOM 1334 N N . VAL A 1 181 ? 65.467 24.389 30.656 1.00 14.50 ? 181 VAL A N 1 ATOM 1335 C CA . VAL A 1 181 ? 65.659 23.068 30.054 1.00 16.17 ? 181 VAL A CA 1 ATOM 1336 C C . VAL A 1 181 ? 66.376 23.217 28.707 1.00 17.44 ? 181 VAL A C 1 ATOM 1337 O O . VAL A 1 181 ? 67.294 22.462 28.379 1.00 15.30 ? 181 VAL A O 1 ATOM 1338 C CB . VAL A 1 181 ? 64.316 22.314 29.875 1.00 16.30 ? 181 VAL A CB 1 ATOM 1339 C CG1 . VAL A 1 181 ? 64.562 20.924 29.302 1.00 18.18 ? 181 VAL A CG1 1 ATOM 1340 C CG2 . VAL A 1 181 ? 63.589 22.202 31.214 1.00 12.11 ? 181 VAL A CG2 1 ATOM 1341 N N . ASP A 1 182 ? 65.950 24.210 27.937 1.00 21.39 ? 182 ASP A N 1 ATOM 1342 C CA . ASP A 1 182 ? 66.536 24.492 26.633 1.00 23.02 ? 182 ASP A CA 1 ATOM 1343 C C . ASP A 1 182 ? 66.974 25.940 26.718 1.00 23.11 ? 182 ASP A C 1 ATOM 1344 O O . ASP A 1 182 ? 66.155 26.826 26.947 1.00 24.57 ? 182 ASP A O 1 ATOM 1345 C CB . ASP A 1 182 ? 65.489 24.326 25.526 1.00 24.13 ? 182 ASP A CB 1 ATOM 1346 C CG . ASP A 1 182 ? 66.092 24.384 24.135 1.00 23.75 ? 182 ASP A CG 1 ATOM 1347 O OD1 . ASP A 1 182 ? 66.663 25.425 23.768 1.00 24.65 ? 182 ASP A OD1 1 ATOM 1348 O OD2 . ASP A 1 182 ? 65.995 23.386 23.406 1.00 24.66 ? 182 ASP A OD2 1 ATOM 1349 N N . GLN A 1 183 ? 68.257 26.188 26.514 1.00 26.48 ? 183 GLN A N 1 ATOM 1350 C CA . GLN A 1 183 ? 68.760 27.550 26.608 1.00 30.49 ? 183 GLN A CA 1 ATOM 1351 C C . GLN A 1 183 ? 68.583 28.434 25.377 1.00 29.95 ? 183 GLN A C 1 ATOM 1352 O O . GLN A 1 183 ? 68.944 29.612 25.408 1.00 30.34 ? 183 GLN A O 1 ATOM 1353 C CB . GLN A 1 183 ? 70.221 27.552 27.080 1.00 34.94 ? 183 GLN A CB 1 ATOM 1354 C CG . GLN A 1 183 ? 70.439 26.935 28.479 1.00 39.60 ? 183 GLN A CG 1 ATOM 1355 C CD . GLN A 1 183 ? 69.826 27.734 29.640 1.00 41.78 ? 183 GLN A CD 1 ATOM 1356 O OE1 . GLN A 1 183 ? 70.068 27.412 30.804 1.00 43.68 ? 183 GLN A OE1 1 ATOM 1357 N NE2 . GLN A 1 183 ? 69.059 28.779 29.333 1.00 40.40 ? 183 GLN A NE2 1 ATOM 1358 N N . THR A 1 184 ? 68.041 27.874 24.299 1.00 28.48 ? 184 THR A N 1 ATOM 1359 C CA . THR A 1 184 ? 67.813 28.651 23.084 1.00 27.44 ? 184 THR A CA 1 ATOM 1360 C C . THR A 1 184 ? 66.418 29.272 23.090 1.00 25.96 ? 184 THR A C 1 ATOM 1361 O O . THR A 1 184 ? 66.163 30.245 22.378 1.00 27.07 ? 184 THR A O 1 ATOM 1362 C CB . THR A 1 184 ? 67.978 27.801 21.801 1.00 29.85 ? 184 THR A CB 1 ATOM 1363 O OG1 . THR A 1 184 ? 66.901 26.859 21.687 1.00 32.16 ? 184 THR A OG1 1 ATOM 1364 C CG2 . THR A 1 184 ? 69.297 27.041 21.828 1.00 31.42 ? 184 THR A CG2 1 ATOM 1365 N N . ILE A 1 185 ? 65.514 28.699 23.884 1.00 21.84 ? 185 ILE A N 1 ATOM 1366 C CA . ILE A 1 185 ? 64.147 29.206 23.974 1.00 20.34 ? 185 ILE A CA 1 ATOM 1367 C C . ILE A 1 185 ? 63.721 29.489 25.415 1.00 18.76 ? 185 ILE A C 1 ATOM 1368 O O . ILE A 1 185 ? 64.225 28.875 26.359 1.00 19.24 ? 185 ILE A O 1 ATOM 1369 C CB . ILE A 1 185 ? 63.124 28.227 23.356 1.00 19.77 ? 185 ILE A CB 1 ATOM 1370 C CG1 . ILE A 1 185 ? 63.273 26.846 23.999 1.00 19.20 ? 185 ILE A CG1 1 ATOM 1371 C CG2 . ILE A 1 185 ? 63.286 28.185 21.846 1.00 19.99 ? 185 ILE A CG2 1 ATOM 1372 C CD1 . ILE A 1 185 ? 62.080 25.961 23.842 1.00 19.36 ? 185 ILE A CD1 1 ATOM 1373 N N . ASP A 1 186 ? 62.779 30.411 25.591 1.00 16.96 ? 186 ASP A N 1 ATOM 1374 C CA . ASP A 1 186 ? 62.255 30.767 26.905 1.00 17.30 ? 186 ASP A CA 1 ATOM 1375 C C . ASP A 1 186 ? 60.761 30.488 26.992 1.00 16.75 ? 186 ASP A C 1 ATOM 1376 O O . ASP A 1 186 ? 60.065 30.441 25.975 1.00 16.10 ? 186 ASP A O 1 ATOM 1377 C CB . ASP A 1 186 ? 62.466 32.278 27.191 1.00 20.99 ? 186 ASP A CB 1 ATOM 1378 C CG . ASP A 1 186 ? 63.849 32.619 27.686 1.00 30.54 ? 186 ASP A CG 1 ATOM 1379 O OD1 . ASP A 1 186 ? 64.627 31.730 28.095 1.00 32.69 ? 186 ASP A OD1 1 ATOM 1380 O OD2 . ASP A 1 186 ? 64.173 33.845 27.666 1.00 36.32 ? 186 ASP A OD2 1 ATOM 1381 H H . ASP A 1 186 ? 62.438 30.858 24.815 1.00 0.00 ? 186 ASP A H 1 ATOM 1382 N N . ALA A 1 187 ? 60.301 30.332 28.216 1.00 12.81 ? 187 ALA A N 1 ATOM 1383 C CA . ALA A 1 187 ? 58.901 30.107 28.534 1.00 9.91 ? 187 ALA A CA 1 ATOM 1384 C C . ALA A 1 187 ? 58.142 29.107 27.656 1.00 9.37 ? 187 ALA A C 1 ATOM 1385 O O . ALA A 1 187 ? 57.077 29.428 27.127 1.00 8.81 ? 187 ALA A O 1 ATOM 1386 C CB . ALA A 1 187 ? 58.158 31.440 28.594 1.00 9.41 ? 187 ALA A CB 1 ATOM 1387 N N . ALA A 1 188 ? 58.667 27.892 27.542 1.00 5.94 ? 188 ALA A N 1 ATOM 1388 C CA . ALA A 1 188 ? 58.005 26.840 26.764 1.00 8.40 ? 188 ALA A CA 1 ATOM 1389 C C . ALA A 1 188 ? 56.994 26.151 27.685 1.00 9.47 ? 188 ALA A C 1 ATOM 1390 O O . ALA A 1 188 ? 57.388 25.480 28.638 1.00 11.07 ? 188 ALA A O 1 ATOM 1391 C CB . ALA A 1 188 ? 59.021 25.844 26.268 1.00 4.43 ? 188 ALA A CB 1 ATOM 1392 N N . PRO A 1 189 ? 55.683 26.303 27.406 1.00 12.29 ? 189 PRO A N 1 ATOM 1393 C CA . PRO A 1 189 ? 54.542 25.748 28.151 1.00 11.25 ? 189 PRO A CA 1 ATOM 1394 C C . PRO A 1 189 ? 54.496 24.229 28.232 1.00 10.53 ? 189 PRO A C 1 ATOM 1395 O O . PRO A 1 189 ? 54.911 23.541 27.295 1.00 11.32 ? 189 PRO A O 1 ATOM 1396 C CB . PRO A 1 189 ? 53.332 26.250 27.352 1.00 12.69 ? 189 PRO A CB 1 ATOM 1397 C CG . PRO A 1 189 ? 53.844 27.417 26.602 1.00 13.14 ? 189 PRO A CG 1 ATOM 1398 C CD . PRO A 1 189 ? 55.206 26.982 26.190 1.00 13.78 ? 189 PRO A CD 1 ATOM 1399 N N . PHE A 1 190 ? 53.971 23.708 29.341 1.00 7.70 ? 190 PHE A N 1 ATOM 1400 C CA . PHE A 1 190 ? 53.839 22.268 29.499 1.00 8.18 ? 190 PHE A CA 1 ATOM 1401 C C . PHE A 1 190 ? 52.501 21.799 28.912 1.00 7.68 ? 190 PHE A C 1 ATOM 1402 O O . PHE A 1 190 ? 52.345 20.629 28.564 1.00 7.90 ? 190 PHE A O 1 ATOM 1403 C CB . PHE A 1 190 ? 54.022 21.837 30.961 1.00 10.92 ? 190 PHE A CB 1 ATOM 1404 C CG . PHE A 1 190 ? 55.452 21.947 31.449 1.00 11.67 ? 190 PHE A CG 1 ATOM 1405 C CD1 . PHE A 1 190 ? 56.515 22.017 30.542 1.00 10.27 ? 190 PHE A CD1 1 ATOM 1406 C CD2 . PHE A 1 190 ? 55.736 21.996 32.814 1.00 15.07 ? 190 PHE A CD2 1 ATOM 1407 C CE1 . PHE A 1 190 ? 57.841 22.134 30.987 1.00 13.94 ? 190 PHE A CE1 1 ATOM 1408 C CE2 . PHE A 1 190 ? 57.065 22.113 33.280 1.00 13.58 ? 190 PHE A CE2 1 ATOM 1409 C CZ . PHE A 1 190 ? 58.113 22.184 32.364 1.00 13.90 ? 190 PHE A CZ 1 ATOM 1410 N N . ASP A 1 191 ? 51.541 22.716 28.816 1.00 6.68 ? 191 ASP A N 1 ATOM 1411 C CA . ASP A 1 191 ? 50.251 22.427 28.198 1.00 7.26 ? 191 ASP A CA 1 ATOM 1412 C C . ASP A 1 191 ? 49.803 23.658 27.413 1.00 7.89 ? 191 ASP A C 1 ATOM 1413 O O . ASP A 1 191 ? 50.404 24.727 27.563 1.00 8.92 ? 191 ASP A O 1 ATOM 1414 C CB . ASP A 1 191 ? 49.198 21.876 29.197 1.00 4.04 ? 191 ASP A CB 1 ATOM 1415 C CG . ASP A 1 191 ? 48.472 22.937 30.020 1.00 2.00 ? 191 ASP A CG 1 ATOM 1416 O OD1 . ASP A 1 191 ? 48.698 24.160 29.902 1.00 7.73 ? 191 ASP A OD1 1 ATOM 1417 O OD2 . ASP A 1 191 ? 47.624 22.517 30.832 1.00 2.03 ? 191 ASP A OD2 1 ATOM 1418 N N . SER A 1 192 ? 48.766 23.515 26.580 1.00 10.54 ? 192 SER A N 1 ATOM 1419 C CA . SER A 1 192 ? 48.283 24.618 25.742 1.00 9.96 ? 192 SER A CA 1 ATOM 1420 C C . SER A 1 192 ? 47.598 25.767 26.462 1.00 10.88 ? 192 SER A C 1 ATOM 1421 O O . SER A 1 192 ? 47.351 26.813 25.864 1.00 12.85 ? 192 SER A O 1 ATOM 1422 C CB . SER A 1 192 ? 47.375 24.100 24.611 1.00 10.97 ? 192 SER A CB 1 ATOM 1423 O OG . SER A 1 192 ? 46.190 23.482 25.102 1.00 13.04 ? 192 SER A OG 1 ATOM 1424 N N . THR A 1 193 ? 47.265 25.572 27.736 1.00 10.48 ? 193 THR A N 1 ATOM 1425 C CA . THR A 1 193 ? 46.611 26.614 28.532 1.00 9.33 ? 193 THR A CA 1 ATOM 1426 C C . THR A 1 193 ? 47.432 26.903 29.799 1.00 10.02 ? 193 THR A C 1 ATOM 1427 O O . THR A 1 193 ? 46.996 26.587 30.925 1.00 8.88 ? 193 THR A O 1 ATOM 1428 C CB . THR A 1 193 ? 45.209 26.169 28.941 1.00 6.60 ? 193 THR A CB 1 ATOM 1429 O OG1 . THR A 1 193 ? 45.276 24.845 29.484 1.00 5.10 ? 193 THR A OG1 1 ATOM 1430 C CG2 . THR A 1 193 ? 44.266 26.160 27.723 1.00 13.35 ? 193 THR A CG2 1 ATOM 1431 N N . PRO A 1 194 ? 48.634 27.476 29.636 1.00 11.22 ? 194 PRO A N 1 ATOM 1432 C CA . PRO A 1 194 ? 49.527 27.795 30.757 1.00 11.17 ? 194 PRO A CA 1 ATOM 1433 C C . PRO A 1 194 ? 49.035 28.824 31.761 1.00 11.85 ? 194 PRO A C 1 ATOM 1434 O O . PRO A 1 194 ? 49.697 29.048 32.775 1.00 10.47 ? 194 PRO A O 1 ATOM 1435 C CB . PRO A 1 194 ? 50.805 28.247 30.057 1.00 11.10 ? 194 PRO A CB 1 ATOM 1436 C CG . PRO A 1 194 ? 50.300 28.856 28.785 1.00 12.19 ? 194 PRO A CG 1 ATOM 1437 C CD . PRO A 1 194 ? 49.243 27.878 28.355 1.00 10.27 ? 194 PRO A CD 1 ATOM 1438 N N . PHE A 1 195 ? 47.889 29.447 31.494 1.00 8.56 ? 195 PHE A N 1 ATOM 1439 C CA . PHE A 1 195 ? 47.339 30.439 32.407 1.00 7.06 ? 195 PHE A CA 1 ATOM 1440 C C . PHE A 1 195 ? 46.023 29.939 32.961 1.00 6.34 ? 195 PHE A C 1 ATOM 1441 O O . PHE A 1 195 ? 45.258 30.695 33.565 1.00 9.72 ? 195 PHE A O 1 ATOM 1442 C CB . PHE A 1 195 ? 47.129 31.775 31.697 1.00 8.38 ? 195 PHE A CB 1 ATOM 1443 C CG . PHE A 1 195 ? 48.322 32.242 30.937 1.00 11.50 ? 195 PHE A CG 1 ATOM 1444 C CD1 . PHE A 1 195 ? 49.506 32.543 31.597 1.00 10.28 ? 195 PHE A CD1 1 ATOM 1445 C CD2 . PHE A 1 195 ? 48.279 32.343 29.554 1.00 9.92 ? 195 PHE A CD2 1 ATOM 1446 C CE1 . PHE A 1 195 ? 50.631 32.935 30.895 1.00 12.92 ? 195 PHE A CE1 1 ATOM 1447 C CE2 . PHE A 1 195 ? 49.401 32.736 28.833 1.00 12.16 ? 195 PHE A CE2 1 ATOM 1448 C CZ . PHE A 1 195 ? 50.580 33.031 29.503 1.00 16.34 ? 195 PHE A CZ 1 ATOM 1449 N N . THR A 1 196 ? 45.768 28.650 32.763 1.00 7.94 ? 196 THR A N 1 ATOM 1450 C CA . THR A 1 196 ? 44.528 28.044 33.224 1.00 10.02 ? 196 THR A CA 1 ATOM 1451 C C . THR A 1 196 ? 44.800 26.725 33.952 1.00 8.72 ? 196 THR A C 1 ATOM 1452 O O . THR A 1 196 ? 45.468 25.824 33.418 1.00 11.08 ? 196 THR A O 1 ATOM 1453 C CB . THR A 1 196 ? 43.567 27.815 32.032 1.00 11.04 ? 196 THR A CB 1 ATOM 1454 O OG1 . THR A 1 196 ? 43.447 29.037 31.288 1.00 12.89 ? 196 THR A OG1 1 ATOM 1455 C CG2 . THR A 1 196 ? 42.184 27.412 32.519 1.00 9.48 ? 196 THR A CG2 1 ATOM 1456 N N . PHE A 1 197 ? 44.290 26.630 35.178 1.00 11.53 ? 197 PHE A N 1 ATOM 1457 C CA . PHE A 1 197 ? 44.458 25.447 36.007 1.00 9.26 ? 197 PHE A CA 1 ATOM 1458 C C . PHE A 1 197 ? 43.391 24.415 35.625 1.00 10.01 ? 197 PHE A C 1 ATOM 1459 O O . PHE A 1 197 ? 42.388 24.235 36.318 1.00 10.26 ? 197 PHE A O 1 ATOM 1460 C CB . PHE A 1 197 ? 44.345 25.838 37.484 1.00 10.75 ? 197 PHE A CB 1 ATOM 1461 C CG . PHE A 1 197 ? 44.895 24.803 38.425 1.00 11.13 ? 197 PHE A CG 1 ATOM 1462 C CD1 . PHE A 1 197 ? 46.267 24.729 38.666 1.00 12.52 ? 197 PHE A CD1 1 ATOM 1463 C CD2 . PHE A 1 197 ? 44.046 23.892 39.055 1.00 10.28 ? 197 PHE A CD2 1 ATOM 1464 C CE1 . PHE A 1 197 ? 46.791 23.758 39.522 1.00 12.13 ? 197 PHE A CE1 1 ATOM 1465 C CE2 . PHE A 1 197 ? 44.556 22.914 39.913 1.00 13.15 ? 197 PHE A CE2 1 ATOM 1466 C CZ . PHE A 1 197 ? 45.931 22.847 40.144 1.00 10.20 ? 197 PHE A CZ 1 ATOM 1467 N N . ASP A 1 198 ? 43.640 23.714 34.528 1.00 11.84 ? 198 ASP A N 1 ATOM 1468 C CA . ASP A 1 198 ? 42.702 22.723 34.011 1.00 10.24 ? 198 ASP A CA 1 ATOM 1469 C C . ASP A 1 198 ? 43.380 21.379 33.824 1.00 9.82 ? 198 ASP A C 1 ATOM 1470 O O . ASP A 1 198 ? 44.553 21.218 34.170 1.00 10.50 ? 198 ASP A O 1 ATOM 1471 C CB . ASP A 1 198 ? 42.114 23.211 32.673 1.00 11.72 ? 198 ASP A CB 1 ATOM 1472 C CG . ASP A 1 198 ? 43.190 23.635 31.665 1.00 13.07 ? 198 ASP A CG 1 ATOM 1473 O OD1 . ASP A 1 198 ? 44.390 23.372 31.899 1.00 9.32 ? 198 ASP A OD1 1 ATOM 1474 O OD2 . ASP A 1 198 ? 42.832 24.237 30.631 1.00 9.96 ? 198 ASP A OD2 1 ATOM 1475 N N . THR A 1 199 ? 42.690 20.454 33.166 1.00 9.64 ? 199 THR A N 1 ATOM 1476 C CA . THR A 1 199 ? 43.227 19.126 32.942 1.00 7.34 ? 199 THR A CA 1 ATOM 1477 C C . THR A 1 199 ? 43.959 18.912 31.615 1.00 8.05 ? 199 THR A C 1 ATOM 1478 O O . THR A 1 199 ? 44.331 17.782 31.290 1.00 10.87 ? 199 THR A O 1 ATOM 1479 C CB . THR A 1 199 ? 42.118 18.070 33.094 1.00 11.60 ? 199 THR A CB 1 ATOM 1480 O OG1 . THR A 1 199 ? 41.189 18.177 32.001 1.00 11.11 ? 199 THR A OG1 1 ATOM 1481 C CG2 . THR A 1 199 ? 41.359 18.286 34.417 1.00 11.26 ? 199 THR A CG2 1 ATOM 1482 N N . GLN A 1 200 ? 44.176 19.974 30.841 1.00 8.00 ? 200 GLN A N 1 ATOM 1483 C CA . GLN A 1 200 ? 44.868 19.816 29.555 1.00 6.62 ? 200 GLN A CA 1 ATOM 1484 C C . GLN A 1 200 ? 46.218 19.089 29.641 1.00 7.53 ? 200 GLN A C 1 ATOM 1485 O O . GLN A 1 200 ? 46.518 18.238 28.802 1.00 8.16 ? 200 GLN A O 1 ATOM 1486 C CB . GLN A 1 200 ? 45.051 21.156 28.823 1.00 6.94 ? 200 GLN A CB 1 ATOM 1487 C CG . GLN A 1 200 ? 43.775 21.818 28.258 1.00 9.46 ? 200 GLN A CG 1 ATOM 1488 C CD . GLN A 1 200 ? 42.975 20.930 27.295 1.00 10.54 ? 200 GLN A CD 1 ATOM 1489 O OE1 . GLN A 1 200 ? 41.776 20.742 27.479 1.00 14.76 ? 200 GLN A OE1 1 ATOM 1490 N NE2 . GLN A 1 200 ? 43.626 20.408 26.268 1.00 8.21 ? 200 GLN A NE2 1 ATOM 1491 N N . VAL A 1 201 ? 47.027 19.391 30.661 1.00 6.81 ? 201 VAL A N 1 ATOM 1492 C CA . VAL A 1 201 ? 48.331 18.744 30.783 1.00 2.80 ? 201 VAL A CA 1 ATOM 1493 C C . VAL A 1 201 ? 48.249 17.221 30.826 1.00 2.00 ? 201 VAL A C 1 ATOM 1494 O O . VAL A 1 201 ? 49.056 16.536 30.205 1.00 2.24 ? 201 VAL A O 1 ATOM 1495 C CB . VAL A 1 201 ? 49.181 19.317 31.989 1.00 5.12 ? 201 VAL A CB 1 ATOM 1496 C CG1 . VAL A 1 201 ? 48.560 18.946 33.323 1.00 2.97 ? 201 VAL A CG1 1 ATOM 1497 C CG2 . VAL A 1 201 ? 50.614 18.818 31.906 1.00 4.31 ? 201 VAL A CG2 1 ATOM 1498 N N . PHE A 1 202 ? 47.259 16.678 31.522 1.00 2.00 ? 202 PHE A N 1 ATOM 1499 C CA . PHE A 1 202 ? 47.134 15.234 31.593 1.00 4.22 ? 202 PHE A CA 1 ATOM 1500 C C . PHE A 1 202 ? 46.791 14.630 30.227 1.00 6.91 ? 202 PHE A C 1 ATOM 1501 O O . PHE A 1 202 ? 47.304 13.573 29.857 1.00 3.21 ? 202 PHE A O 1 ATOM 1502 C CB . PHE A 1 202 ? 46.118 14.843 32.668 1.00 6.45 ? 202 PHE A CB 1 ATOM 1503 C CG . PHE A 1 202 ? 46.577 15.184 34.063 1.00 8.27 ? 202 PHE A CG 1 ATOM 1504 C CD1 . PHE A 1 202 ? 47.482 14.360 34.728 1.00 6.19 ? 202 PHE A CD1 1 ATOM 1505 C CD2 . PHE A 1 202 ? 46.161 16.354 34.680 1.00 7.76 ? 202 PHE A CD2 1 ATOM 1506 C CE1 . PHE A 1 202 ? 47.968 14.700 35.989 1.00 7.10 ? 202 PHE A CE1 1 ATOM 1507 C CE2 . PHE A 1 202 ? 46.645 16.707 35.949 1.00 11.11 ? 202 PHE A CE2 1 ATOM 1508 C CZ . PHE A 1 202 ? 47.548 15.876 36.598 1.00 5.89 ? 202 PHE A CZ 1 ATOM 1509 N N . LEU A 1 203 ? 45.962 15.339 29.461 1.00 8.02 ? 203 LEU A N 1 ATOM 1510 C CA . LEU A 1 203 ? 45.571 14.900 28.123 1.00 9.09 ? 203 LEU A CA 1 ATOM 1511 C C . LEU A 1 203 ? 46.732 15.035 27.125 1.00 6.11 ? 203 LEU A C 1 ATOM 1512 O O . LEU A 1 203 ? 47.111 14.073 26.450 1.00 8.46 ? 203 LEU A O 1 ATOM 1513 C CB . LEU A 1 203 ? 44.368 15.730 27.633 1.00 12.34 ? 203 LEU A CB 1 ATOM 1514 C CG . LEU A 1 203 ? 43.905 15.601 26.168 1.00 15.80 ? 203 LEU A CG 1 ATOM 1515 C CD1 . LEU A 1 203 ? 43.596 14.164 25.836 1.00 16.37 ? 203 LEU A CD1 1 ATOM 1516 C CD2 . LEU A 1 203 ? 42.677 16.470 25.932 1.00 14.85 ? 203 LEU A CD2 1 ATOM 1517 N N . GLU A 1 204 ? 47.355 16.203 27.101 1.00 8.08 ? 204 GLU A N 1 ATOM 1518 C CA . GLU A 1 204 ? 48.422 16.474 26.156 1.00 6.41 ? 204 GLU A CA 1 ATOM 1519 C C . GLU A 1 204 ? 49.705 15.665 26.292 1.00 9.79 ? 204 GLU A C 1 ATOM 1520 O O . GLU A 1 204 ? 50.421 15.456 25.310 1.00 10.54 ? 204 GLU A O 1 ATOM 1521 C CB . GLU A 1 204 ? 48.668 17.974 26.097 1.00 6.07 ? 204 GLU A CB 1 ATOM 1522 C CG . GLU A 1 204 ? 47.410 18.693 25.631 1.00 8.26 ? 204 GLU A CG 1 ATOM 1523 C CD . GLU A 1 204 ? 47.509 20.191 25.666 1.00 8.51 ? 204 GLU A CD 1 ATOM 1524 O OE1 . GLU A 1 204 ? 48.623 20.735 25.586 1.00 12.51 ? 204 GLU A OE1 1 ATOM 1525 O OE2 . GLU A 1 204 ? 46.449 20.839 25.758 1.00 11.80 ? 204 GLU A OE2 1 ATOM 1526 N N . VAL A 1 205 ? 49.985 15.165 27.487 1.00 10.20 ? 205 VAL A N 1 ATOM 1527 C CA . VAL A 1 205 ? 51.175 14.348 27.675 1.00 6.84 ? 205 VAL A CA 1 ATOM 1528 C C . VAL A 1 205 ? 50.951 12.941 27.094 1.00 7.87 ? 205 VAL A C 1 ATOM 1529 O O . VAL A 1 205 ? 51.914 12.252 26.735 1.00 10.66 ? 205 VAL A O 1 ATOM 1530 C CB . VAL A 1 205 ? 51.591 14.310 29.181 1.00 7.01 ? 205 VAL A CB 1 ATOM 1531 C CG1 . VAL A 1 205 ? 52.658 13.250 29.439 1.00 5.66 ? 205 VAL A CG1 1 ATOM 1532 C CG2 . VAL A 1 205 ? 52.132 15.683 29.589 1.00 4.94 ? 205 VAL A CG2 1 ATOM 1533 N N . LEU A 1 206 ? 49.685 12.537 26.947 1.00 8.21 ? 206 LEU A N 1 ATOM 1534 C CA . LEU A 1 206 ? 49.343 11.219 26.398 1.00 9.65 ? 206 LEU A CA 1 ATOM 1535 C C . LEU A 1 206 ? 49.342 11.151 24.864 1.00 11.45 ? 206 LEU A C 1 ATOM 1536 O O . LEU A 1 206 ? 49.189 10.068 24.297 1.00 10.94 ? 206 LEU A O 1 ATOM 1537 C CB . LEU A 1 206 ? 47.991 10.737 26.945 1.00 10.28 ? 206 LEU A CB 1 ATOM 1538 C CG . LEU A 1 206 ? 47.938 10.369 28.438 1.00 10.94 ? 206 LEU A CG 1 ATOM 1539 C CD1 . LEU A 1 206 ? 46.506 10.123 28.890 1.00 11.14 ? 206 LEU A CD1 1 ATOM 1540 C CD2 . LEU A 1 206 ? 48.796 9.138 28.687 1.00 9.53 ? 206 LEU A CD2 1 ATOM 1541 N N . LEU A 1 207 ? 49.540 12.293 24.206 1.00 11.70 ? 207 LEU A N 1 ATOM 1542 C CA . LEU A 1 207 ? 49.571 12.376 22.743 1.00 13.03 ? 207 LEU A CA 1 ATOM 1543 C C . LEU A 1 207 ? 50.957 12.044 22.208 1.00 14.19 ? 207 LEU A C 1 ATOM 1544 O O . LEU A 1 207 ? 51.962 12.259 22.888 1.00 15.64 ? 207 LEU A O 1 ATOM 1545 C CB . LEU A 1 207 ? 49.191 13.784 22.268 1.00 11.71 ? 207 LEU A CB 1 ATOM 1546 C CG . LEU A 1 207 ? 47.783 14.314 22.546 1.00 16.27 ? 207 LEU A CG 1 ATOM 1547 C CD1 . LEU A 1 207 ? 47.727 15.785 22.198 1.00 15.41 ? 207 LEU A CD1 1 ATOM 1548 C CD2 . LEU A 1 207 ? 46.735 13.527 21.750 1.00 15.31 ? 207 LEU A CD2 1 ATOM 1549 N N . LYS A 1 208 ? 51.009 11.526 20.988 1.00 14.08 ? 208 LYS A N 1 ATOM 1550 C CA . LYS A 1 208 ? 52.273 11.179 20.359 1.00 15.86 ? 208 LYS A CA 1 ATOM 1551 C C . LYS A 1 208 ? 53.092 12.442 20.127 1.00 15.38 ? 208 LYS A C 1 ATOM 1552 O O . LYS A 1 208 ? 52.552 13.470 19.734 1.00 16.73 ? 208 LYS A O 1 ATOM 1553 C CB . LYS A 1 208 ? 52.021 10.479 19.023 1.00 20.50 ? 208 LYS A CB 1 ATOM 1554 C CG . LYS A 1 208 ? 53.280 9.862 18.415 1.00 28.75 ? 208 LYS A CG 1 ATOM 1555 C CD . LYS A 1 208 ? 53.054 9.411 16.977 1.00 34.91 ? 208 LYS A CD 1 ATOM 1556 C CE . LYS A 1 208 ? 53.832 10.282 15.992 1.00 38.48 ? 208 LYS A CE 1 ATOM 1557 N NZ . LYS A 1 208 ? 55.310 10.088 16.125 1.00 41.59 ? 208 LYS A NZ 1 ATOM 1558 N N . GLY A 1 209 ? 54.395 12.365 20.366 1.00 14.34 ? 209 GLY A N 1 ATOM 1559 C CA . GLY A 1 209 ? 55.252 13.519 20.167 1.00 15.26 ? 209 GLY A CA 1 ATOM 1560 C C . GLY A 1 209 ? 55.672 13.592 18.711 1.00 16.40 ? 209 GLY A C 1 ATOM 1561 O O . GLY A 1 209 ? 55.988 12.566 18.118 1.00 17.24 ? 209 GLY A O 1 ATOM 1562 N N . VAL A 1 210 ? 55.697 14.795 18.144 1.00 17.49 ? 210 VAL A N 1 ATOM 1563 C CA . VAL A 1 210 ? 56.065 14.979 16.738 1.00 18.15 ? 210 VAL A CA 1 ATOM 1564 C C . VAL A 1 210 ? 57.279 15.877 16.468 1.00 18.26 ? 210 VAL A C 1 ATOM 1565 O O . VAL A 1 210 ? 57.756 15.967 15.329 1.00 18.95 ? 210 VAL A O 1 ATOM 1566 C CB . VAL A 1 210 ? 54.849 15.499 15.918 1.00 15.09 ? 210 VAL A CB 1 ATOM 1567 C CG1 . VAL A 1 210 ? 53.693 14.528 16.048 1.00 14.40 ? 210 VAL A CG1 1 ATOM 1568 C CG2 . VAL A 1 210 ? 54.427 16.877 16.400 1.00 14.40 ? 210 VAL A CG2 1 ATOM 1569 N N . GLY A 1 211 ? 57.778 16.551 17.497 1.00 17.33 ? 211 GLY A N 1 ATOM 1570 C CA . GLY A 1 211 ? 58.935 17.414 17.309 1.00 15.05 ? 211 GLY A CA 1 ATOM 1571 C C . GLY A 1 211 ? 59.397 18.058 18.604 1.00 15.38 ? 211 GLY A C 1 ATOM 1572 O O . GLY A 1 211 ? 58.984 17.648 19.685 1.00 14.49 ? 211 GLY A O 1 ATOM 1573 N N . PHE A 1 212 ? 60.228 19.085 18.488 1.00 16.61 ? 212 PHE A N 1 ATOM 1574 C CA . PHE A 1 212 ? 60.764 19.798 19.642 1.00 17.51 ? 212 PHE A CA 1 ATOM 1575 C C . PHE A 1 212 ? 60.605 21.299 19.467 1.00 18.14 ? 212 PHE A C 1 ATOM 1576 O O . PHE A 1 212 ? 60.732 21.815 18.357 1.00 20.69 ? 212 PHE A O 1 ATOM 1577 C CB . PHE A 1 212 ? 62.247 19.478 19.826 1.00 15.02 ? 212 PHE A CB 1 ATOM 1578 C CG . PHE A 1 212 ? 62.518 18.058 20.206 1.00 16.17 ? 212 PHE A CG 1 ATOM 1579 C CD1 . PHE A 1 212 ? 62.517 17.670 21.537 1.00 15.63 ? 212 PHE A CD1 1 ATOM 1580 C CD2 . PHE A 1 212 ? 62.778 17.103 19.232 1.00 16.29 ? 212 PHE A CD2 1 ATOM 1581 C CE1 . PHE A 1 212 ? 62.769 16.357 21.892 1.00 14.77 ? 212 PHE A CE1 1 ATOM 1582 C CE2 . PHE A 1 212 ? 63.030 15.789 19.579 1.00 17.47 ? 212 PHE A CE2 1 ATOM 1583 C CZ . PHE A 1 212 ? 63.027 15.415 20.916 1.00 15.27 ? 212 PHE A CZ 1 ATOM 1584 N N . PRO A 1 213 ? 60.321 22.019 20.563 1.00 16.54 ? 213 PRO A N 1 ATOM 1585 C CA . PRO A 1 213 ? 60.136 23.470 20.595 1.00 16.20 ? 213 PRO A CA 1 ATOM 1586 C C . PRO A 1 213 ? 61.401 24.232 20.226 1.00 15.41 ? 213 PRO A C 1 ATOM 1587 O O . PRO A 1 213 ? 61.328 25.313 19.648 1.00 16.36 ? 213 PRO A O 1 ATOM 1588 C CB . PRO A 1 213 ? 59.767 23.735 22.053 1.00 17.24 ? 213 PRO A CB 1 ATOM 1589 C CG . PRO A 1 213 ? 59.187 22.467 22.503 1.00 18.74 ? 213 PRO A CG 1 ATOM 1590 C CD . PRO A 1 213 ? 60.059 21.438 21.889 1.00 17.40 ? 213 PRO A CD 1 ATOM 1591 N N . GLY A 1 214 ? 62.556 23.696 20.612 1.00 14.43 ? 214 GLY A N 1 ATOM 1592 C CA . GLY A 1 214 ? 63.822 24.345 20.314 1.00 15.79 ? 214 GLY A CA 1 ATOM 1593 C C . GLY A 1 214 ? 64.816 23.297 19.859 1.00 21.21 ? 214 GLY A C 1 ATOM 1594 O O . GLY A 1 214 ? 64.599 22.647 18.838 1.00 24.30 ? 214 GLY A O 1 ATOM 1595 N N . SER A 1 215 ? 65.895 23.113 20.617 1.00 24.15 ? 215 SER A N 1 ATOM 1596 C CA . SER A 1 215 ? 66.914 22.109 20.300 1.00 25.38 ? 215 SER A CA 1 ATOM 1597 C C . SER A 1 215 ? 66.315 20.737 20.605 1.00 27.38 ? 215 SER A C 1 ATOM 1598 O O . SER A 1 215 ? 65.356 20.622 21.370 1.00 29.83 ? 215 SER A O 1 ATOM 1599 C CB . SER A 1 215 ? 68.156 22.309 21.172 1.00 26.20 ? 215 SER A CB 1 ATOM 1600 O OG . SER A 1 215 ? 68.435 23.685 21.356 1.00 30.47 ? 215 SER A OG 1 ATOM 1601 N N . ALA A 1 216 ? 66.888 19.693 20.027 1.00 29.07 ? 216 ALA A N 1 ATOM 1602 C CA . ALA A 1 216 ? 66.383 18.347 20.249 1.00 30.61 ? 216 ALA A CA 1 ATOM 1603 C C . ALA A 1 216 ? 67.342 17.531 21.106 1.00 32.19 ? 216 ALA A C 1 ATOM 1604 O O . ALA A 1 216 ? 67.168 16.322 21.268 1.00 33.03 ? 216 ALA A O 1 ATOM 1605 C CB . ALA A 1 216 ? 66.154 17.657 18.913 1.00 31.71 ? 216 ALA A CB 1 ATOM 1606 N N . ASN A 1 217 ? 68.328 18.201 21.689 1.00 34.40 ? 217 ASN A N 1 ATOM 1607 C CA . ASN A 1 217 ? 69.337 17.539 22.512 1.00 35.75 ? 217 ASN A CA 1 ATOM 1608 C C . ASN A 1 217 ? 69.434 18.149 23.910 1.00 33.49 ? 217 ASN A C 1 ATOM 1609 O O . ASN A 1 217 ? 70.463 18.722 24.287 1.00 34.24 ? 217 ASN A O 1 ATOM 1610 C CB . ASN A 1 217 ? 70.704 17.606 21.812 1.00 40.25 ? 217 ASN A CB 1 ATOM 1611 C CG . ASN A 1 217 ? 71.104 19.033 21.421 1.00 44.88 ? 217 ASN A CG 1 ATOM 1612 O OD1 . ASN A 1 217 ? 70.272 19.956 21.403 1.00 46.49 ? 217 ASN A OD1 1 ATOM 1613 N ND2 . ASN A 1 217 ? 72.379 19.215 21.085 1.00 47.15 ? 217 ASN A ND2 1 ATOM 1614 N N . ASN A 1 218 ? 68.358 18.025 24.677 1.00 29.66 ? 218 ASN A N 1 ATOM 1615 C CA . ASN A 1 218 ? 68.325 18.563 26.031 1.00 23.98 ? 218 ASN A CA 1 ATOM 1616 C C . ASN A 1 218 ? 68.041 17.461 27.022 1.00 20.53 ? 218 ASN A C 1 ATOM 1617 O O . ASN A 1 218 ? 67.204 16.587 26.783 1.00 17.02 ? 218 ASN A O 1 ATOM 1618 C CB . ASN A 1 218 ? 67.275 19.663 26.158 1.00 24.72 ? 218 ASN A CB 1 ATOM 1619 C CG . ASN A 1 218 ? 67.515 20.804 25.192 1.00 28.03 ? 218 ASN A CG 1 ATOM 1620 O OD1 . ASN A 1 218 ? 66.654 21.130 24.374 1.00 29.47 ? 218 ASN A OD1 1 ATOM 1621 N ND2 . ASN A 1 218 ? 68.691 21.408 25.268 1.00 25.74 ? 218 ASN A ND2 1 ATOM 1622 N N . THR A 1 219 ? 68.766 17.485 28.129 1.00 19.24 ? 219 THR A N 1 ATOM 1623 C CA . THR A 1 219 ? 68.587 16.479 29.156 1.00 15.58 ? 219 THR A CA 1 ATOM 1624 C C . THR A 1 219 ? 67.222 16.673 29.796 1.00 9.22 ? 219 THR A C 1 ATOM 1625 O O . THR A 1 219 ? 66.787 17.800 30.017 1.00 11.27 ? 219 THR A O 1 ATOM 1626 C CB . THR A 1 219 ? 69.686 16.597 30.228 1.00 16.41 ? 219 THR A CB 1 ATOM 1627 O OG1 . THR A 1 219 ? 70.965 16.688 29.585 1.00 18.97 ? 219 THR A OG1 1 ATOM 1628 C CG2 . THR A 1 219 ? 69.674 15.380 31.130 1.00 19.14 ? 219 THR A CG2 1 ATOM 1629 N N . GLY A 1 220 ? 66.526 15.570 30.022 1.00 7.86 ? 220 GLY A N 1 ATOM 1630 C CA . GLY A 1 220 ? 65.228 15.639 30.652 1.00 10.91 ? 220 GLY A CA 1 ATOM 1631 C C . GLY A 1 220 ? 64.070 16.062 29.772 1.00 13.24 ? 220 GLY A C 1 ATOM 1632 O O . GLY A 1 220 ? 62.967 16.264 30.283 1.00 10.72 ? 220 GLY A O 1 ATOM 1633 N N . GLU A 1 221 ? 64.301 16.183 28.463 1.00 14.48 ? 221 GLU A N 1 ATOM 1634 C CA . GLU A 1 221 ? 63.239 16.575 27.532 1.00 16.14 ? 221 GLU A CA 1 ATOM 1635 C C . GLU A 1 221 ? 62.973 15.495 26.488 1.00 14.38 ? 221 GLU A C 1 ATOM 1636 O O . GLU A 1 221 ? 63.890 14.792 26.061 1.00 14.64 ? 221 GLU A O 1 ATOM 1637 C CB . GLU A 1 221 ? 63.584 17.896 26.835 1.00 15.94 ? 221 GLU A CB 1 ATOM 1638 C CG . GLU A 1 221 ? 62.564 18.314 25.770 1.00 19.11 ? 221 GLU A CG 1 ATOM 1639 C CD . GLU A 1 221 ? 62.948 19.580 25.017 1.00 20.26 ? 221 GLU A CD 1 ATOM 1640 O OE1 . GLU A 1 221 ? 64.131 19.962 25.027 1.00 23.52 ? 221 GLU A OE1 1 ATOM 1641 O OE2 . GLU A 1 221 ? 62.053 20.202 24.405 1.00 20.56 ? 221 GLU A OE2 1 ATOM 1642 N N . VAL A 1 222 ? 61.704 15.323 26.136 1.00 14.58 ? 222 VAL A N 1 ATOM 1643 C CA . VAL A 1 222 ? 61.298 14.350 25.120 1.00 13.21 ? 222 VAL A CA 1 ATOM 1644 C C . VAL A 1 222 ? 60.422 15.054 24.074 1.00 12.65 ? 222 VAL A C 1 ATOM 1645 O O . VAL A 1 222 ? 60.071 16.235 24.230 1.00 9.77 ? 222 VAL A O 1 ATOM 1646 C CB . VAL A 1 222 ? 60.560 13.116 25.726 1.00 10.44 ? 222 VAL A CB 1 ATOM 1647 C CG1 . VAL A 1 222 ? 61.542 12.228 26.475 1.00 11.64 ? 222 VAL A CG1 1 ATOM 1648 C CG2 . VAL A 1 222 ? 59.440 13.541 26.646 1.00 10.63 ? 222 VAL A CG2 1 ATOM 1649 N N . ALA A 1 223 ? 60.099 14.346 22.996 1.00 12.54 ? 223 ALA A N 1 ATOM 1650 C CA . ALA A 1 223 ? 59.292 14.917 21.920 1.00 10.26 ? 223 ALA A CA 1 ATOM 1651 C C . ALA A 1 223 ? 57.930 15.459 22.355 1.00 9.48 ? 223 ALA A C 1 ATOM 1652 O O . ALA A 1 223 ? 57.208 14.838 23.141 1.00 12.61 ? 223 ALA A O 1 ATOM 1653 C CB . ALA A 1 223 ? 59.136 13.903 20.783 1.00 10.42 ? 223 ALA A CB 1 ATOM 1654 N N . SER A 1 224 ? 57.599 16.631 21.821 1.00 11.75 ? 224 SER A N 1 ATOM 1655 C CA . SER A 1 224 ? 56.350 17.333 22.087 1.00 12.05 ? 224 SER A CA 1 ATOM 1656 C C . SER A 1 224 ? 55.349 17.158 20.943 1.00 12.40 ? 224 SER A C 1 ATOM 1657 O O . SER A 1 224 ? 55.749 16.995 19.782 1.00 11.79 ? 224 SER A O 1 ATOM 1658 C CB . SER A 1 224 ? 56.647 18.823 22.252 1.00 10.57 ? 224 SER A CB 1 ATOM 1659 O OG . SER A 1 224 ? 55.460 19.590 22.182 1.00 11.92 ? 224 SER A OG 1 ATOM 1660 N N . PRO A 1 225 ? 54.042 17.156 21.251 1.00 13.06 ? 225 PRO A N 1 ATOM 1661 C CA . PRO A 1 225 ? 52.959 16.997 20.274 1.00 12.58 ? 225 PRO A CA 1 ATOM 1662 C C . PRO A 1 225 ? 52.532 18.337 19.641 1.00 13.71 ? 225 PRO A C 1 ATOM 1663 O O . PRO A 1 225 ? 51.783 18.369 18.655 1.00 11.40 ? 225 PRO A O 1 ATOM 1664 C CB . PRO A 1 225 ? 51.829 16.416 21.118 1.00 12.15 ? 225 PRO A CB 1 ATOM 1665 C CG . PRO A 1 225 ? 52.008 17.132 22.420 1.00 10.82 ? 225 PRO A CG 1 ATOM 1666 C CD . PRO A 1 225 ? 53.507 17.044 22.631 1.00 12.39 ? 225 PRO A CD 1 ATOM 1667 N N . LEU A 1 226 ? 52.989 19.437 20.235 1.00 11.88 ? 226 LEU A N 1 ATOM 1668 C CA . LEU A 1 226 ? 52.654 20.779 19.767 1.00 12.15 ? 226 LEU A CA 1 ATOM 1669 C C . LEU A 1 226 ? 53.905 21.665 19.833 1.00 12.85 ? 226 LEU A C 1 ATOM 1670 O O . LEU A 1 226 ? 53.913 22.707 20.500 1.00 12.29 ? 226 LEU A O 1 ATOM 1671 C CB . LEU A 1 226 ? 51.538 21.399 20.633 1.00 12.49 ? 226 LEU A CB 1 ATOM 1672 C CG . LEU A 1 226 ? 50.047 20.999 20.627 1.00 17.02 ? 226 LEU A CG 1 ATOM 1673 C CD1 . LEU A 1 226 ? 49.514 20.858 19.215 1.00 16.10 ? 226 LEU A CD1 1 ATOM 1674 C CD2 . LEU A 1 226 ? 49.806 19.725 21.380 1.00 19.47 ? 226 LEU A CD2 1 ATOM 1675 N N . PRO A 1 227 ? 54.951 21.307 19.068 1.00 12.24 ? 227 PRO A N 1 ATOM 1676 C CA . PRO A 1 227 ? 56.207 22.059 19.048 1.00 13.85 ? 227 PRO A CA 1 ATOM 1677 C C . PRO A 1 227 ? 56.231 23.423 18.363 1.00 15.55 ? 227 PRO A C 1 ATOM 1678 O O . PRO A 1 227 ? 57.099 24.246 18.662 1.00 17.48 ? 227 PRO A O 1 ATOM 1679 C CB . PRO A 1 227 ? 57.164 21.085 18.366 1.00 13.37 ? 227 PRO A CB 1 ATOM 1680 C CG . PRO A 1 227 ? 56.288 20.409 17.369 1.00 11.43 ? 227 PRO A CG 1 ATOM 1681 C CD . PRO A 1 227 ? 55.026 20.139 18.170 1.00 11.00 ? 227 PRO A CD 1 ATOM 1682 N N . LEU A 1 228 ? 55.301 23.657 17.440 1.00 16.40 ? 228 LEU A N 1 ATOM 1683 C CA . LEU A 1 228 ? 55.255 24.919 16.707 1.00 14.45 ? 228 LEU A CA 1 ATOM 1684 C C . LEU A 1 228 ? 55.219 26.188 17.556 1.00 13.73 ? 228 LEU A C 1 ATOM 1685 O O . LEU A 1 228 ? 54.362 26.361 18.428 1.00 11.98 ? 228 LEU A O 1 ATOM 1686 C CB . LEU A 1 228 ? 54.077 24.934 15.724 1.00 14.10 ? 228 LEU A CB 1 ATOM 1687 C CG . LEU A 1 228 ? 53.948 26.186 14.848 1.00 14.70 ? 228 LEU A CG 1 ATOM 1688 C CD1 . LEU A 1 228 ? 55.172 26.337 13.964 1.00 15.36 ? 228 LEU A CD1 1 ATOM 1689 C CD2 . LEU A 1 228 ? 52.686 26.104 14.001 1.00 14.20 ? 228 LEU A CD2 1 ATOM 1690 N N . GLY A 1 229 ? 56.137 27.094 17.254 1.00 14.18 ? 229 GLY A N 1 ATOM 1691 C CA . GLY A 1 229 ? 56.189 28.359 17.946 1.00 15.72 ? 229 GLY A CA 1 ATOM 1692 C C . GLY A 1 229 ? 56.659 29.429 16.985 1.00 16.48 ? 229 GLY A C 1 ATOM 1693 O O . GLY A 1 229 ? 57.348 29.128 16.010 1.00 20.28 ? 229 GLY A O 1 ATOM 1694 N N . SER A 1 230 ? 56.273 30.672 17.237 1.00 18.26 ? 230 SER A N 1 ATOM 1695 C CA . SER A 1 230 ? 56.677 31.790 16.396 1.00 20.73 ? 230 SER A CA 1 ATOM 1696 C C . SER A 1 230 ? 56.895 33.011 17.278 1.00 19.31 ? 230 SER A C 1 ATOM 1697 O O . SER A 1 230 ? 56.003 33.406 18.033 1.00 18.61 ? 230 SER A O 1 ATOM 1698 C CB . SER A 1 230 ? 55.607 32.093 15.340 1.00 24.72 ? 230 SER A CB 1 ATOM 1699 O OG . SER A 1 230 ? 56.044 33.070 14.401 1.00 27.09 ? 230 SER A OG 1 ATOM 1700 N N . GLY A 1 231 ? 58.078 33.608 17.164 1.00 19.75 ? 231 GLY A N 1 ATOM 1701 C CA . GLY A 1 231 ? 58.411 34.781 17.954 1.00 21.95 ? 231 GLY A CA 1 ATOM 1702 C C . GLY A 1 231 ? 58.437 34.440 19.431 1.00 20.43 ? 231 GLY A C 1 ATOM 1703 O O . GLY A 1 231 ? 59.075 33.469 19.838 1.00 20.93 ? 231 GLY A O 1 ATOM 1704 N N . SER A 1 232 ? 57.686 35.205 20.220 1.00 20.61 ? 232 SER A N 1 ATOM 1705 C CA . SER A 1 232 ? 57.609 34.997 21.658 1.00 21.02 ? 232 SER A CA 1 ATOM 1706 C C . SER A 1 232 ? 56.704 33.832 22.050 1.00 20.06 ? 232 SER A C 1 ATOM 1707 O O . SER A 1 232 ? 56.801 33.321 23.168 1.00 20.27 ? 232 SER A O 1 ATOM 1708 C CB . SER A 1 232 ? 57.124 36.270 22.341 1.00 20.12 ? 232 SER A CB 1 ATOM 1709 O OG . SER A 1 232 ? 58.000 37.341 22.056 1.00 25.27 ? 232 SER A OG 1 ATOM 1710 N N . ASP A 1 233 ? 55.815 33.428 21.148 1.00 18.04 ? 233 ASP A N 1 ATOM 1711 C CA . ASP A 1 233 ? 54.903 32.320 21.412 1.00 16.07 ? 233 ASP A CA 1 ATOM 1712 C C . ASP A 1 233 ? 55.641 31.009 21.192 1.00 16.56 ? 233 ASP A C 1 ATOM 1713 O O . ASP A 1 233 ? 55.619 30.438 20.100 1.00 14.69 ? 233 ASP A O 1 ATOM 1714 C CB . ASP A 1 233 ? 53.677 32.401 20.500 1.00 18.40 ? 233 ASP A CB 1 ATOM 1715 C CG . ASP A 1 233 ? 52.889 33.679 20.694 1.00 21.75 ? 233 ASP A CG 1 ATOM 1716 O OD1 . ASP A 1 233 ? 53.184 34.437 21.645 1.00 22.20 ? 233 ASP A OD1 1 ATOM 1717 O OD2 . ASP A 1 233 ? 51.964 33.925 19.896 1.00 23.85 ? 233 ASP A OD2 1 ATOM 1718 N N . THR A 1 234 ? 56.327 30.556 22.236 1.00 14.84 ? 234 THR A N 1 ATOM 1719 C CA . THR A 1 234 ? 57.104 29.331 22.181 1.00 11.27 ? 234 THR A CA 1 ATOM 1720 C C . THR A 1 234 ? 56.196 28.109 22.199 1.00 9.97 ? 234 THR A C 1 ATOM 1721 O O . THR A 1 234 ? 55.101 28.144 22.768 1.00 11.33 ? 234 THR A O 1 ATOM 1722 C CB . THR A 1 234 ? 58.114 29.273 23.360 1.00 12.78 ? 234 THR A CB 1 ATOM 1723 O OG1 . THR A 1 234 ? 58.903 30.472 23.361 1.00 14.87 ? 234 THR A OG1 1 ATOM 1724 C CG2 . THR A 1 234 ? 59.046 28.075 23.219 1.00 11.79 ? 234 THR A CG2 1 ATOM 1725 N N . GLY A 1 235 ? 56.624 27.061 21.506 1.00 9.88 ? 235 GLY A N 1 ATOM 1726 C CA . GLY A 1 235 ? 55.857 25.832 21.460 1.00 11.47 ? 235 GLY A CA 1 ATOM 1727 C C . GLY A 1 235 ? 55.943 25.031 22.753 1.00 12.71 ? 235 GLY A C 1 ATOM 1728 O O . GLY A 1 235 ? 56.825 25.259 23.599 1.00 11.64 ? 235 GLY A O 1 ATOM 1729 N N . GLU A 1 236 ? 55.032 24.076 22.885 1.00 10.50 ? 236 GLU A N 1 ATOM 1730 C CA . GLU A 1 236 ? 54.936 23.211 24.048 1.00 10.20 ? 236 GLU A CA 1 ATOM 1731 C C . GLU A 1 236 ? 56.133 22.281 24.218 1.00 12.31 ? 236 GLU A C 1 ATOM 1732 O O . GLU A 1 236 ? 56.644 21.711 23.251 1.00 10.84 ? 236 GLU A O 1 ATOM 1733 C CB . GLU A 1 236 ? 53.634 22.405 23.975 1.00 10.38 ? 236 GLU A CB 1 ATOM 1734 C CG . GLU A 1 236 ? 53.512 21.261 24.989 1.00 7.91 ? 236 GLU A CG 1 ATOM 1735 C CD . GLU A 1 236 ? 52.114 20.680 25.050 1.00 4.61 ? 236 GLU A CD 1 ATOM 1736 O OE1 . GLU A 1 236 ? 51.150 21.467 25.148 1.00 4.21 ? 236 GLU A OE1 1 ATOM 1737 O OE2 . GLU A 1 236 ? 51.976 19.437 25.028 1.00 4.82 ? 236 GLU A OE2 1 ATOM 1738 N N . MET A 1 237 ? 56.585 22.145 25.460 1.00 11.91 ? 237 MET A N 1 ATOM 1739 C CA . MET A 1 237 ? 57.710 21.274 25.781 1.00 7.74 ? 237 MET A CA 1 ATOM 1740 C C . MET A 1 237 ? 57.178 20.116 26.625 1.00 6.41 ? 237 MET A C 1 ATOM 1741 O O . MET A 1 237 ? 56.166 20.258 27.314 1.00 7.06 ? 237 MET A O 1 ATOM 1742 C CB . MET A 1 237 ? 58.765 22.064 26.565 1.00 11.02 ? 237 MET A CB 1 ATOM 1743 C CG . MET A 1 237 ? 59.958 21.239 27.041 1.00 10.67 ? 237 MET A CG 1 ATOM 1744 S SD . MET A 1 237 ? 61.114 22.253 27.976 1.00 14.16 ? 237 MET A SD 1 ATOM 1745 C CE . MET A 1 237 ? 62.142 22.893 26.691 1.00 10.70 ? 237 MET A CE 1 ATOM 1746 N N . ARG A 1 238 ? 57.829 18.964 26.537 1.00 5.01 ? 238 ARG A N 1 ATOM 1747 C CA . ARG A 1 238 ? 57.429 17.802 27.314 1.00 7.65 ? 238 ARG A CA 1 ATOM 1748 C C . ARG A 1 238 ? 58.614 17.266 28.114 1.00 8.97 ? 238 ARG A C 1 ATOM 1749 O O . ARG A 1 238 ? 59.676 16.990 27.552 1.00 7.40 ? 238 ARG A O 1 ATOM 1750 C CB . ARG A 1 238 ? 56.876 16.691 26.414 1.00 4.31 ? 238 ARG A CB 1 ATOM 1751 C CG . ARG A 1 238 ? 56.477 15.436 27.176 1.00 5.83 ? 238 ARG A CG 1 ATOM 1752 C CD . ARG A 1 238 ? 55.915 14.354 26.263 1.00 8.11 ? 238 ARG A CD 1 ATOM 1753 N NE . ARG A 1 238 ? 54.622 14.738 25.706 1.00 8.67 ? 238 ARG A NE 1 ATOM 1754 C CZ . ARG A 1 238 ? 53.921 13.996 24.850 1.00 7.77 ? 238 ARG A CZ 1 ATOM 1755 N NH1 . ARG A 1 238 ? 54.384 12.825 24.442 1.00 6.98 ? 238 ARG A NH1 1 ATOM 1756 N NH2 . ARG A 1 238 ? 52.741 14.419 24.424 1.00 4.98 ? 238 ARG A NH2 1 ATOM 1757 N N . LEU A 1 239 ? 58.428 17.141 29.427 1.00 10.83 ? 239 LEU A N 1 ATOM 1758 C CA . LEU A 1 239 ? 59.475 16.622 30.319 1.00 10.01 ? 239 LEU A CA 1 ATOM 1759 C C . LEU A 1 239 ? 59.466 15.103 30.353 1.00 8.69 ? 239 LEU A C 1 ATOM 1760 O O . LEU A 1 239 ? 58.404 14.484 30.399 1.00 10.60 ? 239 LEU A O 1 ATOM 1761 C CB . LEU A 1 239 ? 59.268 17.128 31.749 1.00 7.46 ? 239 LEU A CB 1 ATOM 1762 C CG . LEU A 1 239 ? 59.360 18.626 31.975 1.00 6.35 ? 239 LEU A CG 1 ATOM 1763 C CD1 . LEU A 1 239 ? 59.197 18.896 33.459 1.00 5.63 ? 239 LEU A CD1 1 ATOM 1764 C CD2 . LEU A 1 239 ? 60.681 19.157 31.444 1.00 6.44 ? 239 LEU A CD2 1 ATOM 1765 N N . GLN A 1 240 ? 60.658 14.514 30.395 1.00 10.65 ? 240 GLN A N 1 ATOM 1766 C CA . GLN A 1 240 ? 60.825 13.065 30.460 1.00 9.99 ? 240 GLN A CA 1 ATOM 1767 C C . GLN A 1 240 ? 60.049 12.492 31.636 1.00 8.36 ? 240 GLN A C 1 ATOM 1768 O O . GLN A 1 240 ? 59.381 11.473 31.503 1.00 9.67 ? 240 GLN A O 1 ATOM 1769 C CB . GLN A 1 240 ? 62.310 12.710 30.610 1.00 8.96 ? 240 GLN A CB 1 ATOM 1770 C CG . GLN A 1 240 ? 62.652 11.214 30.503 1.00 13.38 ? 240 GLN A CG 1 ATOM 1771 C CD . GLN A 1 240 ? 62.457 10.404 31.799 1.00 19.22 ? 240 GLN A CD 1 ATOM 1772 O OE1 . GLN A 1 240 ? 62.164 9.206 31.748 1.00 20.25 ? 240 GLN A OE1 1 ATOM 1773 N NE2 . GLN A 1 240 ? 62.654 11.043 32.951 1.00 18.53 ? 240 GLN A NE2 1 ATOM 1774 N N . SER A 1 241 ? 60.161 13.145 32.789 1.00 8.41 ? 241 SER A N 1 ATOM 1775 C CA . SER A 1 241 ? 59.490 12.696 34.009 1.00 7.19 ? 241 SER A CA 1 ATOM 1776 C C . SER A 1 241 ? 57.973 12.671 33.890 1.00 5.64 ? 241 SER A C 1 ATOM 1777 O O . SER A 1 241 ? 57.337 11.726 34.348 1.00 7.29 ? 241 SER A O 1 ATOM 1778 C CB . SER A 1 241 ? 59.927 13.546 35.210 1.00 4.77 ? 241 SER A CB 1 ATOM 1779 O OG . SER A 1 241 ? 59.849 14.933 34.927 1.00 7.59 ? 241 SER A OG 1 ATOM 1780 N N . ASP A 1 242 ? 57.391 13.711 33.293 1.00 7.90 ? 242 ASP A N 1 ATOM 1781 C CA . ASP A 1 242 ? 55.938 13.751 33.100 1.00 9.44 ? 242 ASP A CA 1 ATOM 1782 C C . ASP A 1 242 ? 55.518 12.618 32.161 1.00 9.24 ? 242 ASP A C 1 ATOM 1783 O O . ASP A 1 242 ? 54.552 11.906 32.423 1.00 11.12 ? 242 ASP A O 1 ATOM 1784 C CB . ASP A 1 242 ? 55.495 15.115 32.560 1.00 10.19 ? 242 ASP A CB 1 ATOM 1785 C CG . ASP A 1 242 ? 55.401 16.174 33.653 1.00 13.90 ? 242 ASP A CG 1 ATOM 1786 O OD1 . ASP A 1 242 ? 55.421 15.802 34.843 1.00 13.96 ? 242 ASP A OD1 1 ATOM 1787 O OD2 . ASP A 1 242 ? 55.297 17.375 33.328 1.00 11.39 ? 242 ASP A OD2 1 ATOM 1788 N N . PHE A 1 243 ? 56.305 12.413 31.110 1.00 8.97 ? 243 PHE A N 1 ATOM 1789 C CA . PHE A 1 243 ? 56.063 11.357 30.142 1.00 6.51 ? 243 PHE A CA 1 ATOM 1790 C C . PHE A 1 243 ? 56.151 9.988 30.819 1.00 7.28 ? 243 PHE A C 1 ATOM 1791 O O . PHE A 1 243 ? 55.261 9.143 30.662 1.00 4.62 ? 243 PHE A O 1 ATOM 1792 C CB . PHE A 1 243 ? 57.105 11.472 29.025 1.00 11.66 ? 243 PHE A CB 1 ATOM 1793 C CG . PHE A 1 243 ? 56.995 10.405 27.969 1.00 16.32 ? 243 PHE A CG 1 ATOM 1794 C CD1 . PHE A 1 243 ? 55.955 10.429 27.039 1.00 17.47 ? 243 PHE A CD1 1 ATOM 1795 C CD2 . PHE A 1 243 ? 57.928 9.374 27.903 1.00 16.90 ? 243 PHE A CD2 1 ATOM 1796 C CE1 . PHE A 1 243 ? 55.848 9.442 26.059 1.00 17.98 ? 243 PHE A CE1 1 ATOM 1797 C CE2 . PHE A 1 243 ? 57.830 8.380 26.926 1.00 20.54 ? 243 PHE A CE2 1 ATOM 1798 C CZ . PHE A 1 243 ? 56.786 8.414 26.003 1.00 17.01 ? 243 PHE A CZ 1 ATOM 1799 N N . ALA A 1 244 ? 57.213 9.793 31.603 1.00 6.56 ? 244 ALA A N 1 ATOM 1800 C CA . ALA A 1 244 ? 57.463 8.539 32.314 1.00 4.72 ? 244 ALA A CA 1 ATOM 1801 C C . ALA A 1 244 ? 56.352 8.187 33.296 1.00 3.76 ? 244 ALA A C 1 ATOM 1802 O O . ALA A 1 244 ? 55.903 7.043 33.339 1.00 5.30 ? 244 ALA A O 1 ATOM 1803 C CB . ALA A 1 244 ? 58.827 8.596 33.021 1.00 5.01 ? 244 ALA A CB 1 ATOM 1804 N N . LEU A 1 245 ? 55.879 9.176 34.048 1.00 5.81 ? 245 LEU A N 1 ATOM 1805 C CA . LEU A 1 245 ? 54.793 8.955 35.003 1.00 7.97 ? 245 LEU A CA 1 ATOM 1806 C C . LEU A 1 245 ? 53.481 8.623 34.292 1.00 10.24 ? 245 LEU A C 1 ATOM 1807 O O . LEU A 1 245 ? 52.651 7.882 34.814 1.00 11.75 ? 245 LEU A O 1 ATOM 1808 C CB . LEU A 1 245 ? 54.588 10.196 35.873 1.00 7.97 ? 245 LEU A CB 1 ATOM 1809 C CG . LEU A 1 245 ? 55.697 10.413 36.903 1.00 10.18 ? 245 LEU A CG 1 ATOM 1810 C CD1 . LEU A 1 245 ? 55.639 11.817 37.444 1.00 9.14 ? 245 LEU A CD1 1 ATOM 1811 C CD2 . LEU A 1 245 ? 55.566 9.375 38.003 1.00 9.44 ? 245 LEU A CD2 1 ATOM 1812 N N . ALA A 1 246 ? 53.279 9.202 33.113 1.00 11.91 ? 246 ALA A N 1 ATOM 1813 C CA . ALA A 1 246 ? 52.055 8.947 32.352 1.00 12.08 ? 246 ALA A CA 1 ATOM 1814 C C . ALA A 1 246 ? 51.995 7.523 31.795 1.00 11.81 ? 246 ALA A C 1 ATOM 1815 O O . ALA A 1 246 ? 50.912 7.026 31.480 1.00 15.07 ? 246 ALA A O 1 ATOM 1816 C CB . ALA A 1 246 ? 51.914 9.971 31.217 1.00 9.35 ? 246 ALA A CB 1 ATOM 1817 N N . HIS A 1 247 ? 53.147 6.864 31.679 1.00 9.48 ? 247 HIS A N 1 ATOM 1818 C CA . HIS A 1 247 ? 53.198 5.515 31.133 1.00 10.35 ? 247 HIS A CA 1 ATOM 1819 C C . HIS A 1 247 ? 53.682 4.383 32.037 1.00 12.68 ? 247 HIS A C 1 ATOM 1820 O O . HIS A 1 247 ? 53.707 3.223 31.608 1.00 13.65 ? 247 HIS A O 1 ATOM 1821 C CB . HIS A 1 247 ? 54.027 5.519 29.851 1.00 11.26 ? 247 HIS A CB 1 ATOM 1822 C CG . HIS A 1 247 ? 53.440 6.373 28.771 1.00 11.28 ? 247 HIS A CG 1 ATOM 1823 N ND1 . HIS A 1 247 ? 52.193 6.137 28.234 1.00 13.83 ? 247 HIS A ND1 1 ATOM 1824 C CD2 . HIS A 1 247 ? 53.908 7.485 28.163 1.00 12.72 ? 247 HIS A CD2 1 ATOM 1825 C CE1 . HIS A 1 247 ? 51.915 7.071 27.343 1.00 10.81 ? 247 HIS A CE1 1 ATOM 1826 N NE2 . HIS A 1 247 ? 52.940 7.900 27.279 1.00 14.55 ? 247 HIS A NE2 1 ATOM 1827 N N . ASP A 1 248 ? 54.091 4.696 33.265 1.00 12.67 ? 248 ASP A N 1 ATOM 1828 C CA . ASP A 1 248 ? 54.568 3.660 34.187 1.00 7.89 ? 248 ASP A CA 1 ATOM 1829 C C . ASP A 1 248 ? 53.378 2.927 34.791 1.00 5.60 ? 248 ASP A C 1 ATOM 1830 O O . ASP A 1 248 ? 52.389 3.558 35.153 1.00 8.46 ? 248 ASP A O 1 ATOM 1831 C CB . ASP A 1 248 ? 55.420 4.292 35.296 1.00 9.45 ? 248 ASP A CB 1 ATOM 1832 C CG . ASP A 1 248 ? 56.102 3.255 36.165 1.00 7.46 ? 248 ASP A CG 1 ATOM 1833 O OD1 . ASP A 1 248 ? 55.419 2.646 37.000 1.00 6.74 ? 248 ASP A OD1 1 ATOM 1834 O OD2 . ASP A 1 248 ? 57.310 3.014 35.984 1.00 8.95 ? 248 ASP A OD2 1 ATOM 1835 N N . PRO A 1 249 ? 53.456 1.585 34.922 1.00 8.30 ? 249 PRO A N 1 ATOM 1836 C CA . PRO A 1 249 ? 52.379 0.757 35.492 1.00 9.82 ? 249 PRO A CA 1 ATOM 1837 C C . PRO A 1 249 ? 51.869 1.210 36.868 1.00 11.97 ? 249 PRO A C 1 ATOM 1838 O O . PRO A 1 249 ? 50.711 0.969 37.228 1.00 12.24 ? 249 PRO A O 1 ATOM 1839 C CB . PRO A 1 249 ? 53.033 -0.618 35.599 1.00 10.52 ? 249 PRO A CB 1 ATOM 1840 C CG . PRO A 1 249 ? 53.971 -0.635 34.471 1.00 9.22 ? 249 PRO A CG 1 ATOM 1841 C CD . PRO A 1 249 ? 54.584 0.736 34.495 1.00 7.04 ? 249 PRO A CD 1 ATOM 1842 N N . ARG A 1 250 ? 52.734 1.859 37.638 1.00 13.23 ? 250 ARG A N 1 ATOM 1843 C CA . ARG A 1 250 ? 52.370 2.321 38.974 1.00 13.41 ? 250 ARG A CA 1 ATOM 1844 C C . ARG A 1 250 ? 51.519 3.577 38.964 1.00 13.35 ? 250 ARG A C 1 ATOM 1845 O O . ARG A 1 250 ? 50.665 3.761 39.831 1.00 11.60 ? 250 ARG A O 1 ATOM 1846 C CB . ARG A 1 250 ? 53.636 2.592 39.803 1.00 15.00 ? 250 ARG A CB 1 ATOM 1847 C CG . ARG A 1 250 ? 54.467 1.353 40.132 1.00 13.18 ? 250 ARG A CG 1 ATOM 1848 C CD . ARG A 1 250 ? 55.855 1.735 40.655 1.00 13.14 ? 250 ARG A CD 1 ATOM 1849 N NE . ARG A 1 250 ? 56.736 2.195 39.582 1.00 10.06 ? 250 ARG A NE 1 ATOM 1850 C CZ . ARG A 1 250 ? 58.060 2.280 39.674 1.00 12.46 ? 250 ARG A CZ 1 ATOM 1851 N NH1 . ARG A 1 250 ? 58.678 1.948 40.802 1.00 13.90 ? 250 ARG A NH1 1 ATOM 1852 N NH2 . ARG A 1 250 ? 58.777 2.641 38.619 1.00 9.49 ? 250 ARG A NH2 1 ATOM 1853 N N . THR A 1 251 ? 51.724 4.421 37.959 1.00 12.47 ? 251 THR A N 1 ATOM 1854 C CA . THR A 1 251 ? 51.030 5.700 37.889 1.00 13.21 ? 251 THR A CA 1 ATOM 1855 C C . THR A 1 251 ? 50.106 5.956 36.684 1.00 14.01 ? 251 THR A C 1 ATOM 1856 O O . THR A 1 251 ? 49.268 6.864 36.731 1.00 12.68 ? 251 THR A O 1 ATOM 1857 C CB . THR A 1 251 ? 52.070 6.839 37.954 1.00 11.70 ? 251 THR A CB 1 ATOM 1858 O OG1 . THR A 1 251 ? 53.175 6.527 37.092 1.00 10.64 ? 251 THR A OG1 1 ATOM 1859 C CG2 . THR A 1 251 ? 52.596 7.001 39.380 1.00 14.72 ? 251 THR A CG2 1 ATOM 1860 N N . ALA A 1 252 ? 50.251 5.154 35.632 1.00 13.38 ? 252 ALA A N 1 ATOM 1861 C CA . ALA A 1 252 ? 49.462 5.303 34.404 1.00 12.21 ? 252 ALA A CA 1 ATOM 1862 C C . ALA A 1 252 ? 47.965 5.537 34.599 1.00 9.38 ? 252 ALA A C 1 ATOM 1863 O O . ALA A 1 252 ? 47.424 6.520 34.086 1.00 10.23 ? 252 ALA A O 1 ATOM 1864 C CB . ALA A 1 252 ? 49.701 4.120 33.480 1.00 9.42 ? 252 ALA A CB 1 ATOM 1865 N N . CYS A 1 253 ? 47.293 4.673 35.351 1.00 8.69 ? 253 CYS A N 1 ATOM 1866 C CA . CYS A 1 253 ? 45.858 4.857 35.560 1.00 10.70 ? 253 CYS A CA 1 ATOM 1867 C C . CYS A 1 253 ? 45.490 6.093 36.372 1.00 10.98 ? 253 CYS A C 1 ATOM 1868 O O . CYS A 1 253 ? 44.433 6.693 36.153 1.00 10.47 ? 253 CYS A O 1 ATOM 1869 C CB . CYS A 1 253 ? 45.214 3.606 36.142 1.00 9.92 ? 253 CYS A CB 1 ATOM 1870 S SG . CYS A 1 253 ? 45.224 2.189 34.999 1.00 14.58 ? 253 CYS A SG 1 ATOM 1871 N N . ILE A 1 254 ? 46.373 6.502 37.282 1.00 9.19 ? 254 ILE A N 1 ATOM 1872 C CA . ILE A 1 254 ? 46.129 7.688 38.095 1.00 4.72 ? 254 ILE A CA 1 ATOM 1873 C C . ILE A 1 254 ? 46.191 8.919 37.201 1.00 3.41 ? 254 ILE A C 1 ATOM 1874 O O . ILE A 1 254 ? 45.331 9.799 37.273 1.00 5.87 ? 254 ILE A O 1 ATOM 1875 C CB . ILE A 1 254 ? 47.189 7.830 39.226 1.00 6.93 ? 254 ILE A CB 1 ATOM 1876 C CG1 . ILE A 1 254 ? 47.042 6.674 40.226 1.00 6.66 ? 254 ILE A CG1 1 ATOM 1877 C CG2 . ILE A 1 254 ? 47.026 9.176 39.935 1.00 2.76 ? 254 ILE A CG2 1 ATOM 1878 C CD1 . ILE A 1 254 ? 48.202 6.571 41.220 1.00 11.72 ? 254 ILE A CD1 1 ATOM 1879 N N . TRP A 1 255 ? 47.216 8.969 36.357 1.00 2.54 ? 255 TRP A N 1 ATOM 1880 C CA . TRP A 1 255 ? 47.420 10.080 35.439 1.00 4.21 ? 255 TRP A CA 1 ATOM 1881 C C . TRP A 1 255 ? 46.205 10.256 34.509 1.00 7.10 ? 255 TRP A C 1 ATOM 1882 O O . TRP A 1 255 ? 45.684 11.360 34.357 1.00 8.91 ? 255 TRP A O 1 ATOM 1883 C CB . TRP A 1 255 ? 48.702 9.847 34.626 1.00 5.30 ? 255 TRP A CB 1 ATOM 1884 C CG . TRP A 1 255 ? 49.045 10.978 33.692 1.00 9.64 ? 255 TRP A CG 1 ATOM 1885 C CD1 . TRP A 1 255 ? 48.448 11.264 32.490 1.00 9.84 ? 255 TRP A CD1 1 ATOM 1886 C CD2 . TRP A 1 255 ? 50.036 11.998 33.896 1.00 11.60 ? 255 TRP A CD2 1 ATOM 1887 N NE1 . TRP A 1 255 ? 49.002 12.394 31.943 1.00 12.19 ? 255 TRP A NE1 1 ATOM 1888 C CE2 . TRP A 1 255 ? 49.977 12.869 32.783 1.00 11.52 ? 255 TRP A CE2 1 ATOM 1889 C CE3 . TRP A 1 255 ? 50.961 12.264 34.917 1.00 11.66 ? 255 TRP A CE3 1 ATOM 1890 C CZ2 . TRP A 1 255 ? 50.808 13.986 32.658 1.00 10.69 ? 255 TRP A CZ2 1 ATOM 1891 C CZ3 . TRP A 1 255 ? 51.789 13.377 34.791 1.00 11.21 ? 255 TRP A CZ3 1 ATOM 1892 C CH2 . TRP A 1 255 ? 51.704 14.228 33.666 1.00 12.05 ? 255 TRP A CH2 1 ATOM 1893 N N . GLN A 1 256 ? 45.765 9.161 33.893 1.00 9.01 ? 256 GLN A N 1 ATOM 1894 C CA . GLN A 1 256 ? 44.615 9.187 32.985 1.00 9.03 ? 256 GLN A CA 1 ATOM 1895 C C . GLN A 1 256 ? 43.353 9.595 33.729 1.00 10.80 ? 256 GLN A C 1 ATOM 1896 O O . GLN A 1 256 ? 42.515 10.328 33.192 1.00 13.54 ? 256 GLN A O 1 ATOM 1897 C CB . GLN A 1 256 ? 44.418 7.812 32.341 1.00 8.33 ? 256 GLN A CB 1 ATOM 1898 C CG . GLN A 1 256 ? 43.262 7.741 31.344 1.00 7.82 ? 256 GLN A CG 1 ATOM 1899 C CD . GLN A 1 256 ? 43.127 6.378 30.716 1.00 6.93 ? 256 GLN A CD 1 ATOM 1900 O OE1 . GLN A 1 256 ? 44.040 5.902 30.038 1.00 9.40 ? 256 GLN A OE1 1 ATOM 1901 N NE2 . GLN A 1 256 ? 41.982 5.747 30.921 1.00 10.65 ? 256 GLN A NE2 1 ATOM 1902 N N . GLY A 1 257 ? 43.238 9.141 34.974 1.00 10.27 ? 257 GLY A N 1 ATOM 1903 C CA . GLY A 1 257 ? 42.084 9.454 35.797 1.00 8.59 ? 257 GLY A CA 1 ATOM 1904 C C . GLY A 1 257 ? 41.763 10.927 35.960 1.00 8.61 ? 257 GLY A C 1 ATOM 1905 O O . GLY A 1 257 ? 40.630 11.272 36.295 1.00 10.27 ? 257 GLY A O 1 ATOM 1906 N N . PHE A 1 258 ? 42.747 11.797 35.756 1.00 7.92 ? 258 PHE A N 1 ATOM 1907 C CA . PHE A 1 258 ? 42.520 13.235 35.875 1.00 7.80 ? 258 PHE A CA 1 ATOM 1908 C C . PHE A 1 258 ? 42.045 13.904 34.579 1.00 7.79 ? 258 PHE A C 1 ATOM 1909 O O . PHE A 1 258 ? 41.559 15.038 34.612 1.00 6.85 ? 258 PHE A O 1 ATOM 1910 C CB . PHE A 1 258 ? 43.773 13.941 36.393 1.00 8.36 ? 258 PHE A CB 1 ATOM 1911 C CG . PHE A 1 258 ? 44.053 13.673 37.855 1.00 10.69 ? 258 PHE A CG 1 ATOM 1912 C CD1 . PHE A 1 258 ? 43.025 13.738 38.794 1.00 8.71 ? 258 PHE A CD1 1 ATOM 1913 C CD2 . PHE A 1 258 ? 45.333 13.331 38.282 1.00 11.92 ? 258 PHE A CD2 1 ATOM 1914 C CE1 . PHE A 1 258 ? 43.264 13.466 40.137 1.00 13.54 ? 258 PHE A CE1 1 ATOM 1915 C CE2 . PHE A 1 258 ? 45.587 13.055 39.629 1.00 11.53 ? 258 PHE A CE2 1 ATOM 1916 C CZ . PHE A 1 258 ? 44.550 13.122 40.555 1.00 10.45 ? 258 PHE A CZ 1 ATOM 1917 N N . VAL A 1 259 ? 42.193 13.220 33.446 1.00 6.81 ? 259 VAL A N 1 ATOM 1918 C CA . VAL A 1 259 ? 41.765 13.793 32.162 1.00 7.93 ? 259 VAL A CA 1 ATOM 1919 C C . VAL A 1 259 ? 40.273 14.127 32.180 1.00 4.05 ? 259 VAL A C 1 ATOM 1920 O O . VAL A 1 259 ? 39.433 13.269 32.435 1.00 6.35 ? 259 VAL A O 1 ATOM 1921 C CB . VAL A 1 259 ? 42.067 12.848 30.973 1.00 9.37 ? 259 VAL A CB 1 ATOM 1922 C CG1 . VAL A 1 259 ? 41.430 13.397 29.684 1.00 9.50 ? 259 VAL A CG1 1 ATOM 1923 C CG2 . VAL A 1 259 ? 43.573 12.693 30.795 1.00 7.47 ? 259 VAL A CG2 1 ATOM 1924 N N . ASN A 1 260 ? 39.965 15.399 31.985 1.00 7.45 ? 260 ASN A N 1 ATOM 1925 C CA . ASN A 1 260 ? 38.591 15.876 31.960 1.00 10.60 ? 260 ASN A CA 1 ATOM 1926 C C . ASN A 1 260 ? 37.843 15.702 33.289 1.00 14.12 ? 260 ASN A C 1 ATOM 1927 O O . ASN A 1 260 ? 36.611 15.625 33.325 1.00 11.52 ? 260 ASN A O 1 ATOM 1928 C CB . ASN A 1 260 ? 37.821 15.223 30.801 1.00 10.29 ? 260 ASN A CB 1 ATOM 1929 C CG . ASN A 1 260 ? 36.528 15.948 30.477 1.00 10.08 ? 260 ASN A CG 1 ATOM 1930 O OD1 . ASN A 1 260 ? 36.508 17.170 30.300 1.00 11.10 ? 260 ASN A OD1 1 ATOM 1931 N ND2 . ASN A 1 260 ? 35.438 15.202 30.414 1.00 9.19 ? 260 ASN A ND2 1 ATOM 1932 N N . GLU A 1 261 ? 38.594 15.619 34.386 1.00 15.19 ? 261 GLU A N 1 ATOM 1933 C CA . GLU A 1 261 ? 37.998 15.491 35.718 1.00 14.29 ? 261 GLU A CA 1 ATOM 1934 C C . GLU A 1 261 ? 38.496 16.672 36.556 1.00 14.75 ? 261 GLU A C 1 ATOM 1935 O O . GLU A 1 261 ? 39.302 16.505 37.471 1.00 13.23 ? 261 GLU A O 1 ATOM 1936 C CB . GLU A 1 261 ? 38.392 14.164 36.371 1.00 14.54 ? 261 GLU A CB 1 ATOM 1937 C CG . GLU A 1 261 ? 37.753 12.930 35.758 1.00 15.68 ? 261 GLU A CG 1 ATOM 1938 C CD . GLU A 1 261 ? 36.234 12.881 35.913 1.00 17.52 ? 261 GLU A CD 1 ATOM 1939 O OE1 . GLU A 1 261 ? 35.661 13.631 36.728 1.00 16.50 ? 261 GLU A OE1 1 ATOM 1940 O OE2 . GLU A 1 261 ? 35.598 12.071 35.205 1.00 20.79 ? 261 GLU A OE2 1 ATOM 1941 N N . GLN A 1 262 ? 38.015 17.862 36.210 1.00 10.12 ? 262 GLN A N 1 ATOM 1942 C CA . GLN A 1 262 ? 38.386 19.113 36.865 1.00 12.54 ? 262 GLN A CA 1 ATOM 1943 C C . GLN A 1 262 ? 38.208 19.179 38.400 1.00 13.07 ? 262 GLN A C 1 ATOM 1944 O O . GLN A 1 262 ? 39.153 19.509 39.123 1.00 10.03 ? 262 GLN A O 1 ATOM 1945 C CB . GLN A 1 262 ? 37.632 20.275 36.193 1.00 13.17 ? 262 GLN A CB 1 ATOM 1946 C CG . GLN A 1 262 ? 37.946 21.677 36.722 1.00 14.00 ? 262 GLN A CG 1 ATOM 1947 C CD . GLN A 1 262 ? 39.339 22.149 36.361 1.00 17.07 ? 262 GLN A CD 1 ATOM 1948 O OE1 . GLN A 1 262 ? 39.894 21.754 35.335 1.00 16.78 ? 262 GLN A OE1 1 ATOM 1949 N NE2 . GLN A 1 262 ? 39.918 22.991 37.208 1.00 18.52 ? 262 GLN A NE2 1 ATOM 1950 N N . ALA A 1 263 ? 37.009 18.877 38.891 1.00 11.01 ? 263 ALA A N 1 ATOM 1951 C CA . ALA A 1 263 ? 36.737 18.936 40.327 1.00 13.56 ? 263 ALA A CA 1 ATOM 1952 C C . ALA A 1 263 ? 37.596 17.948 41.117 1.00 14.56 ? 263 ALA A C 1 ATOM 1953 O O . ALA A 1 263 ? 38.122 18.290 42.182 1.00 13.18 ? 263 ALA A O 1 ATOM 1954 C CB . ALA A 1 263 ? 35.255 18.707 40.606 1.00 11.00 ? 263 ALA A CB 1 ATOM 1955 N N . PHE A 1 264 ? 37.755 16.746 40.574 1.00 12.53 ? 264 PHE A N 1 ATOM 1956 C CA . PHE A 1 264 ? 38.553 15.690 41.185 1.00 13.48 ? 264 PHE A CA 1 ATOM 1957 C C . PHE A 1 264 ? 40.033 16.092 41.233 1.00 14.05 ? 264 PHE A C 1 ATOM 1958 O O . PHE A 1 264 ? 40.708 15.912 42.256 1.00 12.87 ? 264 PHE A O 1 ATOM 1959 C CB . PHE A 1 264 ? 38.353 14.404 40.375 1.00 12.68 ? 264 PHE A CB 1 ATOM 1960 C CG . PHE A 1 264 ? 39.124 13.216 40.879 1.00 14.36 ? 264 PHE A CG 1 ATOM 1961 C CD1 . PHE A 1 264 ? 39.231 12.945 42.236 1.00 15.15 ? 264 PHE A CD1 1 ATOM 1962 C CD2 . PHE A 1 264 ? 39.717 12.340 39.974 1.00 14.92 ? 264 PHE A CD2 1 ATOM 1963 C CE1 . PHE A 1 264 ? 39.917 11.811 42.686 1.00 15.81 ? 264 PHE A CE1 1 ATOM 1964 C CE2 . PHE A 1 264 ? 40.402 11.207 40.410 1.00 16.42 ? 264 PHE A CE2 1 ATOM 1965 C CZ . PHE A 1 264 ? 40.504 10.943 41.772 1.00 16.55 ? 264 PHE A CZ 1 ATOM 1966 N N . MET A 1 265 ? 40.521 16.662 40.135 1.00 12.86 ? 265 MET A N 1 ATOM 1967 C CA . MET A 1 265 ? 41.903 17.091 40.036 1.00 11.72 ? 265 MET A CA 1 ATOM 1968 C C . MET A 1 265 ? 42.207 18.193 41.046 1.00 12.17 ? 265 MET A C 1 ATOM 1969 O O . MET A 1 265 ? 43.201 18.117 41.770 1.00 11.60 ? 265 MET A O 1 ATOM 1970 C CB . MET A 1 265 ? 42.218 17.590 38.621 1.00 11.97 ? 265 MET A CB 1 ATOM 1971 C CG . MET A 1 265 ? 43.671 17.981 38.437 1.00 14.16 ? 265 MET A CG 1 ATOM 1972 S SD . MET A 1 265 ? 43.994 19.103 37.057 1.00 13.64 ? 265 MET A SD 1 ATOM 1973 C CE . MET A 1 265 ? 43.041 20.522 37.584 1.00 10.21 ? 265 MET A CE 1 ATOM 1974 N N . ALA A 1 266 ? 41.342 19.202 41.101 1.00 9.28 ? 266 ALA A N 1 ATOM 1975 C CA . ALA A 1 266 ? 41.508 20.335 42.007 1.00 11.75 ? 266 ALA A CA 1 ATOM 1976 C C . ALA A 1 266 ? 41.484 19.921 43.487 1.00 11.53 ? 266 ALA A C 1 ATOM 1977 O O . ALA A 1 266 ? 42.349 20.332 44.271 1.00 9.43 ? 266 ALA A O 1 ATOM 1978 C CB . ALA A 1 266 ? 40.444 21.395 41.725 1.00 10.23 ? 266 ALA A CB 1 ATOM 1979 N N . ALA A 1 267 ? 40.525 19.075 43.851 1.00 11.15 ? 267 ALA A N 1 ATOM 1980 C CA . ALA A 1 267 ? 40.402 18.603 45.223 1.00 11.64 ? 267 ALA A CA 1 ATOM 1981 C C . ALA A 1 267 ? 41.613 17.752 45.623 1.00 11.47 ? 267 ALA A C 1 ATOM 1982 O O . ALA A 1 267 ? 42.115 17.873 46.743 1.00 15.75 ? 267 ALA A O 1 ATOM 1983 C CB . ALA A 1 267 ? 39.108 17.816 45.405 1.00 7.10 ? 267 ALA A CB 1 ATOM 1984 N N . SER A 1 268 ? 42.085 16.901 44.719 1.00 10.22 ? 268 SER A N 1 ATOM 1985 C CA . SER A 1 268 ? 43.235 16.052 45.003 1.00 9.84 ? 268 SER A CA 1 ATOM 1986 C C . SER A 1 268 ? 44.517 16.873 45.172 1.00 12.54 ? 268 SER A C 1 ATOM 1987 O O . SER A 1 268 ? 45.378 16.541 45.999 1.00 12.24 ? 268 SER A O 1 ATOM 1988 C CB . SER A 1 268 ? 43.399 14.997 43.911 1.00 9.23 ? 268 SER A CB 1 ATOM 1989 O OG . SER A 1 268 ? 42.228 14.205 43.808 1.00 7.34 ? 268 SER A OG 1 ATOM 1990 N N . PHE A 1 269 ? 44.638 17.948 44.398 1.00 10.67 ? 269 PHE A N 1 ATOM 1991 C CA . PHE A 1 269 ? 45.788 18.839 44.480 1.00 9.15 ? 269 PHE A CA 1 ATOM 1992 C C . PHE A 1 269 ? 45.756 19.572 45.829 1.00 11.47 ? 269 PHE A C 1 ATOM 1993 O O . PHE A 1 269 ? 46.789 19.713 46.487 1.00 11.00 ? 269 PHE A O 1 ATOM 1994 C CB . PHE A 1 269 ? 45.747 19.863 43.348 1.00 6.98 ? 269 PHE A CB 1 ATOM 1995 C CG . PHE A 1 269 ? 46.917 20.810 43.335 1.00 4.26 ? 269 PHE A CG 1 ATOM 1996 C CD1 . PHE A 1 269 ? 48.177 20.374 42.936 1.00 6.02 ? 269 PHE A CD1 1 ATOM 1997 C CD2 . PHE A 1 269 ? 46.757 22.135 43.707 1.00 4.24 ? 269 PHE A CD2 1 ATOM 1998 C CE1 . PHE A 1 269 ? 49.261 21.249 42.909 1.00 3.33 ? 269 PHE A CE1 1 ATOM 1999 C CE2 . PHE A 1 269 ? 47.829 23.016 43.684 1.00 4.54 ? 269 PHE A CE2 1 ATOM 2000 C CZ . PHE A 1 269 ? 49.091 22.570 43.279 1.00 4.70 ? 269 PHE A CZ 1 ATOM 2001 N N . ARG A 1 270 ? 44.582 20.069 46.216 1.00 10.76 ? 270 ARG A N 1 ATOM 2002 C CA . ARG A 1 270 ? 44.433 20.771 47.489 1.00 12.33 ? 270 ARG A CA 1 ATOM 2003 C C . ARG A 1 270 ? 44.895 19.866 48.637 1.00 11.07 ? 270 ARG A C 1 ATOM 2004 O O . ARG A 1 270 ? 45.695 20.275 49.474 1.00 13.23 ? 270 ARG A O 1 ATOM 2005 C CB . ARG A 1 270 ? 42.983 21.188 47.720 1.00 13.48 ? 270 ARG A CB 1 ATOM 2006 C CG . ARG A 1 270 ? 42.821 22.069 48.941 1.00 16.11 ? 270 ARG A CG 1 ATOM 2007 C CD . ARG A 1 270 ? 41.377 22.417 49.214 1.00 21.27 ? 270 ARG A CD 1 ATOM 2008 N NE . ARG A 1 270 ? 41.247 23.340 50.341 1.00 26.21 ? 270 ARG A NE 1 ATOM 2009 C CZ . ARG A 1 270 ? 41.167 22.965 51.615 1.00 29.37 ? 270 ARG A CZ 1 ATOM 2010 N NH1 . ARG A 1 270 ? 41.201 21.678 51.944 1.00 31.79 ? 270 ARG A NH1 1 ATOM 2011 N NH2 . ARG A 1 270 ? 41.038 23.882 52.565 1.00 32.72 ? 270 ARG A NH2 1 ATOM 2012 N N . ALA A 1 271 ? 44.406 18.630 48.638 1.00 7.67 ? 271 ALA A N 1 ATOM 2013 C CA . ALA A 1 271 ? 44.753 17.632 49.642 1.00 10.15 ? 271 ALA A CA 1 ATOM 2014 C C . ALA A 1 271 ? 46.262 17.419 49.739 1.00 11.48 ? 271 ALA A C 1 ATOM 2015 O O . ALA A 1 271 ? 46.846 17.547 50.815 1.00 15.03 ? 271 ALA A O 1 ATOM 2016 C CB . ALA A 1 271 ? 44.065 16.319 49.324 1.00 9.69 ? 271 ALA A CB 1 ATOM 2017 N N . ALA A 1 272 ? 46.895 17.109 48.613 1.00 10.87 ? 272 ALA A N 1 ATOM 2018 C CA . ALA A 1 272 ? 48.332 16.888 48.580 1.00 11.11 ? 272 ALA A CA 1 ATOM 2019 C C . ALA A 1 272 ? 49.129 18.119 49.027 1.00 11.41 ? 272 ALA A C 1 ATOM 2020 O O . ALA A 1 272 ? 50.157 17.985 49.693 1.00 10.03 ? 272 ALA A O 1 ATOM 2021 C CB . ALA A 1 272 ? 48.762 16.442 47.190 1.00 9.78 ? 272 ALA A CB 1 ATOM 2022 N N . MET A 1 273 ? 48.653 19.311 48.672 1.00 10.48 ? 273 MET A N 1 ATOM 2023 C CA . MET A 1 273 ? 49.322 20.550 49.060 1.00 11.97 ? 273 MET A CA 1 ATOM 2024 C C . MET A 1 273 ? 49.246 20.804 50.566 1.00 12.85 ? 273 MET A C 1 ATOM 2025 O O . MET A 1 273 ? 50.150 21.417 51.134 1.00 13.65 ? 273 MET A O 1 ATOM 2026 C CB . MET A 1 273 ? 48.760 21.763 48.306 1.00 14.20 ? 273 MET A CB 1 ATOM 2027 C CG . MET A 1 273 ? 49.273 21.920 46.871 1.00 16.87 ? 273 MET A CG 1 ATOM 2028 S SD . MET A 1 273 ? 51.050 22.156 46.725 1.00 15.83 ? 273 MET A SD 1 ATOM 2029 C CE . MET A 1 273 ? 51.212 23.795 47.307 1.00 14.26 ? 273 MET A CE 1 ATOM 2030 N N . SER A 1 274 ? 48.169 20.356 51.208 1.00 14.13 ? 274 SER A N 1 ATOM 2031 C CA . SER A 1 274 ? 48.028 20.528 52.652 1.00 15.14 ? 274 SER A CA 1 ATOM 2032 C C . SER A 1 274 ? 49.209 19.845 53.354 1.00 13.33 ? 274 SER A C 1 ATOM 2033 O O . SER A 1 274 ? 49.794 20.409 54.273 1.00 14.99 ? 274 SER A O 1 ATOM 2034 C CB . SER A 1 274 ? 46.709 19.932 53.141 1.00 14.57 ? 274 SER A CB 1 ATOM 2035 O OG . SER A 1 274 ? 45.619 20.639 52.585 1.00 27.16 ? 274 SER A OG 1 ATOM 2036 N N . LYS A 1 275 ? 49.576 18.654 52.881 1.00 12.19 ? 275 LYS A N 1 ATOM 2037 C CA . LYS A 1 275 ? 50.693 17.910 53.445 1.00 12.50 ? 275 LYS A CA 1 ATOM 2038 C C . LYS A 1 275 ? 52.029 18.556 53.118 1.00 14.78 ? 275 LYS A C 1 ATOM 2039 O O . LYS A 1 275 ? 52.885 18.712 53.992 1.00 15.86 ? 275 LYS A O 1 ATOM 2040 C CB . LYS A 1 275 ? 50.720 16.483 52.917 1.00 13.55 ? 275 LYS A CB 1 ATOM 2041 C CG . LYS A 1 275 ? 49.684 15.558 53.491 1.00 19.25 ? 275 LYS A CG 1 ATOM 2042 C CD . LYS A 1 275 ? 49.946 14.126 53.022 1.00 23.74 ? 275 LYS A CD 1 ATOM 2043 C CE . LYS A 1 275 ? 51.387 13.702 53.303 1.00 24.98 ? 275 LYS A CE 1 ATOM 2044 N NZ . LYS A 1 275 ? 51.630 12.271 52.970 1.00 26.71 ? 275 LYS A NZ 1 ATOM 2045 N N . LEU A 1 276 ? 52.214 18.899 51.847 1.00 13.76 ? 276 LEU A N 1 ATOM 2046 C CA . LEU A 1 276 ? 53.460 19.507 51.386 1.00 13.07 ? 276 LEU A CA 1 ATOM 2047 C C . LEU A 1 276 ? 53.809 20.797 52.132 1.00 11.29 ? 276 LEU A C 1 ATOM 2048 O O . LEU A 1 276 ? 54.955 20.997 52.525 1.00 11.98 ? 276 LEU A O 1 ATOM 2049 C CB . LEU A 1 276 ? 53.394 19.790 49.876 1.00 11.02 ? 276 LEU A CB 1 ATOM 2050 C CG . LEU A 1 276 ? 54.697 20.280 49.225 1.00 8.76 ? 276 LEU A CG 1 ATOM 2051 C CD1 . LEU A 1 276 ? 55.599 19.102 48.942 1.00 8.15 ? 276 LEU A CD1 1 ATOM 2052 C CD2 . LEU A 1 276 ? 54.417 21.039 47.937 1.00 11.68 ? 276 LEU A CD2 1 ATOM 2053 N N . ALA A 1 277 ? 52.809 21.650 52.332 1.00 9.74 ? 277 ALA A N 1 ATOM 2054 C CA . ALA A 1 277 ? 52.986 22.936 52.990 1.00 9.80 ? 277 ALA A CA 1 ATOM 2055 C C . ALA A 1 277 ? 53.464 22.886 54.446 1.00 12.78 ? 277 ALA A C 1 ATOM 2056 O O . ALA A 1 277 ? 53.935 23.895 54.971 1.00 10.69 ? 277 ALA A O 1 ATOM 2057 C CB . ALA A 1 277 ? 51.701 23.737 52.897 1.00 8.48 ? 277 ALA A CB 1 ATOM 2058 N N . VAL A 1 278 ? 53.319 21.735 55.101 1.00 12.69 ? 278 VAL A N 1 ATOM 2059 C CA . VAL A 1 278 ? 53.734 21.601 56.494 1.00 13.66 ? 278 VAL A CA 1 ATOM 2060 C C . VAL A 1 278 ? 54.870 20.613 56.729 1.00 12.38 ? 278 VAL A C 1 ATOM 2061 O O . VAL A 1 278 ? 55.077 20.164 57.860 1.00 16.39 ? 278 VAL A O 1 ATOM 2062 C CB . VAL A 1 278 ? 52.539 21.249 57.417 1.00 13.12 ? 278 VAL A CB 1 ATOM 2063 C CG1 . VAL A 1 278 ? 51.512 22.365 57.390 1.00 15.38 ? 278 VAL A CG1 1 ATOM 2064 C CG2 . VAL A 1 278 ? 51.906 19.939 56.995 1.00 14.24 ? 278 VAL A CG2 1 ATOM 2065 N N . LEU A 1 279 ? 55.623 20.296 55.679 1.00 8.04 ? 279 LEU A N 1 ATOM 2066 C CA . LEU A 1 279 ? 56.743 19.376 55.821 1.00 10.08 ? 279 LEU A CA 1 ATOM 2067 C C . LEU A 1 279 ? 57.759 20.001 56.780 1.00 8.28 ? 279 LEU A C 1 ATOM 2068 O O . LEU A 1 279 ? 58.120 21.171 56.645 1.00 5.58 ? 279 LEU A O 1 ATOM 2069 C CB . LEU A 1 279 ? 57.394 19.067 54.467 1.00 8.64 ? 279 LEU A CB 1 ATOM 2070 C CG . LEU A 1 279 ? 56.644 18.122 53.509 1.00 7.76 ? 279 LEU A CG 1 ATOM 2071 C CD1 . LEU A 1 279 ? 57.525 17.829 52.297 1.00 5.29 ? 279 LEU A CD1 1 ATOM 2072 C CD2 . LEU A 1 279 ? 56.279 16.820 54.191 1.00 5.13 ? 279 LEU A CD2 1 ATOM 2073 N N . GLY A 1 280 ? 58.166 19.219 57.773 1.00 12.33 ? 280 GLY A N 1 ATOM 2074 C CA . GLY A 1 280 ? 59.107 19.681 58.780 1.00 12.57 ? 280 GLY A CA 1 ATOM 2075 C C . GLY A 1 280 ? 58.427 20.372 59.952 1.00 13.08 ? 280 GLY A C 1 ATOM 2076 O O . GLY A 1 280 ? 59.093 21.041 60.743 1.00 15.74 ? 280 GLY A O 1 ATOM 2077 N N . HIS A 1 281 ? 57.109 20.226 60.067 1.00 13.67 ? 281 HIS A N 1 ATOM 2078 C CA . HIS A 1 281 ? 56.359 20.858 61.151 1.00 12.75 ? 281 HIS A CA 1 ATOM 2079 C C . HIS A 1 281 ? 55.244 19.946 61.616 1.00 15.00 ? 281 HIS A C 1 ATOM 2080 O O . HIS A 1 281 ? 54.853 19.024 60.902 1.00 18.50 ? 281 HIS A O 1 ATOM 2081 C CB . HIS A 1 281 ? 55.749 22.191 60.685 1.00 12.94 ? 281 HIS A CB 1 ATOM 2082 C CG . HIS A 1 281 ? 56.765 23.197 60.239 1.00 14.39 ? 281 HIS A CG 1 ATOM 2083 N ND1 . HIS A 1 281 ? 57.267 23.234 58.955 1.00 16.27 ? 281 HIS A ND1 1 ATOM 2084 C CD2 . HIS A 1 281 ? 57.415 24.172 60.919 1.00 11.64 ? 281 HIS A CD2 1 ATOM 2085 C CE1 . HIS A 1 281 ? 58.180 24.177 58.866 1.00 15.09 ? 281 HIS A CE1 1 ATOM 2086 N NE2 . HIS A 1 281 ? 58.291 24.765 60.044 1.00 15.05 ? 281 HIS A NE2 1 ATOM 2087 N N . ASN A 1 282 ? 54.763 20.171 62.835 1.00 16.37 ? 282 ASN A N 1 ATOM 2088 C CA . ASN A 1 282 ? 53.652 19.393 63.385 1.00 15.83 ? 282 ASN A CA 1 ATOM 2089 C C . ASN A 1 282 ? 52.441 20.287 63.146 1.00 14.51 ? 282 ASN A C 1 ATOM 2090 O O . ASN A 1 282 ? 52.385 21.397 63.679 1.00 13.86 ? 282 ASN A O 1 ATOM 2091 C CB . ASN A 1 282 ? 53.847 19.154 64.894 1.00 20.42 ? 282 ASN A CB 1 ATOM 2092 C CG . ASN A 1 282 ? 52.690 18.371 65.534 1.00 23.83 ? 282 ASN A CG 1 ATOM 2093 O OD1 . ASN A 1 282 ? 51.556 18.388 65.045 1.00 25.69 ? 282 ASN A OD1 1 ATOM 2094 N ND2 . ASN A 1 282 ? 52.975 17.700 66.644 1.00 24.94 ? 282 ASN A ND2 1 ATOM 2095 N N . ARG A 1 283 ? 51.470 19.825 62.359 1.00 13.50 ? 283 ARG A N 1 ATOM 2096 C CA . ARG A 1 283 ? 50.309 20.663 62.085 1.00 15.02 ? 283 ARG A CA 1 ATOM 2097 C C . ARG A 1 283 ? 49.486 21.041 63.312 1.00 15.14 ? 283 ARG A C 1 ATOM 2098 O O . ARG A 1 283 ? 48.721 22.002 63.267 1.00 11.46 ? 283 ARG A O 1 ATOM 2099 C CB . ARG A 1 283 ? 49.420 20.093 60.965 1.00 16.61 ? 283 ARG A CB 1 ATOM 2100 C CG . ARG A 1 283 ? 48.841 18.723 61.194 1.00 16.75 ? 283 ARG A CG 1 ATOM 2101 C CD . ARG A 1 283 ? 47.912 18.344 60.034 1.00 19.21 ? 283 ARG A CD 1 ATOM 2102 N NE . ARG A 1 283 ? 46.706 19.172 60.011 1.00 22.76 ? 283 ARG A NE 1 ATOM 2103 C CZ . ARG A 1 283 ? 46.362 20.001 59.023 1.00 24.06 ? 283 ARG A CZ 1 ATOM 2104 N NH1 . ARG A 1 283 ? 47.125 20.125 57.937 1.00 23.79 ? 283 ARG A NH1 1 ATOM 2105 N NH2 . ARG A 1 283 ? 45.268 20.745 59.144 1.00 19.00 ? 283 ARG A NH2 1 ATOM 2106 N N . ASN A 1 284 ? 49.650 20.309 64.411 1.00 16.04 ? 284 ASN A N 1 ATOM 2107 C CA . ASN A 1 284 ? 48.925 20.636 65.639 1.00 16.79 ? 284 ASN A CA 1 ATOM 2108 C C . ASN A 1 284 ? 49.539 21.864 66.314 1.00 15.13 ? 284 ASN A C 1 ATOM 2109 O O . ASN A 1 284 ? 48.967 22.423 67.247 1.00 16.93 ? 284 ASN A O 1 ATOM 2110 C CB . ASN A 1 284 ? 48.937 19.453 66.604 1.00 20.10 ? 284 ASN A CB 1 ATOM 2111 C CG . ASN A 1 284 ? 48.244 18.235 66.033 1.00 24.43 ? 284 ASN A CG 1 ATOM 2112 O OD1 . ASN A 1 284 ? 48.877 17.381 65.412 1.00 29.32 ? 284 ASN A OD1 1 ATOM 2113 N ND2 . ASN A 1 284 ? 46.936 18.153 66.227 1.00 27.11 ? 284 ASN A ND2 1 ATOM 2114 N N . SER A 1 285 ? 50.693 22.296 65.825 1.00 12.92 ? 285 SER A N 1 ATOM 2115 C CA . SER A 1 285 ? 51.374 23.454 66.391 1.00 14.27 ? 285 SER A CA 1 ATOM 2116 C C . SER A 1 285 ? 51.209 24.720 65.553 1.00 13.77 ? 285 SER A C 1 ATOM 2117 O O . SER A 1 285 ? 51.759 25.768 65.899 1.00 11.38 ? 285 SER A O 1 ATOM 2118 C CB . SER A 1 285 ? 52.862 23.140 66.567 1.00 17.57 ? 285 SER A CB 1 ATOM 2119 O OG . SER A 1 285 ? 53.034 21.985 67.382 1.00 24.90 ? 285 SER A OG 1 ATOM 2120 N N . LEU A 1 286 ? 50.424 24.639 64.478 1.00 12.55 ? 286 LEU A N 1 ATOM 2121 C CA . LEU A 1 286 ? 50.221 25.788 63.587 1.00 10.01 ? 286 LEU A CA 1 ATOM 2122 C C . LEU A 1 286 ? 48.784 26.277 63.612 1.00 7.00 ? 286 LEU A C 1 ATOM 2123 O O . LEU A 1 286 ? 47.853 25.478 63.678 1.00 10.85 ? 286 LEU A O 1 ATOM 2124 C CB . LEU A 1 286 ? 50.615 25.409 62.153 1.00 10.57 ? 286 LEU A CB 1 ATOM 2125 C CG . LEU A 1 286 ? 52.033 24.886 61.917 1.00 10.81 ? 286 LEU A CG 1 ATOM 2126 C CD1 . LEU A 1 286 ? 52.176 24.317 60.520 1.00 11.62 ? 286 LEU A CD1 1 ATOM 2127 C CD2 . LEU A 1 286 ? 53.034 26.000 62.138 1.00 13.00 ? 286 LEU A CD2 1 ATOM 2128 N N . ILE A 1 287 ? 48.603 27.589 63.555 1.00 10.24 ? 287 ILE A N 1 ATOM 2129 C CA . ILE A 1 287 ? 47.265 28.167 63.576 1.00 13.86 ? 287 ILE A CA 1 ATOM 2130 C C . ILE A 1 287 ? 46.624 28.141 62.186 1.00 13.91 ? 287 ILE A C 1 ATOM 2131 O O . ILE A 1 287 ? 47.301 28.320 61.179 1.00 8.84 ? 287 ILE A O 1 ATOM 2132 C CB . ILE A 1 287 ? 47.271 29.629 64.078 1.00 14.91 ? 287 ILE A CB 1 ATOM 2133 C CG1 . ILE A 1 287 ? 48.158 30.492 63.180 1.00 17.32 ? 287 ILE A CG1 1 ATOM 2134 C CG2 . ILE A 1 287 ? 47.743 29.691 65.532 1.00 20.85 ? 287 ILE A CG2 1 ATOM 2135 C CD1 . ILE A 1 287 ? 47.938 31.972 63.349 1.00 16.29 ? 287 ILE A CD1 1 ATOM 2136 N N . ASP A 1 288 ? 45.312 27.953 62.144 1.00 14.26 ? 288 ASP A N 1 ATOM 2137 C CA . ASP A 1 288 ? 44.595 27.916 60.878 1.00 14.84 ? 288 ASP A CA 1 ATOM 2138 C C . ASP A 1 288 ? 44.198 29.322 60.415 1.00 12.33 ? 288 ASP A C 1 ATOM 2139 O O . ASP A 1 288 ? 43.359 29.979 61.036 1.00 13.11 ? 288 ASP A O 1 ATOM 2140 C CB . ASP A 1 288 ? 43.355 27.021 61.009 1.00 17.41 ? 288 ASP A CB 1 ATOM 2141 C CG . ASP A 1 288 ? 42.746 26.631 59.662 1.00 21.18 ? 288 ASP A CG 1 ATOM 2142 O OD1 . ASP A 1 288 ? 43.176 27.155 58.613 1.00 19.20 ? 288 ASP A OD1 1 ATOM 2143 O OD2 . ASP A 1 288 ? 41.831 25.784 59.650 1.00 24.01 ? 288 ASP A OD2 1 ATOM 2144 N N . CYS A 1 289 ? 44.820 29.781 59.333 1.00 12.02 ? 289 CYS A N 1 ATOM 2145 C CA . CYS A 1 289 ? 44.516 31.090 58.758 1.00 13.33 ? 289 CYS A CA 1 ATOM 2146 C C . CYS A 1 289 ? 43.987 30.942 57.314 1.00 14.54 ? 289 CYS A C 1 ATOM 2147 O O . CYS A 1 289 ? 44.214 31.819 56.475 1.00 13.75 ? 289 CYS A O 1 ATOM 2148 C CB . CYS A 1 289 ? 45.770 31.973 58.754 1.00 15.85 ? 289 CYS A CB 1 ATOM 2149 S SG . CYS A 1 289 ? 46.365 32.529 60.392 1.00 15.89 ? 289 CYS A SG 1 ATOM 2150 N N . SER A 1 290 ? 43.263 29.856 57.041 1.00 13.92 ? 290 SER A N 1 ATOM 2151 C CA . SER A 1 290 ? 42.722 29.579 55.699 1.00 15.50 ? 290 SER A CA 1 ATOM 2152 C C . SER A 1 290 ? 41.728 30.608 55.165 1.00 17.79 ? 290 SER A C 1 ATOM 2153 O O . SER A 1 290 ? 41.705 30.895 53.966 1.00 21.10 ? 290 SER A O 1 ATOM 2154 C CB . SER A 1 290 ? 42.075 28.193 55.654 1.00 10.06 ? 290 SER A CB 1 ATOM 2155 O OG . SER A 1 290 ? 43.023 27.175 55.912 1.00 12.94 ? 290 SER A OG 1 ATOM 2156 N N . ASP A 1 291 ? 40.927 31.176 56.060 1.00 19.46 ? 291 ASP A N 1 ATOM 2157 C CA . ASP A 1 291 ? 39.921 32.167 55.685 1.00 20.08 ? 291 ASP A CA 1 ATOM 2158 C C . ASP A 1 291 ? 40.516 33.482 55.194 1.00 18.25 ? 291 ASP A C 1 ATOM 2159 O O . ASP A 1 291 ? 39.784 34.405 54.839 1.00 19.49 ? 291 ASP A O 1 ATOM 2160 C CB . ASP A 1 291 ? 38.965 32.421 56.862 1.00 24.57 ? 291 ASP A CB 1 ATOM 2161 C CG . ASP A 1 291 ? 39.671 32.960 58.112 1.00 28.36 ? 291 ASP A CG 1 ATOM 2162 O OD1 . ASP A 1 291 ? 40.917 32.881 58.215 1.00 30.41 ? 291 ASP A OD1 1 ATOM 2163 O OD2 . ASP A 1 291 ? 38.962 33.463 59.007 1.00 29.60 ? 291 ASP A OD2 1 ATOM 2164 N N . VAL A 1 292 ? 41.842 33.562 55.192 1.00 16.55 ? 292 VAL A N 1 ATOM 2165 C CA . VAL A 1 292 ? 42.574 34.750 54.762 1.00 14.95 ? 292 VAL A CA 1 ATOM 2166 C C . VAL A 1 292 ? 43.167 34.571 53.347 1.00 12.83 ? 292 VAL A C 1 ATOM 2167 O O . VAL A 1 292 ? 43.686 35.516 52.750 1.00 12.18 ? 292 VAL A O 1 ATOM 2168 C CB . VAL A 1 292 ? 43.648 35.136 55.850 1.00 17.76 ? 292 VAL A CB 1 ATOM 2169 C CG1 . VAL A 1 292 ? 44.820 35.894 55.266 1.00 16.32 ? 292 VAL A CG1 1 ATOM 2170 C CG2 . VAL A 1 292 ? 42.985 35.990 56.927 1.00 15.70 ? 292 VAL A CG2 1 ATOM 2171 N N . VAL A 1 293 ? 43.074 33.355 52.814 1.00 11.40 ? 293 VAL A N 1 ATOM 2172 C CA . VAL A 1 293 ? 43.564 33.080 51.466 1.00 12.72 ? 293 VAL A CA 1 ATOM 2173 C C . VAL A 1 293 ? 42.451 33.611 50.542 1.00 12.64 ? 293 VAL A C 1 ATOM 2174 O O . VAL A 1 293 ? 41.267 33.353 50.774 1.00 11.79 ? 293 VAL A O 1 ATOM 2175 C CB . VAL A 1 293 ? 43.758 31.566 51.228 1.00 13.18 ? 293 VAL A CB 1 ATOM 2176 C CG1 . VAL A 1 293 ? 44.304 31.318 49.827 1.00 14.88 ? 293 VAL A CG1 1 ATOM 2177 C CG2 . VAL A 1 293 ? 44.710 30.985 52.257 1.00 14.02 ? 293 VAL A CG2 1 ATOM 2178 N N . PRO A 1 294 ? 42.813 34.397 49.522 1.00 11.06 ? 294 PRO A N 1 ATOM 2179 C CA . PRO A 1 294 ? 41.820 34.954 48.592 1.00 12.98 ? 294 PRO A CA 1 ATOM 2180 C C . PRO A 1 294 ? 40.981 33.880 47.884 1.00 11.91 ? 294 PRO A C 1 ATOM 2181 O O . PRO A 1 294 ? 41.435 32.747 47.700 1.00 12.56 ? 294 PRO A O 1 ATOM 2182 C CB . PRO A 1 294 ? 42.688 35.726 47.601 1.00 12.99 ? 294 PRO A CB 1 ATOM 2183 C CG . PRO A 1 294 ? 43.914 36.086 48.412 1.00 14.05 ? 294 PRO A CG 1 ATOM 2184 C CD . PRO A 1 294 ? 44.176 34.806 49.146 1.00 10.23 ? 294 PRO A CD 1 ATOM 2185 N N . VAL A 1 295 ? 39.742 34.218 47.535 1.00 14.21 ? 295 VAL A N 1 ATOM 2186 C CA . VAL A 1 295 ? 38.875 33.274 46.822 1.00 15.28 ? 295 VAL A CA 1 ATOM 2187 C C . VAL A 1 295 ? 39.453 33.153 45.411 1.00 14.91 ? 295 VAL A C 1 ATOM 2188 O O . VAL A 1 295 ? 39.778 34.159 44.779 1.00 15.62 ? 295 VAL A O 1 ATOM 2189 C CB . VAL A 1 295 ? 37.406 33.764 46.752 1.00 18.36 ? 295 VAL A CB 1 ATOM 2190 C CG1 . VAL A 1 295 ? 37.310 35.067 45.974 1.00 20.48 ? 295 VAL A CG1 1 ATOM 2191 C CG2 . VAL A 1 295 ? 36.519 32.694 46.119 1.00 17.67 ? 295 VAL A CG2 1 ATOM 2192 N N . PRO A 1 296 ? 39.654 31.920 44.931 1.00 13.33 ? 296 PRO A N 1 ATOM 2193 C CA . PRO A 1 296 ? 40.213 31.711 43.593 1.00 15.88 ? 296 PRO A CA 1 ATOM 2194 C C . PRO A 1 296 ? 39.273 32.104 42.435 1.00 16.07 ? 296 PRO A C 1 ATOM 2195 O O . PRO A 1 296 ? 38.052 32.220 42.613 1.00 12.56 ? 296 PRO A O 1 ATOM 2196 C CB . PRO A 1 296 ? 40.534 30.218 43.601 1.00 13.77 ? 296 PRO A CB 1 ATOM 2197 C CG . PRO A 1 296 ? 39.421 29.662 44.443 1.00 15.68 ? 296 PRO A CG 1 ATOM 2198 C CD . PRO A 1 296 ? 39.322 30.639 45.577 1.00 13.02 ? 296 PRO A CD 1 ATOM 2199 N N . LYS A 1 297 ? 39.866 32.368 41.273 1.00 16.77 ? 297 LYS A N 1 ATOM 2200 C CA . LYS A 1 297 ? 39.111 32.726 40.073 1.00 17.65 ? 297 LYS A CA 1 ATOM 2201 C C . LYS A 1 297 ? 38.392 31.488 39.544 1.00 18.27 ? 297 LYS A C 1 ATOM 2202 O O . LYS A 1 297 ? 38.986 30.408 39.448 1.00 17.40 ? 297 LYS A O 1 ATOM 2203 C CB . LYS A 1 297 ? 40.048 33.234 38.982 1.00 16.70 ? 297 LYS A CB 1 ATOM 2204 C CG . LYS A 1 297 ? 40.543 34.639 39.160 1.00 15.74 ? 297 LYS A CG 1 ATOM 2205 C CD . LYS A 1 297 ? 41.424 34.973 37.987 1.00 17.66 ? 297 LYS A CD 1 ATOM 2206 C CE . LYS A 1 297 ? 41.921 36.396 38.033 1.00 16.79 ? 297 LYS A CE 1 ATOM 2207 N NZ . LYS A 1 297 ? 42.959 36.578 36.976 1.00 20.92 ? 297 LYS A NZ 1 ATOM 2208 N N . PRO A 1 298 ? 37.102 31.621 39.209 1.00 20.30 ? 298 PRO A N 1 ATOM 2209 C CA . PRO A 1 298 ? 36.340 30.481 38.687 1.00 20.79 ? 298 PRO A CA 1 ATOM 2210 C C . PRO A 1 298 ? 36.694 30.161 37.231 1.00 20.19 ? 298 PRO A C 1 ATOM 2211 O O . PRO A 1 298 ? 37.173 31.019 36.484 1.00 18.12 ? 298 PRO A O 1 ATOM 2212 C CB . PRO A 1 298 ? 34.893 30.955 38.816 1.00 21.79 ? 298 PRO A CB 1 ATOM 2213 C CG . PRO A 1 298 ? 35.010 32.419 38.535 1.00 23.60 ? 298 PRO A CG 1 ATOM 2214 C CD . PRO A 1 298 ? 36.252 32.821 39.319 1.00 20.31 ? 298 PRO A CD 1 ATOM 2215 N N . ALA A 1 299 ? 36.500 28.905 36.856 1.00 21.27 ? 299 ALA A N 1 ATOM 2216 C CA . ALA A 1 299 ? 36.766 28.454 35.500 1.00 23.06 ? 299 ALA A CA 1 ATOM 2217 C C . ALA A 1 299 ? 35.473 28.670 34.707 1.00 22.72 ? 299 ALA A C 1 ATOM 2218 O O . ALA A 1 299 ? 34.456 29.095 35.276 1.00 20.66 ? 299 ALA A O 1 ATOM 2219 C CB . ALA A 1 299 ? 37.132 26.978 35.517 1.00 23.49 ? 299 ALA A CB 1 ATOM 2220 N N . THR A 1 300 ? 35.512 28.400 33.404 1.00 22.93 ? 300 THR A N 1 ATOM 2221 C CA . THR A 1 300 ? 34.320 28.550 32.557 1.00 23.03 ? 300 THR A CA 1 ATOM 2222 C C . THR A 1 300 ? 33.436 27.309 32.669 1.00 22.03 ? 300 THR A C 1 ATOM 2223 O O . THR A 1 300 ? 32.237 27.364 32.404 1.00 24.28 ? 300 THR A O 1 ATOM 2224 C CB . THR A 1 300 ? 34.680 28.761 31.061 1.00 19.49 ? 300 THR A CB 1 ATOM 2225 O OG1 . THR A 1 300 ? 35.547 27.706 30.621 1.00 20.80 ? 300 THR A OG1 1 ATOM 2226 C CG2 . THR A 1 300 ? 35.349 30.102 30.849 1.00 15.81 ? 300 THR A CG2 1 ATOM 2227 N N . GLY A 1 301 ? 34.038 26.186 33.049 1.00 20.41 ? 301 GLY A N 1 ATOM 2228 C CA . GLY A 1 301 ? 33.283 24.954 33.182 1.00 20.50 ? 301 GLY A CA 1 ATOM 2229 C C . GLY A 1 301 ? 33.283 24.086 31.930 1.00 19.21 ? 301 GLY A C 1 ATOM 2230 O O . GLY A 1 301 ? 32.553 23.100 31.856 1.00 20.01 ? 301 GLY A O 1 ATOM 2231 N N . GLN A 1 302 ? 34.097 24.446 30.941 1.00 19.37 ? 302 GLN A N 1 ATOM 2232 C CA . GLN A 1 302 ? 34.189 23.669 29.704 1.00 19.91 ? 302 GLN A CA 1 ATOM 2233 C C . GLN A 1 302 ? 35.032 22.410 29.878 1.00 19.05 ? 302 GLN A C 1 ATOM 2234 O O . GLN A 1 302 ? 35.991 22.397 30.649 1.00 17.08 ? 302 GLN A O 1 ATOM 2235 C CB . GLN A 1 302 ? 34.795 24.504 28.583 1.00 19.24 ? 302 GLN A CB 1 ATOM 2236 C CG . GLN A 1 302 ? 33.852 25.506 27.977 1.00 23.25 ? 302 GLN A CG 1 ATOM 2237 C CD . GLN A 1 302 ? 34.335 25.973 26.625 1.00 23.38 ? 302 GLN A CD 1 ATOM 2238 O OE1 . GLN A 1 302 ? 35.371 26.634 26.524 1.00 22.20 ? 302 GLN A OE1 1 ATOM 2239 N NE2 . GLN A 1 302 ? 33.610 25.614 25.574 1.00 22.87 ? 302 GLN A NE2 1 ATOM 2240 N N . PRO A 1 303 ? 34.689 21.338 29.147 1.00 18.31 ? 303 PRO A N 1 ATOM 2241 C CA . PRO A 1 303 ? 35.423 20.071 29.222 1.00 15.27 ? 303 PRO A CA 1 ATOM 2242 C C . PRO A 1 303 ? 36.765 20.203 28.529 1.00 14.50 ? 303 PRO A C 1 ATOM 2243 O O . PRO A 1 303 ? 37.013 21.178 27.815 1.00 13.23 ? 303 PRO A O 1 ATOM 2244 C CB . PRO A 1 303 ? 34.536 19.108 28.421 1.00 17.39 ? 303 PRO A CB 1 ATOM 2245 C CG . PRO A 1 303 ? 33.178 19.770 28.407 1.00 18.04 ? 303 PRO A CG 1 ATOM 2246 C CD . PRO A 1 303 ? 33.529 21.214 28.247 1.00 17.93 ? 303 PRO A CD 1 ATOM 2247 N N . ALA A 1 304 ? 37.627 19.218 28.743 1.00 11.47 ? 304 ALA A N 1 ATOM 2248 C CA . ALA A 1 304 ? 38.923 19.195 28.093 1.00 11.50 ? 304 ALA A CA 1 ATOM 2249 C C . ALA A 1 304 ? 38.639 18.853 26.626 1.00 11.89 ? 304 ALA A C 1 ATOM 2250 O O . ALA A 1 304 ? 37.687 18.123 26.332 1.00 12.17 ? 304 ALA A O 1 ATOM 2251 C CB . ALA A 1 304 ? 39.802 18.114 28.714 1.00 10.17 ? 304 ALA A CB 1 ATOM 2252 N N . MET A 1 305 ? 39.465 19.357 25.716 1.00 11.85 ? 305 MET A N 1 ATOM 2253 C CA . MET A 1 305 ? 39.299 19.076 24.289 1.00 12.51 ? 305 MET A CA 1 ATOM 2254 C C . MET A 1 305 ? 40.653 18.929 23.610 1.00 12.45 ? 305 MET A C 1 ATOM 2255 O O . MET A 1 305 ? 41.662 19.482 24.084 1.00 11.15 ? 305 MET A O 1 ATOM 2256 C CB . MET A 1 305 ? 38.444 20.162 23.606 1.00 12.64 ? 305 MET A CB 1 ATOM 2257 C CG . MET A 1 305 ? 38.713 21.584 24.063 1.00 18.39 ? 305 MET A CG 1 ATOM 2258 S SD . MET A 1 305 ? 37.485 22.801 23.488 1.00 20.26 ? 305 MET A SD 1 ATOM 2259 C CE . MET A 1 305 ? 36.045 22.302 24.399 1.00 16.83 ? 305 MET A CE 1 ATOM 2260 N N . PHE A 1 306 ? 40.699 18.115 22.557 1.00 10.20 ? 306 PHE A N 1 ATOM 2261 C CA . PHE A 1 306 ? 41.934 17.919 21.805 1.00 11.01 ? 306 PHE A CA 1 ATOM 2262 C C . PHE A 1 306 ? 42.256 19.230 21.109 1.00 13.17 ? 306 PHE A C 1 ATOM 2263 O O . PHE A 1 306 ? 41.368 19.860 20.513 1.00 15.57 ? 306 PHE A O 1 ATOM 2264 C CB . PHE A 1 306 ? 41.766 16.843 20.721 1.00 10.81 ? 306 PHE A CB 1 ATOM 2265 C CG . PHE A 1 306 ? 41.693 15.453 21.248 1.00 8.56 ? 306 PHE A CG 1 ATOM 2266 C CD1 . PHE A 1 306 ? 42.855 14.746 21.539 1.00 9.48 ? 306 PHE A CD1 1 ATOM 2267 C CD2 . PHE A 1 306 ? 40.464 14.851 21.476 1.00 8.05 ? 306 PHE A CD2 1 ATOM 2268 C CE1 . PHE A 1 306 ? 42.790 13.456 22.055 1.00 8.95 ? 306 PHE A CE1 1 ATOM 2269 C CE2 . PHE A 1 306 ? 40.387 13.564 21.990 1.00 9.94 ? 306 PHE A CE2 1 ATOM 2270 C CZ . PHE A 1 306 ? 41.556 12.866 22.282 1.00 9.17 ? 306 PHE A CZ 1 ATOM 2271 N N . PRO A 1 307 ? 43.502 19.697 21.214 1.00 14.31 ? 307 PRO A N 1 ATOM 2272 C CA . PRO A 1 307 ? 43.823 20.954 20.542 1.00 15.09 ? 307 PRO A CA 1 ATOM 2273 C C . PRO A 1 307 ? 43.888 20.722 19.024 1.00 15.93 ? 307 PRO A C 1 ATOM 2274 O O . PRO A 1 307 ? 44.131 19.603 18.570 1.00 15.22 ? 307 PRO A O 1 ATOM 2275 C CB . PRO A 1 307 ? 45.184 21.323 21.141 1.00 15.03 ? 307 PRO A CB 1 ATOM 2276 C CG . PRO A 1 307 ? 45.795 19.999 21.459 1.00 14.99 ? 307 PRO A CG 1 ATOM 2277 C CD . PRO A 1 307 ? 44.642 19.212 22.020 1.00 15.70 ? 307 PRO A CD 1 ATOM 2278 N N . ALA A 1 308 ? 43.654 21.775 18.251 1.00 16.96 ? 308 ALA A N 1 ATOM 2279 C CA . ALA A 1 308 ? 43.685 21.689 16.793 1.00 17.67 ? 308 ALA A CA 1 ATOM 2280 C C . ALA A 1 308 ? 44.953 21.010 16.282 1.00 17.79 ? 308 ALA A C 1 ATOM 2281 O O . ALA A 1 308 ? 46.056 21.330 16.726 1.00 18.53 ? 308 ALA A O 1 ATOM 2282 C CB . ALA A 1 308 ? 43.554 23.073 16.190 1.00 16.67 ? 308 ALA A CB 1 ATOM 2283 N N . SER A 1 309 ? 44.757 20.056 15.373 1.00 18.90 ? 309 SER A N 1 ATOM 2284 C CA . SER A 1 309 ? 45.802 19.256 14.719 1.00 16.70 ? 309 SER A CA 1 ATOM 2285 C C . SER A 1 309 ? 46.112 17.926 15.400 1.00 16.49 ? 309 SER A C 1 ATOM 2286 O O . SER A 1 309 ? 47.013 17.199 14.968 1.00 17.98 ? 309 SER A O 1 ATOM 2287 C CB . SER A 1 309 ? 47.086 20.058 14.458 1.00 19.57 ? 309 SER A CB 1 ATOM 2288 O OG . SER A 1 309 ? 48.016 19.973 15.528 1.00 22.85 ? 309 SER A OG 1 ATOM 2289 N N . THR A 1 310 ? 45.372 17.606 16.463 1.00 14.18 ? 310 THR A N 1 ATOM 2290 C CA . THR A 1 310 ? 45.546 16.338 17.175 1.00 13.61 ? 310 THR A CA 1 ATOM 2291 C C . THR A 1 310 ? 44.161 15.722 17.338 1.00 11.36 ? 310 THR A C 1 ATOM 2292 O O . THR A 1 310 ? 43.154 16.419 17.237 1.00 15.27 ? 310 THR A O 1 ATOM 2293 C CB . THR A 1 310 ? 46.162 16.521 18.605 1.00 12.69 ? 310 THR A CB 1 ATOM 2294 O OG1 . THR A 1 310 ? 45.244 17.246 19.431 1.00 12.93 ? 310 THR A OG1 1 ATOM 2295 C CG2 . THR A 1 310 ? 47.487 17.269 18.554 1.00 12.28 ? 310 THR A CG2 1 ATOM 2296 N N . GLY A 1 311 ? 44.108 14.431 17.628 1.00 12.19 ? 311 GLY A N 1 ATOM 2297 C CA . GLY A 1 311 ? 42.827 13.775 17.810 1.00 11.78 ? 311 GLY A CA 1 ATOM 2298 C C . GLY A 1 311 ? 43.000 12.423 18.465 1.00 12.74 ? 311 GLY A C 1 ATOM 2299 O O . GLY A 1 311 ? 44.135 12.022 18.750 1.00 14.10 ? 311 GLY A O 1 ATOM 2300 N N . PRO A 1 312 ? 41.915 11.677 18.689 1.00 13.16 ? 312 PRO A N 1 ATOM 2301 C CA . PRO A 1 312 ? 41.900 10.349 19.310 1.00 12.84 ? 312 PRO A CA 1 ATOM 2302 C C . PRO A 1 312 ? 42.921 9.376 18.723 1.00 14.15 ? 312 PRO A C 1 ATOM 2303 O O . PRO A 1 312 ? 43.417 8.485 19.423 1.00 15.42 ? 312 PRO A O 1 ATOM 2304 C CB . PRO A 1 312 ? 40.477 9.869 19.066 1.00 12.86 ? 312 PRO A CB 1 ATOM 2305 C CG . PRO A 1 312 ? 39.694 11.131 19.127 1.00 13.63 ? 312 PRO A CG 1 ATOM 2306 C CD . PRO A 1 312 ? 40.537 12.100 18.345 1.00 12.95 ? 312 PRO A CD 1 ATOM 2307 N N . GLN A 1 313 ? 43.237 9.555 17.445 1.00 14.59 ? 313 GLN A N 1 ATOM 2308 C CA . GLN A 1 313 ? 44.197 8.686 16.763 1.00 14.62 ? 313 GLN A CA 1 ATOM 2309 C C . GLN A 1 313 ? 45.640 8.907 17.236 1.00 14.04 ? 313 GLN A C 1 ATOM 2310 O O . GLN A 1 313 ? 46.506 8.059 17.014 1.00 13.12 ? 313 GLN A O 1 ATOM 2311 C CB . GLN A 1 313 ? 44.111 8.871 15.238 1.00 14.75 ? 313 GLN A CB 1 ATOM 2312 C CG . GLN A 1 313 ? 44.626 10.211 14.690 1.00 13.64 ? 313 GLN A CG 1 ATOM 2313 C CD . GLN A 1 313 ? 43.663 11.372 14.888 1.00 18.11 ? 313 GLN A CD 1 ATOM 2314 O OE1 . GLN A 1 313 ? 42.595 11.224 15.478 1.00 17.84 ? 313 GLN A OE1 1 ATOM 2315 N NE2 . GLN A 1 313 ? 44.052 12.547 14.407 1.00 21.23 ? 313 GLN A NE2 1 ATOM 2316 N N . ASP A 1 314 ? 45.881 10.033 17.908 1.00 14.39 ? 314 ASP A N 1 ATOM 2317 C CA . ASP A 1 314 ? 47.218 10.385 18.390 1.00 14.71 ? 314 ASP A CA 1 ATOM 2318 C C . ASP A 1 314 ? 47.525 9.981 19.844 1.00 14.40 ? 314 ASP A C 1 ATOM 2319 O O . ASP A 1 314 ? 48.611 10.257 20.340 1.00 15.97 ? 314 ASP A O 1 ATOM 2320 C CB . ASP A 1 314 ? 47.460 11.890 18.225 1.00 12.17 ? 314 ASP A CB 1 ATOM 2321 C CG . ASP A 1 314 ? 47.365 12.358 16.770 1.00 18.39 ? 314 ASP A CG 1 ATOM 2322 O OD1 . ASP A 1 314 ? 47.994 11.735 15.879 1.00 16.62 ? 314 ASP A OD1 1 ATOM 2323 O OD2 . ASP A 1 314 ? 46.672 13.371 16.520 1.00 19.04 ? 314 ASP A OD2 1 ATOM 2324 N N . LEU A 1 315 ? 46.577 9.334 20.516 1.00 14.72 ? 315 LEU A N 1 ATOM 2325 C CA . LEU A 1 315 ? 46.758 8.915 21.906 1.00 15.22 ? 315 LEU A CA 1 ATOM 2326 C C . LEU A 1 315 ? 47.620 7.668 22.093 1.00 16.60 ? 315 LEU A C 1 ATOM 2327 O O . LEU A 1 315 ? 47.503 6.693 21.338 1.00 14.79 ? 315 LEU A O 1 ATOM 2328 C CB . LEU A 1 315 ? 45.402 8.661 22.561 1.00 14.19 ? 315 LEU A CB 1 ATOM 2329 C CG . LEU A 1 315 ? 44.487 9.855 22.784 1.00 15.86 ? 315 LEU A CG 1 ATOM 2330 C CD1 . LEU A 1 315 ? 43.100 9.360 23.141 1.00 15.87 ? 315 LEU A CD1 1 ATOM 2331 C CD2 . LEU A 1 315 ? 45.057 10.742 23.877 1.00 17.56 ? 315 LEU A CD2 1 ATOM 2332 N N . GLU A 1 316 ? 48.474 7.703 23.115 1.00 15.62 ? 316 GLU A N 1 ATOM 2333 C CA . GLU A 1 316 ? 49.334 6.572 23.456 1.00 15.11 ? 316 GLU A CA 1 ATOM 2334 C C . GLU A 1 316 ? 48.880 6.179 24.861 1.00 15.68 ? 316 GLU A C 1 ATOM 2335 O O . GLU A 1 316 ? 49.430 6.655 25.860 1.00 14.38 ? 316 GLU A O 1 ATOM 2336 C CB . GLU A 1 316 ? 50.806 6.987 23.473 1.00 16.65 ? 316 GLU A CB 1 ATOM 2337 C CG . GLU A 1 316 ? 51.274 7.681 22.208 1.00 20.63 ? 316 GLU A CG 1 ATOM 2338 C CD . GLU A 1 316 ? 52.762 7.941 22.209 1.00 21.21 ? 316 GLU A CD 1 ATOM 2339 O OE1 . GLU A 1 316 ? 53.210 8.855 22.925 1.00 24.70 ? 316 GLU A OE1 1 ATOM 2340 O OE2 . GLU A 1 316 ? 53.488 7.225 21.492 1.00 26.06 ? 316 GLU A OE2 1 ATOM 2341 N N . LEU A 1 317 ? 47.833 5.362 24.927 1.00 14.01 ? 317 LEU A N 1 ATOM 2342 C CA . LEU A 1 317 ? 47.250 4.933 26.195 1.00 16.53 ? 317 LEU A CA 1 ATOM 2343 C C . LEU A 1 317 ? 47.966 3.784 26.902 1.00 18.80 ? 317 LEU A C 1 ATOM 2344 O O . LEU A 1 317 ? 48.416 2.823 26.268 1.00 18.73 ? 317 LEU A O 1 ATOM 2345 C CB . LEU A 1 317 ? 45.779 4.576 26.003 1.00 16.49 ? 317 LEU A CB 1 ATOM 2346 C CG . LEU A 1 317 ? 44.873 5.702 25.506 1.00 15.69 ? 317 LEU A CG 1 ATOM 2347 C CD1 . LEU A 1 317 ? 43.459 5.182 25.397 1.00 16.11 ? 317 LEU A CD1 1 ATOM 2348 C CD2 . LEU A 1 317 ? 44.928 6.891 26.452 1.00 17.71 ? 317 LEU A CD2 1 ATOM 2349 N N . SER A 1 318 ? 48.028 3.876 28.228 1.00 17.85 ? 318 SER A N 1 ATOM 2350 C CA . SER A 1 318 ? 48.688 2.863 29.033 1.00 17.34 ? 318 SER A CA 1 ATOM 2351 C C . SER A 1 318 ? 47.835 2.279 30.154 1.00 18.99 ? 318 SER A C 1 ATOM 2352 O O . SER A 1 318 ? 48.260 1.335 30.813 1.00 22.60 ? 318 SER A O 1 ATOM 2353 C CB . SER A 1 318 ? 49.996 3.419 29.592 1.00 14.71 ? 318 SER A CB 1 ATOM 2354 O OG . SER A 1 318 ? 50.908 3.721 28.542 1.00 14.46 ? 318 SER A OG 1 ATOM 2355 N N . CYS A 1 319 ? 46.649 2.831 30.387 1.00 18.09 ? 319 CYS A N 1 ATOM 2356 C CA . CYS A 1 319 ? 45.783 2.299 31.440 1.00 17.60 ? 319 CYS A CA 1 ATOM 2357 C C . CYS A 1 319 ? 44.740 1.359 30.840 1.00 19.19 ? 319 CYS A C 1 ATOM 2358 O O . CYS A 1 319 ? 43.702 1.798 30.353 1.00 18.17 ? 319 CYS A O 1 ATOM 2359 C CB . CYS A 1 319 ? 45.094 3.421 32.220 1.00 15.69 ? 319 CYS A CB 1 ATOM 2360 S SG . CYS A 1 319 ? 43.978 2.797 33.512 1.00 14.09 ? 319 CYS A SG 1 ATOM 2361 N N . PRO A 1 320 ? 44.960 0.046 30.967 1.00 21.38 ? 320 PRO A N 1 ATOM 2362 C CA . PRO A 1 320 ? 44.049 -0.965 30.429 1.00 23.99 ? 320 PRO A CA 1 ATOM 2363 C C . PRO A 1 320 ? 42.690 -1.107 31.117 1.00 26.06 ? 320 PRO A C 1 ATOM 2364 O O . PRO A 1 320 ? 41.726 -1.568 30.502 1.00 27.98 ? 320 PRO A O 1 ATOM 2365 C CB . PRO A 1 320 ? 44.868 -2.248 30.557 1.00 24.19 ? 320 PRO A CB 1 ATOM 2366 C CG . PRO A 1 320 ? 45.617 -2.025 31.831 1.00 24.12 ? 320 PRO A CG 1 ATOM 2367 C CD . PRO A 1 320 ? 46.086 -0.588 31.685 1.00 22.94 ? 320 PRO A CD 1 ATOM 2368 N N . SER A 1 321 ? 42.605 -0.693 32.375 1.00 25.79 ? 321 SER A N 1 ATOM 2369 C CA . SER A 1 321 ? 41.374 -0.839 33.141 1.00 26.16 ? 321 SER A CA 1 ATOM 2370 C C . SER A 1 321 ? 40.406 0.334 33.211 1.00 25.77 ? 321 SER A C 1 ATOM 2371 O O . SER A 1 321 ? 39.390 0.255 33.911 1.00 25.98 ? 321 SER A O 1 ATOM 2372 C CB . SER A 1 321 ? 41.724 -1.309 34.553 1.00 27.42 ? 321 SER A CB 1 ATOM 2373 O OG . SER A 1 321 ? 42.940 -0.718 34.990 1.00 33.49 ? 321 SER A OG 1 ATOM 2374 N N . GLU A 1 322 ? 40.706 1.430 32.524 1.00 24.70 ? 322 GLU A N 1 ATOM 2375 C CA . GLU A 1 322 ? 39.799 2.571 32.567 1.00 24.52 ? 322 GLU A CA 1 ATOM 2376 C C . GLU A 1 322 ? 39.510 3.137 31.187 1.00 20.64 ? 322 GLU A C 1 ATOM 2377 O O . GLU A 1 322 ? 40.416 3.318 30.372 1.00 16.61 ? 322 GLU A O 1 ATOM 2378 C CB . GLU A 1 322 ? 40.331 3.663 33.501 1.00 27.89 ? 322 GLU A CB 1 ATOM 2379 C CG . GLU A 1 322 ? 40.400 3.232 34.965 1.00 33.46 ? 322 GLU A CG 1 ATOM 2380 C CD . GLU A 1 322 ? 40.655 4.390 35.915 1.00 37.86 ? 322 GLU A CD 1 ATOM 2381 O OE1 . GLU A 1 322 ? 41.671 5.101 35.749 1.00 40.11 ? 322 GLU A OE1 1 ATOM 2382 O OE2 . GLU A 1 322 ? 39.830 4.589 36.830 1.00 40.22 ? 322 GLU A OE2 1 ATOM 2383 N N . ARG A 1 323 ? 38.236 3.391 30.919 1.00 20.71 ? 323 ARG A N 1 ATOM 2384 C CA . ARG A 1 323 ? 37.835 3.933 29.629 1.00 19.97 ? 323 ARG A CA 1 ATOM 2385 C C . ARG A 1 323 ? 38.172 5.412 29.515 1.00 18.57 ? 323 ARG A C 1 ATOM 2386 O O . ARG A 1 323 ? 37.812 6.219 30.376 1.00 18.29 ? 323 ARG A O 1 ATOM 2387 C CB . ARG A 1 323 ? 36.335 3.705 29.376 1.00 21.99 ? 323 ARG A CB 1 ATOM 2388 C CG . ARG A 1 323 ? 35.823 4.317 28.068 1.00 25.85 ? 323 ARG A CG 1 ATOM 2389 C CD . ARG A 1 323 ? 34.458 3.767 27.674 1.00 29.34 ? 323 ARG A CD 1 ATOM 2390 N NE . ARG A 1 323 ? 34.528 2.344 27.348 1.00 33.00 ? 323 ARG A NE 1 ATOM 2391 C CZ . ARG A 1 323 ? 33.581 1.455 27.640 1.00 34.55 ? 323 ARG A CZ 1 ATOM 2392 N NH1 . ARG A 1 323 ? 32.477 1.839 28.269 1.00 34.30 ? 323 ARG A NH1 1 ATOM 2393 N NH2 . ARG A 1 323 ? 33.746 0.176 27.321 1.00 33.40 ? 323 ARG A NH2 1 ATOM 2394 N N . PHE A 1 324 ? 38.904 5.748 28.456 1.00 17.65 ? 324 PHE A N 1 ATOM 2395 C CA . PHE A 1 324 ? 39.288 7.118 28.172 1.00 15.63 ? 324 PHE A CA 1 ATOM 2396 C C . PHE A 1 324 ? 38.002 7.810 27.733 1.00 16.70 ? 324 PHE A C 1 ATOM 2397 O O . PHE A 1 324 ? 37.231 7.255 26.946 1.00 18.10 ? 324 PHE A O 1 ATOM 2398 C CB . PHE A 1 324 ? 40.320 7.141 27.041 1.00 13.91 ? 324 PHE A CB 1 ATOM 2399 C CG . PHE A 1 324 ? 41.027 8.450 26.902 1.00 15.19 ? 324 PHE A CG 1 ATOM 2400 C CD1 . PHE A 1 324 ? 42.125 8.748 27.708 1.00 15.39 ? 324 PHE A CD1 1 ATOM 2401 C CD2 . PHE A 1 324 ? 40.584 9.400 25.991 1.00 14.67 ? 324 PHE A CD2 1 ATOM 2402 C CE1 . PHE A 1 324 ? 42.772 9.979 27.609 1.00 15.56 ? 324 PHE A CE1 1 ATOM 2403 C CE2 . PHE A 1 324 ? 41.222 10.636 25.882 1.00 16.71 ? 324 PHE A CE2 1 ATOM 2404 C CZ . PHE A 1 324 ? 42.316 10.926 26.691 1.00 16.39 ? 324 PHE A CZ 1 ATOM 2405 N N . PRO A 1 325 ? 37.738 9.015 28.250 1.00 15.76 ? 325 PRO A N 1 ATOM 2406 C CA . PRO A 1 325 ? 36.520 9.739 27.882 1.00 16.60 ? 325 PRO A CA 1 ATOM 2407 C C . PRO A 1 325 ? 36.470 10.184 26.420 1.00 17.02 ? 325 PRO A C 1 ATOM 2408 O O . PRO A 1 325 ? 37.486 10.185 25.712 1.00 13.53 ? 325 PRO A O 1 ATOM 2409 C CB . PRO A 1 325 ? 36.548 10.940 28.827 1.00 17.28 ? 325 PRO A CB 1 ATOM 2410 C CG . PRO A 1 325 ? 38.022 11.206 28.976 1.00 16.65 ? 325 PRO A CG 1 ATOM 2411 C CD . PRO A 1 325 ? 38.559 9.811 29.180 1.00 16.11 ? 325 PRO A CD 1 ATOM 2412 N N . THR A 1 326 ? 35.264 10.511 25.966 1.00 18.74 ? 326 THR A N 1 ATOM 2413 C CA . THR A 1 326 ? 35.054 10.993 24.609 1.00 19.21 ? 326 THR A CA 1 ATOM 2414 C C . THR A 1 326 ? 35.140 12.509 24.672 1.00 16.87 ? 326 THR A C 1 ATOM 2415 O O . THR A 1 326 ? 34.347 13.163 25.347 1.00 19.20 ? 326 THR A O 1 ATOM 2416 C CB . THR A 1 326 ? 33.665 10.593 24.068 1.00 20.04 ? 326 THR A CB 1 ATOM 2417 O OG1 . THR A 1 326 ? 33.521 9.171 24.138 1.00 21.59 ? 326 THR A OG1 1 ATOM 2418 C CG2 . THR A 1 326 ? 33.509 11.040 22.618 1.00 22.71 ? 326 THR A CG2 1 ATOM 2419 N N . LEU A 1 327 ? 36.134 13.065 24.000 1.00 16.28 ? 327 LEU A N 1 ATOM 2420 C CA . LEU A 1 327 ? 36.325 14.503 23.989 1.00 15.69 ? 327 LEU A CA 1 ATOM 2421 C C . LEU A 1 327 ? 36.212 15.004 22.553 1.00 15.81 ? 327 LEU A C 1 ATOM 2422 O O . LEU A 1 327 ? 36.436 14.253 21.602 1.00 13.59 ? 327 LEU A O 1 ATOM 2423 C CB . LEU A 1 327 ? 37.704 14.843 24.561 1.00 14.20 ? 327 LEU A CB 1 ATOM 2424 C CG . LEU A 1 327 ? 38.049 14.193 25.908 1.00 13.66 ? 327 LEU A CG 1 ATOM 2425 C CD1 . LEU A 1 327 ? 39.485 14.518 26.268 1.00 14.69 ? 327 LEU A CD1 1 ATOM 2426 C CD2 . LEU A 1 327 ? 37.099 14.670 26.995 1.00 11.86 ? 327 LEU A CD2 1 ATOM 2427 N N . THR A 1 328 ? 35.868 16.275 22.403 1.00 17.35 ? 328 THR A N 1 ATOM 2428 C CA . THR A 1 328 ? 35.747 16.879 21.091 1.00 18.16 ? 328 THR A CA 1 ATOM 2429 C C . THR A 1 328 ? 37.114 17.402 20.687 1.00 18.21 ? 328 THR A C 1 ATOM 2430 O O . THR A 1 328 ? 38.042 17.434 21.498 1.00 16.18 ? 328 THR A O 1 ATOM 2431 C CB . THR A 1 328 ? 34.730 18.046 21.090 1.00 20.68 ? 328 THR A CB 1 ATOM 2432 O OG1 . THR A 1 328 ? 35.244 19.140 21.858 1.00 23.67 ? 328 THR A OG1 1 ATOM 2433 C CG2 . THR A 1 328 ? 33.401 17.592 21.686 1.00 20.98 ? 328 THR A CG2 1 ATOM 2434 N N . THR A 1 329 ? 37.242 17.782 19.424 1.00 19.22 ? 329 THR A N 1 ATOM 2435 C CA . THR A 1 329 ? 38.485 18.314 18.902 1.00 19.81 ? 329 THR A CA 1 ATOM 2436 C C . THR A 1 329 ? 38.218 19.729 18.404 1.00 19.89 ? 329 THR A C 1 ATOM 2437 O O . THR A 1 329 ? 37.161 20.003 17.828 1.00 18.27 ? 329 THR A O 1 ATOM 2438 C CB . THR A 1 329 ? 39.031 17.448 17.733 1.00 21.16 ? 329 THR A CB 1 ATOM 2439 O OG1 . THR A 1 329 ? 39.248 16.102 18.186 1.00 23.95 ? 329 THR A OG1 1 ATOM 2440 C CG2 . THR A 1 329 ? 40.352 18.017 17.207 1.00 21.74 ? 329 THR A CG2 1 ATOM 2441 N N . GLN A 1 330 ? 39.137 20.637 18.709 1.00 20.09 ? 330 GLN A N 1 ATOM 2442 C CA . GLN A 1 330 ? 39.021 22.014 18.270 1.00 24.11 ? 330 GLN A CA 1 ATOM 2443 C C . GLN A 1 330 ? 39.304 22.016 16.773 1.00 25.07 ? 330 GLN A C 1 ATOM 2444 O O . GLN A 1 330 ? 40.279 21.413 16.321 1.00 23.24 ? 330 GLN A O 1 ATOM 2445 C CB . GLN A 1 330 ? 40.033 22.892 19.007 1.00 27.77 ? 330 GLN A CB 1 ATOM 2446 C CG . GLN A 1 330 ? 39.787 22.959 20.509 1.00 34.28 ? 330 GLN A CG 1 ATOM 2447 C CD . GLN A 1 330 ? 40.799 23.826 21.225 1.00 37.92 ? 330 GLN A CD 1 ATOM 2448 O OE1 . GLN A 1 330 ? 41.135 24.913 20.757 1.00 43.27 ? 330 GLN A OE1 1 ATOM 2449 N NE2 . GLN A 1 330 ? 41.310 23.342 22.352 1.00 38.99 ? 330 GLN A NE2 1 ATOM 2450 N N . PRO A 1 331 ? 38.434 22.666 15.981 1.00 26.38 ? 331 PRO A N 1 ATOM 2451 C CA . PRO A 1 331 ? 38.581 22.741 14.520 1.00 26.29 ? 331 PRO A CA 1 ATOM 2452 C C . PRO A 1 331 ? 39.873 23.402 14.048 1.00 25.11 ? 331 PRO A C 1 ATOM 2453 O O . PRO A 1 331 ? 40.379 24.329 14.684 1.00 24.51 ? 331 PRO A O 1 ATOM 2454 C CB . PRO A 1 331 ? 37.352 23.545 14.095 1.00 26.59 ? 331 PRO A CB 1 ATOM 2455 C CG . PRO A 1 331 ? 37.091 24.429 15.283 1.00 29.76 ? 331 PRO A CG 1 ATOM 2456 C CD . PRO A 1 331 ? 37.281 23.467 16.435 1.00 27.89 ? 331 PRO A CD 1 ATOM 2457 N N . GLY A 1 332 ? 40.386 22.928 12.916 1.00 24.78 ? 332 GLY A N 1 ATOM 2458 C CA . GLY A 1 332 ? 41.610 23.477 12.357 1.00 23.81 ? 332 GLY A CA 1 ATOM 2459 C C . GLY A 1 332 ? 42.514 22.391 11.816 1.00 23.87 ? 332 GLY A C 1 ATOM 2460 O O . GLY A 1 332 ? 42.556 21.291 12.356 1.00 25.43 ? 332 GLY A O 1 ATOM 2461 N N . ALA A 1 333 ? 43.232 22.690 10.740 1.00 25.17 ? 333 ALA A N 1 ATOM 2462 C CA . ALA A 1 333 ? 44.137 21.715 10.132 1.00 25.52 ? 333 ALA A CA 1 ATOM 2463 C C . ALA A 1 333 ? 45.546 21.796 10.715 1.00 24.96 ? 333 ALA A C 1 ATOM 2464 O O . ALA A 1 333 ? 46.298 20.817 10.714 1.00 25.22 ? 333 ALA A O 1 ATOM 2465 C CB . ALA A 1 333 ? 44.187 21.923 8.627 1.00 26.29 ? 333 ALA A CB 1 ATOM 2466 N N . SER A 1 334 ? 45.906 22.976 11.196 1.00 22.38 ? 334 SER A N 1 ATOM 2467 C CA . SER A 1 334 ? 47.222 23.185 11.756 1.00 23.24 ? 334 SER A CA 1 ATOM 2468 C C . SER A 1 334 ? 47.156 23.552 13.228 1.00 20.78 ? 334 SER A C 1 ATOM 2469 O O . SER A 1 334 ? 46.088 23.878 13.754 1.00 17.82 ? 334 SER A O 1 ATOM 2470 C CB . SER A 1 334 ? 47.962 24.269 10.969 1.00 25.05 ? 334 SER A CB 1 ATOM 2471 O OG . SER A 1 334 ? 48.294 23.806 9.669 1.00 33.05 ? 334 SER A OG 1 ATOM 2472 N N . GLN A 1 335 ? 48.306 23.453 13.887 1.00 20.56 ? 335 GLN A N 1 ATOM 2473 C CA . GLN A 1 335 ? 48.416 23.772 15.302 1.00 16.71 ? 335 GLN A CA 1 ATOM 2474 C C . GLN A 1 335 ? 48.319 25.275 15.514 1.00 15.11 ? 335 GLN A C 1 ATOM 2475 O O . GLN A 1 335 ? 48.875 26.061 14.740 1.00 17.04 ? 335 GLN A O 1 ATOM 2476 C CB . GLN A 1 335 ? 49.769 23.293 15.851 1.00 15.86 ? 335 GLN A CB 1 ATOM 2477 C CG . GLN A 1 335 ? 49.949 23.598 17.335 1.00 14.90 ? 335 GLN A CG 1 ATOM 2478 C CD . GLN A 1 335 ? 51.398 23.716 17.766 1.00 11.93 ? 335 GLN A CD 1 ATOM 2479 O OE1 . GLN A 1 335 ? 51.767 24.665 18.455 1.00 13.33 ? 335 GLN A OE1 1 ATOM 2480 N NE2 . GLN A 1 335 ? 52.223 22.752 17.375 1.00 7.14 ? 335 GLN A NE2 1 ATOM 2481 N N . SER A 1 336 ? 47.596 25.673 16.550 1.00 15.41 ? 336 SER A N 1 ATOM 2482 C CA . SER A 1 336 ? 47.483 27.081 16.890 1.00 17.32 ? 336 SER A CA 1 ATOM 2483 C C . SER A 1 336 ? 48.704 27.426 17.752 1.00 15.94 ? 336 SER A C 1 ATOM 2484 O O . SER A 1 336 ? 49.291 26.553 18.390 1.00 18.13 ? 336 SER A O 1 ATOM 2485 C CB . SER A 1 336 ? 46.209 27.334 17.695 1.00 19.09 ? 336 SER A CB 1 ATOM 2486 O OG . SER A 1 336 ? 45.067 26.825 17.032 1.00 26.58 ? 336 SER A OG 1 ATOM 2487 N N . LEU A 1 337 ? 49.105 28.687 17.733 1.00 15.92 ? 337 LEU A N 1 ATOM 2488 C CA . LEU A 1 337 ? 50.230 29.137 18.533 1.00 15.66 ? 337 LEU A CA 1 ATOM 2489 C C . LEU A 1 337 ? 49.735 29.342 19.965 1.00 16.27 ? 337 LEU A C 1 ATOM 2490 O O . LEU A 1 337 ? 48.601 29.792 20.178 1.00 16.37 ? 337 LEU A O 1 ATOM 2491 C CB . LEU A 1 337 ? 50.761 30.460 17.987 1.00 16.29 ? 337 LEU A CB 1 ATOM 2492 C CG . LEU A 1 337 ? 52.026 30.436 17.128 1.00 19.86 ? 337 LEU A CG 1 ATOM 2493 C CD1 . LEU A 1 337 ? 51.964 29.333 16.096 1.00 22.25 ? 337 LEU A CD1 1 ATOM 2494 C CD2 . LEU A 1 337 ? 52.207 31.793 16.471 1.00 21.17 ? 337 LEU A CD2 1 ATOM 2495 N N . ILE A 1 338 ? 50.554 28.946 20.936 1.00 12.54 ? 338 ILE A N 1 ATOM 2496 C CA . ILE A 1 338 ? 50.225 29.118 22.346 1.00 10.61 ? 338 ILE A CA 1 ATOM 2497 C C . ILE A 1 338 ? 50.680 30.527 22.734 1.00 8.78 ? 338 ILE A C 1 ATOM 2498 O O . ILE A 1 338 ? 51.850 30.885 22.570 1.00 8.09 ? 338 ILE A O 1 ATOM 2499 C CB . ILE A 1 338 ? 50.918 28.037 23.221 1.00 13.02 ? 338 ILE A CB 1 ATOM 2500 C CG1 . ILE A 1 338 ? 50.441 26.652 22.777 1.00 13.53 ? 338 ILE A CG1 1 ATOM 2501 C CG2 . ILE A 1 338 ? 50.552 28.223 24.693 1.00 10.70 ? 338 ILE A CG2 1 ATOM 2502 C CD1 . ILE A 1 338 ? 51.286 25.507 23.273 1.00 15.31 ? 338 ILE A CD1 1 ATOM 2503 N N . ALA A 1 339 ? 49.721 31.343 23.163 1.00 8.72 ? 339 ALA A N 1 ATOM 2504 C CA . ALA A 1 339 ? 49.956 32.732 23.555 1.00 11.18 ? 339 ALA A CA 1 ATOM 2505 C C . ALA A 1 339 ? 50.993 32.872 24.668 1.00 13.46 ? 339 ALA A C 1 ATOM 2506 O O . ALA A 1 339 ? 50.930 32.172 25.683 1.00 12.37 ? 339 ALA A O 1 ATOM 2507 C CB . ALA A 1 339 ? 48.645 33.381 23.993 1.00 11.35 ? 339 ALA A CB 1 ATOM 2508 N N . HIS A 1 340 ? 51.914 33.809 24.479 1.00 13.88 ? 340 HIS A N 1 ATOM 2509 C CA . HIS A 1 340 ? 52.972 34.075 25.440 1.00 15.77 ? 340 HIS A CA 1 ATOM 2510 C C . HIS A 1 340 ? 52.445 34.884 26.623 1.00 17.15 ? 340 HIS A C 1 ATOM 2511 O O . HIS A 1 340 ? 52.971 34.785 27.727 1.00 18.05 ? 340 HIS A O 1 ATOM 2512 C CB . HIS A 1 340 ? 54.106 34.837 24.757 1.00 14.99 ? 340 HIS A CB 1 ATOM 2513 C CG . HIS A 1 340 ? 55.225 35.216 25.676 1.00 17.18 ? 340 HIS A CG 1 ATOM 2514 N ND1 . HIS A 1 340 ? 56.187 34.317 26.089 1.00 17.11 ? 340 HIS A ND1 1 ATOM 2515 C CD2 . HIS A 1 340 ? 55.552 36.401 26.243 1.00 16.16 ? 340 HIS A CD2 1 ATOM 2516 C CE1 . HIS A 1 340 ? 57.060 34.936 26.866 1.00 18.00 ? 340 HIS A CE1 1 ATOM 2517 N NE2 . HIS A 1 340 ? 56.695 36.202 26.975 1.00 16.48 ? 340 HIS A NE2 1 ATOM 2518 N N . CYS A 1 341 ? 51.423 35.698 26.378 1.00 16.97 ? 341 CYS A N 1 ATOM 2519 C CA . CYS A 1 341 ? 50.834 36.536 27.409 1.00 18.12 ? 341 CYS A CA 1 ATOM 2520 C C . CYS A 1 341 ? 49.386 36.181 27.661 1.00 21.55 ? 341 CYS A C 1 ATOM 2521 O O . CYS A 1 341 ? 48.664 35.800 26.736 1.00 22.57 ? 341 CYS A O 1 ATOM 2522 C CB . CYS A 1 341 ? 50.918 37.996 26.990 1.00 17.13 ? 341 CYS A CB 1 ATOM 2523 S SG . CYS A 1 341 ? 52.619 38.552 26.756 1.00 21.51 ? 341 CYS A SG 1 ATOM 2524 N N . PRO A 1 342 ? 48.925 36.326 28.915 1.00 24.50 ? 342 PRO A N 1 ATOM 2525 C CA . PRO A 1 342 ? 47.535 36.005 29.251 1.00 28.00 ? 342 PRO A CA 1 ATOM 2526 C C . PRO A 1 342 ? 46.516 36.878 28.507 1.00 32.07 ? 342 PRO A C 1 ATOM 2527 O O . PRO A 1 342 ? 45.401 36.431 28.225 1.00 31.78 ? 342 PRO A O 1 ATOM 2528 C CB . PRO A 1 342 ? 47.491 36.200 30.773 1.00 26.95 ? 342 PRO A CB 1 ATOM 2529 C CG . PRO A 1 342 ? 48.571 37.178 31.032 1.00 26.69 ? 342 PRO A CG 1 ATOM 2530 C CD . PRO A 1 342 ? 49.674 36.718 30.120 1.00 25.51 ? 342 PRO A CD 1 ATOM 2531 N N . ASP A 1 343 ? 46.908 38.107 28.172 1.00 34.67 ? 343 ASP A N 1 ATOM 2532 C CA . ASP A 1 343 ? 46.024 39.020 27.444 1.00 37.85 ? 343 ASP A CA 1 ATOM 2533 C C . ASP A 1 343 ? 45.997 38.699 25.948 1.00 38.88 ? 343 ASP A C 1 ATOM 2534 O O . ASP A 1 343 ? 45.177 39.242 25.208 1.00 39.31 ? 343 ASP A O 1 ATOM 2535 C CB . ASP A 1 343 ? 46.453 40.479 27.649 1.00 40.51 ? 343 ASP A CB 1 ATOM 2536 C CG . ASP A 1 343 ? 47.812 40.779 27.046 1.00 44.95 ? 343 ASP A CG 1 ATOM 2537 O OD1 . ASP A 1 343 ? 48.835 40.496 27.709 1.00 48.16 ? 343 ASP A OD1 1 ATOM 2538 O OD2 . ASP A 1 343 ? 47.860 41.299 25.909 1.00 48.01 ? 343 ASP A OD2 1 ATOM 2539 N N . GLY A 1 344 ? 46.915 37.840 25.508 1.00 38.47 ? 344 GLY A N 1 ATOM 2540 C CA . GLY A 1 344 ? 46.977 37.460 24.109 1.00 37.23 ? 344 GLY A CA 1 ATOM 2541 C C . GLY A 1 344 ? 48.228 37.943 23.400 1.00 37.25 ? 344 GLY A C 1 ATOM 2542 O O . GLY A 1 344 ? 48.725 37.275 22.495 1.00 38.11 ? 344 GLY A O 1 ATOM 2543 N N . SER A 1 345 ? 48.740 39.097 23.814 1.00 38.47 ? 345 SER A N 1 ATOM 2544 C CA . SER A 1 345 ? 49.939 39.690 23.218 1.00 38.56 ? 345 SER A CA 1 ATOM 2545 C C . SER A 1 345 ? 51.216 38.868 23.448 1.00 39.38 ? 345 SER A C 1 ATOM 2546 O O . SER A 1 345 ? 51.170 37.747 23.973 1.00 37.99 ? 345 SER A O 1 ATOM 2547 C CB . SER A 1 345 ? 50.126 41.112 23.768 1.00 38.91 ? 345 SER A CB 1 ATOM 2548 O OG . SER A 1 345 ? 51.308 41.728 23.278 1.00 41.14 ? 345 SER A OG 1 ATOM 2549 N N . MET A 1 346 ? 52.339 39.422 22.992 1.00 40.31 ? 346 MET A N 1 ATOM 2550 C CA . MET A 1 346 ? 53.660 38.818 23.152 1.00 41.49 ? 346 MET A CA 1 ATOM 2551 C C . MET A 1 346 ? 54.512 39.681 24.095 1.00 40.81 ? 346 MET A C 1 ATOM 2552 O O . MET A 1 346 ? 55.608 39.281 24.505 1.00 40.37 ? 346 MET A O 1 ATOM 2553 C CB . MET A 1 346 ? 54.378 38.686 21.804 1.00 44.10 ? 346 MET A CB 1 ATOM 2554 C CG . MET A 1 346 ? 53.852 37.584 20.893 1.00 47.13 ? 346 MET A CG 1 ATOM 2555 S SD . MET A 1 346 ? 55.046 37.142 19.589 1.00 52.42 ? 346 MET A SD 1 ATOM 2556 C CE . MET A 1 346 ? 54.539 38.250 18.273 1.00 50.36 ? 346 MET A CE 1 ATOM 2557 N N . SER A 1 347 ? 53.998 40.859 24.442 1.00 39.62 ? 347 SER A N 1 ATOM 2558 C CA . SER A 1 347 ? 54.698 41.789 25.325 1.00 38.68 ? 347 SER A CA 1 ATOM 2559 C C . SER A 1 347 ? 53.976 41.935 26.667 1.00 35.18 ? 347 SER A C 1 ATOM 2560 O O . SER A 1 347 ? 52.932 42.582 26.747 1.00 34.42 ? 347 SER A O 1 ATOM 2561 C CB . SER A 1 347 ? 54.798 43.154 24.646 1.00 41.49 ? 347 SER A CB 1 ATOM 2562 O OG . SER A 1 347 ? 54.993 43.000 23.248 1.00 45.95 ? 347 SER A OG 1 ATOM 2563 N N . CYS A 1 348 ? 54.536 41.326 27.710 1.00 31.71 ? 348 CYS A N 1 ATOM 2564 C CA . CYS A 1 348 ? 53.954 41.387 29.052 1.00 28.04 ? 348 CYS A CA 1 ATOM 2565 C C . CYS A 1 348 ? 55.008 41.052 30.117 1.00 27.76 ? 348 CYS A C 1 ATOM 2566 O O . CYS A 1 348 ? 54.889 40.056 30.836 1.00 23.16 ? 348 CYS A O 1 ATOM 2567 C CB . CYS A 1 348 ? 52.792 40.401 29.149 1.00 23.60 ? 348 CYS A CB 1 ATOM 2568 S SG . CYS A 1 348 ? 53.269 38.709 28.673 1.00 23.44 ? 348 CYS A SG 1 ATOM 2569 N N . PRO A 1 349 ? 56.060 41.879 30.227 1.00 29.36 ? 349 PRO A N 1 ATOM 2570 C CA . PRO A 1 349 ? 57.122 41.638 31.211 1.00 30.95 ? 349 PRO A CA 1 ATOM 2571 C C . PRO A 1 349 ? 56.634 41.785 32.653 1.00 28.31 ? 349 PRO A C 1 ATOM 2572 O O . PRO A 1 349 ? 55.915 42.733 32.984 1.00 29.71 ? 349 PRO A O 1 ATOM 2573 C CB . PRO A 1 349 ? 58.168 42.709 30.860 1.00 32.37 ? 349 PRO A CB 1 ATOM 2574 C CG . PRO A 1 349 ? 57.869 43.053 29.421 1.00 33.37 ? 349 PRO A CG 1 ATOM 2575 C CD . PRO A 1 349 ? 56.367 43.078 29.431 1.00 31.96 ? 349 PRO A CD 1 ATOM 2576 N N . GLY A 1 350 ? 56.979 40.809 33.484 1.00 27.28 ? 350 GLY A N 1 ATOM 2577 C CA . GLY A 1 350 ? 56.586 40.848 34.880 1.00 23.90 ? 350 GLY A CA 1 ATOM 2578 C C . GLY A 1 350 ? 57.563 41.693 35.679 1.00 21.62 ? 350 GLY A C 1 ATOM 2579 O O . GLY A 1 350 ? 58.595 42.126 35.156 1.00 20.51 ? 350 GLY A O 1 ATOM 2580 N N . VAL A 1 351 ? 57.215 41.978 36.925 1.00 18.94 ? 351 VAL A N 1 ATOM 2581 C CA . VAL A 1 351 ? 58.073 42.758 37.810 1.00 15.72 ? 351 VAL A CA 1 ATOM 2582 C C . VAL A 1 351 ? 59.192 41.842 38.295 1.00 14.18 ? 351 VAL A C 1 ATOM 2583 O O . VAL A 1 351 ? 58.966 40.659 38.554 1.00 13.52 ? 351 VAL A O 1 ATOM 2584 C CB . VAL A 1 351 ? 57.274 43.280 39.030 1.00 16.76 ? 351 VAL A CB 1 ATOM 2585 C CG1 . VAL A 1 351 ? 58.187 44.020 39.999 1.00 17.28 ? 351 VAL A CG1 1 ATOM 2586 C CG2 . VAL A 1 351 ? 56.146 44.189 38.560 1.00 17.28 ? 351 VAL A CG2 1 ATOM 2587 N N . GLN A 1 352 ? 60.406 42.367 38.365 1.00 14.76 ? 352 GLN A N 1 ATOM 2588 C CA . GLN A 1 352 ? 61.532 41.577 38.834 1.00 15.07 ? 352 GLN A CA 1 ATOM 2589 C C . GLN A 1 352 ? 62.492 42.454 39.618 1.00 16.47 ? 352 GLN A C 1 ATOM 2590 O O . GLN A 1 352 ? 62.899 43.515 39.145 1.00 18.78 ? 352 GLN A O 1 ATOM 2591 C CB . GLN A 1 352 ? 62.256 40.917 37.661 1.00 13.18 ? 352 GLN A CB 1 ATOM 2592 C CG . GLN A 1 352 ? 63.430 40.023 38.060 1.00 15.09 ? 352 GLN A CG 1 ATOM 2593 C CD . GLN A 1 352 ? 63.035 38.870 38.974 1.00 17.02 ? 352 GLN A CD 1 ATOM 2594 O OE1 . GLN A 1 352 ? 63.599 38.694 40.056 1.00 19.10 ? 352 GLN A OE1 1 ATOM 2595 N NE2 . GLN A 1 352 ? 62.070 38.065 38.534 1.00 12.13 ? 352 GLN A NE2 1 ATOM 2596 N N . PHE A 1 353 ? 62.820 42.020 40.830 1.00 17.50 ? 353 PHE A N 1 ATOM 2597 C CA . PHE A 1 353 ? 63.737 42.753 41.701 1.00 17.05 ? 353 PHE A CA 1 ATOM 2598 C C . PHE A 1 353 ? 65.120 42.106 41.701 1.00 17.07 ? 353 PHE A C 1 ATOM 2599 O O . PHE A 1 353 ? 65.256 40.897 41.524 1.00 15.82 ? 353 PHE A O 1 ATOM 2600 C CB . PHE A 1 353 ? 63.221 42.766 43.139 1.00 15.59 ? 353 PHE A CB 1 ATOM 2601 C CG . PHE A 1 353 ? 61.947 43.532 43.329 1.00 14.21 ? 353 PHE A CG 1 ATOM 2602 C CD1 . PHE A 1 353 ? 61.883 44.887 43.035 1.00 15.98 ? 353 PHE A CD1 1 ATOM 2603 C CD2 . PHE A 1 353 ? 60.810 42.897 43.815 1.00 16.32 ? 353 PHE A CD2 1 ATOM 2604 C CE1 . PHE A 1 353 ? 60.703 45.607 43.221 1.00 16.83 ? 353 PHE A CE1 1 ATOM 2605 C CE2 . PHE A 1 353 ? 59.623 43.606 44.004 1.00 17.16 ? 353 PHE A CE2 1 ATOM 2606 C CZ . PHE A 1 353 ? 59.573 44.967 43.704 1.00 14.73 ? 353 PHE A CZ 1 ATOM 2607 N N . ASN A 1 354 ? 66.146 42.924 41.887 1.00 19.27 ? 354 ASN A N 1 ATOM 2608 C CA . ASN A 1 354 ? 67.512 42.426 41.961 1.00 22.39 ? 354 ASN A CA 1 ATOM 2609 C C . ASN A 1 354 ? 67.683 41.990 43.420 1.00 21.18 ? 354 ASN A C 1 ATOM 2610 O O . ASN A 1 354 ? 67.051 42.551 44.320 1.00 19.78 ? 354 ASN A O 1 ATOM 2611 C CB . ASN A 1 354 ? 68.509 43.538 41.631 1.00 28.50 ? 354 ASN A CB 1 ATOM 2612 C CG . ASN A 1 354 ? 68.280 44.137 40.252 1.00 34.23 ? 354 ASN A CG 1 ATOM 2613 O OD1 . ASN A 1 354 ? 67.704 45.223 40.116 1.00 36.51 ? 354 ASN A OD1 1 ATOM 2614 N ND2 . ASN A 1 354 ? 68.721 43.430 39.220 1.00 36.71 ? 354 ASN A ND2 1 ATOM 2615 N N . GLY A 1 355 ? 68.511 40.984 43.661 1.00 20.76 ? 355 GLY A N 1 ATOM 2616 C CA . GLY A 1 355 ? 68.687 40.533 45.025 1.00 21.13 ? 355 GLY A CA 1 ATOM 2617 C C . GLY A 1 355 ? 69.950 39.727 45.207 1.00 21.57 ? 355 GLY A C 1 ATOM 2618 O O . GLY A 1 355 ? 70.801 39.698 44.315 1.00 19.95 ? 355 GLY A O 1 ATOM 2619 N N . PRO A 1 356 ? 70.100 39.067 46.367 1.00 20.67 ? 356 PRO A N 1 ATOM 2620 C CA . PRO A 1 356 ? 71.271 38.245 46.694 1.00 20.51 ? 356 PRO A CA 1 ATOM 2621 C C . PRO A 1 356 ? 71.372 36.867 46.029 1.00 19.25 ? 356 PRO A C 1 ATOM 2622 O O . PRO A 1 356 ? 72.482 36.336 45.887 1.00 19.46 ? 356 PRO A O 1 ATOM 2623 C CB . PRO A 1 356 ? 71.202 38.152 48.220 1.00 20.94 ? 356 PRO A CB 1 ATOM 2624 C CG . PRO A 1 356 ? 69.727 38.169 48.491 1.00 21.03 ? 356 PRO A CG 1 ATOM 2625 C CD . PRO A 1 356 ? 69.227 39.240 47.545 1.00 19.45 ? 356 PRO A CD 1 ATOM 2626 N N . ALA A 1 357 ? 70.239 36.280 45.643 1.00 18.64 ? 357 ALA A N 1 ATOM 2627 C CA . ALA A 1 357 ? 70.257 34.965 45.009 1.00 19.20 ? 357 ALA A CA 1 ATOM 2628 C C . ALA A 1 357 ? 70.762 35.051 43.573 1.00 20.62 ? 357 ALA A C 1 ATOM 2629 O O . ALA A 1 357 ? 70.503 36.087 42.919 1.00 20.30 ? 357 ALA A O 1 ATOM 2630 C CB . ALA A 1 357 ? 68.876 34.329 45.051 1.00 18.21 ? 357 ALA A CB 1 ATOM 2631 O OXT . ALA A 1 357 ? 71.431 34.090 43.120 1.00 23.46 ? 357 ALA A OXT 1 HETATM 2632 C C1 . NAG B 2 . ? 63.141 36.697 59.778 1.00 16.00 ? 361 NAG A C1 1 HETATM 2633 C C2 . NAG B 2 . ? 62.753 38.100 60.315 1.00 15.90 ? 361 NAG A C2 1 HETATM 2634 C C3 . NAG B 2 . ? 63.160 39.139 59.306 1.00 16.73 ? 361 NAG A C3 1 HETATM 2635 C C4 . NAG B 2 . ? 64.656 39.006 58.988 1.00 17.92 ? 361 NAG A C4 1 HETATM 2636 C C5 . NAG B 2 . ? 65.001 37.582 58.501 1.00 19.07 ? 361 NAG A C5 1 HETATM 2637 C C6 . NAG B 2 . ? 66.496 37.318 58.244 1.00 21.75 ? 361 NAG A C6 1 HETATM 2638 C C7 . NAG B 2 . ? 60.674 37.646 61.567 1.00 19.31 ? 361 NAG A C7 1 HETATM 2639 C C8 . NAG B 2 . ? 59.163 37.817 61.643 1.00 18.78 ? 361 NAG A C8 1 HETATM 2640 N N2 . NAG B 2 . ? 61.309 38.196 60.538 1.00 15.81 ? 361 NAG A N2 1 HETATM 2641 O O3 . NAG B 2 . ? 62.871 40.430 59.793 1.00 18.97 ? 361 NAG A O3 1 HETATM 2642 O O4 . NAG B 2 . ? 65.017 39.974 58.028 1.00 18.34 ? 361 NAG A O4 1 HETATM 2643 O O5 . NAG B 2 . ? 64.542 36.625 59.488 1.00 18.37 ? 361 NAG A O5 1 HETATM 2644 O O6 . NAG B 2 . ? 67.249 37.642 59.393 1.00 27.48 ? 361 NAG A O6 1 HETATM 2645 O O7 . NAG B 2 . ? 61.262 37.008 62.449 1.00 19.69 ? 361 NAG A O7 1 HETATM 2646 C C1 . NAG C 2 . ? 65.471 41.235 58.398 1.00 19.80 ? 362 NAG A C1 1 HETATM 2647 C C2 . NAG C 2 . ? 66.276 41.742 57.263 1.00 21.96 ? 362 NAG A C2 1 HETATM 2648 C C3 . NAG C 2 . ? 66.709 43.150 57.583 1.00 21.35 ? 362 NAG A C3 1 HETATM 2649 C C4 . NAG C 2 . ? 65.535 44.078 57.794 1.00 23.52 ? 362 NAG A C4 1 HETATM 2650 C C5 . NAG C 2 . ? 64.728 43.519 58.970 1.00 23.08 ? 362 NAG A C5 1 HETATM 2651 C C6 . NAG C 2 . ? 63.454 44.291 59.337 1.00 25.13 ? 362 NAG A C6 1 HETATM 2652 C C7 . NAG C 2 . ? 67.611 40.316 55.787 1.00 28.23 ? 362 NAG A C7 1 HETATM 2653 C C8 . NAG C 2 . ? 68.878 39.497 55.603 1.00 28.30 ? 362 NAG A C8 1 HETATM 2654 N N2 . NAG C 2 . ? 67.443 40.922 56.961 1.00 24.53 ? 362 NAG A N2 1 HETATM 2655 O O3 . NAG C 2 . ? 67.477 43.671 56.552 1.00 23.67 ? 362 NAG A O3 1 HETATM 2656 O O4 . NAG C 2 . ? 66.038 45.389 58.024 1.00 26.56 ? 362 NAG A O4 1 HETATM 2657 O O5 . NAG C 2 . ? 64.377 42.145 58.646 1.00 21.73 ? 362 NAG A O5 1 HETATM 2658 O O6 . NAG C 2 . ? 62.752 43.602 60.384 1.00 27.97 ? 362 NAG A O6 1 HETATM 2659 O O7 . NAG C 2 . ? 66.788 40.377 54.870 1.00 28.24 ? 362 NAG A O7 1 HETATM 2660 CA CA . CA D 3 . ? 46.585 24.550 31.805 1.00 8.37 ? 371 CA A CA 1 HETATM 2661 CA CA . CA E 3 . ? 63.384 24.472 52.576 1.00 10.05 ? 372 CA A CA 1 HETATM 2662 MN MN . MN F 4 . ? 59.693 30.668 34.408 1.00 35.32 ? 381 MN A MN 1 HETATM 2663 C CHA . HEM G 5 . ? 58.523 24.081 36.286 1.00 4.87 ? 396 HEM A CHA 1 HETATM 2664 C CHB . HEM G 5 . ? 60.430 19.692 36.987 1.00 2.56 ? 396 HEM A CHB 1 HETATM 2665 C CHC . HEM G 5 . ? 57.178 18.860 40.463 1.00 5.64 ? 396 HEM A CHC 1 HETATM 2666 C CHD . HEM G 5 . ? 55.508 23.375 39.999 1.00 7.56 ? 396 HEM A CHD 1 HETATM 2667 C C1A . HEM G 5 . ? 59.328 22.963 36.167 1.00 3.89 ? 396 HEM A C1A 1 HETATM 2668 C C2A . HEM G 5 . ? 60.492 22.867 35.323 1.00 3.37 ? 396 HEM A C2A 1 HETATM 2669 C C3A . HEM G 5 . ? 61.013 21.642 35.503 1.00 4.34 ? 396 HEM A C3A 1 HETATM 2670 C C4A . HEM G 5 . ? 60.206 20.981 36.506 1.00 6.23 ? 396 HEM A C4A 1 HETATM 2671 C CMA . HEM G 5 . ? 62.239 21.119 34.758 1.00 5.77 ? 396 HEM A CMA 1 HETATM 2672 C CAA . HEM G 5 . ? 61.130 23.879 34.417 1.00 5.94 ? 396 HEM A CAA 1 HETATM 2673 C CBA . HEM G 5 . ? 61.792 25.033 35.139 1.00 7.07 ? 396 HEM A CBA 1 HETATM 2674 C CGA . HEM G 5 . ? 62.621 25.880 34.209 1.00 5.44 ? 396 HEM A CGA 1 HETATM 2675 O O1A . HEM G 5 . ? 63.530 25.337 33.548 1.00 8.47 ? 396 HEM A O1A 1 HETATM 2676 O O2A . HEM G 5 . ? 62.361 27.095 34.129 1.00 5.51 ? 396 HEM A O2A 1 HETATM 2677 C C1B . HEM G 5 . ? 59.655 19.054 37.944 1.00 3.82 ? 396 HEM A C1B 1 HETATM 2678 C C2B . HEM G 5 . ? 59.850 17.701 38.400 1.00 5.43 ? 396 HEM A C2B 1 HETATM 2679 C C3B . HEM G 5 . ? 58.870 17.434 39.278 1.00 7.30 ? 396 HEM A C3B 1 HETATM 2680 C C4B . HEM G 5 . ? 58.142 18.661 39.481 1.00 5.70 ? 396 HEM A C4B 1 HETATM 2681 C CMB . HEM G 5 . ? 60.980 16.771 38.016 1.00 6.40 ? 396 HEM A CMB 1 HETATM 2682 C CAB . HEM G 5 . ? 58.606 16.227 39.944 1.00 11.11 ? 396 HEM A CAB 1 HETATM 2683 C CBB . HEM G 5 . ? 58.778 14.882 39.475 1.00 16.70 ? 396 HEM A CBB 1 HETATM 2684 C C1C . HEM G 5 . ? 56.467 20.031 40.672 1.00 4.59 ? 396 HEM A C1C 1 HETATM 2685 C C2C . HEM G 5 . ? 55.536 20.251 41.763 1.00 6.66 ? 396 HEM A C2C 1 HETATM 2686 C C3C . HEM G 5 . ? 55.161 21.551 41.702 1.00 4.94 ? 396 HEM A C3C 1 HETATM 2687 C C4C . HEM G 5 . ? 55.756 22.101 40.497 1.00 5.42 ? 396 HEM A C4C 1 HETATM 2688 C CMC . HEM G 5 . ? 55.103 19.170 42.760 1.00 7.56 ? 396 HEM A CMC 1 HETATM 2689 C CAC . HEM G 5 . ? 54.387 22.314 42.580 1.00 4.96 ? 396 HEM A CAC 1 HETATM 2690 C CBC . HEM G 5 . ? 53.194 21.935 43.312 1.00 9.03 ? 396 HEM A CBC 1 HETATM 2691 C C1D . HEM G 5 . ? 56.088 23.910 38.861 1.00 5.42 ? 396 HEM A C1D 1 HETATM 2692 C C2D . HEM G 5 . ? 55.751 25.177 38.275 1.00 3.49 ? 396 HEM A C2D 1 HETATM 2693 C C3D . HEM G 5 . ? 56.623 25.384 37.269 1.00 4.77 ? 396 HEM A C3D 1 HETATM 2694 C C4D . HEM G 5 . ? 57.463 24.219 37.175 1.00 4.29 ? 396 HEM A C4D 1 HETATM 2695 C CMD . HEM G 5 . ? 54.642 26.179 38.636 1.00 4.08 ? 396 HEM A CMD 1 HETATM 2696 C CAD . HEM G 5 . ? 56.629 26.603 36.392 1.00 4.26 ? 396 HEM A CAD 1 HETATM 2697 C CBD . HEM G 5 . ? 57.475 27.814 36.698 1.00 9.15 ? 396 HEM A CBD 1 HETATM 2698 C CGD . HEM G 5 . ? 57.292 28.906 35.667 1.00 12.97 ? 396 HEM A CGD 1 HETATM 2699 O O1D . HEM G 5 . ? 57.943 29.960 35.786 1.00 11.16 ? 396 HEM A O1D 1 HETATM 2700 O O2D . HEM G 5 . ? 56.477 28.733 34.735 1.00 12.82 ? 396 HEM A O2D 1 HETATM 2701 N NA . HEM G 5 . ? 59.169 21.806 36.892 1.00 3.57 ? 396 HEM A NA 1 HETATM 2702 N NB . HEM G 5 . ? 58.565 19.615 38.575 1.00 3.95 ? 396 HEM A NB 1 HETATM 2703 N NC . HEM G 5 . ? 56.582 21.174 39.904 1.00 4.41 ? 396 HEM A NC 1 HETATM 2704 N ND . HEM G 5 . ? 57.049 23.277 38.092 1.00 4.08 ? 396 HEM A ND 1 HETATM 2705 FE FE . HEM G 5 . ? 57.777 21.477 38.308 1.00 7.58 ? 396 HEM A FE 1 HETATM 2706 O O . HOH H 6 . ? 55.701 17.805 30.424 1.00 7.58 ? 401 HOH A O 1 HETATM 2707 O O . HOH H 6 . ? 63.707 26.253 28.054 1.00 11.44 ? 402 HOH A O 1 HETATM 2708 O O . HOH H 6 . ? 54.138 18.731 28.447 1.00 3.88 ? 403 HOH A O 1 HETATM 2709 O O . HOH H 6 . ? 49.775 25.747 55.229 1.00 9.47 ? 404 HOH A O 1 HETATM 2710 O O . HOH H 6 . ? 47.989 7.498 31.513 1.00 12.00 ? 405 HOH A O 1 HETATM 2711 O O . HOH H 6 . ? 45.684 29.743 29.539 1.00 8.50 ? 406 HOH A O 1 HETATM 2712 O O . HOH H 6 . ? 52.542 10.071 25.478 1.00 15.80 ? 407 HOH A O 1 HETATM 2713 O O . HOH H 6 . ? 52.781 30.756 26.986 1.00 14.16 ? 408 HOH A O 1 HETATM 2714 O O . HOH H 6 . ? 60.960 5.528 34.713 1.00 22.95 ? 409 HOH A O 1 HETATM 2715 O O . HOH H 6 . ? 69.451 19.940 44.890 1.00 11.07 ? 410 HOH A O 1 HETATM 2716 O O . HOH H 6 . ? 45.655 22.910 50.688 1.00 9.38 ? 411 HOH A O 1 HETATM 2717 O O . HOH H 6 . ? 61.539 30.631 58.058 1.00 19.45 ? 412 HOH A O 1 HETATM 2718 O O . HOH H 6 . ? 53.154 27.920 20.315 1.00 10.50 ? 413 HOH A O 1 HETATM 2719 O O . HOH H 6 . ? 60.347 27.079 59.679 1.00 7.53 ? 414 HOH A O 1 HETATM 2720 O O . HOH H 6 . ? 35.796 15.813 38.525 1.00 16.74 ? 415 HOH A O 1 HETATM 2721 O O . HOH H 6 . ? 67.328 22.619 47.481 1.00 13.18 ? 416 HOH A O 1 HETATM 2722 O O . HOH H 6 . ? 53.870 30.158 24.504 1.00 10.18 ? 417 HOH A O 1 HETATM 2723 O O . HOH H 6 . ? 44.773 29.136 46.774 1.00 15.85 ? 418 HOH A O 1 HETATM 2724 O O . HOH H 6 . ? 55.879 31.543 25.973 1.00 10.31 ? 419 HOH A O 1 HETATM 2725 O O . HOH H 6 . ? 38.718 28.329 40.934 1.00 13.02 ? 420 HOH A O 1 HETATM 2726 O O . HOH H 6 . ? 58.185 35.849 41.152 1.00 11.42 ? 421 HOH A O 1 HETATM 2727 O O . HOH H 6 . ? 57.805 2.217 43.722 1.00 12.86 ? 422 HOH A O 1 HETATM 2728 O O . HOH H 6 . ? 73.225 23.443 56.615 1.00 13.54 ? 423 HOH A O 1 HETATM 2729 O O . HOH H 6 . ? 51.106 24.666 31.277 1.00 11.53 ? 424 HOH A O 1 HETATM 2730 O O . HOH H 6 . ? 51.658 37.069 37.362 1.00 17.08 ? 425 HOH A O 1 HETATM 2731 O O . HOH H 6 . ? 53.233 17.374 26.298 1.00 10.19 ? 426 HOH A O 1 HETATM 2732 O O . HOH H 6 . ? 68.522 19.944 47.679 1.00 13.37 ? 427 HOH A O 1 HETATM 2733 O O . HOH H 6 . ? 66.944 37.898 39.995 1.00 23.13 ? 428 HOH A O 1 HETATM 2734 O O . HOH H 6 . ? 54.288 42.231 59.356 1.00 24.80 ? 429 HOH A O 1 HETATM 2735 O O . HOH H 6 . ? 51.067 26.786 49.963 1.00 14.51 ? 430 HOH A O 1 HETATM 2736 O O . HOH H 6 . ? 45.980 13.908 46.750 1.00 16.63 ? 431 HOH A O 1 HETATM 2737 O O . HOH H 6 . ? 68.541 17.514 43.634 1.00 17.13 ? 432 HOH A O 1 HETATM 2738 O O . HOH H 6 . ? 46.789 5.945 29.704 1.00 17.99 ? 433 HOH A O 1 HETATM 2739 O O . HOH H 6 . ? 59.313 10.212 23.961 1.00 33.09 ? 434 HOH A O 1 HETATM 2740 O O . HOH H 6 . ? 46.551 23.505 18.298 1.00 11.60 ? 435 HOH A O 1 HETATM 2741 O O . HOH H 6 . ? 71.320 27.018 39.997 1.00 23.14 ? 436 HOH A O 1 HETATM 2742 O O . HOH H 6 . ? 57.263 12.047 23.588 1.00 15.54 ? 437 HOH A O 1 HETATM 2743 O O . HOH H 6 . ? 35.205 17.784 24.887 1.00 11.90 ? 438 HOH A O 1 HETATM 2744 O O . HOH H 6 . ? 53.097 36.527 32.144 1.00 15.43 ? 439 HOH A O 1 HETATM 2745 O O . HOH H 6 . ? 54.600 40.872 37.346 1.00 16.98 ? 440 HOH A O 1 HETATM 2746 O O . HOH H 6 . ? 58.457 30.612 32.156 1.00 13.86 ? 441 HOH A O 1 HETATM 2747 O O . HOH H 6 . ? 48.910 5.787 45.363 1.00 22.71 ? 442 HOH A O 1 HETATM 2748 O O . HOH H 6 . ? 48.369 23.332 55.183 1.00 19.57 ? 443 HOH A O 1 HETATM 2749 O O . HOH H 6 . ? 72.955 26.245 57.636 1.00 12.97 ? 444 HOH A O 1 HETATM 2750 O O . HOH H 6 . ? 71.512 19.758 42.139 1.00 16.19 ? 445 HOH A O 1 HETATM 2751 O O . HOH H 6 . ? 58.737 26.628 19.515 1.00 16.40 ? 446 HOH A O 1 HETATM 2752 O O . HOH H 6 . ? 68.184 36.565 53.242 1.00 23.10 ? 447 HOH A O 1 HETATM 2753 O O . HOH H 6 . ? 56.975 38.417 55.411 1.00 34.30 ? 448 HOH A O 1 HETATM 2754 O O . HOH H 6 . ? 40.573 18.558 49.373 1.00 21.28 ? 449 HOH A O 1 HETATM 2755 O O . HOH H 6 . ? 45.128 39.964 33.584 1.00 39.01 ? 450 HOH A O 1 HETATM 2756 O O . HOH H 6 . ? 54.384 17.430 58.837 1.00 23.52 ? 451 HOH A O 1 HETATM 2757 O O . HOH H 6 . ? 57.767 15.869 36.256 1.00 17.09 ? 452 HOH A O 1 HETATM 2758 O O . HOH H 6 . ? 44.665 43.316 58.995 1.00 29.69 ? 453 HOH A O 1 HETATM 2759 O O . HOH H 6 . ? 63.521 21.881 22.686 1.00 19.29 ? 454 HOH A O 1 HETATM 2760 O O . HOH H 6 . ? 65.740 16.474 56.619 1.00 11.33 ? 455 HOH A O 1 HETATM 2761 O O . HOH H 6 . ? 60.732 -0.829 37.344 1.00 24.74 ? 456 HOH A O 1 HETATM 2762 O O . HOH H 6 . ? 73.219 21.295 58.134 1.00 23.78 ? 457 HOH A O 1 HETATM 2763 O O . HOH H 6 . ? 68.894 29.949 41.000 1.00 13.15 ? 458 HOH A O 1 HETATM 2764 O O . HOH H 6 . ? 60.441 33.718 31.132 1.00 26.91 ? 459 HOH A O 1 HETATM 2765 O O . HOH H 6 . ? 64.113 12.432 42.597 1.00 22.45 ? 460 HOH A O 1 HETATM 2766 O O . HOH H 6 . ? 40.236 29.744 59.228 1.00 27.94 ? 461 HOH A O 1 HETATM 2767 O O . HOH H 6 . ? 53.344 32.672 68.340 1.00 44.39 ? 462 HOH A O 1 HETATM 2768 O O . HOH H 6 . ? 51.683 42.230 57.175 1.00 30.35 ? 463 HOH A O 1 HETATM 2769 O O . HOH H 6 . ? 65.210 20.521 38.205 1.00 30.71 ? 464 HOH A O 1 HETATM 2770 O O . HOH H 6 . ? 65.660 45.740 41.731 1.00 28.75 ? 465 HOH A O 1 HETATM 2771 O O . HOH H 6 . ? 58.876 6.047 30.039 1.00 34.87 ? 466 HOH A O 1 HETATM 2772 O O . HOH H 6 . ? 65.726 41.347 46.462 1.00 20.54 ? 467 HOH A O 1 HETATM 2773 O O . HOH H 6 . ? 56.466 21.636 64.850 1.00 21.07 ? 468 HOH A O 1 HETATM 2774 O O . HOH H 6 . ? 74.170 22.586 52.036 1.00 15.12 ? 469 HOH A O 1 HETATM 2775 O O . HOH H 6 . ? 37.902 11.168 22.595 1.00 33.50 ? 470 HOH A O 1 HETATM 2776 O O . HOH H 6 . ? 73.221 32.436 52.297 1.00 21.31 ? 471 HOH A O 1 HETATM 2777 O O . HOH H 6 . ? 76.564 21.066 45.554 1.00 15.59 ? 472 HOH A O 1 HETATM 2778 O O . HOH H 6 . ? 69.082 35.613 56.114 1.00 23.51 ? 473 HOH A O 1 HETATM 2779 O O . HOH H 6 . ? 58.905 32.884 25.137 1.00 42.33 ? 474 HOH A O 1 HETATM 2780 O O . HOH H 6 . ? 49.410 26.675 52.489 1.00 11.91 ? 475 HOH A O 1 HETATM 2781 O O . HOH H 6 . ? 57.248 24.003 63.915 1.00 28.68 ? 476 HOH A O 1 HETATM 2782 O O . HOH H 6 . ? 46.264 22.838 63.293 1.00 47.12 ? 477 HOH A O 1 HETATM 2783 O O . HOH H 6 . ? 65.432 23.378 34.340 1.00 25.97 ? 478 HOH A O 1 HETATM 2784 O O . HOH H 6 . ? 58.851 14.372 56.896 1.00 20.05 ? 479 HOH A O 1 HETATM 2785 O O . HOH H 6 . ? 66.269 13.278 44.189 1.00 35.14 ? 480 HOH A O 1 HETATM 2786 O O . HOH H 6 . ? 66.232 4.387 43.142 1.00 50.58 ? 481 HOH A O 1 HETATM 2787 O O . HOH H 6 . ? 34.457 18.533 37.084 1.00 34.13 ? 482 HOH A O 1 HETATM 2788 O O . HOH H 6 . ? 64.282 36.047 63.344 1.00 21.63 ? 483 HOH A O 1 HETATM 2789 O O . HOH H 6 . ? 62.899 22.810 16.384 1.00 34.42 ? 484 HOH A O 1 HETATM 2790 O O . HOH H 6 . ? 36.726 20.155 43.644 1.00 29.62 ? 485 HOH A O 1 HETATM 2791 O O . HOH H 6 . ? 41.970 19.634 14.464 1.00 37.64 ? 486 HOH A O 1 HETATM 2792 O O . HOH H 6 . ? 71.015 16.618 42.398 1.00 38.79 ? 487 HOH A O 1 HETATM 2793 O O . HOH H 6 . ? 40.105 26.097 34.492 1.00 25.62 ? 488 HOH A O 1 HETATM 2794 O O . HOH H 6 . ? 77.151 33.579 51.468 1.00 29.01 ? 489 HOH A O 1 HETATM 2795 O O . HOH H 6 . ? 47.976 24.907 20.526 1.00 28.40 ? 490 HOH A O 1 HETATM 2796 O O . HOH H 6 . ? 67.092 8.046 37.250 1.00 32.80 ? 491 HOH A O 1 HETATM 2797 O O . HOH H 6 . ? 57.880 27.293 53.157 1.00 9.16 ? 492 HOH A O 1 HETATM 2798 O O . HOH H 6 . ? 64.527 24.367 50.410 1.00 6.59 ? 493 HOH A O 1 HETATM 2799 O O . HOH H 6 . ? 43.430 10.171 39.105 1.00 16.41 ? 494 HOH A O 1 HETATM 2800 O O . HOH H 6 . ? 66.679 23.609 55.330 1.00 12.69 ? 495 HOH A O 1 HETATM 2801 O O . HOH H 6 . ? 55.654 7.703 46.579 1.00 16.14 ? 496 HOH A O 1 HETATM 2802 O O . HOH H 6 . ? 59.569 18.828 24.199 1.00 11.24 ? 497 HOH A O 1 HETATM 2803 O O . HOH H 6 . ? 59.986 38.308 58.035 1.00 19.62 ? 498 HOH A O 1 HETATM 2804 O O . HOH H 6 . ? 69.486 27.869 51.028 1.00 16.47 ? 499 HOH A O 1 HETATM 2805 O O . HOH H 6 . ? 55.592 2.734 45.009 1.00 10.81 ? 500 HOH A O 1 HETATM 2806 O O . HOH H 6 . ? 55.421 10.498 22.166 1.00 19.96 ? 501 HOH A O 1 HETATM 2807 O O . HOH H 6 . ? 41.530 28.568 52.240 1.00 15.40 ? 502 HOH A O 1 HETATM 2808 O O . HOH H 6 . ? 47.954 24.057 51.576 1.00 21.19 ? 503 HOH A O 1 HETATM 2809 O O . HOH H 6 . ? 38.328 27.841 32.608 1.00 18.89 ? 504 HOH A O 1 HETATM 2810 O O . HOH H 6 . ? 60.968 29.388 38.645 1.00 40.16 ? 505 HOH A O 1 HETATM 2811 O O . HOH H 6 . ? 39.695 20.461 32.130 1.00 22.10 ? 506 HOH A O 1 HETATM 2812 O O . HOH H 6 . ? 51.981 17.020 61.028 1.00 28.40 ? 507 HOH A O 1 HETATM 2813 O O . HOH H 6 . ? 53.102 16.864 55.988 1.00 17.89 ? 508 HOH A O 1 HETATM 2814 O O . HOH H 6 . ? 66.541 29.722 27.857 1.00 26.77 ? 509 HOH A O 1 HETATM 2815 O O . HOH H 6 . ? 43.595 27.043 64.870 1.00 30.97 ? 510 HOH A O 1 HETATM 2816 O O . HOH H 6 . ? 39.166 34.147 34.114 1.00 37.98 ? 511 HOH A O 1 HETATM 2817 O O . HOH H 6 . ? 75.033 19.894 50.097 1.00 26.37 ? 512 HOH A O 1 HETATM 2818 O O . HOH H 6 . ? 48.107 30.703 26.405 1.00 25.48 ? 513 HOH A O 1 HETATM 2819 O O . HOH H 6 . ? 39.989 7.690 32.418 1.00 32.35 ? 514 HOH A O 1 HETATM 2820 O O . HOH H 6 . ? 54.720 36.016 30.017 1.00 16.91 ? 515 HOH A O 1 HETATM 2821 O O . HOH H 6 . ? 58.444 46.093 35.884 1.00 19.03 ? 516 HOH A O 1 HETATM 2822 O O . HOH H 6 . ? 53.201 48.148 44.020 1.00 18.53 ? 517 HOH A O 1 HETATM 2823 O O . HOH H 6 . ? 60.976 7.696 29.703 1.00 30.44 ? 518 HOH A O 1 HETATM 2824 O O . HOH H 6 . ? 44.721 39.781 30.201 1.00 20.70 ? 519 HOH A O 1 HETATM 2825 O O . HOH H 6 . ? 60.140 28.362 34.357 1.00 31.31 ? 520 HOH A O 1 HETATM 2826 O O . HOH H 6 . ? 58.236 19.692 64.196 1.00 46.85 ? 521 HOH A O 1 HETATM 2827 O O . HOH H 6 . ? 58.755 3.937 46.796 1.00 31.95 ? 522 HOH A O 1 HETATM 2828 O O . HOH H 6 . ? 65.946 10.808 48.845 1.00 24.54 ? 523 HOH A O 1 HETATM 2829 O O . HOH H 6 . ? 35.311 7.434 21.444 1.00 33.45 ? 524 HOH A O 1 HETATM 2830 O O . HOH H 6 . ? 69.528 24.151 24.547 1.00 29.30 ? 525 HOH A O 1 HETATM 2831 O O . HOH H 6 . ? 57.394 16.405 58.170 1.00 24.04 ? 526 HOH A O 1 HETATM 2832 O O . HOH H 6 . ? 46.946 8.683 48.924 1.00 28.17 ? 527 HOH A O 1 HETATM 2833 O O . HOH H 6 . ? 44.991 0.836 23.905 1.00 29.35 ? 528 HOH A O 1 HETATM 2834 O O . HOH H 6 . ? 46.158 2.609 39.979 1.00 37.86 ? 529 HOH A O 1 HETATM 2835 O O . HOH H 6 . ? 65.969 20.720 60.394 1.00 30.22 ? 530 HOH A O 1 HETATM 2836 O O . HOH H 6 . ? 66.942 34.387 60.383 1.00 40.67 ? 531 HOH A O 1 HETATM 2837 O O . HOH H 6 . ? 66.837 41.035 37.994 1.00 41.47 ? 532 HOH A O 1 HETATM 2838 O O . HOH H 6 . ? 44.130 3.830 28.666 1.00 28.53 ? 533 HOH A O 1 HETATM 2839 O O . HOH H 6 . ? 41.653 28.218 28.783 1.00 18.42 ? 534 HOH A O 1 HETATM 2840 O O . HOH H 6 . ? 56.490 37.901 30.518 1.00 25.98 ? 535 HOH A O 1 HETATM 2841 O O . HOH H 6 . ? 68.685 20.243 29.494 1.00 31.00 ? 536 HOH A O 1 HETATM 2842 O O . HOH H 6 . ? 52.628 34.670 13.988 1.00 45.80 ? 537 HOH A O 1 HETATM 2843 O O . HOH H 6 . ? 67.391 14.436 41.659 1.00 26.95 ? 538 HOH A O 1 HETATM 2844 O O . HOH H 6 . ? 58.566 34.152 63.091 1.00 45.83 ? 539 HOH A O 1 HETATM 2845 O O . HOH H 6 . ? 61.627 11.809 22.167 1.00 27.24 ? 540 HOH A O 1 HETATM 2846 O O . HOH H 6 . ? 30.779 1.071 30.175 1.00 20.72 ? 541 HOH A O 1 HETATM 2847 O O . HOH H 6 . ? 36.853 19.367 32.858 1.00 28.76 ? 542 HOH A O 1 HETATM 2848 O O . HOH H 6 . ? 54.854 34.067 60.759 1.00 16.41 ? 543 HOH A O 1 HETATM 2849 O O . HOH H 6 . ? 62.678 7.053 54.078 1.00 24.02 ? 544 HOH A O 1 HETATM 2850 O O . HOH H 6 . ? 64.738 22.704 53.464 1.00 13.92 ? 545 HOH A O 1 HETATM 2851 O O . HOH H 6 . ? 40.960 13.372 45.852 1.00 27.96 ? 546 HOH A O 1 HETATM 2852 O O . HOH H 6 . ? 58.952 3.970 34.008 1.00 24.26 ? 547 HOH A O 1 HETATM 2853 O O . HOH H 6 . ? 37.352 27.949 28.587 1.00 34.76 ? 548 HOH A O 1 HETATM 2854 O O . HOH H 6 . ? 57.071 4.839 31.671 1.00 22.84 ? 549 HOH A O 1 HETATM 2855 O O . HOH H 6 . ? 48.153 3.910 38.354 1.00 22.49 ? 550 HOH A O 1 HETATM 2856 O O . HOH H 6 . ? 48.964 0.759 40.419 1.00 27.66 ? 551 HOH A O 1 HETATM 2857 O O . HOH H 6 . ? 47.234 30.900 16.836 1.00 31.78 ? 552 HOH A O 1 HETATM 2858 O O . HOH H 6 . ? 74.080 26.273 60.110 1.00 23.82 ? 553 HOH A O 1 HETATM 2859 O O . HOH H 6 . ? 65.700 23.402 60.747 1.00 21.25 ? 554 HOH A O 1 HETATM 2860 O O . HOH H 6 . ? 60.019 35.581 39.357 1.00 37.96 ? 555 HOH A O 1 HETATM 2861 O O . HOH H 6 . ? 60.098 21.958 39.799 1.00 6.73 ? 556 HOH A O 1 HETATM 2862 O O . HOH H 6 . ? 44.644 5.908 19.857 1.00 26.21 ? 557 HOH A O 1 HETATM 2863 O O . HOH H 6 . ? 56.253 12.388 57.199 1.00 34.77 ? 558 HOH A O 1 HETATM 2864 O O . HOH H 6 . ? 54.102 19.950 68.885 1.00 31.51 ? 559 HOH A O 1 HETATM 2865 O O . HOH H 6 . ? 46.335 -3.102 35.353 1.00 45.07 ? 560 HOH A O 1 HETATM 2866 O O . HOH H 6 . ? 53.965 38.236 36.064 1.00 14.38 ? 561 HOH A O 1 HETATM 2867 O O . HOH H 6 . ? 44.176 41.071 51.011 1.00 27.61 ? 562 HOH A O 1 HETATM 2868 O O . HOH H 6 . ? 37.861 31.885 33.409 1.00 24.41 ? 563 HOH A O 1 HETATM 2869 O O . HOH H 6 . ? 58.617 38.319 27.674 1.00 46.60 ? 564 HOH A O 1 HETATM 2870 O O . HOH H 6 . ? 46.455 4.363 22.214 1.00 31.34 ? 565 HOH A O 1 HETATM 2871 O O . HOH H 6 . ? 32.465 27.878 36.684 1.00 37.15 ? 566 HOH A O 1 HETATM 2872 O O . HOH H 6 . ? 42.360 19.134 51.363 1.00 35.65 ? 567 HOH A O 1 HETATM 2873 O O . HOH H 6 . ? 50.428 14.601 17.905 1.00 32.75 ? 568 HOH A O 1 HETATM 2874 O O . HOH H 6 . ? 71.251 14.383 49.403 1.00 32.23 ? 569 HOH A O 1 HETATM 2875 O O . HOH H 6 . ? 74.664 37.812 47.607 1.00 36.34 ? 570 HOH A O 1 HETATM 2876 O O . HOH H 6 . ? 58.692 38.210 32.792 1.00 33.43 ? 571 HOH A O 1 HETATM 2877 O O . HOH H 6 . ? 63.085 0.212 38.995 1.00 35.02 ? 572 HOH A O 1 HETATM 2878 O O . HOH H 6 . ? 50.828 22.355 12.570 1.00 35.54 ? 573 HOH A O 1 HETATM 2879 O O . HOH H 6 . ? 38.493 26.344 19.803 1.00 44.06 ? 574 HOH A O 1 HETATM 2880 O O . HOH H 6 . ? 67.430 20.267 32.315 1.00 49.95 ? 575 HOH A O 1 HETATM 2881 O O . HOH H 6 . ? 43.135 39.642 35.641 1.00 38.77 ? 576 HOH A O 1 HETATM 2882 O O . HOH H 6 . ? 62.024 25.244 60.822 1.00 40.33 ? 577 HOH A O 1 HETATM 2883 O O . HOH H 6 . ? 71.233 31.662 41.767 1.00 45.12 ? 578 HOH A O 1 HETATM 2884 O O . HOH H 6 . ? 42.615 36.286 43.382 1.00 37.09 ? 579 HOH A O 1 HETATM 2885 O O . HOH H 6 . ? 62.568 6.109 49.485 1.00 34.00 ? 580 HOH A O 1 HETATM 2886 O O . HOH H 6 . ? 72.160 17.666 38.610 1.00 32.74 ? 581 HOH A O 1 HETATM 2887 O O . HOH H 6 . ? 64.876 11.927 27.799 1.00 41.86 ? 582 HOH A O 1 HETATM 2888 O O . HOH H 6 . ? 63.044 17.934 64.602 1.00 46.10 ? 583 HOH A O 1 HETATM 2889 O O . HOH H 6 . ? 70.658 14.450 60.357 1.00 52.95 ? 584 HOH A O 1 HETATM 2890 O O . HOH H 6 . ? 51.290 33.385 63.378 1.00 42.79 ? 585 HOH A O 1 HETATM 2891 O O . HOH H 6 . ? 49.444 15.699 15.561 1.00 48.16 ? 586 HOH A O 1 HETATM 2892 O O . HOH H 6 . ? 69.109 13.752 39.577 1.00 42.59 ? 587 HOH A O 1 HETATM 2893 O O . HOH H 6 . ? 34.688 7.096 25.749 1.00 36.16 ? 588 HOH A O 1 HETATM 2894 O O . HOH H 6 . ? 65.746 17.391 23.692 1.00 28.50 ? 589 HOH A O 1 HETATM 2895 O O . HOH H 6 . ? 73.960 33.719 44.662 1.00 40.76 ? 590 HOH A O 1 HETATM 2896 O O . HOH H 6 . ? 45.480 35.508 34.443 1.00 27.39 ? 591 HOH A O 1 HETATM 2897 O O . HOH H 6 . ? 46.385 13.938 49.649 1.00 44.42 ? 592 HOH A O 1 HETATM 2898 O O . HOH H 6 . ? 35.857 23.271 34.268 1.00 39.22 ? 593 HOH A O 1 HETATM 2899 O O . HOH H 6 . ? 55.696 46.965 47.238 1.00 31.39 ? 594 HOH A O 1 HETATM 2900 O O . HOH H 6 . ? 61.444 3.326 37.103 1.00 16.38 ? 595 HOH A O 1 HETATM 2901 O O . HOH H 6 . ? 51.869 26.184 68.961 1.00 29.44 ? 596 HOH A O 1 HETATM 2902 O O . HOH H 6 . ? 62.244 31.697 40.096 1.00 25.11 ? 597 HOH A O 1 HETATM 2903 O O . HOH H 6 . ? 56.305 32.511 62.682 1.00 26.30 ? 598 HOH A O 1 HETATM 2904 O O . HOH H 6 . ? 60.083 3.616 44.438 1.00 24.22 ? 599 HOH A O 1 HETATM 2905 O O . HOH H 6 . ? 61.598 22.229 60.245 1.00 19.02 ? 600 HOH A O 1 HETATM 2906 O O . HOH H 6 . ? 44.345 33.459 32.984 1.00 20.46 ? 601 HOH A O 1 HETATM 2907 O O . HOH H 6 . ? 65.249 8.826 45.507 1.00 29.11 ? 602 HOH A O 1 HETATM 2908 O O . HOH H 6 . ? 39.362 10.359 32.912 1.00 19.91 ? 603 HOH A O 1 HETATM 2909 O O . HOH H 6 . ? 50.588 18.284 16.015 1.00 25.25 ? 604 HOH A O 1 HETATM 2910 O O . HOH H 6 . ? 59.621 23.715 16.628 1.00 18.97 ? 605 HOH A O 1 HETATM 2911 O O . HOH H 6 . ? 74.499 21.034 42.140 1.00 20.81 ? 606 HOH A O 1 HETATM 2912 O O . HOH H 6 . ? 38.821 24.917 46.931 1.00 31.13 ? 607 HOH A O 1 HETATM 2913 O O . HOH H 6 . ? 62.961 31.178 35.789 1.00 48.64 ? 608 HOH A O 1 HETATM 2914 O O . HOH H 6 . ? 48.405 1.962 36.317 1.00 38.90 ? 609 HOH A O 1 HETATM 2915 O O . HOH H 6 . ? 42.107 1.168 37.138 1.00 31.41 ? 610 HOH A O 1 HETATM 2916 O O . HOH H 6 . ? 74.312 14.726 51.638 1.00 43.02 ? 611 HOH A O 1 HETATM 2917 O O . HOH H 6 . ? 61.757 32.041 65.140 1.00 44.76 ? 612 HOH A O 1 HETATM 2918 O O . HOH H 6 . ? 70.005 36.355 40.104 1.00 40.76 ? 613 HOH A O 1 HETATM 2919 O O . HOH H 6 . ? 37.162 34.040 55.020 1.00 46.46 ? 614 HOH A O 1 HETATM 2920 O O . HOH H 6 . ? 44.944 25.073 63.853 1.00 27.17 ? 615 HOH A O 1 HETATM 2921 O O . HOH H 6 . ? 61.755 32.030 23.236 1.00 33.18 ? 616 HOH A O 1 HETATM 2922 O O . HOH H 6 . ? 56.097 5.009 46.959 1.00 19.61 ? 617 HOH A O 1 HETATM 2923 O O . HOH H 6 . ? 65.592 11.748 30.736 1.00 32.66 ? 618 HOH A O 1 HETATM 2924 O O . HOH H 6 . ? 67.661 12.912 29.545 1.00 34.86 ? 619 HOH A O 1 HETATM 2925 O O . HOH H 6 . ? 38.105 30.703 29.288 1.00 38.71 ? 620 HOH A O 1 HETATM 2926 O O . HOH H 6 . ? 62.216 29.973 50.587 1.00 43.21 ? 621 HOH A O 1 HETATM 2927 O O . HOH H 6 . ? 42.560 7.737 39.970 1.00 34.63 ? 622 HOH A O 1 HETATM 2928 O O . HOH H 6 . ? 32.811 8.239 21.327 1.00 28.55 ? 623 HOH A O 1 HETATM 2929 O O . HOH H 6 . ? 38.434 23.513 33.383 1.00 41.71 ? 624 HOH A O 1 HETATM 2930 O O . HOH H 6 . ? 38.388 23.800 27.957 1.00 35.64 ? 625 HOH A O 1 HETATM 2931 O O . HOH H 6 . ? 37.872 35.423 36.565 1.00 32.58 ? 626 HOH A O 1 HETATM 2932 O O . HOH H 6 . ? 60.333 29.135 13.068 1.00 39.56 ? 627 HOH A O 1 HETATM 2933 O O . HOH H 6 . ? 53.714 39.221 33.344 1.00 43.30 ? 628 HOH A O 1 HETATM 2934 O O . HOH H 6 . ? 38.702 9.464 36.781 1.00 38.69 ? 629 HOH A O 1 HETATM 2935 O O . HOH H 6 . ? 68.346 23.235 33.972 1.00 31.50 ? 630 HOH A O 1 HETATM 2936 O O . HOH H 6 . ? 37.966 26.558 43.479 1.00 48.56 ? 631 HOH A O 1 HETATM 2937 O O . HOH H 6 . ? 30.987 23.815 26.133 1.00 33.48 ? 632 HOH A O 1 HETATM 2938 O O . HOH H 6 . ? 42.019 35.593 33.976 1.00 33.57 ? 633 HOH A O 1 HETATM 2939 O O . HOH H 6 . ? 55.773 25.976 65.163 1.00 34.54 ? 634 HOH A O 1 HETATM 2940 O O . HOH H 6 . ? 43.565 -2.085 27.589 1.00 37.42 ? 635 HOH A O 1 HETATM 2941 O O . HOH H 6 . ? 52.878 20.968 15.341 1.00 50.94 ? 636 HOH A O 1 HETATM 2942 O O . HOH H 6 . ? 36.124 11.525 32.279 1.00 45.97 ? 637 HOH A O 1 HETATM 2943 O O . HOH H 6 . ? 33.087 16.506 26.517 1.00 39.28 ? 638 HOH A O 1 HETATM 2944 O O . HOH H 6 . ? 50.661 16.670 57.564 1.00 37.40 ? 639 HOH A O 1 HETATM 2945 O O . HOH H 6 . ? 60.468 14.396 59.364 1.00 42.18 ? 640 HOH A O 1 HETATM 2946 O O . HOH H 6 . ? 51.720 41.323 34.727 1.00 41.40 ? 641 HOH A O 1 HETATM 2947 O O . HOH H 6 . ? 43.279 22.848 60.731 1.00 42.40 ? 642 HOH A O 1 HETATM 2948 O O . HOH H 6 . ? 43.611 24.501 19.573 1.00 43.15 ? 643 HOH A O 1 HETATM 2949 O O . HOH H 6 . ? 49.211 20.481 11.485 1.00 37.86 ? 644 HOH A O 1 HETATM 2950 O O . HOH H 6 . ? 42.847 38.461 50.830 1.00 42.54 ? 645 HOH A O 1 HETATM 2951 O O . HOH H 6 . ? 60.832 30.507 20.788 1.00 50.63 ? 646 HOH A O 1 HETATM 2952 O O . HOH H 6 . ? 62.332 27.655 17.964 1.00 43.52 ? 647 HOH A O 1 HETATM 2953 O O . HOH H 6 . ? 45.233 43.346 25.335 1.00 38.79 ? 648 HOH A O 1 HETATM 2954 O O . HOH H 6 . ? 52.801 35.476 62.136 1.00 48.37 ? 649 HOH A O 1 HETATM 2955 O O . HOH H 6 . ? 55.713 30.750 33.369 1.00 17.35 ? 650 HOH A O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 ALA 1 1 1 ALA ALA A . n A 1 2 VAL 2 2 2 VAL VAL A . n A 1 3 CYS 3 3 3 CYS CYS A . n A 1 4 PRO 4 4 4 PRO PRO 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 THR 7 7 7 THR THR A . n A 1 8 ARG 8 8 8 ARG ARG A . n A 1 9 VAL 9 9 9 VAL VAL A . n A 1 10 SER 10 10 10 SER SER A . n A 1 11 HIS 11 11 11 HIS HIS A . n A 1 12 ALA 12 12 12 ALA ALA A . n A 1 13 ALA 13 13 13 ALA ALA A . n A 1 14 CYS 14 14 14 CYS CYS A . n A 1 15 CYS 15 15 15 CYS CYS A . n A 1 16 ALA 16 16 16 ALA ALA A . n A 1 17 PHE 17 17 17 PHE PHE A . n A 1 18 ILE 18 18 18 ILE ILE A . n A 1 19 PRO 19 19 19 PRO PRO A . n A 1 20 LEU 20 20 20 LEU LEU A . n A 1 21 ALA 21 21 21 ALA ALA A . n A 1 22 GLN 22 22 22 GLN GLN A . n A 1 23 ASP 23 23 23 ASP ASP A . n A 1 24 LEU 24 24 24 LEU LEU A . n A 1 25 GLN 25 25 25 GLN GLN A . n A 1 26 GLU 26 26 26 GLU GLU A . n A 1 27 THR 27 27 27 THR THR A . n A 1 28 ILE 28 28 28 ILE ILE A . n A 1 29 PHE 29 29 29 PHE PHE A . n A 1 30 GLN 30 30 30 GLN GLN A . n A 1 31 ASN 31 31 31 ASN ASN A . n A 1 32 GLU 32 32 32 GLU GLU A . n A 1 33 CYS 33 33 33 CYS CYS A . n A 1 34 GLY 34 34 34 GLY GLY A . n A 1 35 GLU 35 35 35 GLU GLU A . n A 1 36 ASP 36 36 36 ASP ASP A . n A 1 37 ALA 37 37 37 ALA ALA A . n A 1 38 HIS 38 38 38 HIS HIS A . n A 1 39 GLU 39 39 39 GLU GLU A . n A 1 40 VAL 40 40 40 VAL VAL A . n A 1 41 ILE 41 41 41 ILE ILE A . n A 1 42 ARG 42 42 42 ARG ARG A . n A 1 43 LEU 43 43 43 LEU LEU A . n A 1 44 THR 44 44 44 THR THR A . n A 1 45 PHE 45 45 45 PHE PHE A . n A 1 46 HIS 46 46 46 HIS HIS A . n A 1 47 ASP 47 47 47 ASP ASP A . n A 1 48 ALA 48 48 48 ALA ALA A . n A 1 49 ILE 49 49 49 ILE ILE A . n A 1 50 ALA 50 50 50 ALA ALA A . n A 1 51 ILE 51 51 51 ILE ILE A . n A 1 52 SER 52 52 52 SER SER A . n A 1 53 ARG 53 53 53 ARG ARG A . n A 1 54 SER 54 54 54 SER SER A . n A 1 55 GLN 55 55 55 GLN GLN A . n A 1 56 GLY 56 56 56 GLY GLY A . n A 1 57 PRO 57 57 57 PRO PRO A . n A 1 58 LYS 58 58 58 LYS LYS A . n A 1 59 ALA 59 59 59 ALA ALA A . n A 1 60 GLY 60 60 60 GLY GLY A . n A 1 61 GLY 61 61 61 GLY GLY A . n A 1 62 GLY 62 62 62 GLY GLY A . n A 1 63 ALA 63 63 63 ALA ALA A . n A 1 64 ASP 64 64 64 ASP ASP A . n A 1 65 GLY 65 65 65 GLY GLY A . n A 1 66 SER 66 66 66 SER SER A . n A 1 67 MET 67 67 67 MET MET A . n A 1 68 LEU 68 68 68 LEU LEU A . n A 1 69 LEU 69 69 69 LEU LEU A . n A 1 70 PHE 70 70 70 PHE PHE A . n A 1 71 PRO 71 71 71 PRO PRO A . n A 1 72 THR 72 72 72 THR THR A . n A 1 73 VAL 73 73 73 VAL VAL A . n A 1 74 GLU 74 74 74 GLU GLU A . n A 1 75 PRO 75 75 75 PRO PRO A . n A 1 76 ASN 76 76 76 ASN ASN A . n A 1 77 PHE 77 77 77 PHE PHE A . n A 1 78 SER 78 78 78 SER SER A . n A 1 79 ALA 79 79 79 ALA ALA A . n A 1 80 ASN 80 80 80 ASN ASN A . n A 1 81 ASN 81 81 81 ASN ASN A . n A 1 82 GLY 82 82 82 GLY GLY A . n A 1 83 ILE 83 83 83 ILE ILE A . n A 1 84 ASP 84 84 84 ASP ASP A . n A 1 85 ASP 85 85 85 ASP ASP A . n A 1 86 SER 86 86 86 SER SER A . n A 1 87 VAL 87 87 87 VAL VAL A . n A 1 88 ASN 88 88 88 ASN ASN A . n A 1 89 ASN 89 89 89 ASN ASN A . n A 1 90 LEU 90 90 90 LEU LEU A . n A 1 91 ILE 91 91 91 ILE ILE A . n A 1 92 PRO 92 92 92 PRO PRO A . n A 1 93 PHE 93 93 93 PHE PHE A . n A 1 94 MET 94 94 94 MET MET A . n A 1 95 GLN 95 95 95 GLN GLN A . n A 1 96 LYS 96 96 96 LYS LYS A . n A 1 97 HIS 97 97 97 HIS HIS A . n A 1 98 ASN 98 98 98 ASN ASN A . n A 1 99 THR 99 99 99 THR THR A . n A 1 100 ILE 100 100 100 ILE ILE A . n A 1 101 SER 101 101 101 SER SER A . n A 1 102 ALA 102 102 102 ALA ALA A . n A 1 103 ALA 103 103 103 ALA ALA A . n A 1 104 ASP 104 104 104 ASP ASP A . n A 1 105 LEU 105 105 105 LEU LEU A . n A 1 106 VAL 106 106 106 VAL VAL A . n A 1 107 GLN 107 107 107 GLN GLN A . n A 1 108 PHE 108 108 108 PHE PHE A . n A 1 109 ALA 109 109 109 ALA ALA A . n A 1 110 GLY 110 110 110 GLY GLY A . n A 1 111 ALA 111 111 111 ALA ALA A . n A 1 112 VAL 112 112 112 VAL VAL A . n A 1 113 ALA 113 113 113 ALA ALA A . n A 1 114 LEU 114 114 114 LEU LEU A . n A 1 115 SER 115 115 115 SER SER A . n A 1 116 ASN 116 116 116 ASN ASN A . n A 1 117 CYS 117 117 117 CYS CYS A . n A 1 118 PRO 118 118 118 PRO PRO A . n A 1 119 GLY 119 119 119 GLY GLY A . n A 1 120 ALA 120 120 120 ALA ALA A . n A 1 121 PRO 121 121 121 PRO PRO A . n A 1 122 ARG 122 122 122 ARG ARG A . n A 1 123 LEU 123 123 123 LEU LEU A . n A 1 124 GLU 124 124 124 GLU GLU A . n A 1 125 PHE 125 125 125 PHE PHE A . n A 1 126 LEU 126 126 126 LEU LEU A . n A 1 127 ALA 127 127 127 ALA ALA A . n A 1 128 GLY 128 128 128 GLY GLY A . n A 1 129 ARG 129 129 129 ARG ARG A . n A 1 130 PRO 130 130 130 PRO PRO A . n A 1 131 ASN 131 131 131 ASN ASN A . n A 1 132 LYS 132 132 132 LYS LYS A . n A 1 133 THR 133 133 133 THR THR A . n A 1 134 ILE 134 134 134 ILE ILE A . n A 1 135 ALA 135 135 135 ALA ALA A . n A 1 136 ALA 136 136 136 ALA ALA A . n A 1 137 VAL 137 137 137 VAL VAL A . n A 1 138 ASP 138 138 138 ASP ASP A . n A 1 139 GLY 139 139 139 GLY GLY A . n A 1 140 LEU 140 140 140 LEU LEU A . n A 1 141 ILE 141 141 141 ILE ILE A . n A 1 142 PRO 142 142 142 PRO PRO A . n A 1 143 GLU 143 143 143 GLU GLU A . n A 1 144 PRO 144 144 144 PRO PRO A . n A 1 145 GLN 145 145 145 GLN GLN A . n A 1 146 ASP 146 146 146 ASP ASP A . n A 1 147 SER 147 147 147 SER SER A . n A 1 148 VAL 148 148 148 VAL VAL A . n A 1 149 THR 149 149 149 THR THR A . n A 1 150 LYS 150 150 150 LYS LYS A . n A 1 151 ILE 151 151 151 ILE ILE A . n A 1 152 LEU 152 152 152 LEU LEU A . n A 1 153 GLN 153 153 153 GLN GLN A . n A 1 154 ARG 154 154 154 ARG ARG A . n A 1 155 PHE 155 155 155 PHE PHE A . n A 1 156 GLU 156 156 156 GLU GLU A . n A 1 157 ASP 157 157 157 ASP ASP A . n A 1 158 ALA 158 158 158 ALA ALA A . n A 1 159 GLY 159 159 159 GLY GLY A . n A 1 160 GLY 160 160 160 GLY GLY A . n A 1 161 PHE 161 161 161 PHE PHE A . n A 1 162 THR 162 162 162 THR THR A . n A 1 163 PRO 163 163 163 PRO PRO A . n A 1 164 PHE 164 164 164 PHE PHE A . n A 1 165 GLU 165 165 165 GLU GLU A . n A 1 166 VAL 166 166 166 VAL VAL A . n A 1 167 VAL 167 167 167 VAL VAL A . n A 1 168 SER 168 168 168 SER SER A . n A 1 169 LEU 169 169 169 LEU LEU A . n A 1 170 LEU 170 170 170 LEU LEU A . n A 1 171 ALA 171 171 171 ALA ALA A . n A 1 172 SER 172 172 172 SER SER A . n A 1 173 HIS 173 173 173 HIS HIS A . n A 1 174 SER 174 174 174 SER SER A . n A 1 175 VAL 175 175 175 VAL VAL A . n A 1 176 ALA 176 176 176 ALA ALA A . n A 1 177 ARG 177 177 177 ARG ARG A . n A 1 178 ALA 178 178 178 ALA ALA A . n A 1 179 ASP 179 179 179 ASP ASP A . n A 1 180 LYS 180 180 180 LYS LYS A . n A 1 181 VAL 181 181 181 VAL VAL A . n A 1 182 ASP 182 182 182 ASP ASP A . n A 1 183 GLN 183 183 183 GLN GLN A . n A 1 184 THR 184 184 184 THR THR A . n A 1 185 ILE 185 185 185 ILE ILE A . n A 1 186 ASP 186 186 186 ASP ASP A . n A 1 187 ALA 187 187 187 ALA ALA A . n A 1 188 ALA 188 188 188 ALA ALA A . n A 1 189 PRO 189 189 189 PRO PRO A . n A 1 190 PHE 190 190 190 PHE PHE A . n A 1 191 ASP 191 191 191 ASP ASP A . n A 1 192 SER 192 192 192 SER SER A . n A 1 193 THR 193 193 193 THR THR A . n A 1 194 PRO 194 194 194 PRO PRO A . n A 1 195 PHE 195 195 195 PHE PHE A . n A 1 196 THR 196 196 196 THR THR A . n A 1 197 PHE 197 197 197 PHE PHE A . n A 1 198 ASP 198 198 198 ASP ASP A . n A 1 199 THR 199 199 199 THR THR A . n A 1 200 GLN 200 200 200 GLN GLN A . n A 1 201 VAL 201 201 201 VAL VAL A . n A 1 202 PHE 202 202 202 PHE PHE A . n A 1 203 LEU 203 203 203 LEU LEU A . n A 1 204 GLU 204 204 204 GLU GLU A . n A 1 205 VAL 205 205 205 VAL VAL A . n A 1 206 LEU 206 206 206 LEU LEU A . n A 1 207 LEU 207 207 207 LEU LEU A . n A 1 208 LYS 208 208 208 LYS LYS A . n A 1 209 GLY 209 209 209 GLY GLY A . n A 1 210 VAL 210 210 210 VAL VAL A . n A 1 211 GLY 211 211 211 GLY GLY A . n A 1 212 PHE 212 212 212 PHE PHE A . n A 1 213 PRO 213 213 213 PRO PRO A . n A 1 214 GLY 214 214 214 GLY GLY A . n A 1 215 SER 215 215 215 SER SER A . n A 1 216 ALA 216 216 216 ALA ALA A . n A 1 217 ASN 217 217 217 ASN ASN A . n A 1 218 ASN 218 218 218 ASN ASN A . n A 1 219 THR 219 219 219 THR THR A . n A 1 220 GLY 220 220 220 GLY GLY A . n A 1 221 GLU 221 221 221 GLU GLU A . n A 1 222 VAL 222 222 222 VAL VAL A . n A 1 223 ALA 223 223 223 ALA ALA A . n A 1 224 SER 224 224 224 SER SER A . n A 1 225 PRO 225 225 225 PRO PRO A . n A 1 226 LEU 226 226 226 LEU LEU A . n A 1 227 PRO 227 227 227 PRO PRO A . n A 1 228 LEU 228 228 228 LEU LEU A . n A 1 229 GLY 229 229 229 GLY GLY A . n A 1 230 SER 230 230 230 SER SER A . n A 1 231 GLY 231 231 231 GLY GLY A . n A 1 232 SER 232 232 232 SER SER A . n A 1 233 ASP 233 233 233 ASP ASP A . n A 1 234 THR 234 234 234 THR THR A . n A 1 235 GLY 235 235 235 GLY GLY A . n A 1 236 GLU 236 236 236 GLU GLU A . n A 1 237 MET 237 237 237 MET MET A . n A 1 238 ARG 238 238 238 ARG ARG A . n A 1 239 LEU 239 239 239 LEU LEU A . n A 1 240 GLN 240 240 240 GLN GLN A . n A 1 241 SER 241 241 241 SER SER A . n A 1 242 ASP 242 242 242 ASP ASP A . n A 1 243 PHE 243 243 243 PHE PHE A . n A 1 244 ALA 244 244 244 ALA ALA A . n A 1 245 LEU 245 245 245 LEU LEU A . n A 1 246 ALA 246 246 246 ALA ALA A . n A 1 247 HIS 247 247 247 HIS HIS A . n A 1 248 ASP 248 248 248 ASP ASP A . n A 1 249 PRO 249 249 249 PRO PRO A . n A 1 250 ARG 250 250 250 ARG ARG A . n A 1 251 THR 251 251 251 THR THR A . n A 1 252 ALA 252 252 252 ALA ALA A . n A 1 253 CYS 253 253 253 CYS CYS A . n A 1 254 ILE 254 254 254 ILE ILE A . n A 1 255 TRP 255 255 255 TRP TRP A . n A 1 256 GLN 256 256 256 GLN GLN A . n A 1 257 GLY 257 257 257 GLY GLY A . n A 1 258 PHE 258 258 258 PHE PHE A . n A 1 259 VAL 259 259 259 VAL VAL A . n A 1 260 ASN 260 260 260 ASN ASN A . n A 1 261 GLU 261 261 261 GLU GLU A . n A 1 262 GLN 262 262 262 GLN GLN A . n A 1 263 ALA 263 263 263 ALA ALA A . n A 1 264 PHE 264 264 264 PHE PHE A . n A 1 265 MET 265 265 265 MET MET A . n A 1 266 ALA 266 266 266 ALA ALA A . n A 1 267 ALA 267 267 267 ALA ALA A . n A 1 268 SER 268 268 268 SER SER A . n A 1 269 PHE 269 269 269 PHE PHE A . n A 1 270 ARG 270 270 270 ARG ARG A . n A 1 271 ALA 271 271 271 ALA ALA A . n A 1 272 ALA 272 272 272 ALA ALA A . n A 1 273 MET 273 273 273 MET MET A . n A 1 274 SER 274 274 274 SER SER A . n A 1 275 LYS 275 275 275 LYS LYS A . n A 1 276 LEU 276 276 276 LEU LEU A . n A 1 277 ALA 277 277 277 ALA ALA A . n A 1 278 VAL 278 278 278 VAL VAL A . n A 1 279 LEU 279 279 279 LEU LEU A . n A 1 280 GLY 280 280 280 GLY GLY A . n A 1 281 HIS 281 281 281 HIS HIS A . n A 1 282 ASN 282 282 282 ASN ASN A . n A 1 283 ARG 283 283 283 ARG ARG A . n A 1 284 ASN 284 284 284 ASN ASN A . n A 1 285 SER 285 285 285 SER SER A . n A 1 286 LEU 286 286 286 LEU LEU A . n A 1 287 ILE 287 287 287 ILE ILE A . n A 1 288 ASP 288 288 288 ASP ASP A . n A 1 289 CYS 289 289 289 CYS CYS A . n A 1 290 SER 290 290 290 SER SER A . n A 1 291 ASP 291 291 291 ASP ASP A . n A 1 292 VAL 292 292 292 VAL VAL A . n A 1 293 VAL 293 293 293 VAL VAL A . n A 1 294 PRO 294 294 294 PRO PRO A . n A 1 295 VAL 295 295 295 VAL VAL A . n A 1 296 PRO 296 296 296 PRO PRO A . n A 1 297 LYS 297 297 297 LYS LYS A . n A 1 298 PRO 298 298 298 PRO PRO A . n A 1 299 ALA 299 299 299 ALA ALA A . n A 1 300 THR 300 300 300 THR THR A . n A 1 301 GLY 301 301 301 GLY GLY A . n A 1 302 GLN 302 302 302 GLN GLN A . n A 1 303 PRO 303 303 303 PRO PRO A . n A 1 304 ALA 304 304 304 ALA ALA A . n A 1 305 MET 305 305 305 MET MET A . n A 1 306 PHE 306 306 306 PHE PHE A . n A 1 307 PRO 307 307 307 PRO PRO A . n A 1 308 ALA 308 308 308 ALA ALA A . n A 1 309 SER 309 309 309 SER SER A . n A 1 310 THR 310 310 310 THR THR A . n A 1 311 GLY 311 311 311 GLY GLY A . n A 1 312 PRO 312 312 312 PRO PRO A . n A 1 313 GLN 313 313 313 GLN GLN A . n A 1 314 ASP 314 314 314 ASP ASP A . n A 1 315 LEU 315 315 315 LEU LEU A . n A 1 316 GLU 316 316 316 GLU GLU A . n A 1 317 LEU 317 317 317 LEU LEU A . n A 1 318 SER 318 318 318 SER SER A . n A 1 319 CYS 319 319 319 CYS CYS A . n A 1 320 PRO 320 320 320 PRO PRO A . n A 1 321 SER 321 321 321 SER SER A . n A 1 322 GLU 322 322 322 GLU GLU A . n A 1 323 ARG 323 323 323 ARG ARG A . n A 1 324 PHE 324 324 324 PHE PHE A . n A 1 325 PRO 325 325 325 PRO PRO A . n A 1 326 THR 326 326 326 THR THR A . n A 1 327 LEU 327 327 327 LEU LEU A . n A 1 328 THR 328 328 328 THR THR A . n A 1 329 THR 329 329 329 THR THR A . n A 1 330 GLN 330 330 330 GLN GLN A . n A 1 331 PRO 331 331 331 PRO PRO A . n A 1 332 GLY 332 332 332 GLY GLY A . n A 1 333 ALA 333 333 333 ALA ALA A . n A 1 334 SER 334 334 334 SER SER A . n A 1 335 GLN 335 335 335 GLN GLN A . n A 1 336 SER 336 336 336 SER SER A . n A 1 337 LEU 337 337 337 LEU LEU A . n A 1 338 ILE 338 338 338 ILE ILE A . n A 1 339 ALA 339 339 339 ALA ALA A . n A 1 340 HIS 340 340 340 HIS HIS A . n A 1 341 CYS 341 341 341 CYS CYS A . n A 1 342 PRO 342 342 342 PRO PRO A . n A 1 343 ASP 343 343 343 ASP ASP A . n A 1 344 GLY 344 344 344 GLY GLY A . n A 1 345 SER 345 345 345 SER SER A . n A 1 346 MET 346 346 346 MET MET A . n A 1 347 SER 347 347 347 SER SER A . n A 1 348 CYS 348 348 348 CYS CYS A . n A 1 349 PRO 349 349 349 PRO PRO A . n A 1 350 GLY 350 350 350 GLY GLY A . n A 1 351 VAL 351 351 351 VAL VAL A . n A 1 352 GLN 352 352 352 GLN GLN A . n A 1 353 PHE 353 353 353 PHE PHE A . n A 1 354 ASN 354 354 354 ASN ASN A . n A 1 355 GLY 355 355 355 GLY GLY A . n A 1 356 PRO 356 356 356 PRO PRO A . n A 1 357 ALA 357 357 357 ALA ALA 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 1 361 361 NAG NAG A . C 2 NAG 2 362 362 NAG NAG A . D 3 CA 1 371 371 CA CA A . E 3 CA 1 372 372 CA CA A . F 4 MN 1 381 381 MN MN A . G 5 HEM 1 396 396 HEM HEM A . H 6 HOH 1 401 401 HOH HOH A . H 6 HOH 2 402 402 HOH HOH A . H 6 HOH 3 403 403 HOH HOH A . H 6 HOH 4 404 404 HOH HOH A . H 6 HOH 5 405 405 HOH HOH A . H 6 HOH 6 406 406 HOH HOH A . H 6 HOH 7 407 407 HOH HOH A . H 6 HOH 8 408 408 HOH HOH A . H 6 HOH 9 409 409 HOH HOH A . H 6 HOH 10 410 410 HOH HOH A . H 6 HOH 11 411 411 HOH HOH A . H 6 HOH 12 412 412 HOH HOH A . H 6 HOH 13 413 413 HOH HOH A . H 6 HOH 14 414 414 HOH HOH A . H 6 HOH 15 415 415 HOH HOH A . H 6 HOH 16 416 416 HOH HOH A . H 6 HOH 17 417 417 HOH HOH A . H 6 HOH 18 418 418 HOH HOH A . H 6 HOH 19 419 419 HOH HOH A . H 6 HOH 20 420 420 HOH HOH A . H 6 HOH 21 421 421 HOH HOH A . H 6 HOH 22 422 422 HOH HOH A . H 6 HOH 23 423 423 HOH HOH A . H 6 HOH 24 424 424 HOH HOH A . H 6 HOH 25 425 425 HOH HOH A . H 6 HOH 26 426 426 HOH HOH A . H 6 HOH 27 427 427 HOH HOH A . H 6 HOH 28 428 428 HOH HOH A . H 6 HOH 29 429 429 HOH HOH A . H 6 HOH 30 430 430 HOH HOH A . H 6 HOH 31 431 431 HOH HOH A . H 6 HOH 32 432 432 HOH HOH A . H 6 HOH 33 433 433 HOH HOH A . H 6 HOH 34 434 434 HOH HOH A . H 6 HOH 35 435 435 HOH HOH A . H 6 HOH 36 436 436 HOH HOH A . H 6 HOH 37 437 437 HOH HOH A . H 6 HOH 38 438 438 HOH HOH A . H 6 HOH 39 439 439 HOH HOH A . H 6 HOH 40 440 440 HOH HOH A . H 6 HOH 41 441 441 HOH HOH A . H 6 HOH 42 442 442 HOH HOH A . H 6 HOH 43 443 443 HOH HOH A . H 6 HOH 44 444 444 HOH HOH A . H 6 HOH 45 445 445 HOH HOH A . H 6 HOH 46 446 446 HOH HOH A . H 6 HOH 47 447 447 HOH HOH A . H 6 HOH 48 448 448 HOH HOH A . H 6 HOH 49 449 449 HOH HOH A . H 6 HOH 50 450 450 HOH HOH A . H 6 HOH 51 451 451 HOH HOH A . H 6 HOH 52 452 452 HOH HOH A . H 6 HOH 53 453 453 HOH HOH A . H 6 HOH 54 454 454 HOH HOH A . H 6 HOH 55 455 455 HOH HOH A . H 6 HOH 56 456 456 HOH HOH A . H 6 HOH 57 457 457 HOH HOH A . H 6 HOH 58 458 458 HOH HOH A . H 6 HOH 59 459 459 HOH HOH A . H 6 HOH 60 460 460 HOH HOH A . H 6 HOH 61 461 461 HOH HOH A . H 6 HOH 62 462 462 HOH HOH A . H 6 HOH 63 463 463 HOH HOH A . H 6 HOH 64 464 464 HOH HOH A . H 6 HOH 65 465 465 HOH HOH A . H 6 HOH 66 466 466 HOH HOH A . H 6 HOH 67 467 467 HOH HOH A . H 6 HOH 68 468 468 HOH HOH A . H 6 HOH 69 469 469 HOH HOH A . H 6 HOH 70 470 470 HOH HOH A . H 6 HOH 71 471 471 HOH HOH A . H 6 HOH 72 472 472 HOH HOH A . H 6 HOH 73 473 473 HOH HOH A . H 6 HOH 74 474 474 HOH HOH A . H 6 HOH 75 475 475 HOH HOH A . H 6 HOH 76 476 476 HOH HOH A . H 6 HOH 77 477 477 HOH HOH A . H 6 HOH 78 478 478 HOH HOH A . H 6 HOH 79 479 479 HOH HOH A . H 6 HOH 80 480 480 HOH HOH A . H 6 HOH 81 481 481 HOH HOH A . H 6 HOH 82 482 482 HOH HOH A . H 6 HOH 83 483 483 HOH HOH A . H 6 HOH 84 484 484 HOH HOH A . H 6 HOH 85 485 485 HOH HOH A . H 6 HOH 86 486 486 HOH HOH A . H 6 HOH 87 487 487 HOH HOH A . H 6 HOH 88 488 488 HOH HOH A . H 6 HOH 89 489 489 HOH HOH A . H 6 HOH 90 490 490 HOH HOH A . H 6 HOH 91 491 491 HOH HOH A . H 6 HOH 92 492 492 HOH HOH A . H 6 HOH 93 493 493 HOH HOH A . H 6 HOH 94 494 494 HOH HOH A . H 6 HOH 95 495 495 HOH HOH A . H 6 HOH 96 496 496 HOH HOH A . H 6 HOH 97 497 497 HOH HOH A . H 6 HOH 98 498 498 HOH HOH A . H 6 HOH 99 499 499 HOH HOH A . H 6 HOH 100 500 500 HOH HOH A . H 6 HOH 101 501 501 HOH HOH A . H 6 HOH 102 502 502 HOH HOH A . H 6 HOH 103 503 503 HOH HOH A . H 6 HOH 104 504 504 HOH HOH A . H 6 HOH 105 505 505 HOH HOH A . H 6 HOH 106 506 506 HOH HOH A . H 6 HOH 107 507 507 HOH HOH A . H 6 HOH 108 508 508 HOH HOH A . H 6 HOH 109 509 509 HOH HOH A . H 6 HOH 110 510 510 HOH HOH A . H 6 HOH 111 511 511 HOH HOH A . H 6 HOH 112 512 512 HOH HOH A . H 6 HOH 113 513 513 HOH HOH A . H 6 HOH 114 514 514 HOH HOH A . H 6 HOH 115 515 515 HOH HOH A . H 6 HOH 116 516 516 HOH HOH A . H 6 HOH 117 517 517 HOH HOH A . H 6 HOH 118 518 518 HOH HOH A . H 6 HOH 119 519 519 HOH HOH A . H 6 HOH 120 520 520 HOH HOH A . H 6 HOH 121 521 521 HOH HOH A . H 6 HOH 122 522 522 HOH HOH A . H 6 HOH 123 523 523 HOH HOH A . H 6 HOH 124 524 524 HOH HOH A . H 6 HOH 125 525 525 HOH HOH A . H 6 HOH 126 526 526 HOH HOH A . H 6 HOH 127 527 527 HOH HOH A . H 6 HOH 128 528 528 HOH HOH A . H 6 HOH 129 529 529 HOH HOH A . H 6 HOH 130 530 530 HOH HOH A . H 6 HOH 131 531 531 HOH HOH A . H 6 HOH 132 532 532 HOH HOH A . H 6 HOH 133 533 533 HOH HOH A . H 6 HOH 134 534 534 HOH HOH A . H 6 HOH 135 535 535 HOH HOH A . H 6 HOH 136 536 536 HOH HOH A . H 6 HOH 137 537 537 HOH HOH A . H 6 HOH 138 538 538 HOH HOH A . H 6 HOH 139 539 539 HOH HOH A . H 6 HOH 140 540 540 HOH HOH A . H 6 HOH 141 541 541 HOH HOH A . H 6 HOH 142 542 542 HOH HOH A . H 6 HOH 143 543 543 HOH HOH A . H 6 HOH 144 544 544 HOH HOH A . H 6 HOH 145 545 545 HOH HOH A . H 6 HOH 146 546 546 HOH HOH A . H 6 HOH 147 547 547 HOH HOH A . H 6 HOH 148 548 548 HOH HOH A . H 6 HOH 149 549 549 HOH HOH A . H 6 HOH 150 550 550 HOH HOH A . H 6 HOH 151 551 551 HOH HOH A . H 6 HOH 152 552 552 HOH HOH A . H 6 HOH 153 553 553 HOH HOH A . H 6 HOH 154 554 554 HOH HOH A . H 6 HOH 155 555 555 HOH HOH A . H 6 HOH 156 556 556 HOH HOH A . H 6 HOH 157 557 557 HOH HOH A . H 6 HOH 158 558 558 HOH HOH A . H 6 HOH 159 559 559 HOH HOH A . H 6 HOH 160 560 560 HOH HOH A . H 6 HOH 161 561 561 HOH HOH A . H 6 HOH 162 562 562 HOH HOH A . H 6 HOH 163 563 563 HOH HOH A . H 6 HOH 164 564 564 HOH HOH A . H 6 HOH 165 565 565 HOH HOH A . H 6 HOH 166 566 566 HOH HOH A . H 6 HOH 167 567 567 HOH HOH A . H 6 HOH 168 568 568 HOH HOH A . H 6 HOH 169 569 569 HOH HOH A . H 6 HOH 170 570 570 HOH HOH A . H 6 HOH 171 571 571 HOH HOH A . H 6 HOH 172 572 572 HOH HOH A . H 6 HOH 173 573 573 HOH HOH A . H 6 HOH 174 574 574 HOH HOH A . H 6 HOH 175 575 575 HOH HOH A . H 6 HOH 176 576 576 HOH HOH A . H 6 HOH 177 577 577 HOH HOH A . H 6 HOH 178 578 578 HOH HOH A . H 6 HOH 179 579 579 HOH HOH A . H 6 HOH 180 580 580 HOH HOH A . H 6 HOH 181 581 581 HOH HOH A . H 6 HOH 182 582 582 HOH HOH A . H 6 HOH 183 583 583 HOH HOH A . H 6 HOH 184 584 584 HOH HOH A . H 6 HOH 185 585 585 HOH HOH A . H 6 HOH 186 586 586 HOH HOH A . H 6 HOH 187 587 587 HOH HOH A . H 6 HOH 188 588 588 HOH HOH A . H 6 HOH 189 589 589 HOH HOH A . H 6 HOH 190 590 590 HOH HOH A . H 6 HOH 191 591 591 HOH HOH A . H 6 HOH 192 592 592 HOH HOH A . H 6 HOH 193 593 593 HOH HOH A . H 6 HOH 194 594 594 HOH HOH A . H 6 HOH 195 595 595 HOH HOH A . H 6 HOH 196 596 596 HOH HOH A . H 6 HOH 197 597 597 HOH HOH A . H 6 HOH 198 598 598 HOH HOH A . H 6 HOH 199 599 599 HOH HOH A . H 6 HOH 200 600 600 HOH HOH A . H 6 HOH 201 601 601 HOH HOH A . H 6 HOH 202 602 602 HOH HOH A . H 6 HOH 203 603 603 HOH HOH A . H 6 HOH 204 604 604 HOH HOH A . H 6 HOH 205 605 605 HOH HOH A . H 6 HOH 206 606 606 HOH HOH A . H 6 HOH 207 607 607 HOH HOH A . H 6 HOH 208 608 608 HOH HOH A . H 6 HOH 209 609 609 HOH HOH A . H 6 HOH 210 610 610 HOH HOH A . H 6 HOH 211 611 611 HOH HOH A . H 6 HOH 212 612 612 HOH HOH A . H 6 HOH 213 613 613 HOH HOH A . H 6 HOH 214 614 614 HOH HOH A . H 6 HOH 215 615 615 HOH HOH A . H 6 HOH 216 616 616 HOH HOH A . H 6 HOH 217 617 617 HOH HOH A . H 6 HOH 218 618 618 HOH HOH A . H 6 HOH 219 619 619 HOH HOH A . H 6 HOH 220 620 620 HOH HOH A . H 6 HOH 221 621 621 HOH HOH A . H 6 HOH 222 622 622 HOH HOH A . H 6 HOH 223 623 623 HOH HOH A . H 6 HOH 224 624 624 HOH HOH A . H 6 HOH 225 625 625 HOH HOH A . H 6 HOH 226 626 626 HOH HOH A . H 6 HOH 227 627 627 HOH HOH A . H 6 HOH 228 628 628 HOH HOH A . H 6 HOH 229 629 629 HOH HOH A . H 6 HOH 230 630 630 HOH HOH A . H 6 HOH 231 631 631 HOH HOH A . H 6 HOH 232 632 632 HOH HOH A . H 6 HOH 233 633 633 HOH HOH A . H 6 HOH 234 634 634 HOH HOH A . H 6 HOH 235 635 635 HOH HOH A . H 6 HOH 236 636 636 HOH HOH A . H 6 HOH 237 637 637 HOH HOH A . H 6 HOH 238 638 638 HOH HOH A . H 6 HOH 239 639 639 HOH HOH A . H 6 HOH 240 640 640 HOH HOH A . H 6 HOH 241 641 641 HOH HOH A . H 6 HOH 242 642 642 HOH HOH A . H 6 HOH 243 643 643 HOH HOH A . H 6 HOH 244 644 644 HOH HOH A . H 6 HOH 245 645 645 HOH HOH A . H 6 HOH 246 646 646 HOH HOH A . H 6 HOH 247 647 647 HOH HOH A . H 6 HOH 248 648 648 HOH HOH A . H 6 HOH 249 649 649 HOH HOH A . H 6 HOH 250 650 650 HOH HOH A . # _pdbx_struct_mod_residue.id 1 _pdbx_struct_mod_residue.label_asym_id A _pdbx_struct_mod_residue.label_comp_id ASN _pdbx_struct_mod_residue.label_seq_id 131 _pdbx_struct_mod_residue.auth_asym_id A _pdbx_struct_mod_residue.auth_comp_id ASN _pdbx_struct_mod_residue.auth_seq_id 131 _pdbx_struct_mod_residue.PDB_ins_code ? _pdbx_struct_mod_residue.parent_comp_id ASN _pdbx_struct_mod_residue.details 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_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,E,F,G,H # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 OD2 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OD1 ? A ASP 198 ? A ASP 198 ? 1_555 89.8 ? 2 OD2 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OG ? A SER 174 ? A SER 174 ? 1_555 79.9 ? 3 OD1 ? A ASP 198 ? A ASP 198 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OG ? A SER 174 ? A SER 174 ? 1_555 71.3 ? 4 OD2 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OD1 ? A ASP 191 ? A ASP 191 ? 1_555 47.2 ? 5 OD1 ? A ASP 198 ? A ASP 198 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OD1 ? A ASP 191 ? A ASP 191 ? 1_555 127.5 ? 6 OG ? A SER 174 ? A SER 174 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OD1 ? A ASP 191 ? A ASP 191 ? 1_555 117.0 ? 7 OD2 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 193 ? A THR 193 ? 1_555 120.7 ? 8 OD1 ? A ASP 198 ? A ASP 198 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 193 ? A THR 193 ? 1_555 127.0 ? 9 OG ? A SER 174 ? A SER 174 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 193 ? A THR 193 ? 1_555 148.8 ? 10 OD1 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 193 ? A THR 193 ? 1_555 74.3 ? 11 OD2 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OG1 ? A THR 193 ? A THR 193 ? 1_555 87.4 ? 12 OD1 ? A ASP 198 ? A ASP 198 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OG1 ? A THR 193 ? A THR 193 ? 1_555 69.8 ? 13 OG ? A SER 174 ? A SER 174 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OG1 ? A THR 193 ? A THR 193 ? 1_555 139.0 ? 14 OD1 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OG1 ? A THR 193 ? A THR 193 ? 1_555 78.5 ? 15 O ? A THR 193 ? A THR 193 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 OG1 ? A THR 193 ? A THR 193 ? 1_555 69.6 ? 16 OD2 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A SER 174 ? A SER 174 ? 1_555 90.9 ? 17 OD1 ? A ASP 198 ? A ASP 198 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A SER 174 ? A SER 174 ? 1_555 142.8 ? 18 OG ? A SER 174 ? A SER 174 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A SER 174 ? A SER 174 ? 1_555 72.3 ? 19 OD1 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A SER 174 ? A SER 174 ? 1_555 76.6 ? 20 O ? A THR 193 ? A THR 193 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A SER 174 ? A SER 174 ? 1_555 83.5 ? 21 OG1 ? A THR 193 ? A THR 193 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A SER 174 ? A SER 174 ? 1_555 147.4 ? 22 OD2 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 196 ? A THR 196 ? 1_555 156.4 ? 23 OD1 ? A ASP 198 ? A ASP 198 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 196 ? A THR 196 ? 1_555 79.1 ? 24 OG ? A SER 174 ? A SER 174 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 196 ? A THR 196 ? 1_555 76.8 ? 25 OD1 ? A ASP 191 ? A ASP 191 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 196 ? A THR 196 ? 1_555 152.0 ? 26 O ? A THR 193 ? A THR 193 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 196 ? A THR 196 ? 1_555 82.2 ? 27 OG1 ? A THR 193 ? A THR 193 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 196 ? A THR 196 ? 1_555 107.7 ? 28 O ? A SER 174 ? A SER 174 ? 1_555 CA ? D CA . ? A CA 371 ? 1_555 O ? A THR 196 ? A THR 196 ? 1_555 85.8 ? 29 O ? H HOH . ? A HOH 493 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? A GLY 62 ? A GLY 62 ? 1_555 145.8 ? 30 O ? H HOH . ? A HOH 493 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? H HOH . ? A HOH 545 ? 1_555 91.9 ? 31 O ? A GLY 62 ? A GLY 62 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? H HOH . ? A HOH 545 ? 1_555 85.8 ? 32 O ? H HOH . ? A HOH 493 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OD1 ? A ASP 47 ? A ASP 47 ? 1_555 91.1 ? 33 O ? A GLY 62 ? A GLY 62 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OD1 ? A ASP 47 ? A ASP 47 ? 1_555 95.3 ? 34 O ? H HOH . ? A HOH 545 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OD1 ? A ASP 47 ? A ASP 47 ? 1_555 172.9 ? 35 O ? H HOH . ? A HOH 493 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OD1 ? A ASP 64 ? A ASP 64 ? 1_555 144.2 ? 36 O ? A GLY 62 ? A GLY 62 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OD1 ? A ASP 64 ? A ASP 64 ? 1_555 70.0 ? 37 O ? H HOH . ? A HOH 545 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OD1 ? A ASP 64 ? A ASP 64 ? 1_555 90.2 ? 38 OD1 ? A ASP 47 ? A ASP 47 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OD1 ? A ASP 64 ? A ASP 64 ? 1_555 83.6 ? 39 O ? H HOH . ? A HOH 493 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OG ? A SER 66 ? A SER 66 ? 1_555 79.6 ? 40 O ? A GLY 62 ? A GLY 62 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OG ? A SER 66 ? A SER 66 ? 1_555 133.7 ? 41 O ? H HOH . ? A HOH 545 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OG ? A SER 66 ? A SER 66 ? 1_555 83.8 ? 42 OD1 ? A ASP 47 ? A ASP 47 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OG ? A SER 66 ? A SER 66 ? 1_555 90.4 ? 43 OD1 ? A ASP 64 ? A ASP 64 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 OG ? A SER 66 ? A SER 66 ? 1_555 65.1 ? 44 O ? H HOH . ? A HOH 493 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? A ASP 47 ? A ASP 47 ? 1_555 78.2 ? 45 O ? A GLY 62 ? A GLY 62 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? A ASP 47 ? A ASP 47 ? 1_555 69.5 ? 46 O ? H HOH . ? A HOH 545 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? A ASP 47 ? A ASP 47 ? 1_555 104.7 ? 47 OD1 ? A ASP 47 ? A ASP 47 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? A ASP 47 ? A ASP 47 ? 1_555 82.2 ? 48 OD1 ? A ASP 64 ? A ASP 64 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? A ASP 47 ? A ASP 47 ? 1_555 135.4 ? 49 OG ? A SER 66 ? A SER 66 ? 1_555 CA ? E CA . ? A CA 372 ? 1_555 O ? A ASP 47 ? A ASP 47 ? 1_555 156.4 ? 50 O ? H HOH . ? A HOH 441 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 OE2 ? A GLU 35 ? A GLU 35 ? 1_555 76.2 ? 51 O ? H HOH . ? A HOH 441 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 O1D ? G HEM . ? A HEM 396 ? 1_555 98.6 ? 52 OE2 ? A GLU 35 ? A GLU 35 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 O1D ? G HEM . ? A HEM 396 ? 1_555 101.8 ? 53 O ? H HOH . ? A HOH 441 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 OD2 ? A ASP 179 ? A ASP 179 ? 1_555 83.4 ? 54 OE2 ? A GLU 35 ? A GLU 35 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 OD2 ? A ASP 179 ? A ASP 179 ? 1_555 85.8 ? 55 O1D ? G HEM . ? A HEM 396 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 OD2 ? A ASP 179 ? A ASP 179 ? 1_555 172.4 ? 56 O ? H HOH . ? A HOH 441 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 O ? H HOH . ? A HOH 520 ? 1_555 92.9 ? 57 OE2 ? A GLU 35 ? A GLU 35 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 O ? H HOH . ? A HOH 520 ? 1_555 168.9 ? 58 O1D ? G HEM . ? A HEM 396 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 O ? H HOH . ? A HOH 520 ? 1_555 81.8 ? 59 OD2 ? A ASP 179 ? A ASP 179 ? 1_555 MN ? F MN . ? A MN 381 ? 1_555 O ? H HOH . ? A HOH 520 ? 1_555 90.8 ? 60 O ? H HOH . ? A HOH 556 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NA ? G HEM . ? A HEM 396 ? 1_555 76.9 ? 61 O ? H HOH . ? A HOH 556 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NB ? G HEM . ? A HEM 396 ? 1_555 76.5 ? 62 NA ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NB ? G HEM . ? A HEM 396 ? 1_555 88.5 ? 63 O ? H HOH . ? A HOH 556 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NC ? G HEM . ? A HEM 396 ? 1_555 95.5 ? 64 NA ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NC ? G HEM . ? A HEM 396 ? 1_555 172.4 ? 65 NB ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NC ? G HEM . ? A HEM 396 ? 1_555 89.3 ? 66 O ? H HOH . ? A HOH 556 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 ND ? G HEM . ? A HEM 396 ? 1_555 102.1 ? 67 NA ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 ND ? G HEM . ? A HEM 396 ? 1_555 91.7 ? 68 NB ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 ND ? G HEM . ? A HEM 396 ? 1_555 178.5 ? 69 NC ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 ND ? G HEM . ? A HEM 396 ? 1_555 90.3 ? 70 O ? H HOH . ? A HOH 556 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NE2 ? A HIS 173 ? A HIS 173 ? 1_555 161.1 ? 71 NA ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NE2 ? A HIS 173 ? A HIS 173 ? 1_555 91.9 ? 72 NB ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NE2 ? A HIS 173 ? A HIS 173 ? 1_555 88.2 ? 73 NC ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NE2 ? A HIS 173 ? A HIS 173 ? 1_555 95.3 ? 74 ND ? G HEM . ? A HEM 396 ? 1_555 FE ? G HEM . ? A HEM 396 ? 1_555 NE2 ? A HIS 173 ? A HIS 173 ? 1_555 93.3 ? # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 1995-09-15 2 'Structure model' 1 1 2008-03-03 3 'Structure model' 1 2 2011-07-13 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # 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' # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal XENGEN 'data collection' . ? 1 X-PLOR 'model building' . ? 2 X-PLOR refinement . ? 3 XENGEN 'data reduction' . ? 4 X-PLOR phasing . ? 5 # _pdbx_validate_rmsd_bond.id 1 _pdbx_validate_rmsd_bond.PDB_model_num 1 _pdbx_validate_rmsd_bond.auth_atom_id_1 CG _pdbx_validate_rmsd_bond.auth_asym_id_1 A _pdbx_validate_rmsd_bond.auth_comp_id_1 HIS _pdbx_validate_rmsd_bond.auth_seq_id_1 173 _pdbx_validate_rmsd_bond.PDB_ins_code_1 ? _pdbx_validate_rmsd_bond.label_alt_id_1 ? _pdbx_validate_rmsd_bond.auth_atom_id_2 CD2 _pdbx_validate_rmsd_bond.auth_asym_id_2 A _pdbx_validate_rmsd_bond.auth_comp_id_2 HIS _pdbx_validate_rmsd_bond.auth_seq_id_2 173 _pdbx_validate_rmsd_bond.PDB_ins_code_2 ? _pdbx_validate_rmsd_bond.label_alt_id_2 ? _pdbx_validate_rmsd_bond.bond_value 1.417 _pdbx_validate_rmsd_bond.bond_target_value 1.354 _pdbx_validate_rmsd_bond.bond_deviation 0.063 _pdbx_validate_rmsd_bond.bond_standard_deviation 0.009 _pdbx_validate_rmsd_bond.linker_flag N # 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 PRO A 4 ? ? -58.93 13.36 2 1 VAL A 73 ? ? -101.89 -80.75 3 1 THR A 133 ? ? -164.74 -165.82 4 1 ASP A 198 ? ? -125.95 -169.84 5 1 SER A 309 ? ? 93.30 2.97 6 1 SER A 345 ? ? -65.80 -175.92 7 1 CYS A 348 ? ? -159.90 63.26 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 'CALCIUM ION' CA 4 'MANGANESE (II) ION' MN 5 'PROTOPORPHYRIN IX CONTAINING FE' HEM 6 water HOH #